0 B15R1.1849 C=Cc1c(ccc(c1C)C(=O)OC)OC 271570a_100011290941_100010761468 [0,0,0,0,0,0|2,0,1]=3 1 B15R1.1849 CCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000210202 [0,0,0,0,0,0|2,0,0]=2 2 B15R1.1849 CCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000210202 [0,0,0,0,0,0|2,0,0]=2 3 B15R1.1849 CCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000210202 [0,0,0,0,0,0|2,0,0]=2 4 B15R1.1849 CCC(=O)c1ccc(c(c1F)C#N)OC 1458a_200009924707_100000210202 [0,0,0,0,0,0|4,0,0]=4 5 B15R1.1849 CNC(=O)c1ccc(c(c1Br)OC)OC 11a_106832991635_100010284110 [0,0,0,0,0,0|2,0,0]=2 6 B15R1.1849 CNC(=O)c1ccc(c(c1Br)OC)OC 1626a_100102657272_100010284110 [0,0,0,0,0,0|2,0,0]=2 7 B15R1.1849 CNC(=O)c1ccc(c(c1Br)OC)OC 240690a_100102657272_100010284110 [0,0,0,0,0,0|2,0,0]=2 8 B15R1.1849 CNC(=O)c1ccc(c(c1Br)OC)OC 527a_100102657272_100010284110 [0,0,0,0,0,0|2,0,0]=2 9 B15R1.1849 CNC(=O)c1ccc(c(c1C)OC)OC 11a_106832991635_100000092638 [0,0,0,0,0,0|2,0,0]=2 10 B15R1.1849 CNC(=O)c1ccc(c(c1C)OC)OC 1626a_100102657272_100000092638 [0,0,0,0,0,0|2,0,0]=2 11 B15R1.1849 CNC(=O)c1ccc(c(c1C)OC)OC 240690a_100102657272_100000092638 [0,0,0,0,0,0|2,0,0]=2 12 B15R1.1849 CNC(=O)c1ccc(c(c1C)OC)OC 527a_100102657272_100000092638 [0,0,0,0,0,0|2,0,0]=2 13 B15R1.1849 CNC(=O)c1ccc(c(c1Cl)OC)OC 11a_106832991635_100011216413 [0,0,0,0,0,0|2,0,0]=2 14 B15R1.1849 CNC(=O)c1ccc(c(c1Cl)OC)OC 1626a_100102657272_100011216413 [0,0,0,0,0,0|2,0,0]=2 15 B15R1.1849 CNC(=O)c1ccc(c(c1Cl)OC)OC 240690a_100102657272_100011216413 [0,0,0,0,0,0|2,0,0]=2 16 B15R1.1849 CNC(=O)c1ccc(c(c1Cl)OC)OC 527a_100102657272_100011216413 [0,0,0,0,0,0|2,0,0]=2 17 B15R1.1849 CNC(=O)c1ccc(c(c1F)C#N)OC 11a_106832991635_200009924707 [0,0,0,0,0,0|4,0,0]=4 18 B15R1.1849 CNC(=O)c1ccc(c(c1F)C#N)OC 240690a_100102657272_200009924707 [0,0,0,0,0,0|4,0,0]=4 19 B15R1.1849 COC(=O)c1ccc(c(c1C)SC)OC 62a_100010761468_200000210301 [0,0,0,0,0,0|1,1,0]=2 20 B15R1.1849 COC(=O)c1ccc(c(c1C)SC)OC 62a_200000210301_100010761468 [0,0,0,0,0,0|1,1,0]=2 21 B15R1.1849 COC(=O)c1ccc(c(c1C)S[13CH3])OC 62a_100010761468_200025704644 [0,0,0,0,0,0|1,1,0]=2 22 B15R1.1849 COC(=O)c1ccc(c(c1C)S[13CH3])OC 62a_200025704644_100010761468 [0,0,0,0,0,0|1,1,0]=2 23 B15R1.1849 COc1ccc(c(c1OC)Br)C(=O)CF 1458a_100010284110_100015361967 [0,0,0,0,0,0|3,0,0]=3 24 B15R1.1849 COc1ccc(c(c1OC)C)C(=O)CF 1458a_100000092638_100015361967 [0,0,0,0,0,0|3,0,0]=3 25 B15R1.1849 COc1ccc(c(c1OC)Cl)C(=O)CF 1458a_100011216413_100015361967 [0,0,0,0,0,0|3,0,0]=3 26 B14R1.1864 C=Cc1cc(ccc1CC)C(=O)OC 271570a_100011290941_200012360130 [1,0,0,0,0,0|2,0,1]=4 27 B14R1.1864 C=Cc1cc(ccc1OC)C(=O)OC 271570a_100011290941_100000189012 [1,0,0,0,0,0|1,0,1]=3 28 B14R1.1864 C=Cc1cc(cnc1OC)C(=O)OC 271570a_100011290941_100010189640 [1,0,0,0,0,0|2,0,1]=4 29 B14R1.1864 C=Cc1cc(ncc1OC)C(=O)OC 271570a_100011290941_200010136175 [1,0,0,0,0,0|2,0,1]=4 30 B14R1.1864 C=Cc1ccc(cc1OC)C(=O)OC 271570a_100011290941_100009816954 [1,0,0,0,0,0|1,0,1]=3 31 B14R1.1864 C=Cc1ccc(nc1OC)C(=O)OC 271570a_100011290941_100010189641 [1,0,0,0,0,0|2,0,1]=4 32 B14R1.1864 C=Cc1cnc(cc1OC)C(=O)OC 271570a_100011290941_100010136178 [1,0,0,0,0,0|2,0,1]=4 33 B14R1.1864 C=Cc1nc(ccc1OC)C(=O)OC 271570a_100011290941_100010205418 [1,0,0,0,0,0|2,0,1]=4 34 B14R1.1864 C=Cc1ncc(cc1OC)C(=O)OC 271570a_100011290941_100010074909 [1,0,0,0,0,0|2,0,1]=4 35 B14R1.1864 CCC(=O)c1ccc(c(c1)C#N)OC 1458a_100011999887_100000210202 [1,0,0,0,0,0|3,0,0]=4 36 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)C#N 1458a_100009879710_100000210202 [1,0,0,0,0,0|3,0,0]=4 37 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000210202 [1,0,0,0,0,0|1,0,0]=2 38 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 34a_100000012293_200000210301 [1,0,0,0,0,0|1,0,0]=2 39 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 7a_100000012293_200000210301 [1,0,0,0,0,0|1,0,0]=2 40 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_100000012293_200025704644 [1,0,0,0,0,0|1,0,0]=2 41 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000012293_200025704644 [1,0,0,0,0,0|1,0,0]=2 42 B14R1.1864 CCC(O)c1ccc(c(c1)OC)OC 34a_200000015950_200000210301 [1,0,0,0,0,0|1,0,2]=4 43 B14R1.1864 CCC(O)c1ccc(c(c1)OC)OC 7a_200000015950_200000210301 [1,0,0,0,0,0|1,0,2]=4 44 B14R1.1864 CCC(O)c1ccc(c(c1)OC)O[13CH3] 34a_200000015950_200025704644 [1,0,0,0,0,0|1,0,2]=4 45 B14R1.1864 CCC(O)c1ccc(c(c1)OC)O[13CH3] 7a_200000015950_200025704644 [1,0,0,0,0,0|1,0,2]=4 46 B14R1.1864 CCN(C)c1ccc(c(c1)OC)OC 2230a_100000221037_200000210301 [1,0,0,0,0,0|3,0,0]=4 47 B14R1.1864 CCN(C)c1ccc(c(c1)OC)OC 269982a_100000221037_200000210301 [1,0,0,0,0,0|3,0,0]=4 48 B14R1.1864 CCN(C)c1ccc(c(c1)OC)OC 34a_100000221037_200000210301 [1,0,0,0,0,0|3,0,0]=4 49 B14R1.1864 CCN([13CH3])c1ccc(c(c1)OC)OC 2230a_100000221037_200025704644 [1,0,0,0,0,0|3,0,0]=4 50 B14R1.1864 CCN([13CH3])c1ccc(c(c1)OC)OC 269982a_100000221037_200025704644 [1,0,0,0,0,0|3,0,0]=4 51 B14R1.1864 CCN([13CH3])c1ccc(c(c1)OC)OC 34a_100000221037_200025704644 [1,0,0,0,0,0|3,0,0]=4 52 B14R1.1864 CCc1ccc(cc1SC)C(=O)OC 62a_200000210301_200012360130 [1,0,0,0,0,0|1,1,0]=3 53 B14R1.1864 CCc1ccc(cc1SC)C(=O)OC 62a_200012360130_200000210301 [1,0,0,0,0,0|1,1,0]=3 54 B14R1.1864 CCc1ccc(cc1S[13CH3])C(=O)OC 62a_200012360130_200025704644 [1,0,0,0,0,0|1,1,0]=3 55 B14R1.1864 CCc1ccc(cc1S[13CH3])C(=O)OC 62a_200025704644_200012360130 [1,0,0,0,0,0|1,1,0]=3 56 B14R1.1864 CNC(=O)c1ccc(c(c1)C#N)OC 11a_106832991635_100011999887 [1,0,0,0,0,0|3,0,0]=4 57 B14R1.1864 CNC(=O)c1ccc(c(c1)C#N)OC 1626a_100102657272_100011999887 [1,0,0,0,0,0|3,0,0]=4 58 B14R1.1864 CNC(=O)c1ccc(c(c1)C#N)OC 240690a_100102657272_100011999887 [1,0,0,0,0,0|3,0,0]=4 59 B14R1.1864 CNC(=O)c1ccc(c(c1)C#N)OC 527a_100102657272_100011999887 [1,0,0,0,0,0|3,0,0]=4 60 B14R1.1864 CNC(=O)c1ccc(c(c1)NC)OC 2230a_100000740754_200000210301 [1,0,0,0,0,0|2,0,0]=3 61 B14R1.1864 CNC(=O)c1ccc(c(c1)NC)OC 34a_100000740754_200000210301 [1,0,0,0,0,0|2,0,0]=3 62 B14R1.1864 CNC(=O)c1ccc(c(c1)N[13CH3])OC 2230a_100000740754_200025704644 [1,0,0,0,0,0|2,0,0]=3 63 B14R1.1864 CNC(=O)c1ccc(c(c1)N[13CH3])OC 34a_100000740754_200025704644 [1,0,0,0,0,0|2,0,0]=3 64 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)C#N 11a_106832991635_100009879710 [1,0,0,0,0,0|3,0,0]=4 65 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)C#N 1626a_100102657272_100009879710 [1,0,0,0,0,0|3,0,0]=4 66 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)C#N 240690a_100102657272_100009879710 [1,0,0,0,0,0|3,0,0]=4 67 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)C#N 527a_100102657272_100009879710 [1,0,0,0,0,0|3,0,0]=4 68 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)NC 2230a_100011850465_200000210301 [1,0,0,0,0,0|2,0,0]=3 69 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)NC 34a_100011850465_200000210301 [1,0,0,0,0,0|2,0,0]=3 70 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)N[13CH3] 2230a_100011850465_200025704644 [1,0,0,0,0,0|2,0,0]=3 71 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)N[13CH3] 34a_100011850465_200025704644 [1,0,0,0,0,0|2,0,0]=3 72 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 11a_106832991635_100000211223 [1,0,0,0,0,0|1,0,0]=2 73 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 1626a_100102657272_100000211223 [1,0,0,0,0,0|1,0,0]=2 74 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 240690a_100102657272_100000211223 [1,0,0,0,0,0|1,0,0]=2 75 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 527a_100102657272_100000211223 [1,0,0,0,0,0|1,0,0]=2 76 B14R1.1864 CNC(C)c1ccc(c(c1)OC)OC 269862a_106832991636_100000171757 [1,0,0,0,0,0|2,0,1]=4 77 B14R1.1864 CN[C@H](C)c1ccc(c(c1)OC)OC 2230a_100025717294_200000210301 [1,0,0,0,0,0|2,0,1]=4 78 B14R1.1864 CNc1ccc(cc1C#N)C(=O)OC 27a_100102657272_100010150795 [1,0,0,0,0,0|3,0,0]=4 79 B14R1.1864 CNc1ncc(cc1OC)C(=O)OC 27a_100102657272_100010074909 [1,0,0,0,0,0|2,0,0]=3 80 B14R1.1864 COC(=O)c1cc(c(cn1)OC)SC 62a_200000210301_200010136175 [1,0,0,0,0,0|1,1,0]=3 81 B14R1.1864 COC(=O)c1cc(c(cn1)OC)SC 62a_200010136175_200000210301 [1,0,0,0,0,0|1,1,0]=3 82 B14R1.1864 COC(=O)c1cc(c(cn1)OC)S[13CH3] 62a_200010136175_200025704644 [1,0,0,0,0,0|1,1,0]=3 83 B14R1.1864 COC(=O)c1cc(c(cn1)OC)S[13CH3] 62a_200025704644_200010136175 [1,0,0,0,0,0|1,1,0]=3 84 B14R1.1864 COC(=O)c1cc(c(cn1)SC)OC 62a_100010136178_200000210301 [1,0,0,0,0,0|1,1,0]=3 85 B14R1.1864 COC(=O)c1cc(c(cn1)SC)OC 62a_200000210301_100010136178 [1,0,0,0,0,0|1,1,0]=3 86 B14R1.1864 COC(=O)c1cc(c(cn1)S[13CH3])OC 62a_100010136178_200025704644 [1,0,0,0,0,0|1,1,0]=3 87 B14R1.1864 COC(=O)c1cc(c(cn1)S[13CH3])OC 62a_200025704644_100010136178 [1,0,0,0,0,0|1,1,0]=3 88 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)OC 34a_100009865136_200000210301 [1,0,0,0,0,0|2,0,0]=3 89 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)OC 7a_100009865136_200000210301 [1,0,0,0,0,0|2,0,0]=3 90 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)O[13CH3] 34a_100009865136_200025704644 [1,0,0,0,0,0|2,0,0]=3 91 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)O[13CH3] 7a_100009865136_200025704644 [1,0,0,0,0,0|2,0,0]=3 92 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)SC 62a_200000210301_100010150795 [1,0,0,0,0,0|2,1,0]=4 93 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)S[13CH3] 62a_200025704644_100010150795 [1,0,0,0,0,0|2,1,0]=4 94 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)SC 62a_100012274322_200000210301 [1,0,0,0,0,0|2,1,0]=4 95 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)SC 62a_200000210301_100012274322 [1,0,0,0,0,0|2,1,0]=4 96 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)S[13CH3] 62a_100012274322_200025704644 [1,0,0,0,0,0|2,1,0]=4 97 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100012274322 [1,0,0,0,0,0|2,1,0]=4 98 B14R1.1864 COC(=O)c1ccc(c(c1)CO)SC 62a_100010201863_200000210301 [1,0,0,0,0,0|2,1,0]=4 99 B14R1.1864 COC(=O)c1ccc(c(c1)CO)SC 62a_200000210301_100010201863 [1,0,0,0,0,0|2,1,0]=4 100 B14R1.1864 COC(=O)c1ccc(c(c1)CO)S[13CH3] 62a_100010201863_200025704644 [1,0,0,0,0,0|2,1,0]=4 101 B14R1.1864 COC(=O)c1ccc(c(c1)CO)S[13CH3] 62a_200025704644_100010201863 [1,0,0,0,0,0|2,1,0]=4 102 B14R1.1864 COC(=O)c1ccc(c(c1)OC)C#N 34a_100000044657_200000210301 [1,0,0,0,0,0|2,0,0]=3 103 B14R1.1864 COC(=O)c1ccc(c(c1)OC)C#N 7a_100000044657_200000210301 [1,0,0,0,0,0|2,0,0]=3 104 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 34a_100000212147_200000210301 [1,0,0,0,0,0|0,0,0]=1 105 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 34a_100011215032_200000210301 [1,0,0,0,0,0|0,0,0]=1 106 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 7a_100000212147_200000210301 [1,0,0,0,0,0|0,0,0]=1 107 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 7a_100011215032_200000210301 [1,0,0,0,0,0|0,0,0]=1 108 B14R1.1864 COC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_100000212147_200025704644 [1,0,0,0,0,0|0,0,0]=1 109 B14R1.1864 COC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000212147_200025704644 [1,0,0,0,0,0|0,0,0]=1 110 B14R1.1864 COC(=O)c1ccc(c(c1)OC)SC 62a_100009816954_200000210301 [1,0,0,0,0,0|0,1,0]=2 111 B14R1.1864 COC(=O)c1ccc(c(c1)OC)SC 62a_200000210301_100009816954 [1,0,0,0,0,0|0,1,0]=2 112 B14R1.1864 COC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_100009816954_200025704644 [1,0,0,0,0,0|0,1,0]=2 113 B14R1.1864 COC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100009816954 [1,0,0,0,0,0|0,1,0]=2 114 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])C#N 34a_100000044657_200025704644 [1,0,0,0,0,0|2,0,0]=3 115 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])C#N 7a_100000044657_200025704644 [1,0,0,0,0,0|2,0,0]=3 116 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])OC 34a_100011215032_200025704644 [1,0,0,0,0,0|0,0,0]=1 117 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])OC 7a_100011215032_200025704644 [1,0,0,0,0,0|0,0,0]=1 118 B14R1.1864 COC(=O)c1ccc(c(c1)SC)C#N 62a_200000210301_100009861381 [1,0,0,0,0,0|2,1,0]=4 119 B14R1.1864 COC(=O)c1ccc(c(c1)SC)C=O 62a_100012179231_200000210301 [1,0,0,0,0,0|2,1,0]=4 120 B14R1.1864 COC(=O)c1ccc(c(c1)SC)C=O 62a_200000210301_100012179231 [1,0,0,0,0,0|2,1,0]=4 121 B14R1.1864 COC(=O)c1ccc(c(c1)SC)CO 62a_100012355398_200000210301 [1,0,0,0,0,0|2,1,0]=4 122 B14R1.1864 COC(=O)c1ccc(c(c1)SC)CO 62a_200000210301_100012355398 [1,0,0,0,0,0|2,1,0]=4 123 B14R1.1864 COC(=O)c1ccc(c(c1)SC)OC 62a_100000189012_200000210301 [1,0,0,0,0,0|0,1,0]=2 124 B14R1.1864 COC(=O)c1ccc(c(c1)SC)OC 62a_200000210301_100000189012 [1,0,0,0,0,0|0,1,0]=2 125 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])C#N 62a_200025704644_100009861381 [1,0,0,0,0,0|2,1,0]=4 126 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])C=O 62a_100012179231_200025704644 [1,0,0,0,0,0|2,1,0]=4 127 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])C=O 62a_200025704644_100012179231 [1,0,0,0,0,0|2,1,0]=4 128 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])CO 62a_100012355398_200025704644 [1,0,0,0,0,0|2,1,0]=4 129 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])CO 62a_200025704644_100012355398 [1,0,0,0,0,0|2,1,0]=4 130 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])OC 62a_100000189012_200025704644 [1,0,0,0,0,0|0,1,0]=2 131 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])OC 62a_200025704644_100000189012 [1,0,0,0,0,0|0,1,0]=2 132 B14R1.1864 COC(=O)c1ccc(c(n1)OC)SC 62a_100010189641_200000210301 [1,0,0,0,0,0|1,1,0]=3 133 B14R1.1864 COC(=O)c1ccc(c(n1)OC)SC 62a_200000210301_100010189641 [1,0,0,0,0,0|1,1,0]=3 134 B14R1.1864 COC(=O)c1ccc(c(n1)OC)S[13CH3] 62a_100010189641_200025704644 [1,0,0,0,0,0|1,1,0]=3 135 B14R1.1864 COC(=O)c1ccc(c(n1)OC)S[13CH3] 62a_200025704644_100010189641 [1,0,0,0,0,0|1,1,0]=3 136 B14R1.1864 COC(=O)c1ccc(c(n1)SC)OC 62a_100010205418_200000210301 [1,0,0,0,0,0|1,1,0]=3 137 B14R1.1864 COC(=O)c1ccc(c(n1)SC)OC 62a_200000210301_100010205418 [1,0,0,0,0,0|1,1,0]=3 138 B14R1.1864 COC(=O)c1ccc(c(n1)S[13CH3])OC 62a_100010205418_200025704644 [1,0,0,0,0,0|1,1,0]=3 139 B14R1.1864 COC(=O)c1ccc(c(n1)S[13CH3])OC 62a_200025704644_100010205418 [1,0,0,0,0,0|1,1,0]=3 140 B14R1.1864 COC(=O)c1cnc(c(c1)OC)OC 34a_100009867281_200000210301 [1,0,0,0,0,0|1,0,0]=2 141 B14R1.1864 COC(=O)c1cnc(c(c1)OC)SC 62a_100010136190_200000210301 [1,0,0,0,0,0|1,1,0]=3 142 B14R1.1864 COC(=O)c1cnc(c(c1)OC)SC 62a_200000210301_100010074909 [1,0,0,0,0,0|1,1,0]=3 143 B14R1.1864 COC(=O)c1cnc(c(c1)OC)S[13CH3] 62a_100010136190_200025704644 [1,0,0,0,0,0|1,1,0]=3 144 B14R1.1864 COC(=O)c1cnc(c(c1)OC)S[13CH3] 62a_200025704644_100010074909 [1,0,0,0,0,0|1,1,0]=3 145 B14R1.1864 COC(=O)c1cnc(c(c1)O[13CH3])OC 34a_100009867281_200025704644 [1,0,0,0,0,0|1,0,0]=2 146 B14R1.1864 COC(=O)c1cnc(c(c1)SC)OC 62a_100010189640_200000210301 [1,0,0,0,0,0|1,1,0]=3 147 B14R1.1864 COC(=O)c1cnc(c(c1)SC)OC 62a_200000210301_100010189640 [1,0,0,0,0,0|1,1,0]=3 148 B14R1.1864 COC(=O)c1cnc(c(c1)S[13CH3])OC 62a_100010189640_200025704644 [1,0,0,0,0,0|1,1,0]=3 149 B14R1.1864 COC(=O)c1cnc(c(c1)S[13CH3])OC 62a_200025704644_100010189640 [1,0,0,0,0,0|1,1,0]=3 150 B14R1.1864 COc1cc(ccc1O[13CH3])C(=NO)N 34a_200000748009_200025704644 [1,0,0,0,0,0|3,0,0]=4 151 B14R1.1864 COc1cc(ccc1O[13CH3])C(=O)NN 34a_100000008232_200025704644 [1,0,0,0,0,0|2,0,0]=3 152 B14R1.1864 COc1ccc(cc1OC)C(=NO)N 34a_200000748009_200000210301 [1,0,0,0,0,0|3,0,0]=4 153 B14R1.1864 COc1ccc(cc1OC)C(=O)CF 1458a_100000211223_100015361967 [1,0,0,0,0,0|2,0,0]=3 154 B14R1.1864 COc1ccc(cc1OC)C(=O)NN 34a_100000008232_200000210301 [1,0,0,0,0,0|2,0,0]=3 155 B14R1.1864 COc1ccc(cc1OC)C(=O)NN 34a_200012634778_200000210301 [1,0,0,0,0,0|2,0,0]=3 156 B14R1.1864 COc1ccc(cc1OC)C(C)OC 34a_100000246476_200000210301 [1,0,0,0,0,0|1,0,1]=3 157 B14R1.1864 COc1ccc(cc1OC)C(C)OC 7a_100000246476_200000210301 [1,0,0,0,0,0|1,0,1]=3 158 B14R1.1864 COc1ccc(cc1OC)C(C)O[13CH3] 34a_100000246476_200025704644 [1,0,0,0,0,0|1,0,1]=3 159 B14R1.1864 COc1ccc(cc1OC)C(C)O[13CH3] 7a_100000246476_200025704644 [1,0,0,0,0,0|1,0,1]=3 160 B14R1.1864 COc1ccc(cc1OC)[C@@H](C)N[13CH3] 2230a_100025717294_200025704644 [1,0,0,0,0,0|2,0,1]=4 161 B14R1.1864 COc1ccc(cc1O[13CH3])C(=O)NN 34a_200012634778_200025704644 [1,0,0,0,0,0|2,0,0]=3 162 B14R1.1864 COc1ccc(cc1SC)C(=O)NN 62a_100000186317_200000210301 [1,0,0,0,0,0|2,1,0]=4 163 B14R1.1864 COc1ccc(cc1SC)C(=O)NN 62a_200000210301_100000186317 [1,0,0,0,0,0|2,1,0]=4 164 B14R1.1864 COc1ccc(cc1S[13CH3])C(=O)NN 62a_100000186317_200025704644 [1,0,0,0,0,0|2,1,0]=4 165 B14R1.1864 COc1ccc(cc1S[13CH3])C(=O)NN 62a_200025704644_100000186317 [1,0,0,0,0,0|2,1,0]=4 166 B14R1.2023 C=C(C)c1ccc(c(c1C)OC)OC 271570a_100000694244_100010000156 [1,0,0,0,0,0|2,0,0]=3 167 B14R1.2023 C=Cc1c(ccc(c1N)C(=O)C)OC 271570a_100011290941_100010236346 [1,0,0,0,0,0|2,0,1]=4 168 B14R1.2023 COc1ccc(c(c1C#N)F)C(=O)C 1458a_200009924707_200000210301 [1,0,0,0,0,0|3,0,0]=4 169 B14R1.2023 COc1ccc(c(c1C#N)F)C(=O)[13CH3] 1458a_200009924707_200025704644 [1,0,0,0,0,0|3,0,0]=4 170 B14R1.2023 COc1ccc(c(c1OC)Br)C(=O)C 1458a_100010284110_200000210301 [1,0,0,0,0,0|1,0,0]=2 171 B14R1.2023 COc1ccc(c(c1OC)Br)C(=O)[13CH3] 1458a_100010284110_200025704644 [1,0,0,0,0,0|1,0,0]=2 172 B14R1.2023 COc1ccc(c(c1OC)C)C(=O)C 1458a_100000092638_200000210301 [1,0,0,0,0,0|1,0,0]=2 173 B14R1.2023 COc1ccc(c(c1OC)C)C(=O)[13CH3] 1458a_100000092638_200025704644 [1,0,0,0,0,0|1,0,0]=2 174 B14R1.2023 COc1ccc(c(c1OC)Cl)C(=O)C 1458a_100011216413_200000210301 [1,0,0,0,0,0|1,0,0]=2 175 B14R1.2023 COc1ccc(c(c1OC)Cl)C(=O)[13CH3] 1458a_100011216413_200025704644 [1,0,0,0,0,0|1,0,0]=2 176 B14R1.2023 COc1ccc(c(c1SC)N)C(=O)C 62a_100010236346_200000210301 [1,0,0,0,0,0|1,1,0]=3 177 B14R1.2023 COc1ccc(c(c1S[13CH3])N)C(=O)C 62a_100010236346_200025704644 [1,0,0,0,0,0|1,1,0]=3 178 B14R1.2316 C=Cc1ccc(c(c1C)C)C(=O)OC 271570a_100011290941_100010761469 [1,0,0,0,0,0|2,0,1]=4 179 B14R1.2316 C=Cc1ccc(c(c1C)F)C(=O)OC 271570a_100011290941_100010172522 [1,0,0,0,0,0|2,0,1]=4 180 B14R1.2316 C=Cc1ccc(c(c1C)N)C(=O)OC 271570a_100011290941_100000764893 [1,0,0,0,0,0|2,0,1]=4 181 B14R1.2316 C=Cc1ccc(c(c1F)O)C(=O)OC 271570a_100011290941_100011092008 [1,0,0,0,0,0|2,0,1]=4 182 B14R1.2316 C=Cc1ccc(c(c1O)C)C(=O)OC 271570a_100011290941_100010889012 [1,0,0,0,0,0|2,0,1]=4 183 B14R1.2316 C=Cc1ccc(c(c1O)F)C(=O)OC 271570a_100011290941_100011096176 [1,0,0,0,0,0|2,0,1]=4 184 B14R1.2316 CCC(=O)c1ccc(c(c1C)C)OC 1458a_200000082569_100000210202 [1,0,0,0,0,0|2,0,0]=3 185 B14R1.2316 CCC(=O)c1ccc(c(c1F)F)OC 1458a_100000061877_100000210202 [1,0,0,0,0,0|3,0,0]=4 186 B14R1.2316 CCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000210202 [1,0,0,0,0,0|1,0,0]=2 187 B14R1.2316 CNC(=O)c1ccc(c(c1C)C)OC 11a_106832991635_200000082569 [1,0,0,0,0,0|2,0,0]=3 188 B14R1.2316 CNC(=O)c1ccc(c(c1C)C)OC 1626a_100102657272_200000082569 [1,0,0,0,0,0|2,0,0]=3 189 B14R1.2316 CNC(=O)c1ccc(c(c1C)C)OC 240690a_100102657272_200000082569 [1,0,0,0,0,0|2,0,0]=3 190 B14R1.2316 CNC(=O)c1ccc(c(c1C)C)OC 527a_100102657272_200000082569 [1,0,0,0,0,0|2,0,0]=3 191 B14R1.2316 CNC(=O)c1ccc(c(c1F)F)OC 11a_106832991635_100000061877 [1,0,0,0,0,0|3,0,0]=4 192 B14R1.2316 CNC(=O)c1ccc(c(c1F)F)OC 1626a_100102657272_100000061877 [1,0,0,0,0,0|3,0,0]=4 193 B14R1.2316 CNC(=O)c1ccc(c(c1F)F)OC 240690a_100102657272_100000061877 [1,0,0,0,0,0|3,0,0]=4 194 B14R1.2316 CNC(=O)c1ccc(c(c1F)F)OC 527a_100102657272_100000061877 [1,0,0,0,0,0|3,0,0]=4 195 B14R1.2316 COC(=O)c1ccc(c(c1C)C)SC 62a_100010761469_200000210301 [1,0,0,0,0,0|1,1,0]=3 196 B14R1.2316 COC(=O)c1ccc(c(c1C)C)SC 62a_200000210301_100010761469 [1,0,0,0,0,0|1,1,0]=3 197 B14R1.2316 COC(=O)c1ccc(c(c1C)C)S[13CH3] 62a_100010761469_200025704644 [1,0,0,0,0,0|1,1,0]=3 198 B14R1.2316 COC(=O)c1ccc(c(c1C)C)S[13CH3] 62a_200025704644_100010761469 [1,0,0,0,0,0|1,1,0]=3 199 B14R1.2316 COC(=O)c1ccc(c(c1C)F)SC 62a_100010291505_200000210301 [1,0,0,0,0,0|2,1,0]=4 200 B14R1.2316 COC(=O)c1ccc(c(c1C)F)SC 62a_200000210301_100010291505 [1,0,0,0,0,0|2,1,0]=4 201 B14R1.2316 COC(=O)c1ccc(c(c1C)F)S[13CH3] 62a_100010291505_200025704644 [1,0,0,0,0,0|2,1,0]=4 202 B14R1.2316 COC(=O)c1ccc(c(c1C)F)S[13CH3] 62a_200025704644_100010291505 [1,0,0,0,0,0|2,1,0]=4 203 B14R1.2316 COC(=O)c1ccc(c(c1C)O)OC 271570a_203496583355_100010761468 [1,0,0,0,0,0|1,0,0]=2 204 B14R1.2316 COC(=O)c1ccc(c(c1C)O)SC 62a_100010889012_200000210301 [1,0,0,0,0,0|1,1,0]=3 205 B14R1.2316 COC(=O)c1ccc(c(c1C)O)SC 62a_200000210301_100010889012 [1,0,0,0,0,0|1,1,0]=3 206 B14R1.2316 COC(=O)c1ccc(c(c1C)O)S[13CH3] 62a_100010889012_200025704644 [1,0,0,0,0,0|1,1,0]=3 207 B14R1.2316 COC(=O)c1ccc(c(c1C)O)S[13CH3] 62a_200025704644_100010889012 [1,0,0,0,0,0|1,1,0]=3 208 B14R1.2316 COC(=O)c1ccc(c(c1F)C)SC 62a_100010172522_200000210301 [1,0,0,0,0,0|1,1,0]=3 209 B14R1.2316 COC(=O)c1ccc(c(c1F)C)SC 62a_200000210301_100010172522 [1,0,0,0,0,0|1,1,0]=3 210 B14R1.2316 COC(=O)c1ccc(c(c1F)C)S[13CH3] 62a_100010172522_200025704644 [1,0,0,0,0,0|1,1,0]=3 211 B14R1.2316 COC(=O)c1ccc(c(c1F)C)S[13CH3] 62a_200025704644_100010172522 [1,0,0,0,0,0|1,1,0]=3 212 B14R1.2316 COC(=O)c1ccc(c(c1F)F)OC 34a_100000101000_200000210301 [1,0,0,0,0,0|2,0,0]=3 213 B14R1.2316 COC(=O)c1ccc(c(c1F)F)OC 7a_100000101000_200000210301 [1,0,0,0,0,0|2,0,0]=3 214 B14R1.2316 COC(=O)c1ccc(c(c1F)F)O[13CH3] 34a_100000101000_200025704644 [1,0,0,0,0,0|2,0,0]=3 215 B14R1.2316 COC(=O)c1ccc(c(c1F)F)O[13CH3] 7a_100000101000_200025704644 [1,0,0,0,0,0|2,0,0]=3 216 B14R1.2316 COC(=O)c1ccc(c(c1F)F)SC 62a_100010982024_200000210301 [1,0,0,0,0,0|2,1,0]=4 217 B14R1.2316 COC(=O)c1ccc(c(c1F)F)SC 62a_200000210301_100010982024 [1,0,0,0,0,0|2,1,0]=4 218 B14R1.2316 COC(=O)c1ccc(c(c1F)F)S[13CH3] 62a_100010982024_200025704644 [1,0,0,0,0,0|2,1,0]=4 219 B14R1.2316 COC(=O)c1ccc(c(c1F)F)S[13CH3] 62a_200025704644_100010982024 [1,0,0,0,0,0|2,1,0]=4 220 B14R1.2316 COC(=O)c1ccc(c(c1F)O)SC 62a_100011096176_200000210301 [1,0,0,0,0,0|1,1,0]=3 221 B14R1.2316 COC(=O)c1ccc(c(c1F)O)SC 62a_200000210301_100011096176 [1,0,0,0,0,0|1,1,0]=3 222 B14R1.2316 COC(=O)c1ccc(c(c1F)O)S[13CH3] 62a_100011096176_200025704644 [1,0,0,0,0,0|1,1,0]=3 223 B14R1.2316 COC(=O)c1ccc(c(c1F)O)S[13CH3] 62a_200025704644_100011096176 [1,0,0,0,0,0|1,1,0]=3 224 B14R1.2316 COC(=O)c1ccc(c(c1N)C)SC 62a_100000764893_200000210301 [1,0,0,0,0,0|1,1,0]=3 225 B14R1.2316 COC(=O)c1ccc(c(c1N)C)S[13CH3] 62a_100000764893_200025704644 [1,0,0,0,0,0|1,1,0]=3 226 B14R1.2316 COC(=O)c1ccc(c(c1N)F)SC 62a_100022009169_200000210301 [1,0,0,0,0,0|2,1,0]=4 227 B14R1.2316 COC(=O)c1ccc(c(c1N)F)S[13CH3] 62a_100022009169_200025704644 [1,0,0,0,0,0|2,1,0]=4 228 B14R1.2316 COc1ccc(c(c1C)C)C(=O)CF 1458a_200000082569_100015361967 [1,0,0,0,0,0|3,0,0]=4 229 B14R1.2316 COc1ccc(c(c1O)O)C(=O)CF 1458a_100000045701_100015361967 [1,0,0,0,0,0|2,0,0]=3 230 B14R1.4114 C=Cc1c(ccc(c1C)C(=O)OC)C 271570a_100011290941_200010734123 [1,0,0,0,0,0|2,0,1]=4 231 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)Br 1458a_100009816242_100000210202 [1,0,0,0,0,0|3,0,0]=4 232 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)Cl 1458a_100010116254_100000210202 [1,0,0,0,0,0|3,0,0]=4 233 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)F 1458a_100000061937_100000210202 [1,0,0,0,0,0|3,0,0]=4 234 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Br 11a_106832991635_100009816242 [1,0,0,0,0,0|3,0,0]=4 235 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Br 1626a_100102657272_100009816242 [1,0,0,0,0,0|3,0,0]=4 236 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Br 240690a_100102657272_100009816242 [1,0,0,0,0,0|3,0,0]=4 237 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Br 527a_100102657272_100009816242 [1,0,0,0,0,0|3,0,0]=4 238 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 11a_106832991635_100010116254 [1,0,0,0,0,0|3,0,0]=4 239 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 1626a_100102657272_100010116254 [1,0,0,0,0,0|3,0,0]=4 240 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 240690a_100102657272_100010116254 [1,0,0,0,0,0|3,0,0]=4 241 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)Cl 527a_100102657272_100010116254 [1,0,0,0,0,0|3,0,0]=4 242 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)F 11a_106832991635_100000061937 [1,0,0,0,0,0|3,0,0]=4 243 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)F 1626a_100102657272_100000061937 [1,0,0,0,0,0|3,0,0]=4 244 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)F 240690a_100102657272_100000061937 [1,0,0,0,0,0|3,0,0]=4 245 B14R1.4114 CNC(=O)c1ccc(c(c1F)OC)F 527a_100102657272_100000061937 [1,0,0,0,0,0|3,0,0]=4 246 B14R1.4114 COC(=O)c1ccc(c(c1C)OC)Br 34a_100010889012_200000210301 [1,0,0,0,0,0|2,0,0]=3 247 B14R1.4114 COC(=O)c1ccc(c(c1C)OC)Br 7a_100010889012_200000210301 [1,0,0,0,0,0|2,0,0]=3 248 B14R1.4114 COC(=O)c1ccc(c(c1C)O[13CH3])Br 34a_100010889012_200025704644 [1,0,0,0,0,0|2,0,0]=3 249 B14R1.4114 COC(=O)c1ccc(c(c1C)O[13CH3])Br 7a_100010889012_200025704644 [1,0,0,0,0,0|2,0,0]=3 250 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)C 62a_200000210301_200010734123 [1,0,0,0,0,0|1,1,0]=3 251 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)C 62a_200010734123_200000210301 [1,0,0,0,0,0|1,1,0]=3 252 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)N 62a_100010764323_200000210301 [1,0,0,0,0,0|2,1,0]=4 253 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)N 62a_200000210301_100010764323 [1,0,0,0,0,0|2,1,0]=4 254 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])C 62a_200010734123_200025704644 [1,0,0,0,0,0|1,1,0]=3 255 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])C 62a_200025704644_200010734123 [1,0,0,0,0,0|1,1,0]=3 256 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])N 62a_100010764323_200025704644 [1,0,0,0,0,0|2,1,0]=4 257 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])N 62a_200025704644_100010764323 [1,0,0,0,0,0|2,1,0]=4 258 B14R1.4114 COC(=O)c1ccc(c(c1Cl)SC)N 62a_200000210301_200016031531 [1,0,0,0,0,0|2,1,0]=4 259 B14R1.4114 COC(=O)c1ccc(c(c1Cl)SC)N 62a_200016031531_200000210301 [1,0,0,0,0,0|2,1,0]=4 260 B14R1.4114 COC(=O)c1ccc(c(c1Cl)S[13CH3])N 62a_200016031531_200025704644 [1,0,0,0,0,0|2,1,0]=4 261 B14R1.4114 COC(=O)c1ccc(c(c1Cl)S[13CH3])N 62a_200025704644_200016031531 [1,0,0,0,0,0|2,1,0]=4 262 B14R1.4114 COC(=O)c1ccc(c(c1F)OC)Br 34a_100011096176_200000210301 [1,0,0,0,0,0|2,0,0]=3 263 B14R1.4114 COC(=O)c1ccc(c(c1F)OC)Br 7a_100011096176_200000210301 [1,0,0,0,0,0|2,0,0]=3 264 B14R1.4114 COC(=O)c1ccc(c(c1F)O[13CH3])Br 34a_100011096176_200025704644 [1,0,0,0,0,0|2,0,0]=3 265 B14R1.4114 COC(=O)c1ccc(c(c1F)O[13CH3])Br 7a_100011096176_200025704644 [1,0,0,0,0,0|2,0,0]=3 266 B14R1.4114 COC(=O)c1ccc(c(c1F)SC)F 62a_100000697099_200000210301 [1,0,0,0,0,0|2,1,0]=4 267 B14R1.4114 COC(=O)c1ccc(c(c1F)SC)F 62a_200000210301_100000697099 [1,0,0,0,0,0|2,1,0]=4 268 B14R1.4114 COC(=O)c1ccc(c(c1F)S[13CH3])F 62a_100000697099_200025704644 [1,0,0,0,0,0|2,1,0]=4 269 B14R1.4114 COC(=O)c1ccc(c(c1F)S[13CH3])F 62a_200025704644_100000697099 [1,0,0,0,0,0|2,1,0]=4 270 B14R1.10285 C=C=Cc1ccc(c(c1C)OC)OC 271570a_100015277604_100010000156 [1,0,0,0,0,0|2,0,1]=4 271 B14R1.10285 CC=Cc1ccc(c(c1C)OC)OC 271570a_100016259895_100010000156 [1,0,0,0,0,0|2,0,0]=3 272 B14R1.10285 CCSc1ccc(c(c1C)OC)OC 62a_100000210202_100010000156 [1,0,0,0,0,0|3,0,0]=4 273 B14R1.10285 CNCc1ccc(c(c1Br)OC)OC 207a_100102657272_100009814707 [1,0,0,0,0,0|2,0,1]=4 274 B14R1.10285 CNCc1ccc(c(c1Br)OC)OC 270004a_106832991635_100009814707 [1,0,0,0,0,0|2,0,1]=4 275 B14R1.10285 CNCc1ccc(c(c1C)OC)OC 207a_100102657272_100000050322 [1,0,0,0,0,0|2,0,1]=4 276 B14R1.10285 CNCc1ccc(c(c1C)OC)OC 270004a_106832991635_100000050322 [1,0,0,0,0,0|2,0,1]=4 277 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 207a_100102657272_100000033805 [1,0,0,0,0,0|2,0,1]=4 278 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 2230a_106832991635_100011890039 [1,0,0,0,0,0|2,0,1]=4 279 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 270004a_106832991635_100000033805 [1,0,0,0,0,0|2,0,1]=4 280 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 34a_102515433231_200000210301 [1,0,0,0,0,0|2,0,1]=4 281 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 7a_106832991635_100011890039 [1,0,0,0,0,0|2,0,1]=4 282 B14R1.10285 CNCc1ccc(c(c1F)OC)OC 207a_100102657272_100009852382 [1,0,0,0,0,0|2,0,1]=4 283 B14R1.10285 CNCc1ccc(c(c1F)OC)OC 270004a_106832991635_100009852382 [1,0,0,0,0,0|2,0,1]=4 284 B14R1.10285 CNCc1ccc(c(c1I)OC)OC 207a_100102657272_100010191550 [1,0,0,0,0,0|2,0,1]=4 285 B14R1.10285 CNCc1ccc(c(c1I)OC)OC 270004a_106832991635_100010191550 [1,0,0,0,0,0|2,0,1]=4 286 B14R1.10285 COCc1ccc(c(c1Cl)OC)OC 34a_100011218542_200000210301 [1,0,0,0,0,0|1,0,1]=3 287 B14R1.10285 COCc1ccc(c(c1Cl)OC)OC 7a_100011218542_200000210301 [1,0,0,0,0,0|1,0,1]=3 288 B14R1.10285 COc1ccc(c(c1OC)Cl)CN[13CH3] 34a_102515433231_200025704644 [1,0,0,0,0,0|2,0,1]=4 289 B14R1.10285 COc1ccc(c(c1OC)Cl)CO[13CH3] 34a_100011218542_200025704644 [1,0,0,0,0,0|1,0,1]=3 290 B14R1.10285 COc1ccc(c(c1OC)Cl)CO[13CH3] 7a_100011218542_200025704644 [1,0,0,0,0,0|1,0,1]=3 291 B14R1.10285 COc1ccc(c(c1OC)Cl)CSC 62a_200000210301_100011890039 [1,0,0,0,0,0|1,1,1]=4 292 B14R1.10285 COc1ccc(c(c1OC)Cl)CS[13CH3] 62a_200025704644_100011890039 [1,0,0,0,0,0|1,1,1]=4 293 B16R1.20126 COc1ccc(c(c1OC)Br)C(=O)C(C)C 1458a_100010284110_100000210206 [0,1,0,0,0,0|2,0,0]=3 294 B16R1.20126 COc1ccc(c(c1OC)Br)C(=O)N(C)C 11a_100102631434_100010284110 [0,1,0,0,0,0|2,0,0]=3 295 B16R1.20126 COc1ccc(c(c1OC)Br)C(=O)N(C)C 1626a_100102631434_100010284110 [0,1,0,0,0,0|2,0,0]=3 296 B16R1.20126 COc1ccc(c(c1OC)Br)C(=O)N(C)C 240690a_100102631434_100010284110 [0,1,0,0,0,0|2,0,0]=3 297 B16R1.20126 COc1ccc(c(c1OC)Br)C(=O)N(C)C 527a_100102631434_100010284110 [0,1,0,0,0,0|2,0,0]=3 298 B16R1.20126 COc1ccc(c(c1OC)C)C(=C(C)C)C 271570a_200000049429_100010000156 [0,1,0,0,0,0|3,0,0]=4 299 B16R1.20126 COc1ccc(c(c1OC)C)C(=O)C(C)C 1458a_100000092638_100000210206 [0,1,0,0,0,0|2,0,0]=3 300 B16R1.20126 COc1ccc(c(c1OC)C)C(=O)N(C)C 11a_100102631434_100000092638 [0,1,0,0,0,0|2,0,0]=3 301 B16R1.20126 COc1ccc(c(c1OC)C)C(=O)N(C)C 1626a_100102631434_100000092638 [0,1,0,0,0,0|2,0,0]=3 302 B16R1.20126 COc1ccc(c(c1OC)C)C(=O)N(C)C 240690a_100102631434_100000092638 [0,1,0,0,0,0|2,0,0]=3 303 B16R1.20126 COc1ccc(c(c1OC)C)C(=O)N(C)C 527a_100102631434_100000092638 [0,1,0,0,0,0|2,0,0]=3 304 B16R1.20126 COc1ccc(c(c1OC)Cl)C(=O)C(C)C 1458a_100011216413_100000210206 [0,1,0,0,0,0|2,0,0]=3 305 B16R1.20126 COc1ccc(c(c1OC)Cl)C(=O)N(C)C 11a_100102631434_100011216413 [0,1,0,0,0,0|2,0,0]=3 306 B16R1.20126 COc1ccc(c(c1OC)Cl)C(=O)N(C)C 1626a_100102631434_100011216413 [0,1,0,0,0,0|2,0,0]=3 307 B16R1.20126 COc1ccc(c(c1OC)Cl)C(=O)N(C)C 240690a_100102631434_100011216413 [0,1,0,0,0,0|2,0,0]=3 308 B16R1.20126 COc1ccc(c(c1OC)Cl)C(=O)N(C)C 527a_100102631434_100011216413 [0,1,0,0,0,0|2,0,0]=3 309 B16R1.20187 C=C(C)c1c(ccc(c1C)C(=O)OC)OC 271570a_100000694244_100010761468 [0,1,0,0,0,0|2,0,0]=3 310 B16R1.25775 C=CCc1ccc(c(c1OC)C)C(=O)OC 34a_200010675153_200000210301 [0,1,0,0,0,0|2,0,1]=4 311 B16R1.25775 C=CCc1ccc(c(c1OC)C)C(=O)OC 7a_200010675153_200000210301 [0,1,0,0,0,0|2,0,1]=4 312 B16R1.25775 C=CCc1ccc(c(c1O[13CH3])C)C(=O)OC 34a_200010675153_200025704644 [0,1,0,0,0,0|2,0,1]=4 313 B16R1.25775 C=CCc1ccc(c(c1O[13CH3])C)C(=O)OC 7a_200010675153_200025704644 [0,1,0,0,0,0|2,0,1]=4 314 B16R1.30631 CCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000210202 [0,1,0,0,0,0|1,0,0]=2 315 B16R1.30631 CNC(=O)c1ccc(c(c1OC)OC)OC 11a_106832991635_100000211208 [0,1,0,0,0,0|1,0,0]=2 316 B16R1.30631 CNC(=O)c1ccc(c(c1OC)OC)OC 1626a_100102657272_100000211208 [0,1,0,0,0,0|1,0,0]=2 317 B16R1.30631 CNC(=O)c1ccc(c(c1OC)OC)OC 240690a_100102657272_100000211208 [0,1,0,0,0,0|1,0,0]=2 318 B16R1.30631 CNC(=O)c1ccc(c(c1OC)OC)OC 527a_100102657272_100000211208 [0,1,0,0,0,0|1,0,0]=2 319 B16R1.30631 COc1ccc(c(c1OC)OC)C(=O)CF 1458a_100000211208_100015361967 [0,1,0,0,0,0|2,0,0]=3 320 B16R1.48114 C=C=Cc1c(ccc(c1C)C(=O)OC)OC 271570a_100015277604_100010761468 [0,1,0,0,0,0|2,0,1]=4 321 B16R1.48114 CC=Cc1c(ccc(c1C)C(=O)OC)OC 271570a_100016259895_100010761468 [0,1,0,0,0,0|2,0,0]=3 322 B16R1.48114 CCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000210202_100010761468 [0,1,0,0,0,0|1,1,0]=3 323 B16R1.48114 CCSc1c(ccc(c1C)C(=O)OC)OC 62a_100010761468_100000210202 [0,1,0,0,0,0|1,1,0]=3 324 B16R1.48114 COC(=O)c1ccc(c(c1C)SCF)OC 62a_100010761468_100015361967 [0,1,0,0,0,0|1,1,0]=3 325 B16R1.48114 COC(=O)c1ccc(c(c1C)SCF)OC 62a_100015361967_100010761468 [0,1,0,0,0,0|1,1,0]=3 326 B16R1.70664 C#CCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000184674 [0,1,0,0,0,0|2,0,1]=4 327 B16R1.70664 C#CCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000184674 [0,1,0,0,0,0|2,0,1]=4 328 B16R1.70664 C#CCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000184674 [0,1,0,0,0,0|2,0,1]=4 329 B16R1.70664 C=CCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000210623 [0,1,0,0,0,0|2,0,1]=4 330 B16R1.70664 C=CCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000210623 [0,1,0,0,0,0|2,0,1]=4 331 B16R1.70664 C=CCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000210623 [0,1,0,0,0,0|2,0,1]=4 332 B16R1.70664 CCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000210303 [0,1,0,0,0,0|2,0,0]=3 333 B16R1.70664 CCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000210303 [0,1,0,0,0,0|2,0,0]=3 334 B16R1.70664 CCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000210303 [0,1,0,0,0,0|2,0,0]=3 335 B16R1.70664 CCNC(=O)c1ccc(c(c1Br)OC)OC 11a_100015525214_100010284110 [0,1,0,0,0,0|2,0,0]=3 336 B16R1.70664 CCNC(=O)c1ccc(c(c1Br)OC)OC 240690a_100015525214_100010284110 [0,1,0,0,0,0|2,0,0]=3 337 B16R1.70664 CCNC(=O)c1ccc(c(c1Br)OC)OC 527a_100015525214_100010284110 [0,1,0,0,0,0|2,0,0]=3 338 B16R1.70664 CCNC(=O)c1ccc(c(c1C)OC)OC 11a_100015525214_100000092638 [0,1,0,0,0,0|2,0,0]=3 339 B16R1.70664 CCNC(=O)c1ccc(c(c1C)OC)OC 240690a_100015525214_100000092638 [0,1,0,0,0,0|2,0,0]=3 340 B16R1.70664 CCNC(=O)c1ccc(c(c1C)OC)OC 527a_100015525214_100000092638 [0,1,0,0,0,0|2,0,0]=3 341 B16R1.70664 CCNC(=O)c1ccc(c(c1Cl)OC)OC 11a_100015525214_100011216413 [0,1,0,0,0,0|2,0,0]=3 342 B16R1.70664 CCNC(=O)c1ccc(c(c1Cl)OC)OC 240690a_100015525214_100011216413 [0,1,0,0,0,0|2,0,0]=3 343 B16R1.70664 CCNC(=O)c1ccc(c(c1Cl)OC)OC 527a_100015525214_100011216413 [0,1,0,0,0,0|2,0,0]=3 344 B16R1.70664 CNNC(=O)c1ccc(c(c1Br)OC)OC 22a_100016993582_100010284110 [0,1,0,0,0,0|2,0,0]=3 345 B16R1.70664 CNNC(=O)c1ccc(c(c1C)OC)OC 22a_100016993582_100000092638 [0,1,0,0,0,0|2,0,0]=3 346 B16R1.70664 CNNC(=O)c1ccc(c(c1Cl)OC)OC 22a_100016993582_100011216413 [0,1,0,0,0,0|2,0,0]=3 347 B16R1.70664 COc1ccc(c(c1OC)Br)C(=O)CC#N 1458a_100010284110_100011214920 [0,1,0,0,0,0|2,0,1]=4 348 B16R1.70664 COc1ccc(c(c1OC)Br)C(=O)CCF 1458a_100010284110_100011217306 [0,1,0,0,0,0|2,0,0]=3 349 B16R1.70664 COc1ccc(c(c1OC)Br)C(=O)CCO 1458a_100010284110_100000211926 [0,1,0,0,0,0|2,0,0]=3 350 B16R1.70664 COc1ccc(c(c1OC)C)C(=O)CC#N 1458a_100000092638_100011214920 [0,1,0,0,0,0|2,0,1]=4 351 B16R1.70664 COc1ccc(c(c1OC)C)C(=O)CCF 1458a_100000092638_100011217306 [0,1,0,0,0,0|2,0,0]=3 352 B16R1.70664 COc1ccc(c(c1OC)C)C(=O)CCO 1458a_100000092638_100000211926 [0,1,0,0,0,0|2,0,0]=3 353 B16R1.70664 COc1ccc(c(c1OC)Cl)C(=O)CC#N 1458a_100011216413_100011214920 [0,1,0,0,0,0|2,0,1]=4 354 B16R1.70664 COc1ccc(c(c1OC)Cl)C(=O)CCF 1458a_100011216413_100011217306 [0,1,0,0,0,0|2,0,0]=3 355 B16R1.70664 COc1ccc(c(c1OC)Cl)C(=O)CCO 1458a_100011216413_100000211926 [0,1,0,0,0,0|2,0,0]=3 356 B16R1.88007 C#CC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000211873_100011890039 [0,0,0,0,0,1|2,0,1]=4 357 B16R1.88007 C=CC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000185746_100011890039 [0,0,0,0,0,1|2,0,1]=4 358 B16R1.88007 CCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000210414_100011890039 [0,0,0,0,0,1|2,0,0]=3 359 B16R1.88007 CCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100012648522_100000210202 [0,0,0,0,0,1|2,0,0]=3 360 B16R1.88007 CCC(=O)Cc1ccc(c(c1F)OC)OC 1458a_200010293705_100000210202 [0,0,0,0,0,1|2,0,0]=3 361 B16R1.88007 CNC(=O)Cc1ccc(c(c1Cl)OC)OC 11a_106832991635_100012648522 [0,0,0,0,0,1|2,0,0]=3 362 B16R1.88007 CNC(=O)Cc1ccc(c(c1Cl)OC)OC 1626a_100102657272_100012648522 [0,0,0,0,0,1|2,0,0]=3 363 B16R1.88007 CNC(=O)Cc1ccc(c(c1Cl)OC)OC 240690a_100102657272_100012648522 [0,0,0,0,0,1|2,0,0]=3 364 B16R1.88007 CNC(=O)Cc1ccc(c(c1Cl)OC)OC 527a_100102657272_100012648522 [0,0,0,0,0,1|2,0,0]=3 365 B16R1.88007 CNC(=O)Cc1ccc(c(c1F)OC)OC 11a_106832991635_200010293705 [0,0,0,0,0,1|2,0,0]=3 366 B16R1.88007 CNC(=O)Cc1ccc(c(c1F)OC)OC 1626a_100102657272_200010293705 [0,0,0,0,0,1|2,0,0]=3 367 B16R1.88007 CNC(=O)Cc1ccc(c(c1F)OC)OC 240690a_100102657272_200010293705 [0,0,0,0,0,1|2,0,0]=3 368 B16R1.88007 CNC(=O)Cc1ccc(c(c1F)OC)OC 527a_100102657272_200010293705 [0,0,0,0,0,1|2,0,0]=3 369 B16R1.88007 COC(=O)Cc1ccc(c(c1O)OC)OC 271570a_203496583355_200039450660 [0,0,0,0,0,1|0,0,0]=1 370 B16R1.88007 COc1ccc(c(c1OC)C)SC(C)OC 62a_100009879195_100010000156 [0,0,0,0,0,1|2,0,1]=4 371 B16R1.88007 COc1ccc(c(c1OC)Cl)CC(=O)CF 1458a_100012648522_100015361967 [0,0,0,0,0,1|3,0,0]=4 372 B16R1.88007 COc1ccc(c(c1OC)Cl)CC(=O)CO 1458a_100000210174_100011890039 [0,0,0,0,0,1|3,0,0]=4 373 B16R1.88007 COc1ccc(c(c1OC)F)CC(=O)CF 1458a_200010293705_100015361967 [0,0,0,0,0,1|3,0,0]=4 374 B13R1.49 C=Cc1cc(ccc1C)C(=O)OC 271570a_100011290941_100011218856 [2,0,0,0,0,0|1,0,1]=4 375 B13R1.49 C=Cc1cc(ccc1O)C(=O)OC 271570a_100011290941_100000216328 [2,0,0,0,0,0|1,0,1]=4 376 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210202 [2,0,0,0,0,0|2,0,0]=4 377 B13R1.49 CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210202 [2,0,0,0,0,0|1,0,0]=3 378 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210202 [2,0,0,0,0,0|2,0,0]=4 379 B13R1.49 CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210202 [2,0,0,0,0,0|2,0,0]=4 380 B13R1.49 CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210202 [2,0,0,0,0,0|2,0,0]=4 381 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [2,0,0,0,0,0|1,0,0]=3 382 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 2230a_100000737617_200000210301 [2,0,0,0,0,0|2,0,0]=4 383 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 34a_100000737617_200000210301 [2,0,0,0,0,0|2,0,0]=4 384 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 7a_100000737617_200000210301 [2,0,0,0,0,0|2,0,0]=4 385 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 2230a_100000737617_200025704644 [2,0,0,0,0,0|2,0,0]=4 386 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 34a_100000737617_200025704644 [2,0,0,0,0,0|2,0,0]=4 387 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 7a_100000737617_200025704644 [2,0,0,0,0,0|2,0,0]=4 388 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 11a_106832991635_100011934951 [2,0,0,0,0,0|2,0,0]=4 389 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 1626a_100102657272_100011934951 [2,0,0,0,0,0|2,0,0]=4 390 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 240690a_100102657272_100011934951 [2,0,0,0,0,0|2,0,0]=4 391 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 527a_100102657272_100011934951 [2,0,0,0,0,0|2,0,0]=4 392 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 11a_106832991635_100000212341 [2,0,0,0,0,0|1,0,0]=3 393 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 1626a_100102657272_100000212341 [2,0,0,0,0,0|1,0,0]=3 394 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 240690a_100102657272_100000212341 [2,0,0,0,0,0|1,0,0]=3 395 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 527a_100102657272_100000212341 [2,0,0,0,0,0|1,0,0]=3 396 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 11a_106832991635_100000181799 [2,0,0,0,0,0|2,0,0]=4 397 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 1626a_100102657272_100000181799 [2,0,0,0,0,0|2,0,0]=4 398 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 240690a_100102657272_100000181799 [2,0,0,0,0,0|2,0,0]=4 399 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 527a_100102657272_100000181799 [2,0,0,0,0,0|2,0,0]=4 400 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 11a_106832991635_100000757635 [2,0,0,0,0,0|2,0,0]=4 401 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 1626a_100102657272_100000757635 [2,0,0,0,0,0|2,0,0]=4 402 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 240690a_100102657272_100000757635 [2,0,0,0,0,0|2,0,0]=4 403 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 527a_100102657272_100000757635 [2,0,0,0,0,0|2,0,0]=4 404 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 11a_106832991635_100012356290 [2,0,0,0,0,0|2,0,0]=4 405 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 1626a_100102657272_100012356290 [2,0,0,0,0,0|2,0,0]=4 406 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 240690a_100102657272_100012356290 [2,0,0,0,0,0|2,0,0]=4 407 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 527a_100102657272_100012356290 [2,0,0,0,0,0|2,0,0]=4 408 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [2,0,0,0,0,0|1,0,0]=3 409 B13R1.49 COC(=O)c1cc(c(cn1)C)SC 62a_100000065005_200000210301 [2,0,0,0,0,0|1,1,0]=4 410 B13R1.49 COC(=O)c1cc(c(cn1)C)SC 62a_200000210301_100000065005 [2,0,0,0,0,0|1,1,0]=4 411 B13R1.49 COC(=O)c1cc(c(cn1)C)S[13CH3] 62a_100000065005_200025704644 [2,0,0,0,0,0|1,1,0]=4 412 B13R1.49 COC(=O)c1cc(c(cn1)C)S[13CH3] 62a_200025704644_100000065005 [2,0,0,0,0,0|1,1,0]=4 413 B13R1.49 COC(=O)c1cc(c(cn1)O)OC 271570a_203496583355_100010136178 [2,0,0,0,0,0|1,0,0]=3 414 B13R1.49 COC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010150795 [2,0,0,0,0,0|2,0,0]=4 415 B13R1.49 COC(=O)c1ccc(c(c1)C=O)O 271570a_203496583355_100012274322 [2,0,0,0,0,0|2,0,0]=4 416 B13R1.49 COC(=O)c1ccc(c(c1)CO)O 271570a_203496583355_100010201863 [2,0,0,0,0,0|2,0,0]=4 417 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 34a_100011934688_200000210301 [2,0,0,0,0,0|1,0,0]=3 418 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 7a_100011934688_200000210301 [2,0,0,0,0,0|1,0,0]=3 419 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 34a_100000736511_200000210301 [2,0,0,0,0,0|0,0,0]=2 420 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 7a_100000736511_200000210301 [2,0,0,0,0,0|0,0,0]=2 421 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 34a_100000103815_200000210301 [2,0,0,0,0,0|1,0,0]=3 422 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 7a_100000103815_200000210301 [2,0,0,0,0,0|1,0,0]=3 423 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 34a_100000062259_200000210301 [2,0,0,0,0,0|1,0,0]=3 424 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 7a_100000062259_200000210301 [2,0,0,0,0,0|1,0,0]=3 425 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 34a_100012350776_200000210301 [2,0,0,0,0,0|1,0,0]=3 426 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 7a_100012350776_200000210301 [2,0,0,0,0,0|1,0,0]=3 427 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 34a_100000757247_200000210301 [2,0,0,0,0,0|1,0,0]=3 428 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 7a_100000757247_200000210301 [2,0,0,0,0,0|1,0,0]=3 429 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [2,0,0,0,0,0|0,0,0]=2 430 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 34a_100011934688_200025704644 [2,0,0,0,0,0|1,0,0]=3 431 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100011934688_200025704644 [2,0,0,0,0,0|1,0,0]=3 432 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000736511_200025704644 [2,0,0,0,0,0|0,0,0]=2 433 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000736511_200025704644 [2,0,0,0,0,0|0,0,0]=2 434 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 34a_100000103815_200025704644 [2,0,0,0,0,0|1,0,0]=3 435 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 7a_100000103815_200025704644 [2,0,0,0,0,0|1,0,0]=3 436 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000062259_200025704644 [2,0,0,0,0,0|1,0,0]=3 437 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000062259_200025704644 [2,0,0,0,0,0|1,0,0]=3 438 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 34a_100012350776_200025704644 [2,0,0,0,0,0|1,0,0]=3 439 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 7a_100012350776_200025704644 [2,0,0,0,0,0|1,0,0]=3 440 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 34a_100000757247_200025704644 [2,0,0,0,0,0|1,0,0]=3 441 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000757247_200025704644 [2,0,0,0,0,0|1,0,0]=3 442 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_100012349818_200000210301 [2,0,0,0,0,0|1,1,0]=4 443 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_200000210301_100012349818 [2,0,0,0,0,0|1,1,0]=4 444 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_100000723194_200000210301 [2,0,0,0,0,0|0,1,0]=3 445 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_200000210301_100000723194 [2,0,0,0,0,0|0,1,0]=3 446 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_100011294800_200000210301 [2,0,0,0,0,0|1,1,0]=4 447 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_200000210301_100011294800 [2,0,0,0,0,0|1,1,0]=4 448 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_100000722584_200000210301 [2,0,0,0,0,0|1,1,0]=4 449 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100000722584 [2,0,0,0,0,0|1,1,0]=4 450 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_100000187552_200000210301 [2,0,0,0,0,0|1,1,0]=4 451 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_200000210301_100000187552 [2,0,0,0,0,0|1,1,0]=4 452 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_100000216328_200000210301 [2,0,0,0,0,0|0,1,0]=3 453 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100000216328 [2,0,0,0,0,0|0,1,0]=3 454 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100012349818_200025704644 [2,0,0,0,0,0|1,1,0]=4 455 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012349818 [2,0,0,0,0,0|1,1,0]=4 456 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_100000723194_200025704644 [2,0,0,0,0,0|0,1,0]=3 457 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100000723194 [2,0,0,0,0,0|0,1,0]=3 458 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_100011294800_200025704644 [2,0,0,0,0,0|1,1,0]=4 459 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011294800 [2,0,0,0,0,0|1,1,0]=4 460 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000722584_200025704644 [2,0,0,0,0,0|1,1,0]=4 461 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000722584 [2,0,0,0,0,0|1,1,0]=4 462 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_100000187552_200025704644 [2,0,0,0,0,0|1,1,0]=4 463 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100000187552 [2,0,0,0,0,0|1,1,0]=4 464 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_100000216328_200025704644 [2,0,0,0,0,0|0,1,0]=3 465 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100000216328 [2,0,0,0,0,0|0,1,0]=3 466 B13R1.49 COC(=O)c1ccc(c(n1)OC)O 271570a_203496583355_100010189641 [2,0,0,0,0,0|1,0,0]=3 467 B13R1.49 COC(=O)c1ccc(c(n1)SC)C 62a_100010143800_200000210301 [2,0,0,0,0,0|1,1,0]=4 468 B13R1.49 COC(=O)c1ccc(c(n1)SC)C 62a_200000210301_100010143800 [2,0,0,0,0,0|1,1,0]=4 469 B13R1.49 COC(=O)c1ccc(c(n1)SC)O 62a_200000210301_200009815348 [2,0,0,0,0,0|1,1,0]=4 470 B13R1.49 COC(=O)c1ccc(c(n1)SC)O 62a_200009815348_200000210301 [2,0,0,0,0,0|1,1,0]=4 471 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])C 62a_100010143800_200025704644 [2,0,0,0,0,0|1,1,0]=4 472 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])C 62a_200025704644_100010143800 [2,0,0,0,0,0|1,1,0]=4 473 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])O 62a_200009815348_200025704644 [2,0,0,0,0,0|1,1,0]=4 474 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])O 62a_200025704644_200009815348 [2,0,0,0,0,0|1,1,0]=4 475 B13R1.49 COC(=O)c1cnc(c(c1)OC)Cl 34a_100009840551_200000210301 [2,0,0,0,0,0|2,0,0]=4 476 B13R1.49 COC(=O)c1cnc(c(c1)OC)Cl 7a_100009840551_200000210301 [2,0,0,0,0,0|2,0,0]=4 477 B13R1.49 COC(=O)c1cnc(c(c1)OC)I 34a_100010999399_200000210301 [2,0,0,0,0,0|2,0,0]=4 478 B13R1.49 COC(=O)c1cnc(c(c1)OC)I 7a_100010999399_200000210301 [2,0,0,0,0,0|2,0,0]=4 479 B13R1.49 COC(=O)c1cnc(c(c1)OC)N 34a_100009857207_200000210301 [2,0,0,0,0,0|2,0,0]=4 480 B13R1.49 COC(=O)c1cnc(c(c1)OC)N 7a_100009857207_200000210301 [2,0,0,0,0,0|2,0,0]=4 481 B13R1.49 COC(=O)c1cnc(c(c1)OC)O 271570a_203496583355_100010074909 [2,0,0,0,0,0|1,0,0]=3 482 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])Cl 34a_100009840551_200025704644 [2,0,0,0,0,0|2,0,0]=4 483 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])Cl 7a_100009840551_200025704644 [2,0,0,0,0,0|2,0,0]=4 484 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])I 34a_100010999399_200025704644 [2,0,0,0,0,0|2,0,0]=4 485 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])I 7a_100010999399_200025704644 [2,0,0,0,0,0|2,0,0]=4 486 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])N 34a_100009857207_200025704644 [2,0,0,0,0,0|2,0,0]=4 487 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])N 7a_100009857207_200025704644 [2,0,0,0,0,0|2,0,0]=4 488 B13R1.49 COC(=O)c1cnc(c(c1)SC)O 62a_100010109663_200000210301 [2,0,0,0,0,0|1,1,0]=4 489 B13R1.49 COC(=O)c1cnc(c(c1)SC)O 62a_200000210301_100010109663 [2,0,0,0,0,0|1,1,0]=4 490 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])O 62a_100010109663_200025704644 [2,0,0,0,0,0|1,1,0]=4 491 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])O 62a_200025704644_100010109663 [2,0,0,0,0,0|1,1,0]=4 492 B13R1.49 COc1cc(ccc1C)C(=O)CF 1458a_100000212341_100015361967 [2,0,0,0,0,0|2,0,0]=4 493 B13R1.49 COc1cc(ccc1O)C(=O)CF 1458a_100000687070_100015361967 [2,0,0,0,0,0|2,0,0]=4 494 B13R1.386 C=C=Cc1ccc(c(c1)OC)OC 271570a_100015277604_100000187503 [2,0,0,0,0,0|1,0,1]=4 495 B13R1.386 CC=Cc1ccc(c(c1)CC)OC 271570a_100016259895_200010179862 [2,0,0,0,0,0|2,0,0]=4 496 B13R1.386 CC=Cc1ccc(c(c1)OC)CC 271570a_100016259895_200010710398 [2,0,0,0,0,0|2,0,0]=4 497 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 271570a_100016259895_100000187503 [2,0,0,0,0,0|1,0,0]=3 498 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 34a_100015195088_200000210301 [2,0,0,0,0,0|1,0,0]=3 499 B13R1.386 CC=Cc1ccc(c(c1)OC)O[13CH3] 34a_100015195088_200025704644 [2,0,0,0,0,0|1,0,0]=3 500 B13R1.386 CC=Cc1ccc(c(c1)OC)SC 271570a_100016259895_200011001119 [2,0,0,0,0,0|1,1,0]=4 501 B13R1.386 CC=Cc1ccc(c(c1)SC)OC 271570a_100016259895_200009892704 [2,0,0,0,0,0|1,1,0]=4 502 B13R1.386 CC=Cc1ccc(c(n1)OC)OC 271570a_100016259895_100010214848 [2,0,0,0,0,0|2,0,0]=4 503 B13R1.386 CC=Cc1cnc(c(c1)OC)OC 271570a_100016259895_100010234541 [2,0,0,0,0,0|2,0,0]=4 504 B13R1.386 CCCc1ccc(c(c1)OC)OC 34a_100000012292_200000210301 [2,0,0,0,0,0|1,0,1]=4 505 B13R1.386 CCCc1ccc(c(c1)OC)OC 7a_100000012292_200000210301 [2,0,0,0,0,0|1,0,1]=4 506 B13R1.386 CCCc1ccc(c(c1)OC)O[13CH3] 34a_100000012292_200025704644 [2,0,0,0,0,0|1,0,1]=4 507 B13R1.386 CCCc1ccc(c(c1)OC)O[13CH3] 7a_100000012292_200025704644 [2,0,0,0,0,0|1,0,1]=4 508 B13R1.386 CCNc1ccc(c(c1)OC)OC 34a_100000187404_100000210202 [2,0,0,0,0,0|2,0,0]=4 509 B13R1.386 CCOc1ccc(c(c1)OC)OC 34a_100000039706_100000210202 [2,0,0,0,0,0|2,0,0]=4 510 B13R1.386 CCSc1ccc(c(c1)OC)OC 62a_100000210202_100011356967 [2,0,0,0,0,0|2,0,0]=4 511 B13R1.386 CNCc1ccc(c(c1)OC)OC 207a_100102657272_100000170513 [2,0,0,0,0,0|1,0,1]=4 512 B13R1.386 CNCc1ccc(c(c1)OC)OC 2230a_106832991635_100011233839 [2,0,0,0,0,0|1,0,1]=4 513 B13R1.386 CNCc1ccc(c(c1)OC)OC 270004a_106832991635_100000170513 [2,0,0,0,0,0|1,0,1]=4 514 B13R1.386 CNCc1ccc(c(c1)OC)OC 34a_100000185555_200000210301 [2,0,0,0,0,0|1,0,1]=4 515 B13R1.386 CNCc1ccc(c(c1)OC)OC 34a_100000188468_200000210301 [2,0,0,0,0,0|1,0,1]=4 516 B13R1.386 CNCc1ccc(c(c1)O[13CH3])OC 34a_100000188468_200025704644 [2,0,0,0,0,0|1,0,1]=4 517 B13R1.386 COCc1ccc(c(c1)OC)OC 34a_100000210929_200000210301 [2,0,0,0,0,0|0,0,1]=3 518 B13R1.386 COc1ccc(cc1OC)CN[13CH3] 34a_100000185555_200025704644 [2,0,0,0,0,0|1,0,1]=4 519 B13R1.386 COc1ccc(cc1OC)CO[13CH3] 34a_100000210929_200025704644 [2,0,0,0,0,0|0,0,1]=3 520 B13R1.386 COc1ccc(cc1OC)CSC 62a_200000210301_100011233839 [2,0,0,0,0,0|0,1,1]=4 521 B13R1.386 COc1ccc(cc1OC)CS[13CH3] 62a_200025704644_100011233839 [2,0,0,0,0,0|0,1,1]=4 522 B13R1.3088 C=Cc1ccc(cc1C)C(=O)OC 271570a_100011290941_100011215878 [2,0,0,0,0,0|1,0,1]=4 523 B13R1.3088 C=Cc1ccc(cc1O)C(=O)OC 271570a_100011290941_100012350776 [2,0,0,0,0,0|1,0,1]=4 524 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)OC 1458a_100000187947_100000210202 [2,0,0,0,0,0|2,0,0]=4 525 B13R1.3088 CCC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000210202 [2,0,0,0,0,0|1,0,0]=3 526 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200012349626 [2,0,0,0,0,0|1,1,0]=4 527 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200012349626_200000210301 [2,0,0,0,0,0|1,1,0]=4 528 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200012349626_200025704644 [2,0,0,0,0,0|1,1,0]=4 529 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200012349626 [2,0,0,0,0,0|1,1,0]=4 530 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 1458a_100000188346_100000210202 [2,0,0,0,0,0|2,0,0]=4 531 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 34a_100011218862_200000210301 [2,0,0,0,0,0|2,0,0]=4 532 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 7a_100011218862_200000210301 [2,0,0,0,0,0|2,0,0]=4 533 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100011218862_200025704644 [2,0,0,0,0,0|2,0,0]=4 534 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100011218862_200025704644 [2,0,0,0,0,0|2,0,0]=4 535 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC 1458a_100000186160_100000210202 [2,0,0,0,0,0|2,0,0]=4 536 B13R1.3088 CCC(=O)c1ccc(c(c1)I)OC 1458a_100000188716_100000210202 [2,0,0,0,0,0|2,0,0]=4 537 B13R1.3088 CCC(=O)c1ccc(c(c1)O)CC 1458a_100000089006_100000210202 [2,0,0,0,0,0|2,0,0]=4 538 B13R1.3088 CCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210202 [2,0,0,0,0,0|1,0,0]=3 539 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 240690a_100102657272_100000089006 [2,0,0,0,0,0|2,0,0]=4 540 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 527a_100102657272_100000089006 [2,0,0,0,0,0|2,0,0]=4 541 B13R1.3088 CCc1ccc(cc1O)C(=O)OC 271570a_203496583355_200012360130 [2,0,0,0,0,0|1,0,0]=3 542 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 11a_106832991635_100000187947 [2,0,0,0,0,0|2,0,0]=4 543 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 1626a_100102657272_100000187947 [2,0,0,0,0,0|2,0,0]=4 544 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 240690a_100102657272_100000187947 [2,0,0,0,0,0|2,0,0]=4 545 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 527a_100102657272_100000187947 [2,0,0,0,0,0|2,0,0]=4 546 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 2230a_100000739472_200000210301 [2,0,0,0,0,0|2,0,0]=4 547 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 27a_100102657272_200013065384 [2,0,0,0,0,0|2,0,0]=4 548 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 34a_100000739472_200000210301 [2,0,0,0,0,0|2,0,0]=4 549 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 7a_100000739472_200000210301 [2,0,0,0,0,0|2,0,0]=4 550 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 2230a_100000739472_200025704644 [2,0,0,0,0,0|2,0,0]=4 551 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 34a_100000739472_200025704644 [2,0,0,0,0,0|2,0,0]=4 552 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 7a_100000739472_200025704644 [2,0,0,0,0,0|2,0,0]=4 553 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 11a_106832991635_100011202886 [2,0,0,0,0,0|1,0,0]=3 554 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 1626a_100102657272_100011202886 [2,0,0,0,0,0|1,0,0]=3 555 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 240690a_100102657272_100011202886 [2,0,0,0,0,0|1,0,0]=3 556 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 527a_100102657272_100011202886 [2,0,0,0,0,0|1,0,0]=3 557 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200013065384 [2,0,0,0,0,0|1,1,0]=4 558 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200013065384_200000210301 [2,0,0,0,0,0|1,1,0]=4 559 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200013065384_200025704644 [2,0,0,0,0,0|1,1,0]=4 560 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200013065384 [2,0,0,0,0,0|1,1,0]=4 561 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 11a_106832991635_100000188346 [2,0,0,0,0,0|2,0,0]=4 562 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 1626a_100102657272_100000188346 [2,0,0,0,0,0|2,0,0]=4 563 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 240690a_100102657272_100000188346 [2,0,0,0,0,0|2,0,0]=4 564 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 527a_100102657272_100000188346 [2,0,0,0,0,0|2,0,0]=4 565 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 11a_106832991635_100000186160 [2,0,0,0,0,0|2,0,0]=4 566 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 1626a_100102657272_100000186160 [2,0,0,0,0,0|2,0,0]=4 567 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 240690a_100102657272_100000186160 [2,0,0,0,0,0|2,0,0]=4 568 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 527a_100102657272_100000186160 [2,0,0,0,0,0|2,0,0]=4 569 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 11a_106832991635_100000188716 [2,0,0,0,0,0|2,0,0]=4 570 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 1626a_100102657272_100000188716 [2,0,0,0,0,0|2,0,0]=4 571 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 240690a_100102657272_100000188716 [2,0,0,0,0,0|2,0,0]=4 572 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 527a_100102657272_100000188716 [2,0,0,0,0,0|2,0,0]=4 573 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 240690a_100102657272_100000766810 [2,0,0,0,0,0|1,0,0]=3 574 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 527a_100102657272_100000766810 [2,0,0,0,0,0|1,0,0]=3 575 B13R1.3088 CNc1ncc(cc1C)C(=O)OC 27a_100102657272_100009862495 [2,0,0,0,0,0|2,0,0]=4 576 B13R1.3088 COC(=O)c1cc(c(cn1)OC)O 271570a_203496583355_200010136175 [2,0,0,0,0,0|1,0,0]=3 577 B13R1.3088 COC(=O)c1cc(c(cn1)SC)C 62a_100010080863_200000210301 [2,0,0,0,0,0|1,1,0]=4 578 B13R1.3088 COC(=O)c1cc(c(cn1)SC)C 62a_200000210301_100010080863 [2,0,0,0,0,0|1,1,0]=4 579 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])C 62a_100010080863_200025704644 [2,0,0,0,0,0|1,1,0]=4 580 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])C 62a_200025704644_100010080863 [2,0,0,0,0,0|1,1,0]=4 581 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 34a_100000216328_200000210301 [2,0,0,0,0,0|1,0,0]=3 582 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 7a_100000216328_200000210301 [2,0,0,0,0,0|1,0,0]=3 583 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100000216328_200025704644 [2,0,0,0,0,0|1,0,0]=3 584 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100000216328_200025704644 [2,0,0,0,0,0|1,0,0]=3 585 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_100011294788_200000210301 [2,0,0,0,0,0|1,1,0]=4 586 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_200000210301_100011294788 [2,0,0,0,0,0|1,1,0]=4 587 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100011294788_200025704644 [2,0,0,0,0,0|1,1,0]=4 588 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100011294788 [2,0,0,0,0,0|1,1,0]=4 589 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 34a_100011997373_200000210301 [2,0,0,0,0,0|0,0,0]=2 590 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 7a_100011997373_200000210301 [2,0,0,0,0,0|0,0,0]=2 591 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100011997373_200025704644 [2,0,0,0,0,0|0,0,0]=2 592 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100011997373_200025704644 [2,0,0,0,0,0|0,0,0]=2 593 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_100011215878_200000210301 [2,0,0,0,0,0|0,1,0]=3 594 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_200000210301_100011215878 [2,0,0,0,0,0|0,1,0]=3 595 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100011215878_200025704644 [2,0,0,0,0,0|0,1,0]=3 596 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011215878 [2,0,0,0,0,0|0,1,0]=3 597 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 34a_100000151454_200000210301 [2,0,0,0,0,0|1,0,0]=3 598 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 7a_100000151454_200000210301 [2,0,0,0,0,0|1,0,0]=3 599 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000151454_200025704644 [2,0,0,0,0,0|1,0,0]=3 600 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000151454_200025704644 [2,0,0,0,0,0|1,0,0]=3 601 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_100012356344_200000210301 [2,0,0,0,0,0|1,1,0]=4 602 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_200000210301_100012356344 [2,0,0,0,0,0|1,1,0]=4 603 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_100012356344_200025704644 [2,0,0,0,0,0|1,1,0]=4 604 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100012356344 [2,0,0,0,0,0|1,1,0]=4 605 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 34a_100000075456_200000210301 [2,0,0,0,0,0|1,0,0]=3 606 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 7a_100000075456_200000210301 [2,0,0,0,0,0|1,0,0]=3 607 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000075456_200025704644 [2,0,0,0,0,0|1,0,0]=3 608 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000075456_200025704644 [2,0,0,0,0,0|1,0,0]=3 609 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_100000703229_200000210301 [2,0,0,0,0,0|1,1,0]=4 610 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_200000210301_100000703229 [2,0,0,0,0,0|1,1,0]=4 611 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000703229_200025704644 [2,0,0,0,0,0|1,1,0]=4 612 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000703229 [2,0,0,0,0,0|1,1,0]=4 613 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 34a_100010162523_200000210301 [2,0,0,0,0,0|1,0,0]=3 614 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 7a_100010162523_200000210301 [2,0,0,0,0,0|1,0,0]=3 615 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 34a_100010162523_200025704644 [2,0,0,0,0,0|1,0,0]=3 616 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 7a_100010162523_200025704644 [2,0,0,0,0,0|1,0,0]=3 617 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 34a_100000724433_200000210301 [2,0,0,0,0,0|1,0,0]=3 618 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 7a_100000724433_200000210301 [2,0,0,0,0,0|1,0,0]=3 619 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000724433_200025704644 [2,0,0,0,0,0|1,0,0]=3 620 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000724433_200025704644 [2,0,0,0,0,0|1,0,0]=3 621 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_100011450966_200000210301 [2,0,0,0,0,0|1,1,0]=4 622 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_200000210301_100011450966 [2,0,0,0,0,0|1,1,0]=4 623 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100011450966_200025704644 [2,0,0,0,0,0|1,1,0]=4 624 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011450966 [2,0,0,0,0,0|1,1,0]=4 625 B13R1.3088 COC(=O)c1ccc(c(c1)O)C#N 271570a_203496583355_100009861381 [2,0,0,0,0,0|2,0,0]=4 626 B13R1.3088 COC(=O)c1ccc(c(c1)O)C=O 271570a_203496583355_100012179231 [2,0,0,0,0,0|2,0,0]=4 627 B13R1.3088 COC(=O)c1ccc(c(c1)O)CO 271570a_203496583355_100012355398 [2,0,0,0,0,0|2,0,0]=4 628 B13R1.3088 COC(=O)c1ccc(c(c1)O)OC 271570a_203496583355_100000189012 [2,0,0,0,0,0|0,0,0]=2 629 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_100012350776_200000210301 [2,0,0,0,0,0|0,1,0]=3 630 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_200000210301_100012350776 [2,0,0,0,0,0|0,1,0]=3 631 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_100012350776_200025704644 [2,0,0,0,0,0|0,1,0]=3 632 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012350776 [2,0,0,0,0,0|0,1,0]=3 633 B13R1.3088 COC(=O)c1ccc(c(n1)Br)OC 34a_200009815348_200000210301 [2,0,0,0,0,0|2,0,0]=4 634 B13R1.3088 COC(=O)c1ccc(c(n1)Br)OC 7a_200009815348_200000210301 [2,0,0,0,0,0|2,0,0]=4 635 B13R1.3088 COC(=O)c1ccc(c(n1)Br)O[13CH3] 34a_200009815348_200025704644 [2,0,0,0,0,0|2,0,0]=4 636 B13R1.3088 COC(=O)c1ccc(c(n1)Br)O[13CH3] 7a_200009815348_200025704644 [2,0,0,0,0,0|2,0,0]=4 637 B13R1.3088 COC(=O)c1ccc(c(n1)C)SC 62a_100010207261_200000210301 [2,0,0,0,0,0|1,1,0]=4 638 B13R1.3088 COC(=O)c1ccc(c(n1)C)SC 62a_200000210301_100010207261 [2,0,0,0,0,0|1,1,0]=4 639 B13R1.3088 COC(=O)c1ccc(c(n1)C)S[13CH3] 62a_100010207261_200025704644 [2,0,0,0,0,0|1,1,0]=4 640 B13R1.3088 COC(=O)c1ccc(c(n1)C)S[13CH3] 62a_200025704644_100010207261 [2,0,0,0,0,0|1,1,0]=4 641 B13R1.3088 COC(=O)c1ccc(c(n1)O)OC 271570a_203496583355_100010205418 [2,0,0,0,0,0|1,0,0]=3 642 B13R1.3088 COC(=O)c1ccc(c(n1)O)SC 62a_200000210301_100010189637 [2,0,0,0,0,0|1,1,0]=4 643 B13R1.3088 COC(=O)c1ccc(c(n1)O)S[13CH3] 62a_200025704644_100010189637 [2,0,0,0,0,0|1,1,0]=4 644 B13R1.3088 COC(=O)c1cnc(c(c1)Br)OC 34a_100015192546_200000210301 [2,0,0,0,0,0|2,0,0]=4 645 B13R1.3088 COC(=O)c1cnc(c(c1)Br)O[13CH3] 34a_100015192546_200025704644 [2,0,0,0,0,0|2,0,0]=4 646 B13R1.3088 COC(=O)c1cnc(c(c1)C)SC 62a_200000210301_100009862495 [2,0,0,0,0,0|1,1,0]=4 647 B13R1.3088 COC(=O)c1cnc(c(c1)C)SC 62a_200010136688_200000210301 [2,0,0,0,0,0|1,1,0]=4 648 B13R1.3088 COC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200010136688_200025704644 [2,0,0,0,0,0|1,1,0]=4 649 B13R1.3088 COC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009862495 [2,0,0,0,0,0|1,1,0]=4 650 B13R1.3088 COC(=O)c1cnc(c(c1)O)OC 271570a_203496583355_100010189640 [2,0,0,0,0,0|1,0,0]=3 651 B13R1.3088 COC(=O)c1cnc(c(c1)O)SC 62a_100010999399_200000210301 [2,0,0,0,0,0|1,1,0]=4 652 B13R1.3088 COC(=O)c1cnc(c(c1)O)SC 62a_200000210301_100010999399 [2,0,0,0,0,0|1,1,0]=4 653 B13R1.3088 COC(=O)c1cnc(c(c1)O)S[13CH3] 62a_100010999399_200025704644 [2,0,0,0,0,0|1,1,0]=4 654 B13R1.3088 COC(=O)c1cnc(c(c1)O)S[13CH3] 62a_200025704644_100010999399 [2,0,0,0,0,0|1,1,0]=4 655 B13R1.3088 COc1ccc(cc1C)C(=O)CF 1458a_100011202886_100015361967 [2,0,0,0,0,0|2,0,0]=4 656 B13R1.3088 COc1ccc(cc1O)C(=O)CF 1458a_100000766810_100015361967 [2,0,0,0,0,0|2,0,0]=4 657 B13R1.3088 COc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000186317 [2,0,0,0,0,0|2,0,0]=4 658 B13R1.3091 C=C(C)c1ccc(c(c1)CC)OC 271570a_100000694244_200010179862 [2,0,0,0,0,0|2,0,0]=4 659 B13R1.3091 C=C(C)c1ccc(c(c1)OC)CC 271570a_100000694244_200010710398 [2,0,0,0,0,0|2,0,0]=4 660 B13R1.3091 C=C(C)c1ccc(c(c1)OC)OC 271570a_100000694244_100000187503 [2,0,0,0,0,0|1,0,0]=3 661 B13R1.3091 C=C(C)c1ccc(c(c1)OC)SC 271570a_100000694244_200011001119 [2,0,0,0,0,0|1,1,0]=4 662 B13R1.3091 C=C(C)c1ccc(c(c1)SC)OC 271570a_100000694244_200009892704 [2,0,0,0,0,0|1,1,0]=4 663 B13R1.3091 C=C(C)c1ccc(c(n1)OC)OC 271570a_100000694244_100010214848 [2,0,0,0,0,0|2,0,0]=4 664 B13R1.3091 C=C(C)c1cnc(c(c1)OC)OC 271570a_100000694244_100010234541 [2,0,0,0,0,0|2,0,0]=4 665 B13R1.3091 C=Cc1cc(ccc1OC)C(=O)C 271570a_100011290941_100000185153 [2,0,0,0,0,0|1,0,1]=4 666 B13R1.3091 C=Cc1ccc(cc1OC)C(=O)C 271570a_100011290941_100010110075 [2,0,0,0,0,0|1,0,1]=4 667 B13R1.3091 CC(=O)c1ccc(c(c1)CCl)O[13CH3] 34a_100000010293_200025704644 [2,0,0,0,0,0|2,0,0]=4 668 B13R1.3091 CC(=O)c1ccc(c(c1)CCl)O[13CH3] 7a_100000010293_200025704644 [2,0,0,0,0,0|2,0,0]=4 669 B13R1.3091 CC(=O)c1ccc(c(c1)CO)O[13CH3] 7a_100000025453_200025704644 [2,0,0,0,0,0|2,0,0]=4 670 B13R1.3091 CNc1cc(ccc1OC)C(=O)N 34a_100000740584_200000210301 [2,0,0,0,0,0|2,0,0]=4 671 B13R1.3091 CNc1ccc(cc1OC)C(=O)N 27a_100102657272_100009817049 [2,0,0,0,0,0|2,0,0]=4 672 B13R1.3091 CNc1ccc(cc1OC)C(=O)N 34a_100011850419_200000210301 [2,0,0,0,0,0|2,0,0]=4 673 B13R1.3091 COc1cc(ccc1C#N)C(=O)C 1458a_100009879710_200000210301 [2,0,0,0,0,0|2,0,0]=4 674 B13R1.3091 COc1cc(ccc1C#N)C(=O)[13CH3] 1458a_100009879710_200025704644 [2,0,0,0,0,0|2,0,0]=4 675 B13R1.3091 COc1cc(ccc1N[13CH3])C(=O)N 34a_100011850419_200025704644 [2,0,0,0,0,0|2,0,0]=4 676 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 34a_100000186468_200025704644 [2,0,0,0,0,0|0,0,0]=2 677 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 7a_100000186468_200025704644 [2,0,0,0,0,0|0,0,0]=2 678 B13R1.3091 COc1cc(ccc1O[13CH3])C(C)O 34a_100000246512_200025704644 [2,0,0,0,0,0|0,0,2]=4 679 B13R1.3091 COc1cc(ccc1O[13CH3])C(C)O 7a_100000246512_200025704644 [2,0,0,0,0,0|0,0,2]=4 680 B13R1.3091 COc1cc(ccc1O[13CH3])[N+](=O)[O-] 34a_100000742293_200025704644 [2,0,0,0,0,0|1,0,1]=4 681 B13R1.3091 COc1cc(ccc1O[13CH3])[N+](=O)[O-] 7a_100000742293_200025704644 [2,0,0,0,0,0|1,0,1]=4 682 B13R1.3091 COc1cc(ccc1SC)C(=O)C 62a_100010110075_200000210301 [2,0,0,0,0,0|0,1,0]=3 683 B13R1.3091 COc1cc(ccc1SC)C(=O)N 62a_100009817049_200000210301 [2,0,0,0,0,0|1,1,0]=4 684 B13R1.3091 COc1cc(ccc1S[13CH3])C(=O)C 62a_100010110075_200025704644 [2,0,0,0,0,0|0,1,0]=3 685 B13R1.3091 COc1cc(ccc1S[13CH3])C(=O)N 62a_100009817049_200025704644 [2,0,0,0,0,0|1,1,0]=4 686 B13R1.3091 COc1ccc(cc1C#N)C(=O)C 1458a_100011999887_200000210301 [2,0,0,0,0,0|2,0,0]=4 687 B13R1.3091 COc1ccc(cc1C#N)C(=O)[13CH3] 1458a_100011999887_200025704644 [2,0,0,0,0,0|2,0,0]=4 688 B13R1.3091 COc1ccc(cc1CCl)C(=O)C 34a_100000010293_200000210301 [2,0,0,0,0,0|2,0,0]=4 689 B13R1.3091 COc1ccc(cc1CCl)C(=O)C 7a_100000010293_200000210301 [2,0,0,0,0,0|2,0,0]=4 690 B13R1.3091 COc1ccc(cc1CO)C(=O)C 7a_100000025453_200000210301 [2,0,0,0,0,0|2,0,0]=4 691 B13R1.3091 COc1ccc(cc1N[13CH3])C(=O)N 34a_100000740584_200025704644 [2,0,0,0,0,0|2,0,0]=4 692 B13R1.3091 COc1ccc(cc1OC)C(=O)C 1458a_100000211223_200000210301 [2,0,0,0,0,0|0,0,0]=2 693 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000186468_200000210301 [2,0,0,0,0,0|0,0,0]=2 694 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000732934_200000210301 [2,0,0,0,0,0|0,0,0]=2 695 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000186468_200000210301 [2,0,0,0,0,0|0,0,0]=2 696 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000732934_200000210301 [2,0,0,0,0,0|0,0,0]=2 697 B13R1.3091 COc1ccc(cc1OC)C(=O)[13CH3] 1458a_100000211223_200025704644 [2,0,0,0,0,0|0,0,0]=2 698 B13R1.3091 COc1ccc(cc1OC)C(C)O 34a_100000246512_200000210301 [2,0,0,0,0,0|0,0,2]=4 699 B13R1.3091 COc1ccc(cc1OC)C(C)O 7a_100000246512_200000210301 [2,0,0,0,0,0|0,0,2]=4 700 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 34a_100000211812_200000210301 [2,0,0,0,0,0|1,0,1]=4 701 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 34a_100000742293_200000210301 [2,0,0,0,0,0|1,0,1]=4 702 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 7a_100000211812_200000210301 [2,0,0,0,0,0|1,0,1]=4 703 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 7a_100000742293_200000210301 [2,0,0,0,0,0|1,0,1]=4 704 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 34a_100000732934_200025704644 [2,0,0,0,0,0|0,0,0]=2 705 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 7a_100000732934_200025704644 [2,0,0,0,0,0|0,0,0]=2 706 B13R1.3091 COc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000211812_200025704644 [2,0,0,0,0,0|1,0,1]=4 707 B13R1.3091 COc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000211812_200025704644 [2,0,0,0,0,0|1,0,1]=4 708 B13R1.3091 COc1ccc(cc1SC)C(=O)C 62a_100000185153_200000210301 [2,0,0,0,0,0|0,1,0]=3 709 B13R1.3091 COc1ccc(cc1SC)C(=O)C 62a_200000210301_100000039561 [2,0,0,0,0,0|0,1,0]=3 710 B13R1.3091 COc1ccc(cc1S[13CH3])C(=O)C 62a_100000185153_200025704644 [2,0,0,0,0,0|0,1,0]=3 711 B13R1.3091 COc1ccc(cc1S[13CH3])C(=O)C 62a_200025704644_100000039561 [2,0,0,0,0,0|0,1,0]=3 712 B13R1.2422 C=Cc1ccc(c(c1C)OC)OC 271570a_100011290941_100010000156 [2,0,0,0,0,0|1,0,1]=4 713 B13R1.2422 CNc1ccc(c(c1OC)F)OC 34a_100000070076_200000210301 [2,0,0,0,0,0|2,0,0]=4 714 B13R1.2422 COc1c(ccc(c1F)C=O)SC 62a_200000210301_200010981996 [2,0,0,0,0,0|1,1,0]=4 715 B13R1.2422 COc1c(ccc(c1F)C=O)SC 62a_200010981996_200000210301 [2,0,0,0,0,0|1,1,0]=4 716 B13R1.2422 COc1c(ccc(c1F)C=O)S[13CH3] 62a_200010981996_200025704644 [2,0,0,0,0,0|1,1,0]=4 717 B13R1.2422 COc1c(ccc(c1F)C=O)S[13CH3] 62a_200025704644_200010981996 [2,0,0,0,0,0|1,1,0]=4 718 B13R1.2422 COc1ccc(c(c1C)OC)SC 62a_100010234078_200000210301 [2,0,0,0,0,0|1,1,0]=4 719 B13R1.2422 COc1ccc(c(c1C)OC)SC 62a_200000210301_100010234078 [2,0,0,0,0,0|1,1,0]=4 720 B13R1.2422 COc1ccc(c(c1C)OC)S[13CH3] 62a_100010234078_200025704644 [2,0,0,0,0,0|1,1,0]=4 721 B13R1.2422 COc1ccc(c(c1C)OC)S[13CH3] 62a_200025704644_100010234078 [2,0,0,0,0,0|1,1,0]=4 722 B13R1.2422 COc1ccc(c(c1F)OC)N[13CH3] 34a_100000070076_200025704644 [2,0,0,0,0,0|2,0,0]=4 723 B13R1.2422 COc1ccc(c(c1F)OC)SC 62a_200000210301_200010341284 [2,0,0,0,0,0|1,1,0]=4 724 B13R1.2422 COc1ccc(c(c1F)OC)SC 62a_200010341284_200000210301 [2,0,0,0,0,0|1,1,0]=4 725 B13R1.2422 COc1ccc(c(c1F)OC)S[13CH3] 62a_200010341284_200025704644 [2,0,0,0,0,0|1,1,0]=4 726 B13R1.2422 COc1ccc(c(c1F)OC)S[13CH3] 62a_200025704644_200010341284 [2,0,0,0,0,0|1,1,0]=4 727 B13R1.2422 COc1ccc(c(c1F)SC)OC 62a_200000210301_200016180952 [2,0,0,0,0,0|1,1,0]=4 728 B13R1.2422 COc1ccc(c(c1F)SC)OC 62a_200016180952_200000210301 [2,0,0,0,0,0|1,1,0]=4 729 B13R1.2422 COc1ccc(c(c1F)S[13CH3])OC 62a_200016180952_200025704644 [2,0,0,0,0,0|1,1,0]=4 730 B13R1.2422 COc1ccc(c(c1F)S[13CH3])OC 62a_200025704644_200016180952 [2,0,0,0,0,0|1,1,0]=4 731 B13R1.2422 COc1ccc(c(c1OC)C)SC 62a_200000210301_100010000156 [2,0,0,0,0,0|1,1,0]=4 732 B13R1.2422 COc1ccc(c(c1OC)C)S[13CH3] 62a_200025704644_100010000156 [2,0,0,0,0,0|1,1,0]=4 733 B13R1.2422 COc1ccc(c(c1OC)O)C=O 271570a_203496583355_100009814707 [2,0,0,0,0,0|0,0,0]=2 734 B13R1.2422 COc1ccc(c(c1SC)O)C=O 62a_200000210301_100016072024 [2,0,0,0,0,0|0,1,0]=3 735 B13R1.2422 COc1ccc(c(c1S[13CH3])O)C=O 62a_200025704644_100016072024 [2,0,0,0,0,0|0,1,0]=3 736 B13R1.3096 C=C(C)c1ccc(c(c1C)C)OC 271570a_100000694244_100000049725 [2,0,0,0,0,0|2,0,0]=4 737 B13R1.3096 COc1ccc(c(c1C)C)C(=O)C 1458a_200000082569_200000210301 [2,0,0,0,0,0|1,0,0]=3 738 B13R1.3096 COc1ccc(c(c1C)C)C(=O)[13CH3] 1458a_200000082569_200025704644 [2,0,0,0,0,0|1,0,0]=3 739 B13R1.3096 COc1ccc(c(c1F)F)C(=O)C 1458a_100000061877_200000210301 [2,0,0,0,0,0|2,0,0]=4 740 B13R1.3096 COc1ccc(c(c1F)F)C(=O)[13CH3] 1458a_100000061877_200025704644 [2,0,0,0,0,0|2,0,0]=4 741 B13R1.3096 COc1ccc(c(c1O)N)C(=O)C 271570a_203496583355_100010236346 [2,0,0,0,0,0|1,0,0]=3 742 B13R1.3096 COc1ccc(c(c1O)O)C(=O)C 1458a_100000045701_200000210301 [2,0,0,0,0,0|0,0,0]=2 743 B13R1.3096 COc1ccc(c(c1O)O)C(=O)[13CH3] 1458a_100000045701_200025704644 [2,0,0,0,0,0|0,0,0]=2 744 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Br 1458a_100009816242_200000210301 [2,0,0,0,0,0|2,0,0]=4 745 B13R1.3230 COc1c(ccc(c1F)C(=O)C)Cl 1458a_100010116254_200000210301 [2,0,0,0,0,0|2,0,0]=4 746 B13R1.3230 COc1c(ccc(c1F)C(=O)C)F 1458a_100000061937_200000210301 [2,0,0,0,0,0|2,0,0]=4 747 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100009816242_200025704644 [2,0,0,0,0,0|2,0,0]=4 748 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100010116254_200025704644 [2,0,0,0,0,0|2,0,0]=4 749 B13R1.3230 COc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000061937_200025704644 [2,0,0,0,0,0|2,0,0]=4 750 B13R1.95 C=Cc1ccc(c(c1)O)C(=O)OC 271570a_100011290941_100000062286 [2,0,0,0,0,0|1,0,1]=4 751 B13R1.95 CCC(=O)c1ccc(cc1Br)OC 1458a_100000748873_100000210202 [2,0,0,0,0,0|2,0,0]=4 752 B13R1.95 CCC(=O)c1ccc(cc1C)OC 1458a_100000763155_100000210202 [2,0,0,0,0,0|2,0,0]=4 753 B13R1.95 CCC(=O)c1ccc(cc1Cl)OC 1458a_100000753557_100000210202 [2,0,0,0,0,0|2,0,0]=4 754 B13R1.95 CCC(=O)c1ccc(cc1F)OC 1458a_100000198494_100000210202 [2,0,0,0,0,0|2,0,0]=4 755 B13R1.95 CCC(=O)c1ccc(cc1I)OC 1458a_100000688016_100000210202 [2,0,0,0,0,0|2,0,0]=4 756 B13R1.95 CCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000210202 [2,0,0,0,0,0|1,0,0]=3 757 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 11a_106832991635_100000748873 [2,0,0,0,0,0|2,0,0]=4 758 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 1626a_100102657272_100000748873 [2,0,0,0,0,0|2,0,0]=4 759 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 240690a_100102657272_100000748873 [2,0,0,0,0,0|2,0,0]=4 760 B13R1.95 CNC(=O)c1ccc(cc1Br)OC 527a_100102657272_100000748873 [2,0,0,0,0,0|2,0,0]=4 761 B13R1.95 CNC(=O)c1ccc(cc1C)OC 11a_106832991635_100000763155 [2,0,0,0,0,0|2,0,0]=4 762 B13R1.95 CNC(=O)c1ccc(cc1C)OC 1626a_100102657272_100000763155 [2,0,0,0,0,0|2,0,0]=4 763 B13R1.95 CNC(=O)c1ccc(cc1C)OC 240690a_100102657272_100000763155 [2,0,0,0,0,0|2,0,0]=4 764 B13R1.95 CNC(=O)c1ccc(cc1C)OC 527a_100102657272_100000763155 [2,0,0,0,0,0|2,0,0]=4 765 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 11a_106832991635_100000753557 [2,0,0,0,0,0|2,0,0]=4 766 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 1626a_100102657272_100000753557 [2,0,0,0,0,0|2,0,0]=4 767 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 240690a_100102657272_100000753557 [2,0,0,0,0,0|2,0,0]=4 768 B13R1.95 CNC(=O)c1ccc(cc1Cl)OC 527a_100102657272_100000753557 [2,0,0,0,0,0|2,0,0]=4 769 B13R1.95 CNC(=O)c1ccc(cc1F)OC 11a_106832991635_100000198494 [2,0,0,0,0,0|2,0,0]=4 770 B13R1.95 CNC(=O)c1ccc(cc1F)OC 1626a_100102657272_100000198494 [2,0,0,0,0,0|2,0,0]=4 771 B13R1.95 CNC(=O)c1ccc(cc1F)OC 240690a_100102657272_100000198494 [2,0,0,0,0,0|2,0,0]=4 772 B13R1.95 CNC(=O)c1ccc(cc1F)OC 527a_100102657272_100000198494 [2,0,0,0,0,0|2,0,0]=4 773 B13R1.95 CNC(=O)c1ccc(cc1I)OC 11a_106832991635_100000688016 [2,0,0,0,0,0|2,0,0]=4 774 B13R1.95 CNC(=O)c1ccc(cc1I)OC 1626a_100102657272_100000688016 [2,0,0,0,0,0|2,0,0]=4 775 B13R1.95 CNC(=O)c1ccc(cc1I)OC 240690a_100102657272_100000688016 [2,0,0,0,0,0|2,0,0]=4 776 B13R1.95 CNC(=O)c1ccc(cc1I)OC 527a_100102657272_100000688016 [2,0,0,0,0,0|2,0,0]=4 777 B13R1.95 CNC(=O)c1ccc(cc1O)NC 34a_100000223174_200000210301 [2,0,0,0,0,0|2,0,0]=4 778 B13R1.95 CNC(=O)c1ccc(cc1O)N[13CH3] 34a_100000223174_200025704644 [2,0,0,0,0,0|2,0,0]=4 779 B13R1.95 CNC(=O)c1ccc(cc1O)OC 11a_106832991635_100000212123 [2,0,0,0,0,0|1,0,0]=3 780 B13R1.95 CNC(=O)c1ccc(cc1O)OC 240690a_100102657272_100000212123 [2,0,0,0,0,0|1,0,0]=3 781 B13R1.95 CNC(=O)c1ccc(cc1O)OC 527a_100102657272_100000212123 [2,0,0,0,0,0|1,0,0]=3 782 B13R1.95 COC(=O)c1ccc(cc1Br)OC 34a_100010150825_200000210301 [2,0,0,0,0,0|1,0,0]=3 783 B13R1.95 COC(=O)c1ccc(cc1Br)OC 7a_100010150825_200000210301 [2,0,0,0,0,0|1,0,0]=3 784 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 34a_100010150825_200025704644 [2,0,0,0,0,0|1,0,0]=3 785 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 7a_100010150825_200025704644 [2,0,0,0,0,0|1,0,0]=3 786 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_100010247156_200000210301 [2,0,0,0,0,0|1,1,0]=4 787 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_200000210301_100010247156 [2,0,0,0,0,0|1,1,0]=4 788 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_100010247156_200025704644 [2,0,0,0,0,0|1,1,0]=4 789 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_200025704644_100010247156 [2,0,0,0,0,0|1,1,0]=4 790 B13R1.95 COC(=O)c1ccc(cc1C)OC 34a_100012000157_200000210301 [2,0,0,0,0,0|1,0,0]=3 791 B13R1.95 COC(=O)c1ccc(cc1C)OC 7a_100012000157_200000210301 [2,0,0,0,0,0|1,0,0]=3 792 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 34a_100012000157_200025704644 [2,0,0,0,0,0|1,0,0]=3 793 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 7a_100012000157_200025704644 [2,0,0,0,0,0|1,0,0]=3 794 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_100000747612_200000210301 [2,0,0,0,0,0|1,1,0]=4 795 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_200000210301_100000747612 [2,0,0,0,0,0|1,1,0]=4 796 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_100000747612_200025704644 [2,0,0,0,0,0|1,1,0]=4 797 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100000747612 [2,0,0,0,0,0|1,1,0]=4 798 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 34a_100000081488_200000210301 [2,0,0,0,0,0|1,0,0]=3 799 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 7a_100000081488_200000210301 [2,0,0,0,0,0|1,0,0]=3 800 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100000081488_200025704644 [2,0,0,0,0,0|1,0,0]=3 801 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100000081488_200025704644 [2,0,0,0,0,0|1,0,0]=3 802 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_100000060724_200000210301 [2,0,0,0,0,0|1,1,0]=4 803 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_200000210301_100000060724 [2,0,0,0,0,0|1,1,0]=4 804 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_100000060724_200025704644 [2,0,0,0,0,0|1,1,0]=4 805 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_200025704644_100000060724 [2,0,0,0,0,0|1,1,0]=4 806 B13R1.95 COC(=O)c1ccc(cc1F)OC 34a_100011999631_200000210301 [2,0,0,0,0,0|1,0,0]=3 807 B13R1.95 COC(=O)c1ccc(cc1F)OC 7a_100011999631_200000210301 [2,0,0,0,0,0|1,0,0]=3 808 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 34a_100011999631_200025704644 [2,0,0,0,0,0|1,0,0]=3 809 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 7a_100011999631_200025704644 [2,0,0,0,0,0|1,0,0]=3 810 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_100000216654_200000210301 [2,0,0,0,0,0|1,1,0]=4 811 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_200000210301_100000216654 [2,0,0,0,0,0|1,1,0]=4 812 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_100000216654_200025704644 [2,0,0,0,0,0|1,1,0]=4 813 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000216654 [2,0,0,0,0,0|1,1,0]=4 814 B13R1.95 COC(=O)c1ccc(cc1N)OC 34a_100000701581_200000210301 [2,0,0,0,0,0|1,0,0]=3 815 B13R1.95 COC(=O)c1ccc(cc1N)OC 7a_100000701581_200000210301 [2,0,0,0,0,0|1,0,0]=3 816 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 34a_100000701581_200025704644 [2,0,0,0,0,0|1,0,0]=3 817 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 7a_100000701581_200025704644 [2,0,0,0,0,0|1,0,0]=3 818 B13R1.95 COC(=O)c1ccc(cc1N)SC 62a_100011373473_200000210301 [2,0,0,0,0,0|1,1,0]=4 819 B13R1.95 COC(=O)c1ccc(cc1N)S[13CH3] 62a_100011373473_200025704644 [2,0,0,0,0,0|1,1,0]=4 820 B13R1.95 COC(=O)c1ccc(cc1O)C#N 271570a_203496583355_100009832033 [2,0,0,0,0,0|2,0,0]=4 821 B13R1.95 COC(=O)c1ccc(cc1O)C=O 271570a_203496583355_100010630601 [2,0,0,0,0,0|2,0,0]=4 822 B13R1.95 COC(=O)c1ccc(cc1O)OC 271570a_203496583355_100009815674 [2,0,0,0,0,0|0,0,0]=2 823 B13R1.95 COC(=O)c1ccc(cc1O)SC 62a_200000210301_100000062286 [2,0,0,0,0,0|0,1,0]=3 824 B13R1.95 COC(=O)c1ccc(cc1O)S[13CH3] 62a_200025704644_100000062286 [2,0,0,0,0,0|0,1,0]=3 825 B13R1.95 COC(=O)c1ccc(nc1O)OC 271570a_203496583355_100010136187 [2,0,0,0,0,0|1,0,0]=3 826 B13R1.95 COC(=O)c1cnc(cc1O)OC 271570a_203496583355_100010136350 [2,0,0,0,0,0|1,0,0]=3 827 B13R1.95 COC(=O)c1ncc(cc1Cl)OC 34a_100009855505_200000210301 [2,0,0,0,0,0|2,0,0]=4 828 B13R1.95 COC(=O)c1ncc(cc1Cl)OC 7a_100009855505_200000210301 [2,0,0,0,0,0|2,0,0]=4 829 B13R1.95 COC(=O)c1ncc(cc1Cl)O[13CH3] 34a_100009855505_200025704644 [2,0,0,0,0,0|2,0,0]=4 830 B13R1.95 COC(=O)c1ncc(cc1Cl)O[13CH3] 7a_100009855505_200025704644 [2,0,0,0,0,0|2,0,0]=4 831 B13R1.95 COC(=O)c1ncc(cc1O)SC 62a_200000210301_100010071521 [2,0,0,0,0,0|1,1,0]=4 832 B13R1.95 COC(=O)c1ncc(cc1O)S[13CH3] 62a_200025704644_100010071521 [2,0,0,0,0,0|1,1,0]=4 833 B13R1.95 COc1ccc(c(c1)O)C(=O)CF 1458a_100000212123_100015361967 [2,0,0,0,0,0|2,0,0]=4 834 B13R1.1254 CC=Cc1ccc(c(c1C)C)OC 271570a_100016259895_100000049725 [2,0,0,0,0,0|2,0,0]=4 835 B13R1.1808 CCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210202 [2,0,0,0,0,0|2,0,0]=4 836 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_100000210202 [2,0,0,0,0,0|2,0,0]=4 837 B13R1.1808 CCC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_100000210202 [2,0,0,0,0,0|2,0,0]=4 838 B13R1.1808 CCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210202 [2,0,0,0,0,0|1,0,0]=3 839 B13R1.1808 CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210202 [2,0,0,0,0,0|1,0,0]=3 840 B13R1.1808 CNC(=O)c1ccc(c(c1Cl)O)O 240690a_100102657272_100009910189 [2,0,0,0,0,0|2,0,0]=4 841 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 11a_106832991635_100010768504 [2,0,0,0,0,0|2,0,0]=4 842 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 1626a_100102657272_100010768504 [2,0,0,0,0,0|2,0,0]=4 843 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 240690a_100102657272_100010768504 [2,0,0,0,0,0|2,0,0]=4 844 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 527a_100102657272_100010768504 [2,0,0,0,0,0|2,0,0]=4 845 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 11a_106832991635_100010188221 [2,0,0,0,0,0|2,0,0]=4 846 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 1626a_100102657272_100010188221 [2,0,0,0,0,0|2,0,0]=4 847 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 240690a_100102657272_100010188221 [2,0,0,0,0,0|2,0,0]=4 848 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 527a_100102657272_100010188221 [2,0,0,0,0,0|2,0,0]=4 849 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 240690a_100102657272_100000742916 [2,0,0,0,0,0|1,0,0]=3 850 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 527a_100102657272_100000742916 [2,0,0,0,0,0|1,0,0]=3 851 B13R1.1808 COC(=O)c1ccc(c(c1C)C)O 271570a_203496583355_100010761469 [2,0,0,0,0,0|1,0,0]=3 852 B13R1.1808 COC(=O)c1ccc(c(c1C)F)O 271570a_203496583355_100010291505 [2,0,0,0,0,0|2,0,0]=4 853 B13R1.1808 COC(=O)c1ccc(c(c1C)O)C 271570a_203496583355_200010734123 [2,0,0,0,0,0|1,0,0]=3 854 B13R1.1808 COC(=O)c1ccc(c(c1C)O)N 271570a_203496583355_100010764323 [2,0,0,0,0,0|2,0,0]=4 855 B13R1.1808 COC(=O)c1ccc(c(c1C)O)O 271570a_203496583355_100010889012 [2,0,0,0,0,0|1,0,0]=3 856 B13R1.1808 COC(=O)c1ccc(c(c1Cl)O)N 271570a_203496583355_200016031531 [2,0,0,0,0,0|2,0,0]=4 857 B13R1.1808 COC(=O)c1ccc(c(c1F)C)O 271570a_203496583355_100010172522 [2,0,0,0,0,0|1,0,0]=3 858 B13R1.1808 COC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010982024 [2,0,0,0,0,0|2,0,0]=4 859 B13R1.1808 COC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100000697099 [2,0,0,0,0,0|2,0,0]=4 860 B13R1.1808 COC(=O)c1ccc(c(c1F)O)O 271570a_203496583355_100011096176 [2,0,0,0,0,0|1,0,0]=3 861 B13R1.1808 COC(=O)c1ccc(c(c1N)C)O 271570a_203496583355_100000764893 [2,0,0,0,0,0|1,0,0]=3 862 B13R1.1808 COC(=O)c1ccc(c(c1N)F)O 271570a_203496583355_100022009169 [2,0,0,0,0,0|2,0,0]=4 863 B13R1.1808 COC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_100010710315 [2,0,0,0,0,0|2,0,0]=4 864 B13R1.1808 COC(=O)c1ccc(c(c1O)F)O 271570a_203496583355_100011092008 [2,0,0,0,0,0|1,0,0]=3 865 B13R1.1808 Cc1ccc(c(c1C)O)C(=O)CF 1458a_100000742916_100015361967 [2,0,0,0,0,0|2,0,0]=4 866 B13R1.1808 O=C(CF)c1ccc(c(c1O)O)O 1458a_100000037941_100015361967 [2,0,0,0,0,0|2,0,0]=4 867 B13R1.82 C=Cc1cccc(c1O)C(=O)OC 271570a_100011290941_100009816214 [2,0,0,0,0,0|1,0,1]=4 868 B13R1.82 CCC(=O)c1cccc(c1Br)OC 1458a_100010245468_100000210202 [2,0,0,0,0,0|2,0,0]=4 869 B13R1.82 CCC(=O)c1cccc(c1C)OC 1458a_100011217801_100000210202 [2,0,0,0,0,0|2,0,0]=4 870 B13R1.82 CCC(=O)c1cccc(c1Cl)OC 1458a_100000068443_100000210202 [2,0,0,0,0,0|2,0,0]=4 871 B13R1.82 CCC(=O)c1cccc(c1F)OC 1458a_100000766180_100000210202 [2,0,0,0,0,0|2,0,0]=4 872 B13R1.82 CCC(=O)c1cccc(c1I)OC 1458a_100010075502_100000210202 [2,0,0,0,0,0|2,0,0]=4 873 B13R1.82 CCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210202 [2,0,0,0,0,0|1,0,0]=3 874 B13R1.82 CCc1cccc(c1O)C(=O)OC 271570a_203496583355_200009992460 [2,0,0,0,0,0|1,0,0]=3 875 B13R1.82 CNC(=O)c1cccc(c1Br)OC 11a_106832991635_100010245468 [2,0,0,0,0,0|2,0,0]=4 876 B13R1.82 CNC(=O)c1cccc(c1Br)OC 1626a_100102657272_100010245468 [2,0,0,0,0,0|2,0,0]=4 877 B13R1.82 CNC(=O)c1cccc(c1Br)OC 240690a_100102657272_100010245468 [2,0,0,0,0,0|2,0,0]=4 878 B13R1.82 CNC(=O)c1cccc(c1Br)OC 527a_100102657272_100010245468 [2,0,0,0,0,0|2,0,0]=4 879 B13R1.82 CNC(=O)c1cccc(c1C)OC 11a_106832991635_100011217801 [2,0,0,0,0,0|2,0,0]=4 880 B13R1.82 CNC(=O)c1cccc(c1C)OC 1626a_100102657272_100011217801 [2,0,0,0,0,0|2,0,0]=4 881 B13R1.82 CNC(=O)c1cccc(c1C)OC 240690a_100102657272_100011217801 [2,0,0,0,0,0|2,0,0]=4 882 B13R1.82 CNC(=O)c1cccc(c1C)OC 527a_100102657272_100011217801 [2,0,0,0,0,0|2,0,0]=4 883 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 11a_106832991635_100000068443 [2,0,0,0,0,0|2,0,0]=4 884 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 1626a_100102657272_100000068443 [2,0,0,0,0,0|2,0,0]=4 885 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 240690a_100102657272_100000068443 [2,0,0,0,0,0|2,0,0]=4 886 B13R1.82 CNC(=O)c1cccc(c1Cl)OC 527a_100102657272_100000068443 [2,0,0,0,0,0|2,0,0]=4 887 B13R1.82 CNC(=O)c1cccc(c1F)OC 11a_106832991635_100000766180 [2,0,0,0,0,0|2,0,0]=4 888 B13R1.82 CNC(=O)c1cccc(c1F)OC 1626a_100102657272_100000766180 [2,0,0,0,0,0|2,0,0]=4 889 B13R1.82 CNC(=O)c1cccc(c1F)OC 240690a_100102657272_100000766180 [2,0,0,0,0,0|2,0,0]=4 890 B13R1.82 CNC(=O)c1cccc(c1F)OC 527a_100102657272_100000766180 [2,0,0,0,0,0|2,0,0]=4 891 B13R1.82 CNC(=O)c1cccc(c1I)OC 11a_106832991635_100010075502 [2,0,0,0,0,0|2,0,0]=4 892 B13R1.82 CNC(=O)c1cccc(c1I)OC 1626a_100102657272_100010075502 [2,0,0,0,0,0|2,0,0]=4 893 B13R1.82 CNC(=O)c1cccc(c1I)OC 240690a_100102657272_100010075502 [2,0,0,0,0,0|2,0,0]=4 894 B13R1.82 CNC(=O)c1cccc(c1I)OC 527a_100102657272_100010075502 [2,0,0,0,0,0|2,0,0]=4 895 B13R1.82 CNC(=O)c1cccc(c1O)OC 240690a_100102657272_100000212136 [2,0,0,0,0,0|1,0,0]=3 896 B13R1.82 CNC(=O)c1cccc(c1O)OC 527a_100102657272_100000212136 [2,0,0,0,0,0|1,0,0]=3 897 B13R1.82 COC(=O)c1cccc(c1Br)OC 34a_200010230364_200000210301 [2,0,0,0,0,0|1,0,0]=3 898 B13R1.82 COC(=O)c1cccc(c1Br)OC 7a_200010230364_200000210301 [2,0,0,0,0,0|1,0,0]=3 899 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 34a_200010230364_200025704644 [2,0,0,0,0,0|1,0,0]=3 900 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 7a_200010230364_200025704644 [2,0,0,0,0,0|1,0,0]=3 901 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_100010240208_200000210301 [2,0,0,0,0,0|1,1,0]=4 902 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_200000210301_100010240208 [2,0,0,0,0,0|1,1,0]=4 903 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_100010240208_200025704644 [2,0,0,0,0,0|1,1,0]=4 904 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_200025704644_100010240208 [2,0,0,0,0,0|1,1,0]=4 905 B13R1.82 COC(=O)c1cccc(c1C)OC 34a_100011999632_200000210301 [2,0,0,0,0,0|1,0,0]=3 906 B13R1.82 COC(=O)c1cccc(c1C)OC 7a_100011999632_200000210301 [2,0,0,0,0,0|1,0,0]=3 907 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 34a_100011999632_200025704644 [2,0,0,0,0,0|1,0,0]=3 908 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 7a_100011999632_200025704644 [2,0,0,0,0,0|1,0,0]=3 909 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_100012298220_200000210301 [2,0,0,0,0,0|1,1,0]=4 910 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_200000210301_100012298220 [2,0,0,0,0,0|1,1,0]=4 911 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_100012298220_200025704644 [2,0,0,0,0,0|1,1,0]=4 912 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012298220 [2,0,0,0,0,0|1,1,0]=4 913 B13R1.82 COC(=O)c1cccc(c1Cl)OC 34a_100009866855_200000210301 [2,0,0,0,0,0|1,0,0]=3 914 B13R1.82 COC(=O)c1cccc(c1Cl)OC 7a_100009866855_200000210301 [2,0,0,0,0,0|1,0,0]=3 915 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 34a_100009866855_200025704644 [2,0,0,0,0,0|1,0,0]=3 916 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 7a_100009866855_200025704644 [2,0,0,0,0,0|1,0,0]=3 917 B13R1.82 COC(=O)c1cccc(c1F)OC 34a_100009854753_200000210301 [2,0,0,0,0,0|1,0,0]=3 918 B13R1.82 COC(=O)c1cccc(c1F)OC 7a_100009854753_200000210301 [2,0,0,0,0,0|1,0,0]=3 919 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 34a_100009854753_200025704644 [2,0,0,0,0,0|1,0,0]=3 920 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 7a_100009854753_200025704644 [2,0,0,0,0,0|1,0,0]=3 921 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_100012355674_200000210301 [2,0,0,0,0,0|1,1,0]=4 922 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_200000210301_100012355674 [2,0,0,0,0,0|1,1,0]=4 923 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_100012355674_200025704644 [2,0,0,0,0,0|1,1,0]=4 924 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355674 [2,0,0,0,0,0|1,1,0]=4 925 B13R1.82 COC(=O)c1cccc(c1N)OC 34a_100015205654_200000210301 [2,0,0,0,0,0|1,0,0]=3 926 B13R1.82 COC(=O)c1cccc(c1N)OC 7a_100015205654_200000210301 [2,0,0,0,0,0|1,0,0]=3 927 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 34a_100015205654_200025704644 [2,0,0,0,0,0|1,0,0]=3 928 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 7a_100015205654_200025704644 [2,0,0,0,0,0|1,0,0]=3 929 B13R1.82 COC(=O)c1cccc(c1N)SC 62a_100011356556_200000210301 [2,0,0,0,0,0|1,1,0]=4 930 B13R1.82 COC(=O)c1cccc(c1N)S[13CH3] 62a_100011356556_200025704644 [2,0,0,0,0,0|1,1,0]=4 931 B13R1.82 COC(=O)c1cccc(c1O)OC 271570a_203496583355_100010189551 [2,0,0,0,0,0|0,0,0]=2 932 B13R1.82 COC(=O)c1cccc(c1O)SC 62a_100009816214_200000210301 [2,0,0,0,0,0|0,1,0]=3 933 B13R1.82 COC(=O)c1cccc(c1O)S[13CH3] 62a_100009816214_200025704644 [2,0,0,0,0,0|0,1,0]=3 934 B13R1.82 COc1cccc(c1O)C(=O)CF 1458a_100000212136_100015361967 [2,0,0,0,0,0|2,0,0]=4 935 B15R1.374 CCC(=O)c1cc(c(c(c1)OC)OC)Cl 1458a_100000180162_100000210202 [1,1,0,0,0,0|1,0,0]=3 936 B15R1.374 CCC(=O)c1cc(c(c(c1)OC)OC)O 1458a_100000032013_100000210202 [1,1,0,0,0,0|1,0,0]=3 937 B15R1.374 CNC(=O)c1cc(c(c(c1)OC)OC)Cl 11a_106832991635_100000180162 [1,1,0,0,0,0|1,0,0]=3 938 B15R1.374 CNC(=O)c1cc(c(c(c1)OC)OC)Cl 1626a_100102657272_100000180162 [1,1,0,0,0,0|1,0,0]=3 939 B15R1.374 CNC(=O)c1cc(c(c(c1)OC)OC)Cl 240690a_100102657272_100000180162 [1,1,0,0,0,0|1,0,0]=3 940 B15R1.374 CNC(=O)c1cc(c(c(c1)OC)OC)Cl 527a_100102657272_100000180162 [1,1,0,0,0,0|1,0,0]=3 941 B15R1.374 CNC(=O)c1cc(c(c(c1)OC)OC)O 240690a_100102657272_100000032013 [1,1,0,0,0,0|1,0,0]=3 942 B15R1.374 CNC(=O)c1cc(c(c(c1)OC)OC)O 527a_100102657272_100000032013 [1,1,0,0,0,0|1,0,0]=3 943 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)Br 34a_200009811556_200000210301 [1,1,0,0,0,0|0,0,0]=2 944 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)Br 7a_200009811556_200000210301 [1,1,0,0,0,0|0,0,0]=2 945 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)F 34a_200010080224_200000210301 [1,1,0,0,0,0|0,0,0]=2 946 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)F 7a_200010080224_200000210301 [1,1,0,0,0,0|0,0,0]=2 947 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)O 271570a_203496583355_100000727075 [1,1,0,0,0,0|0,0,0]=2 948 B15R1.374 COC(=O)c1cc(c(c(c1)OC)O[13CH3])Br 34a_200009811556_200025704644 [1,1,0,0,0,0|0,0,0]=2 949 B15R1.374 COC(=O)c1cc(c(c(c1)OC)O[13CH3])Br 7a_200009811556_200025704644 [1,1,0,0,0,0|0,0,0]=2 950 B15R1.374 COC(=O)c1cc(c(c(c1)O[13CH3])OC)F 34a_200010080224_200025704644 [1,1,0,0,0,0|0,0,0]=2 951 B15R1.374 COC(=O)c1cc(c(c(c1)O[13CH3])OC)F 7a_200010080224_200025704644 [1,1,0,0,0,0|0,0,0]=2 952 B15R1.374 COc1cc(cc(c1OC)Cl)C(=O)CF 1458a_100000180162_100015361967 [1,1,0,0,0,0|2,0,0]=4 953 B15R1.374 COc1cc(cc(c1OC)O)C(=O)CF 1458a_100000032013_100015361967 [1,1,0,0,0,0|2,0,0]=4 954 B15R1.815 C#CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000184674 [1,1,0,0,0,0|1,0,1]=4 955 B15R1.815 C=CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000210623 [1,1,0,0,0,0|1,0,1]=4 956 B15R1.815 C=Cc1cc(ccc1OC)C(=O)OCC 271570a_100011290941_100012360133 [1,1,0,0,0,0|1,0,1]=4 957 B15R1.815 C=Cc1ccc(cc1OC)C(=O)OCC 271570a_100011290941_100010189661 [1,1,0,0,0,0|1,0,1]=4 958 B15R1.815 CCCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000210303 [1,1,0,0,0,0|1,0,0]=3 959 B15R1.815 CCCC(=O)c1ccc(c(c1)OC)OC 34a_200010659475_200000210301 [1,1,0,0,0,0|1,0,0]=3 960 B15R1.815 CCCC(=O)c1ccc(c(c1)OC)OC 7a_200010659475_200000210301 [1,1,0,0,0,0|1,0,0]=3 961 B15R1.815 CCCC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_200010659475_200025704644 [1,1,0,0,0,0|1,0,0]=3 962 B15R1.815 CCCC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_200010659475_200025704644 [1,1,0,0,0,0|1,0,0]=3 963 B15R1.815 CCNC(=O)c1ccc(c(c1)OC)OC 11a_100015525214_100000211223 [1,1,0,0,0,0|1,0,0]=3 964 B15R1.815 CCNC(=O)c1ccc(c(c1)OC)OC 240690a_100015525214_100000211223 [1,1,0,0,0,0|1,0,0]=3 965 B15R1.815 CCNC(=O)c1ccc(c(c1)OC)OC 527a_100015525214_100000211223 [1,1,0,0,0,0|1,0,0]=3 966 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)OC 7a_100000038551_200000210301 [1,1,0,0,0,0|0,0,0]=2 967 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000038551_200025704644 [1,1,0,0,0,0|0,0,0]=2 968 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)SC 62a_100010189661_200000210301 [1,1,0,0,0,0|0,1,0]=3 969 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)SC 62a_200000210301_100010189661 [1,1,0,0,0,0|0,1,0]=3 970 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_100010189661_200025704644 [1,1,0,0,0,0|0,1,0]=3 971 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100010189661 [1,1,0,0,0,0|0,1,0]=3 972 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)CC 62a_200000210301_200012360145 [1,1,0,0,0,0|1,1,0]=4 973 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)CC 62a_200012360145_200000210301 [1,1,0,0,0,0|1,1,0]=4 974 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)OC 62a_100012360133_200000210301 [1,1,0,0,0,0|0,1,0]=3 975 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)OC 62a_200000210301_100012360133 [1,1,0,0,0,0|0,1,0]=3 976 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])CC 62a_200012360145_200025704644 [1,1,0,0,0,0|1,1,0]=4 977 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])CC 62a_200025704644_200012360145 [1,1,0,0,0,0|1,1,0]=4 978 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])OC 62a_100012360133_200025704644 [1,1,0,0,0,0|0,1,0]=3 979 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])OC 62a_200025704644_100012360133 [1,1,0,0,0,0|0,1,0]=3 980 B15R1.815 CCOC(C)c1ccc(c(c1)OC)OC 34a_100000246476_100000210202 [1,1,0,0,0,0|1,0,1]=4 981 B15R1.815 CCOC(C)c1ccc(c(c1)OC)OC 7a_100000246476_100000210202 [1,1,0,0,0,0|1,0,1]=4 982 B15R1.815 CNCC(=O)c1ccc(c(c1)OC)OC 2230a_106832991635_100000184214 [1,1,0,0,0,0|1,0,0]=3 983 B15R1.815 CNCC(=O)c1ccc(c(c1)OC)OC 7a_106832991635_100000184214 [1,1,0,0,0,0|1,0,0]=3 984 B15R1.815 CNNC(=O)c1ccc(c(c1)OC)OC 22a_100016993582_100000211223 [1,1,0,0,0,0|1,0,0]=3 985 B15R1.815 COC[C@H](N)c1ccc(c(c1)OC)OC 34a_100009818805_200000210301 [1,1,0,0,0,0|1,0,1]=4 986 B15R1.815 COc1ccc(cc1OC)C(=O)CC#N 1458a_100000211223_100011214920 [1,1,0,0,0,0|1,0,1]=4 987 B15R1.815 COc1ccc(cc1OC)C(=O)CCF 1458a_100000211223_100011217306 [1,1,0,0,0,0|1,0,0]=3 988 B15R1.815 COc1ccc(cc1OC)C(=O)CCO 1458a_100000211223_100000211926 [1,1,0,0,0,0|1,0,0]=3 989 B15R1.815 COc1ccc(cc1OC)C(=O)CSC 62a_100000184214_200000210301 [1,1,0,0,0,0|0,1,0]=3 990 B15R1.815 COc1ccc(cc1OC)C(=O)CS[13CH3] 62a_100000184214_200025704644 [1,1,0,0,0,0|0,1,0]=3 991 B15R1.815 COc1ccc(cc1OC)C(C)OCF 34a_100000246476_100015361967 [1,1,0,0,0,0|1,0,1]=4 992 B15R1.815 COc1ccc(cc1OC)C(C)OCF 7a_100000246476_100015361967 [1,1,0,0,0,0|1,0,1]=4 993 B15R1.815 COc1ccc(cc1OC)[C@@H](N)CO[13CH3] 34a_100009818805_200025704644 [1,1,0,0,0,0|1,0,1]=4 994 B15R1.1827 C=Cc1cc(c(cc1OC)C(=O)OC)N 271570a_100011290941_100014686525 [1,1,0,0,0,0|1,0,1]=4 995 B15R1.1827 C=Cc1cc(c(cc1OC)C)C(=O)OC 271570a_100011290941_100010236281 [1,1,0,0,0,0|1,0,1]=4 996 B15R1.1827 C=Cc1cc(c(cc1OC)F)C(=O)OC 271570a_100011290941_100015648668 [1,1,0,0,0,0|1,0,1]=4 997 B15R1.1827 C=Cc1cc(c(cc1OC)N)C(=O)OC 271570a_100011290941_100000730826 [1,1,0,0,0,0|1,0,1]=4 998 B15R1.1827 C=Cc1cc(c(cc1OC)O)C(=O)OC 271570a_100011290941_200010007936 [1,1,0,0,0,0|1,0,1]=4 999 B15R1.1827 CCC(=O)c1cc(c(cc1Br)OC)OC 1458a_100011217046_100000210202 [1,1,0,0,0,0|1,0,0]=3 1000 B15R1.1827 CCC(=O)c1cc(c(cc1C)OC)OC 1458a_100000765401_100000210202 [1,1,0,0,0,0|1,0,0]=3 1001 B15R1.1827 CCC(=O)c1cc(c(cc1Cl)OC)OC 1458a_100000692841_100000210202 [1,1,0,0,0,0|1,0,0]=3 1002 B15R1.1827 CCC(=O)c1cc(c(cc1F)OC)OC 1458a_100000687845_100000210202 [1,1,0,0,0,0|1,0,0]=3 1003 B15R1.1827 CCC(=O)c1cc(c(cc1I)OC)OC 1458a_100000749224_100000210202 [1,1,0,0,0,0|1,0,0]=3 1004 B15R1.1827 CCC(=O)c1cc(c(cc1O)OC)OC 1458a_100012177203_100000210202 [1,1,0,0,0,0|1,0,0]=3 1005 B15R1.1827 CNC(=O)c1cc(c(cc1Br)OC)OC 11a_106832991635_100011217046 [1,1,0,0,0,0|1,0,0]=3 1006 B15R1.1827 CNC(=O)c1cc(c(cc1Br)OC)OC 1626a_100102657272_100011217046 [1,1,0,0,0,0|1,0,0]=3 1007 B15R1.1827 CNC(=O)c1cc(c(cc1Br)OC)OC 240690a_100102657272_100011217046 [1,1,0,0,0,0|1,0,0]=3 1008 B15R1.1827 CNC(=O)c1cc(c(cc1Br)OC)OC 527a_100102657272_100011217046 [1,1,0,0,0,0|1,0,0]=3 1009 B15R1.1827 CNC(=O)c1cc(c(cc1C)OC)OC 11a_106832991635_100000765401 [1,1,0,0,0,0|1,0,0]=3 1010 B15R1.1827 CNC(=O)c1cc(c(cc1C)OC)OC 1626a_100102657272_100000765401 [1,1,0,0,0,0|1,0,0]=3 1011 B15R1.1827 CNC(=O)c1cc(c(cc1C)OC)OC 240690a_100102657272_100000765401 [1,1,0,0,0,0|1,0,0]=3 1012 B15R1.1827 CNC(=O)c1cc(c(cc1C)OC)OC 527a_100102657272_100000765401 [1,1,0,0,0,0|1,0,0]=3 1013 B15R1.1827 CNC(=O)c1cc(c(cc1Cl)OC)OC 11a_106832991635_100000692841 [1,1,0,0,0,0|1,0,0]=3 1014 B15R1.1827 CNC(=O)c1cc(c(cc1Cl)OC)OC 1626a_100102657272_100000692841 [1,1,0,0,0,0|1,0,0]=3 1015 B15R1.1827 CNC(=O)c1cc(c(cc1Cl)OC)OC 240690a_100102657272_100000692841 [1,1,0,0,0,0|1,0,0]=3 1016 B15R1.1827 CNC(=O)c1cc(c(cc1Cl)OC)OC 527a_100102657272_100000692841 [1,1,0,0,0,0|1,0,0]=3 1017 B15R1.1827 CNC(=O)c1cc(c(cc1F)OC)OC 11a_106832991635_100000687845 [1,1,0,0,0,0|1,0,0]=3 1018 B15R1.1827 CNC(=O)c1cc(c(cc1F)OC)OC 1626a_100102657272_100000687845 [1,1,0,0,0,0|1,0,0]=3 1019 B15R1.1827 CNC(=O)c1cc(c(cc1F)OC)OC 240690a_100102657272_100000687845 [1,1,0,0,0,0|1,0,0]=3 1020 B15R1.1827 CNC(=O)c1cc(c(cc1F)OC)OC 527a_100102657272_100000687845 [1,1,0,0,0,0|1,0,0]=3 1021 B15R1.1827 CNC(=O)c1cc(c(cc1I)OC)OC 11a_106832991635_100000749224 [1,1,0,0,0,0|1,0,0]=3 1022 B15R1.1827 CNC(=O)c1cc(c(cc1I)OC)OC 1626a_100102657272_100000749224 [1,1,0,0,0,0|1,0,0]=3 1023 B15R1.1827 CNC(=O)c1cc(c(cc1I)OC)OC 240690a_100102657272_100000749224 [1,1,0,0,0,0|1,0,0]=3 1024 B15R1.1827 CNC(=O)c1cc(c(cc1I)OC)OC 527a_100102657272_100000749224 [1,1,0,0,0,0|1,0,0]=3 1025 B15R1.1827 CNC(=O)c1cc(c(cc1O)OC)OC 240690a_100102657272_100012177203 [1,1,0,0,0,0|1,0,0]=3 1026 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)SC 62a_100010236281_200000210301 [1,1,0,0,0,0|0,1,0]=3 1027 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)SC 62a_200000210301_100010236281 [1,1,0,0,0,0|0,1,0]=3 1028 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)S[13CH3] 62a_100010236281_200025704644 [1,1,0,0,0,0|0,1,0]=3 1029 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)S[13CH3] 62a_200025704644_100010236281 [1,1,0,0,0,0|0,1,0]=3 1030 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)SC 62a_100015648668_200000210301 [1,1,0,0,0,0|0,1,0]=3 1031 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)SC 62a_200000210301_100015648668 [1,1,0,0,0,0|0,1,0]=3 1032 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)S[13CH3] 62a_100015648668_200025704644 [1,1,0,0,0,0|0,1,0]=3 1033 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)S[13CH3] 62a_200025704644_100015648668 [1,1,0,0,0,0|0,1,0]=3 1034 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)OC 34a_100009867527_200000210301 [1,1,0,0,0,0|0,0,0]=2 1035 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)OC 7a_100009867527_200000210301 [1,1,0,0,0,0|0,0,0]=2 1036 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)O[13CH3] 34a_100009867527_200025704644 [1,1,0,0,0,0|0,0,0]=2 1037 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)O[13CH3] 7a_100009867527_200025704644 [1,1,0,0,0,0|0,0,0]=2 1038 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)SC 62a_100000730826_200000210301 [1,1,0,0,0,0|0,1,0]=3 1039 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)S[13CH3] 62a_100000730826_200025704644 [1,1,0,0,0,0|0,1,0]=3 1040 B15R1.1827 COC(=O)c1cc(c(cc1N)SC)OC 62a_100014686525_200000210301 [1,1,0,0,0,0|0,1,0]=3 1041 B15R1.1827 COC(=O)c1cc(c(cc1N)S[13CH3])OC 62a_100014686525_200025704644 [1,1,0,0,0,0|0,1,0]=3 1042 B15R1.1827 COC(=O)c1cc(c(cc1O)OC)OC 271570a_203496583355_100000058957 [1,1,0,0,0,0|0,0,0]=2 1043 B15R1.1827 COc1cc(c(cc1OC)C(=O)CBr)F 7a_100010235139_200000210301 [1,1,0,0,0,0|2,0,0]=4 1044 B15R1.1827 COc1cc(c(cc1OC)C(=O)CF)Br 1458a_100011217046_100015361967 [1,1,0,0,0,0|2,0,0]=4 1045 B15R1.1827 COc1cc(c(cc1OC)C(=O)CF)C 1458a_100000765401_100015361967 [1,1,0,0,0,0|2,0,0]=4 1046 B15R1.1827 COc1cc(c(cc1OC)C(=O)CF)Cl 1458a_100000692841_100015361967 [1,1,0,0,0,0|2,0,0]=4 1047 B15R1.1827 COc1cc(c(cc1OC)C(=O)CF)F 1458a_100000687845_100015361967 [1,1,0,0,0,0|2,0,0]=4 1048 B15R1.1827 COc1cc(c(cc1OC)C(=O)CF)I 1458a_100000749224_100015361967 [1,1,0,0,0,0|2,0,0]=4 1049 B15R1.1827 COc1cc(c(cc1OC)C(=O)CF)O 1458a_100012177203_100015361967 [1,1,0,0,0,0|2,0,0]=4 1050 B15R1.1827 COc1cc(c(cc1O[13CH3])F)C(=O)CBr 7a_100010235139_200025704644 [1,1,0,0,0,0|2,0,0]=4 1051 B15R1.3760 C=C(C)c1cc(ccc1CC)C(=O)OC 271570a_100000694244_200012360130 [1,1,0,0,0,0|2,0,0]=4 1052 B15R1.3760 C=C(C)c1cc(ccc1OC)C(=O)OC 271570a_100000694244_100000189012 [1,1,0,0,0,0|1,0,0]=3 1053 B15R1.3760 C=C(C)c1cc(cnc1OC)C(=O)OC 271570a_100000694244_100010189640 [1,1,0,0,0,0|2,0,0]=4 1054 B15R1.3760 C=C(C)c1cc(ncc1OC)C(=O)OC 271570a_100000694244_200010136175 [1,1,0,0,0,0|2,0,0]=4 1055 B15R1.3760 C=C(C)c1nc(ccc1OC)C(=O)OC 271570a_100000694244_100010205418 [1,1,0,0,0,0|2,0,0]=4 1056 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)OC 7a_100000030976_200000210301 [1,1,0,0,0,0|1,0,0]=3 1057 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)O[13CH3] 7a_100000030976_200025704644 [1,1,0,0,0,0|1,0,0]=3 1058 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)SC 62a_200016005208_200000210301 [1,1,0,0,0,0|1,1,0]=4 1059 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)S[13CH3] 62a_200016005208_200025704644 [1,1,0,0,0,0|1,1,0]=4 1060 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)SC 62a_200000210301_200025703530 [1,1,0,0,0,0|1,1,0]=4 1061 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)SC 62a_200025703530_200000210301 [1,1,0,0,0,0|1,1,0]=4 1062 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)S[13CH3] 62a_200025703530_200025704644 [1,1,0,0,0,0|1,1,0]=4 1063 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)S[13CH3] 62a_200025704644_200025703530 [1,1,0,0,0,0|1,1,0]=4 1064 B15R1.3760 COC(=O)c1ccc(c(c1)[N+](=O)[O-])OC 34a_100000188772_200000210301 [1,1,0,0,0,0|2,0,0]=4 1065 B15R1.3760 COC(=O)c1ccc(c(c1)[N+](=O)[O-])OC 7a_100000188772_200000210301 [1,1,0,0,0,0|2,0,0]=4 1066 B15R1.3760 COC(=O)c1ccc(c(c1)[N+](=O)[O-])O[13CH3] 34a_100000188772_200025704644 [1,1,0,0,0,0|2,0,0]=4 1067 B15R1.3760 COC(=O)c1ccc(c(c1)[N+](=O)[O-])O[13CH3] 7a_100000188772_200025704644 [1,1,0,0,0,0|2,0,0]=4 1068 B15R1.4045 C=C(C)c1ccc(cc1OC)C(=O)OC 271570a_100000694244_100009816954 [1,1,0,0,0,0|1,0,0]=3 1069 B15R1.4045 C=C(C)c1ccc(nc1OC)C(=O)OC 271570a_100000694244_100010189641 [1,1,0,0,0,0|2,0,0]=4 1070 B15R1.4045 C=C(C)c1cnc(cc1OC)C(=O)OC 271570a_100000694244_100010136178 [1,1,0,0,0,0|2,0,0]=4 1071 B15R1.4045 C=C(C)c1ncc(cc1OC)C(=O)OC 271570a_100000694244_100010074909 [1,1,0,0,0,0|2,0,0]=4 1072 B15R1.4045 COC(=O)c1ccc(c(c1)OC)[N+](=O)[O-] 34a_100000736507_200000210301 [1,1,0,0,0,0|2,0,0]=4 1073 B15R1.4045 COC(=O)c1ccc(c(c1)OC)[N+](=O)[O-] 7a_100000736507_200000210301 [1,1,0,0,0,0|2,0,0]=4 1074 B15R1.4045 COC(=O)c1ccc(c(c1)O[13CH3])[N+](=O)[O-] 34a_100000736507_200025704644 [1,1,0,0,0,0|2,0,0]=4 1075 B15R1.4045 COC(=O)c1ccc(c(c1)O[13CH3])[N+](=O)[O-] 7a_100000736507_200025704644 [1,1,0,0,0,0|2,0,0]=4 1076 B15R1.4045 COC(=O)c1ccc(c(c1)SC)C(C)C 62a_200000210301_200010236285 [1,1,0,0,0,0|1,1,0]=4 1077 B15R1.4045 COC(=O)c1ccc(c(c1)SC)C(C)C 62a_200010236285_200000210301 [1,1,0,0,0,0|1,1,0]=4 1078 B15R1.4045 COC(=O)c1ccc(c(c1)S[13CH3])C(C)C 62a_200010236285_200025704644 [1,1,0,0,0,0|1,1,0]=4 1079 B15R1.4045 COC(=O)c1ccc(c(c1)S[13CH3])C(C)C 62a_200025704644_200010236285 [1,1,0,0,0,0|1,1,0]=4 1080 B15R1.4045 COC(=O)c1cnc(c(c1)OC)N(C)C 27a_100102631434_100010074909 [1,1,0,0,0,0|2,0,0]=4 1081 B15R1.7061 C=C=Cc1ccc(cc1OC)C(=O)OC 271570a_100015277604_100009816954 [1,1,0,0,0,0|1,0,1]=4 1082 B15R1.7061 CC=Cc1ccc(cc1OC)C(=O)OC 271570a_100016259895_100009816954 [1,1,0,0,0,0|1,0,0]=3 1083 B15R1.7061 CC=Cc1ccc(nc1OC)C(=O)OC 271570a_100016259895_100010189641 [1,1,0,0,0,0|2,0,0]=4 1084 B15R1.7061 CC=Cc1cnc(cc1OC)C(=O)OC 271570a_100016259895_100010136178 [1,1,0,0,0,0|2,0,0]=4 1085 B15R1.7061 CC=Cc1ncc(cc1OC)C(=O)OC 271570a_100016259895_100010074909 [1,1,0,0,0,0|2,0,0]=4 1086 B15R1.7061 CCC(=O)c1ccc(c(c1)OC)CNC 26a_100102657272_100000012293 [1,1,0,0,0,0|2,0,0]=4 1087 B15R1.7061 CCC(=O)c1ccc(c(c1)OC)OCF 34a_100000012293_100015361967 [1,1,0,0,0,0|1,0,0]=3 1088 B15R1.7061 CCC(=O)c1ccc(c(c1)OC)OCF 7a_100000012293_100015361967 [1,1,0,0,0,0|1,0,0]=3 1089 B15R1.7061 CCNc1ccc(cc1OC)C(=O)NC 2230a_100011850465_100000210202 [1,1,0,0,0,0|2,0,0]=4 1090 B15R1.7061 CCNc1ccc(cc1OC)C(=O)NC 34a_100011850465_100000210202 [1,1,0,0,0,0|2,0,0]=4 1091 B15R1.7061 CCNc1ncc(cc1OC)C(=O)OC 27a_100015525214_100010074909 [1,1,0,0,0,0|2,0,0]=4 1092 B15R1.7061 CCOc1ccc(cc1C#N)C(=O)OC 34a_100009865136_100000210202 [1,1,0,0,0,0|2,0,0]=4 1093 B15R1.7061 CCOc1ccc(cc1C#N)C(=O)OC 7a_100009865136_100000210202 [1,1,0,0,0,0|2,0,0]=4 1094 B15R1.7061 CCOc1ccc(cc1OC)C(=O)CC 1458a_100000184834_100000210202 [1,1,0,0,0,0|1,0,0]=3 1095 B15R1.7061 CCOc1ccc(cc1OC)C(=O)CC 34a_100000012293_100000210202 [1,1,0,0,0,0|1,0,0]=3 1096 B15R1.7061 CCOc1ccc(cc1OC)C(=O)CC 7a_100000012293_100000210202 [1,1,0,0,0,0|1,0,0]=3 1097 B15R1.7061 CCOc1ccc(cc1OC)C(=O)CF 1458a_100000184834_100015361967 [1,1,0,0,0,0|2,0,0]=4 1098 B15R1.7061 CCOc1ccc(cc1OC)C(=O)NC 11a_106832991635_100000184834 [1,1,0,0,0,0|1,0,0]=3 1099 B15R1.7061 CCOc1ccc(cc1OC)C(=O)NC 1626a_100102657272_100000184834 [1,1,0,0,0,0|1,0,0]=3 1100 B15R1.7061 CCOc1ccc(cc1OC)C(=O)NC 240690a_100102657272_100000184834 [1,1,0,0,0,0|1,0,0]=3 1101 B15R1.7061 CCOc1ccc(cc1OC)C(=O)NC 527a_100102657272_100000184834 [1,1,0,0,0,0|1,0,0]=3 1102 B15R1.7061 CCOc1ccc(cc1OC)C(=O)NN 34a_100000008232_100000210202 [1,1,0,0,0,0|2,0,0]=4 1103 B15R1.7061 CCOc1ccc(cc1OC)C(=O)OC 34a_100000212147_100000210202 [1,1,0,0,0,0|0,0,0]=2 1104 B15R1.7061 CCOc1ccc(cc1OC)C(=O)OC 7a_100000212147_100000210202 [1,1,0,0,0,0|0,0,0]=2 1105 B15R1.7061 CCSc1ccc(cc1OC)C(=O)OC 62a_100000210202_100009816954 [1,1,0,0,0,0|0,1,0]=3 1106 B15R1.7061 CCSc1ccc(cc1OC)C(=O)OC 62a_100009816954_100000210202 [1,1,0,0,0,0|0,1,0]=3 1107 B15R1.7061 CCSc1ccc(nc1OC)C(=O)OC 62a_100000210202_100010189641 [1,1,0,0,0,0|1,1,0]=4 1108 B15R1.7061 CCSc1ccc(nc1OC)C(=O)OC 62a_100010189641_100000210202 [1,1,0,0,0,0|1,1,0]=4 1109 B15R1.7061 CCSc1cnc(cc1OC)C(=O)OC 62a_100000210202_100010136178 [1,1,0,0,0,0|1,1,0]=4 1110 B15R1.7061 CCSc1cnc(cc1OC)C(=O)OC 62a_100010136178_100000210202 [1,1,0,0,0,0|1,1,0]=4 1111 B15R1.7061 CCSc1ncc(cc1OC)C(=O)OC 62a_100000210202_100010074909 [1,1,0,0,0,0|1,1,0]=4 1112 B15R1.7061 CCSc1ncc(cc1OC)C(=O)OC 62a_100010136190_100000210202 [1,1,0,0,0,0|1,1,0]=4 1113 B15R1.7061 CNC(=O)c1ccc(c(c1)OC)NCF 34a_100011850465_100015361967 [1,1,0,0,0,0|2,0,0]=4 1114 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 2230a_106832991635_100000765176 [1,1,0,0,0,0|1,0,0]=3 1115 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 26a_100102657272_100000212147 [1,1,0,0,0,0|1,0,0]=3 1116 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 270004a_106832991635_100009848378 [1,1,0,0,0,0|1,0,0]=3 1117 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 34a_100102657272_100000765176 [1,1,0,0,0,0|1,0,0]=3 1118 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 7a_106832991635_100000765176 [1,1,0,0,0,0|1,0,0]=3 1119 B15R1.7061 COC(=O)c1cc(c(cn1)SCF)OC 62a_100010136178_100015361967 [1,1,0,0,0,0|1,1,0]=4 1120 B15R1.7061 COC(=O)c1cc(c(cn1)SCF)OC 62a_100015361967_100010136178 [1,1,0,0,0,0|1,1,0]=4 1121 B15R1.7061 COC(=O)c1ccc(c(c1)C#N)OCF 34a_100009865136_100015361967 [1,1,0,0,0,0|2,0,0]=4 1122 B15R1.7061 COC(=O)c1ccc(c(c1)C#N)OCF 7a_100009865136_100015361967 [1,1,0,0,0,0|2,0,0]=4 1123 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CO[13CH3] 34a_100010744631_200025704644 [1,1,0,0,0,0|0,0,0]=2 1124 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CO[13CH3] 7a_100010744631_200025704644 [1,1,0,0,0,0|0,0,0]=2 1125 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CSC 62a_100000765176_200000210301 [1,1,0,0,0,0|0,1,0]=3 1126 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CSC 62a_200000210301_100000765176 [1,1,0,0,0,0|0,1,0]=3 1127 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CS[13CH3] 62a_100000765176_200025704644 [1,1,0,0,0,0|0,1,0]=3 1128 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CS[13CH3] 62a_200025704644_100000765176 [1,1,0,0,0,0|0,1,0]=3 1129 B15R1.7061 COC(=O)c1ccc(c(c1)OC)OCF 34a_100000212147_100015361967 [1,1,0,0,0,0|0,0,0]=2 1130 B15R1.7061 COC(=O)c1ccc(c(c1)OC)OCF 7a_100000212147_100015361967 [1,1,0,0,0,0|0,0,0]=2 1131 B15R1.7061 COC(=O)c1ccc(c(c1)OC)SCF 62a_100009816954_100015361967 [1,1,0,0,0,0|0,1,0]=3 1132 B15R1.7061 COC(=O)c1ccc(c(c1)OC)SCF 62a_100015361967_100009816954 [1,1,0,0,0,0|0,1,0]=3 1133 B15R1.7061 COC(=O)c1ccc(c(n1)OC)SCF 62a_100010189641_100015361967 [1,1,0,0,0,0|1,1,0]=4 1134 B15R1.7061 COC(=O)c1ccc(c(n1)OC)SCF 62a_100015361967_100010189641 [1,1,0,0,0,0|1,1,0]=4 1135 B15R1.7061 COC(=O)c1cnc(c(c1)OC)SCF 62a_100010136190_100015361967 [1,1,0,0,0,0|1,1,0]=4 1136 B15R1.7061 COC(=O)c1cnc(c(c1)OC)SCF 62a_100015361967_100010074909 [1,1,0,0,0,0|1,1,0]=4 1137 B15R1.7061 COCc1ccc(cc1OC)C(=O)OC 34a_100010744631_200000210301 [1,1,0,0,0,0|0,0,0]=2 1138 B15R1.7061 COCc1ccc(cc1OC)C(=O)OC 34a_100138415774_100000765176 [1,1,0,0,0,0|0,0,0]=2 1139 B15R1.7061 COCc1ccc(cc1OC)C(=O)OC 7a_100010744631_200000210301 [1,1,0,0,0,0|0,0,0]=2 1140 B15R1.7061 COc1cc(ccc1OCF)C(=O)NN 34a_100000008232_100015361967 [1,1,0,0,0,0|2,0,0]=4 1141 B15R1.7680 C=C=Cc1cc(ccc1OC)C(=O)OC 271570a_100015277604_100000189012 [1,1,0,0,0,0|1,0,1]=4 1142 B15R1.7680 C=CCc1cc(ccc1OC)C(=O)OC 34a_200000028607_200000210301 [1,1,0,0,0,0|1,0,1]=4 1143 B15R1.7680 C=CCc1cc(ccc1OC)C(=O)OC 7a_200000028607_200000210301 [1,1,0,0,0,0|1,0,1]=4 1144 B15R1.7680 C=CCc1cc(ccc1O[13CH3])C(=O)OC 34a_200000028607_200025704644 [1,1,0,0,0,0|1,0,1]=4 1145 B15R1.7680 C=CCc1cc(ccc1O[13CH3])C(=O)OC 7a_200000028607_200025704644 [1,1,0,0,0,0|1,0,1]=4 1146 B15R1.7680 C=Cc1ccc(cc1COC)C(=O)OC 271570a_100011290941_200010890493 [1,1,0,0,0,0|1,0,1]=4 1147 B15R1.7680 CC=Cc1cc(ccc1CC)C(=O)OC 271570a_100016259895_200012360130 [1,1,0,0,0,0|2,0,0]=4 1148 B15R1.7680 CC=Cc1cc(ccc1OC)C(=O)OC 271570a_100016259895_100000189012 [1,1,0,0,0,0|1,0,0]=3 1149 B15R1.7680 CC=Cc1cc(cnc1OC)C(=O)OC 271570a_100016259895_100010189640 [1,1,0,0,0,0|2,0,0]=4 1150 B15R1.7680 CC=Cc1cc(ncc1OC)C(=O)OC 271570a_100016259895_200010136175 [1,1,0,0,0,0|2,0,0]=4 1151 B15R1.7680 CC=Cc1nc(ccc1OC)C(=O)OC 271570a_100016259895_100010205418 [1,1,0,0,0,0|2,0,0]=4 1152 B15R1.7680 CCNc1cc(ccc1OC)C(=O)NC 2230a_100000740754_100000210202 [1,1,0,0,0,0|2,0,0]=4 1153 B15R1.7680 CCNc1cc(ccc1OC)C(=O)NC 34a_100000740754_100000210202 [1,1,0,0,0,0|2,0,0]=4 1154 B15R1.7680 CCOc1cc(ccc1C#N)C(=O)OC 34a_100000044657_100000210202 [1,1,0,0,0,0|2,0,0]=4 1155 B15R1.7680 CCOc1cc(ccc1C#N)C(=O)OC 7a_100000044657_100000210202 [1,1,0,0,0,0|2,0,0]=4 1156 B15R1.7680 CCOc1cc(ccc1OC)C(=O)CC 1458a_100000181421_100000210202 [1,1,0,0,0,0|1,0,0]=3 1157 B15R1.7680 CCOc1cc(ccc1OC)C(=O)CF 1458a_100000181421_100015361967 [1,1,0,0,0,0|2,0,0]=4 1158 B15R1.7680 CCOc1cc(ccc1OC)C(=O)NC 11a_106832991635_100000181421 [1,1,0,0,0,0|1,0,0]=3 1159 B15R1.7680 CCOc1cc(ccc1OC)C(=O)NC 1626a_100102657272_100000181421 [1,1,0,0,0,0|1,0,0]=3 1160 B15R1.7680 CCOc1cc(ccc1OC)C(=O)NC 240690a_100102657272_100000181421 [1,1,0,0,0,0|1,0,0]=3 1161 B15R1.7680 CCOc1cc(ccc1OC)C(=O)NC 527a_100102657272_100000181421 [1,1,0,0,0,0|1,0,0]=3 1162 B15R1.7680 CCOc1cc(ccc1OC)C(=O)NN 34a_200012634778_100000210202 [1,1,0,0,0,0|2,0,0]=4 1163 B15R1.7680 CCOc1cc(ccc1OC)C(=O)OC 34a_100011215032_100000210202 [1,1,0,0,0,0|0,0,0]=2 1164 B15R1.7680 CCOc1cc(ccc1OC)C(=O)OC 7a_100011215032_100000210202 [1,1,0,0,0,0|0,0,0]=2 1165 B15R1.7680 CCOc1cc(cnc1OC)C(=O)OC 34a_100009867281_100000210202 [1,1,0,0,0,0|1,0,0]=3 1166 B15R1.7680 CCSc1cc(ccc1CC)C(=O)OC 62a_100000210202_200012360130 [1,1,0,0,0,0|1,1,0]=4 1167 B15R1.7680 CCSc1cc(ccc1CC)C(=O)OC 62a_200012360130_100000210202 [1,1,0,0,0,0|1,1,0]=4 1168 B15R1.7680 CCSc1cc(ccc1OC)C(=O)OC 62a_100000189012_100000210202 [1,1,0,0,0,0|0,1,0]=3 1169 B15R1.7680 CCSc1cc(ccc1OC)C(=O)OC 62a_100000210202_100000189012 [1,1,0,0,0,0|0,1,0]=3 1170 B15R1.7680 CCSc1cc(cnc1OC)C(=O)OC 62a_100000210202_100010189640 [1,1,0,0,0,0|1,1,0]=4 1171 B15R1.7680 CCSc1cc(cnc1OC)C(=O)OC 62a_100010189640_100000210202 [1,1,0,0,0,0|1,1,0]=4 1172 B15R1.7680 CCSc1cc(ncc1OC)C(=O)OC 62a_100000210202_200010136175 [1,1,0,0,0,0|1,1,0]=4 1173 B15R1.7680 CCSc1cc(ncc1OC)C(=O)OC 62a_200010136175_100000210202 [1,1,0,0,0,0|1,1,0]=4 1174 B15R1.7680 CCSc1nc(ccc1OC)C(=O)OC 62a_100000210202_100010205418 [1,1,0,0,0,0|1,1,0]=4 1175 B15R1.7680 CCSc1nc(ccc1OC)C(=O)OC 62a_100010205418_100000210202 [1,1,0,0,0,0|1,1,0]=4 1176 B15R1.7680 CCc1ccc(cc1SCF)C(=O)OC 62a_100015361967_200012360130 [1,1,0,0,0,0|1,1,0]=4 1177 B15R1.7680 CCc1ccc(cc1SCF)C(=O)OC 62a_200012360130_100015361967 [1,1,0,0,0,0|1,1,0]=4 1178 B15R1.7680 CNC(=O)c1ccc(c(c1)NCF)OC 34a_100000740754_100015361967 [1,1,0,0,0,0|2,0,0]=4 1179 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 2230a_106832991635_200010762020 [1,1,0,0,0,0|1,0,0]=3 1180 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 26a_100102657272_100011215032 [1,1,0,0,0,0|1,0,0]=3 1181 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 270004a_106832991635_100000059354 [1,1,0,0,0,0|1,0,0]=3 1182 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 34a_100102657272_200010762020 [1,1,0,0,0,0|1,0,0]=3 1183 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 7a_106832991635_200010762020 [1,1,0,0,0,0|1,0,0]=3 1184 B15R1.7680 COC(=O)c1cc(c(cn1)OC)SCF 62a_100015361967_200010136175 [1,1,0,0,0,0|1,1,0]=4 1185 B15R1.7680 COC(=O)c1cc(c(cn1)OC)SCF 62a_200010136175_100015361967 [1,1,0,0,0,0|1,1,0]=4 1186 B15R1.7680 COC(=O)c1ccc(c(c1)CSC)OC 62a_200000210301_200010762020 [1,1,0,0,0,0|0,1,0]=3 1187 B15R1.7680 COC(=O)c1ccc(c(c1)CSC)OC 62a_200010762020_200000210301 [1,1,0,0,0,0|0,1,0]=3 1188 B15R1.7680 COC(=O)c1ccc(c(c1)CS[13CH3])OC 62a_200010762020_200025704644 [1,1,0,0,0,0|0,1,0]=3 1189 B15R1.7680 COC(=O)c1ccc(c(c1)CS[13CH3])OC 62a_200025704644_200010762020 [1,1,0,0,0,0|0,1,0]=3 1190 B15R1.7680 COC(=O)c1ccc(c(c1)OCF)C#N 34a_100000044657_100015361967 [1,1,0,0,0,0|2,0,0]=4 1191 B15R1.7680 COC(=O)c1ccc(c(c1)OCF)C#N 7a_100000044657_100015361967 [1,1,0,0,0,0|2,0,0]=4 1192 B15R1.7680 COC(=O)c1ccc(c(c1)OCF)OC 34a_100011215032_100015361967 [1,1,0,0,0,0|0,0,0]=2 1193 B15R1.7680 COC(=O)c1ccc(c(c1)OCF)OC 7a_100011215032_100015361967 [1,1,0,0,0,0|0,0,0]=2 1194 B15R1.7680 COC(=O)c1ccc(c(c1)SCF)OC 62a_100000189012_100015361967 [1,1,0,0,0,0|0,1,0]=3 1195 B15R1.7680 COC(=O)c1ccc(c(c1)SCF)OC 62a_100015361967_100000189012 [1,1,0,0,0,0|0,1,0]=3 1196 B15R1.7680 COC(=O)c1ccc(c(n1)SCF)OC 62a_100010205418_100015361967 [1,1,0,0,0,0|1,1,0]=4 1197 B15R1.7680 COC(=O)c1ccc(c(n1)SCF)OC 62a_100015361967_100010205418 [1,1,0,0,0,0|1,1,0]=4 1198 B15R1.7680 COC(=O)c1cnc(c(c1)OCF)OC 34a_100009867281_100015361967 [1,1,0,0,0,0|1,0,0]=3 1199 B15R1.7680 COC(=O)c1cnc(c(c1)SCF)OC 62a_100010189640_100015361967 [1,1,0,0,0,0|1,1,0]=4 1200 B15R1.7680 COC(=O)c1cnc(c(c1)SCF)OC 62a_100015361967_100010189640 [1,1,0,0,0,0|1,1,0]=4 1201 B15R1.7680 COCc1cc(ccc1OC)C(=O)OC 34a_100138415774_200010762020 [1,1,0,0,0,0|0,0,0]=2 1202 B15R1.7680 COCc1cc(ccc1SC)C(=O)OC 62a_200000210301_200010890493 [1,1,0,0,0,0|0,1,0]=3 1203 B15R1.7680 COCc1cc(ccc1SC)C(=O)OC 62a_200010890493_200000210301 [1,1,0,0,0,0|0,1,0]=3 1204 B15R1.7680 COCc1cc(ccc1S[13CH3])C(=O)OC 62a_200010890493_200025704644 [1,1,0,0,0,0|0,1,0]=3 1205 B15R1.7680 COCc1cc(ccc1S[13CH3])C(=O)OC 62a_200025704644_200010890493 [1,1,0,0,0,0|0,1,0]=3 1206 B15R1.7680 COc1ccc(cc1OCF)C(=O)NN 34a_200012634778_100015361967 [1,1,0,0,0,0|2,0,0]=4 1207 B15R1.12853 CNc1cc(ccc1OC)C(=O)N(C)C 2230a_100000742845_200000210301 [1,1,0,0,0,0|2,0,0]=4 1208 B15R1.12853 CNc1cc(ccc1OC)C(=O)N(C)C 34a_100000742845_200000210301 [1,1,0,0,0,0|2,0,0]=4 1209 B15R1.12853 CNc1cc(ccc1OC)C(=O)N(C)C 7a_100000742845_200000210301 [1,1,0,0,0,0|2,0,0]=4 1210 B15R1.12853 COc1cc(ccc1O[13CH3])C(=O)N(C)C 34a_100009841360_200025704644 [1,1,0,0,0,0|1,0,0]=3 1211 B15R1.12853 COc1cc(ccc1O[13CH3])C(=O)N(C)C 7a_100009841360_200025704644 [1,1,0,0,0,0|1,0,0]=3 1212 B15R1.12853 COc1ccc(cc1N[13CH3])C(=O)N(C)C 2230a_100000742845_200025704644 [1,1,0,0,0,0|2,0,0]=4 1213 B15R1.12853 COc1ccc(cc1N[13CH3])C(=O)N(C)C 34a_100000742845_200025704644 [1,1,0,0,0,0|2,0,0]=4 1214 B15R1.12853 COc1ccc(cc1N[13CH3])C(=O)N(C)C 7a_100000742845_200025704644 [1,1,0,0,0,0|2,0,0]=4 1215 B15R1.12853 COc1ccc(cc1OC)C(=C(C)C)C 271570a_200000049429_100000187503 [1,1,0,0,0,0|2,0,0]=4 1216 B15R1.12853 COc1ccc(cc1OC)C(=O)C(C)C 1458a_100000211223_100000210206 [1,1,0,0,0,0|1,0,0]=3 1217 B15R1.12853 COc1ccc(cc1OC)C(=O)N(C)C 11a_100102631434_100000211223 [1,1,0,0,0,0|1,0,0]=3 1218 B15R1.12853 COc1ccc(cc1OC)C(=O)N(C)C 1626a_100102631434_100000211223 [1,1,0,0,0,0|1,0,0]=3 1219 B15R1.12853 COc1ccc(cc1OC)C(=O)N(C)C 240690a_100102631434_100000211223 [1,1,0,0,0,0|1,0,0]=3 1220 B15R1.12853 COc1ccc(cc1OC)C(=O)N(C)C 34a_100009841360_200000210301 [1,1,0,0,0,0|1,0,0]=3 1221 B15R1.12853 COc1ccc(cc1OC)C(=O)N(C)C 527a_100102631434_100000211223 [1,1,0,0,0,0|1,0,0]=3 1222 B15R1.12853 COc1ccc(cc1OC)C(=O)N(C)C 7a_100009841360_200000210301 [1,1,0,0,0,0|1,0,0]=3 1223 B15R1.16219 CNS(=O)(=O)c1ccc(c(c1)OC)OC 270084a_100102657272_100000212161 [1,1,0,0,0,0|2,0,0]=4 1224 B15R1.16219 CNS(=O)(=O)c1ccc(c(c1)OC)OC 274078a_100102657272_100000212161 [1,1,0,0,0,0|2,0,0]=4 1225 B15R1.16219 CNS(=O)(=O)c1ccc(c(c1)OC)OC 40a_100102657272_100010304489 [1,1,0,0,0,0|2,0,0]=4 1226 B15R1.1843 C=C(C)c1c(ccc(c1N)C(=O)C)OC 271570a_100000694244_100010236346 [1,1,0,0,0,0|2,0,0]=4 1227 B15R1.1853 C=C(C)c1ccc(c(c1OC)OC)OC 271570a_100000694244_100011320274 [1,1,0,0,0,0|1,0,0]=3 1228 B15R1.1853 COc1ccc(c(c1OC)OC)C(=O)C 1458a_100000211208_200000210301 [1,1,0,0,0,0|0,0,0]=2 1229 B15R1.1853 COc1ccc(c(c1OC)OC)C(=O)[13CH3] 1458a_100000211208_200025704644 [1,1,0,0,0,0|0,0,0]=2 1230 B15R1.14837 CC=Cc1c(ccc(c1N)C(=O)C)OC 271570a_100016259895_100010236346 [1,1,0,0,0,0|2,0,0]=4 1231 B15R1.14837 CCSc1c(ccc(c1N)C(=O)C)OC 62a_100010236346_100000210202 [1,1,0,0,0,0|1,1,0]=4 1232 B15R1.14837 COc1ccc(c(c1SCF)N)C(=O)C 62a_100010236346_100015361967 [1,1,0,0,0,0|1,1,0]=4 1233 B15R1.1875 COc1ccc(c(c1C)C)C(=O)C(C)C 1458a_200000082569_100000210206 [1,1,0,0,0,0|2,0,0]=4 1234 B15R1.1875 COc1ccc(c(c1C)C)C(=O)N(C)C 11a_100102631434_200000082569 [1,1,0,0,0,0|2,0,0]=4 1235 B15R1.1875 COc1ccc(c(c1C)C)C(=O)N(C)C 1626a_100102631434_200000082569 [1,1,0,0,0,0|2,0,0]=4 1236 B15R1.1875 COc1ccc(c(c1C)C)C(=O)N(C)C 240690a_100102631434_200000082569 [1,1,0,0,0,0|2,0,0]=4 1237 B15R1.1875 COc1ccc(c(c1C)C)C(=O)N(C)C 527a_100102631434_200000082569 [1,1,0,0,0,0|2,0,0]=4 1238 B15R1.1875 COc1ccc(c(c1O)O)C(=O)C(C)C 1458a_100000045701_100000210206 [1,1,0,0,0,0|1,0,0]=3 1239 B15R1.10149 CCC(=O)c1c(cc(c(c1Cl)O)OC)Cl 1458a_100010164187_100000210202 [1,1,0,0,0,0|2,0,0]=4 1240 B15R1.10149 CNC(=O)c1c(cc(c(c1Cl)O)OC)Cl 240690a_100102657272_100010164187 [1,1,0,0,0,0|2,0,0]=4 1241 B15R1.10559 C#CCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000184674 [1,1,0,0,0,0|1,0,1]=4 1242 B15R1.10559 C=CCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000210623 [1,1,0,0,0,0|1,0,1]=4 1243 B15R1.10559 CCCC(=O)c1ccc(c(c1C)C)OC 1458a_200000082569_100000210303 [1,1,0,0,0,0|2,0,0]=4 1244 B15R1.10559 CCCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000210303 [1,1,0,0,0,0|1,0,0]=3 1245 B15R1.10559 CCNC(=O)c1ccc(c(c1C)C)OC 11a_100015525214_200000082569 [1,1,0,0,0,0|2,0,0]=4 1246 B15R1.10559 CCNC(=O)c1ccc(c(c1C)C)OC 240690a_100015525214_200000082569 [1,1,0,0,0,0|2,0,0]=4 1247 B15R1.10559 CCNC(=O)c1ccc(c(c1C)C)OC 527a_100015525214_200000082569 [1,1,0,0,0,0|2,0,0]=4 1248 B15R1.10559 CNNC(=O)c1ccc(c(c1C)C)OC 22a_100016993582_200000082569 [1,1,0,0,0,0|2,0,0]=4 1249 B15R1.10559 CNNC(=O)c1ccc(c(c1O)O)OC 22a_100016993582_100000045701 [1,1,0,0,0,0|1,0,0]=3 1250 B15R1.10559 COc1ccc(c(c1C)C)C(=O)CCF 1458a_200000082569_100011217306 [1,1,0,0,0,0|2,0,0]=4 1251 B15R1.10559 COc1ccc(c(c1C)C)C(=O)CCO 1458a_200000082569_100000211926 [1,1,0,0,0,0|2,0,0]=4 1252 B15R1.10559 COc1ccc(c(c1O)O)C(=O)CC#N 1458a_100000045701_100011214920 [1,1,0,0,0,0|1,0,1]=4 1253 B15R1.10559 COc1ccc(c(c1O)O)C(=O)CCF 1458a_100000045701_100011217306 [1,1,0,0,0,0|1,0,0]=3 1254 B15R1.10559 COc1ccc(c(c1O)O)C(=O)CCO 1458a_100000045701_100000211926 [1,1,0,0,0,0|1,0,0]=3 1255 B15R1.11683 C=C(C)c1ccc(c(c1C)C)C(=O)OC 271570a_100000694244_100010761469 [1,1,0,0,0,0|2,0,0]=4 1256 B15R1.11683 C=C(C)c1ccc(c(c1C)F)C(=O)OC 271570a_100000694244_100010172522 [1,1,0,0,0,0|2,0,0]=4 1257 B15R1.11683 C=C(C)c1ccc(c(c1C)N)C(=O)OC 271570a_100000694244_100000764893 [1,1,0,0,0,0|2,0,0]=4 1258 B15R1.11683 C=C(C)c1ccc(c(c1F)O)C(=O)OC 271570a_100000694244_100011092008 [1,1,0,0,0,0|2,0,0]=4 1259 B15R1.11683 C=C(C)c1ccc(c(c1O)C)C(=O)OC 271570a_100000694244_100010889012 [1,1,0,0,0,0|2,0,0]=4 1260 B15R1.11683 C=C(C)c1ccc(c(c1O)F)C(=O)OC 271570a_100000694244_100011096176 [1,1,0,0,0,0|2,0,0]=4 1261 B15R1.16575 CC=Cc1ccc(c(c1C)C)C(=O)OC 271570a_100016259895_100010761469 [1,1,0,0,0,0|2,0,0]=4 1262 B15R1.16575 CC=Cc1ccc(c(c1C)F)C(=O)OC 271570a_100016259895_100010172522 [1,1,0,0,0,0|2,0,0]=4 1263 B15R1.16575 CC=Cc1ccc(c(c1C)N)C(=O)OC 271570a_100016259895_100000764893 [1,1,0,0,0,0|2,0,0]=4 1264 B15R1.16575 CC=Cc1ccc(c(c1F)O)C(=O)OC 271570a_100016259895_100011092008 [1,1,0,0,0,0|2,0,0]=4 1265 B15R1.16575 CC=Cc1ccc(c(c1O)C)C(=O)OC 271570a_100016259895_100010889012 [1,1,0,0,0,0|2,0,0]=4 1266 B15R1.16575 CC=Cc1ccc(c(c1O)F)C(=O)OC 271570a_100016259895_100011096176 [1,1,0,0,0,0|2,0,0]=4 1267 B15R1.16575 CCOc1ccc(c(c1F)F)C(=O)OC 34a_100000101000_100000210202 [1,1,0,0,0,0|2,0,0]=4 1268 B15R1.16575 CCOc1ccc(c(c1F)F)C(=O)OC 7a_100000101000_100000210202 [1,1,0,0,0,0|2,0,0]=4 1269 B15R1.16575 CCSc1ccc(c(c1C)C)C(=O)OC 62a_100000210202_100010761469 [1,1,0,0,0,0|1,1,0]=4 1270 B15R1.16575 CCSc1ccc(c(c1C)C)C(=O)OC 62a_100010761469_100000210202 [1,1,0,0,0,0|1,1,0]=4 1271 B15R1.16575 CCSc1ccc(c(c1C)F)C(=O)OC 62a_100000210202_100010172522 [1,1,0,0,0,0|1,1,0]=4 1272 B15R1.16575 CCSc1ccc(c(c1C)F)C(=O)OC 62a_100010172522_100000210202 [1,1,0,0,0,0|1,1,0]=4 1273 B15R1.16575 CCSc1ccc(c(c1C)N)C(=O)OC 62a_100000764893_100000210202 [1,1,0,0,0,0|1,1,0]=4 1274 B15R1.16575 CCSc1ccc(c(c1O)C)C(=O)OC 62a_100000210202_100010889012 [1,1,0,0,0,0|1,1,0]=4 1275 B15R1.16575 CCSc1ccc(c(c1O)C)C(=O)OC 62a_100010889012_100000210202 [1,1,0,0,0,0|1,1,0]=4 1276 B15R1.16575 CCSc1ccc(c(c1O)F)C(=O)OC 62a_100000210202_100011096176 [1,1,0,0,0,0|1,1,0]=4 1277 B15R1.16575 CCSc1ccc(c(c1O)F)C(=O)OC 62a_100011096176_100000210202 [1,1,0,0,0,0|1,1,0]=4 1278 B15R1.16575 COC(=O)c1ccc(c(c1C)C)SCF 62a_100010761469_100015361967 [1,1,0,0,0,0|1,1,0]=4 1279 B15R1.16575 COC(=O)c1ccc(c(c1C)C)SCF 62a_100015361967_100010761469 [1,1,0,0,0,0|1,1,0]=4 1280 B15R1.16575 COC(=O)c1ccc(c(c1C)O)SCF 62a_100010889012_100015361967 [1,1,0,0,0,0|1,1,0]=4 1281 B15R1.16575 COC(=O)c1ccc(c(c1C)O)SCF 62a_100015361967_100010889012 [1,1,0,0,0,0|1,1,0]=4 1282 B15R1.16575 COC(=O)c1ccc(c(c1F)C)SCF 62a_100010172522_100015361967 [1,1,0,0,0,0|1,1,0]=4 1283 B15R1.16575 COC(=O)c1ccc(c(c1F)C)SCF 62a_100015361967_100010172522 [1,1,0,0,0,0|1,1,0]=4 1284 B15R1.16575 COC(=O)c1ccc(c(c1F)F)OCF 34a_100000101000_100015361967 [1,1,0,0,0,0|2,0,0]=4 1285 B15R1.16575 COC(=O)c1ccc(c(c1F)F)OCF 7a_100000101000_100015361967 [1,1,0,0,0,0|2,0,0]=4 1286 B15R1.16575 COC(=O)c1ccc(c(c1F)O)SCF 62a_100011096176_100015361967 [1,1,0,0,0,0|1,1,0]=4 1287 B15R1.16575 COC(=O)c1ccc(c(c1F)O)SCF 62a_100015361967_100011096176 [1,1,0,0,0,0|1,1,0]=4 1288 B15R1.16575 COC(=O)c1ccc(c(c1N)C)SCF 62a_100000764893_100015361967 [1,1,0,0,0,0|1,1,0]=4 1289 B15R1.21457 COC(=O)c1cc(c(c(c1F)F)OC)F 34a_100010189586_200000210301 [1,1,0,0,0,0|2,0,0]=4 1290 B15R1.21457 COC(=O)c1cc(c(c(c1F)F)OC)F 7a_100010189586_200000210301 [1,1,0,0,0,0|2,0,0]=4 1291 B15R1.21457 COC(=O)c1cc(c(c(c1F)F)O[13CH3])F 34a_100010189586_200025704644 [1,1,0,0,0,0|2,0,0]=4 1292 B15R1.21457 COC(=O)c1cc(c(c(c1F)F)O[13CH3])F 7a_100010189586_200025704644 [1,1,0,0,0,0|2,0,0]=4 1293 B15R1.11684 C=C(C)c1c(ccc(c1C)C(=O)OC)C 271570a_100000694244_200010734123 [1,1,0,0,0,0|2,0,0]=4 1294 B15R1.20147 COC(=O)c1cc(c(c(c1F)OC)F)F 34a_200011302604_200000210301 [1,1,0,0,0,0|2,0,0]=4 1295 B15R1.20147 COC(=O)c1cc(c(c(c1F)OC)F)F 7a_200011302604_200000210301 [1,1,0,0,0,0|2,0,0]=4 1296 B15R1.20147 COC(=O)c1cc(c(c(c1F)O[13CH3])F)F 34a_200011302604_200025704644 [1,1,0,0,0,0|2,0,0]=4 1297 B15R1.20147 COC(=O)c1cc(c(c(c1F)O[13CH3])F)F 7a_200011302604_200025704644 [1,1,0,0,0,0|2,0,0]=4 1298 B15R1.27278 CC=Cc1c(ccc(c1C)C(=O)OC)C 271570a_100016259895_200010734123 [1,1,0,0,0,0|2,0,0]=4 1299 B15R1.27278 CCOc1c(ccc(c1C)C(=O)OC)Br 34a_100010889012_100000210202 [1,1,0,0,0,0|2,0,0]=4 1300 B15R1.27278 CCOc1c(ccc(c1C)C(=O)OC)Br 7a_100010889012_100000210202 [1,1,0,0,0,0|2,0,0]=4 1301 B15R1.27278 CCOc1c(ccc(c1F)C(=O)OC)Br 34a_100011096176_100000210202 [1,1,0,0,0,0|2,0,0]=4 1302 B15R1.27278 CCOc1c(ccc(c1F)C(=O)OC)Br 7a_100011096176_100000210202 [1,1,0,0,0,0|2,0,0]=4 1303 B15R1.27278 CCSc1c(ccc(c1C)C(=O)OC)C 62a_100000210202_200010734123 [1,1,0,0,0,0|1,1,0]=4 1304 B15R1.27278 CCSc1c(ccc(c1C)C(=O)OC)C 62a_200010734123_100000210202 [1,1,0,0,0,0|1,1,0]=4 1305 B15R1.27278 COC(=O)c1ccc(c(c1C)OCF)Br 34a_100010889012_100015361967 [1,1,0,0,0,0|2,0,0]=4 1306 B15R1.27278 COC(=O)c1ccc(c(c1C)OCF)Br 7a_100010889012_100015361967 [1,1,0,0,0,0|2,0,0]=4 1307 B15R1.27278 COC(=O)c1ccc(c(c1C)SCF)C 62a_100015361967_200010734123 [1,1,0,0,0,0|1,1,0]=4 1308 B15R1.27278 COC(=O)c1ccc(c(c1C)SCF)C 62a_200010734123_100015361967 [1,1,0,0,0,0|1,1,0]=4 1309 B15R1.27278 COC(=O)c1ccc(c(c1F)OCF)Br 34a_100011096176_100015361967 [1,1,0,0,0,0|2,0,0]=4 1310 B15R1.27278 COC(=O)c1ccc(c(c1F)OCF)Br 7a_100011096176_100015361967 [1,1,0,0,0,0|2,0,0]=4 1311 B15R1.13088 COc1ccc(c(c1OC)C)C=C(C)C 271570a_100102525489_100010000156 [1,1,0,0,0,0|2,0,0]=4 1312 B15R1.16568 C=C=Cc1ccc(c(c1OC)OC)OC 271570a_100015277604_100011320274 [1,1,0,0,0,0|1,0,1]=4 1313 B15R1.16568 CC=Cc1ccc(c(c1OC)OC)OC 271570a_100016259895_100011320274 [1,1,0,0,0,0|1,0,0]=3 1314 B15R1.16568 CCNc1ccc(c(c1OC)OC)OC 34a_100000751027_100000210202 [1,1,0,0,0,0|2,0,0]=4 1315 B15R1.16568 CCOc1ccc(c(c1OC)OC)OC 34a_100000074623_100000210202 [1,1,0,0,0,0|2,0,0]=4 1316 B15R1.16568 CNCc1ccc(c(c1OC)OC)OC 207a_100102657272_100000210875 [1,1,0,0,0,0|1,0,1]=4 1317 B15R1.16568 CNCc1ccc(c(c1OC)OC)OC 270004a_106832991635_100000210875 [1,1,0,0,0,0|1,0,1]=4 1318 B15R1.16568 COCc1ccc(c(c1OC)OC)OC 34a_100011216276_200000210301 [1,1,0,0,0,0|0,0,1]=3 1319 B15R1.16568 COc1ccc(c(c1OC)OC)CO[13CH3] 34a_100011216276_200025704644 [1,1,0,0,0,0|0,0,1]=3 1320 B15R1.23243 CCOCc1ccc(c(c1Cl)OC)OC 34a_100011218542_100000210202 [1,1,0,0,0,0|1,0,1]=4 1321 B15R1.23243 CCOCc1ccc(c(c1Cl)OC)OC 7a_100011218542_100000210202 [1,1,0,0,0,0|1,0,1]=4 1322 B15R1.23243 COCSc1ccc(c(c1C)OC)OC 62a_100000766300_100010000156 [1,1,0,0,0,0|1,0,1]=4 1323 B15R1.23243 COc1ccc(c(c1OC)Cl)COCF 34a_100011218542_100015361967 [1,1,0,0,0,0|1,0,1]=4 1324 B15R1.23243 COc1ccc(c(c1OC)Cl)COCF 7a_100011218542_100015361967 [1,1,0,0,0,0|1,0,1]=4 1325 B17R1.48214 C=C(C)C(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000185857_100011890039 [0,1,0,0,0,1|2,0,0]=4 1326 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)C(C)C 1458a_100000210198_100011890039 [0,1,0,0,0,1|2,0,0]=4 1327 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)C(C)C 1458a_100012648522_100000210206 [0,1,0,0,0,1|2,0,0]=4 1328 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)C(C)F 1458a_100000062450_100011890039 [0,1,0,0,0,1|2,0,0]=4 1329 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)N(C)C 11a_100102631434_100012648522 [0,1,0,0,0,1|2,0,0]=4 1330 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)N(C)C 1626a_100102631434_100012648522 [0,1,0,0,0,1|2,0,0]=4 1331 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)N(C)C 240690a_100102631434_100012648522 [0,1,0,0,0,1|2,0,0]=4 1332 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)N(C)C 527a_100102631434_100012648522 [0,1,0,0,0,1|2,0,0]=4 1333 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)[C@@H](C)O 1458a_100000717761_100011890039 [0,1,0,0,0,1|2,0,0]=4 1334 B17R1.48214 COc1ccc(c(c1OC)Cl)CC(=O)[C@H](C)O 1458a_217856618621_100011890039 [0,1,0,0,0,1|2,0,0]=4 1335 B17R1.48214 COc1ccc(c(c1OC)F)CC(=O)C(C)C 1458a_200010293705_100000210206 [0,1,0,0,0,1|2,0,0]=4 1336 B17R1.48214 COc1ccc(c(c1OC)F)CC(=O)N(C)C 11a_100102631434_200010293705 [0,1,0,0,0,1|2,0,0]=4 1337 B17R1.48214 COc1ccc(c(c1OC)F)CC(=O)N(C)C 1626a_100102631434_200010293705 [0,1,0,0,0,1|2,0,0]=4 1338 B17R1.48214 COc1ccc(c(c1OC)F)CC(=O)N(C)C 240690a_100102631434_200010293705 [0,1,0,0,0,1|2,0,0]=4 1339 B17R1.48214 COc1ccc(c(c1OC)F)CC(=O)N(C)C 527a_100102631434_200010293705 [0,1,0,0,0,1|2,0,0]=4 1340 B17R1.160507 C=CC(=O)Nc1ccc(c(c1OC)OC)OC 1626a_100000751027_100000185746 [0,1,0,0,0,1|1,0,1]=4 1341 B17R1.160507 C=CC(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000185746 [0,1,0,0,0,1|1,0,1]=4 1342 B17R1.160507 C=Cc1c(ccc(c1OC)OC)CC(=O)OC 271570a_100011290941_200039450660 [0,1,0,0,0,1|1,0,0]=3 1343 B17R1.160507 CCC(=O)Cc1ccc(c(c1OC)OC)OC 1458a_100000212332_100000210202 [0,1,0,0,0,1|1,0,0]=3 1344 B17R1.160507 CCC(=O)Nc1ccc(c(c1OC)OC)OC 11a_100000751027_100000210414 [0,1,0,0,0,1|1,0,0]=3 1345 B17R1.160507 CCC(=O)Nc1ccc(c(c1OC)OC)OC 1626a_100000751027_100000210414 [0,1,0,0,0,1|1,0,0]=3 1346 B17R1.160507 CCC(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000210414 [0,1,0,0,0,1|1,0,0]=3 1347 B17R1.160507 CCC(=O)Nc1ccc(c(c1OC)OC)OC 527a_100000751027_100000210414 [0,1,0,0,0,1|1,0,0]=3 1348 B17R1.160507 CNC(=O)Cc1ccc(c(c1OC)OC)OC 11a_106832991635_100000212332 [0,1,0,0,0,1|1,0,0]=3 1349 B17R1.160507 CNC(=O)Cc1ccc(c(c1OC)OC)OC 1626a_100102657272_100000212332 [0,1,0,0,0,1|1,0,0]=3 1350 B17R1.160507 CNC(=O)Cc1ccc(c(c1OC)OC)OC 240690a_100102657272_100000212332 [0,1,0,0,0,1|1,0,0]=3 1351 B17R1.160507 CNC(=O)Cc1ccc(c(c1OC)OC)OC 527a_100102657272_100000212332 [0,1,0,0,0,1|1,0,0]=3 1352 B17R1.160507 CNC(=O)Nc1ccc(c(c1OC)OC)OC 2430a_100000751027_100102657272 [0,1,0,0,0,1|1,0,0]=3 1353 B17R1.160507 CNC(=O)Nc1ccc(c(c1OC)OC)OC 512a_100000751027_100102657272 [0,1,0,0,0,1|1,0,0]=3 1354 B17R1.160507 COC(=O)Cc1ccc(c(c1SC)OC)OC 62a_200039450660_200000210301 [0,1,0,0,0,1|0,1,0]=3 1355 B17R1.160507 COC(=O)Cc1ccc(c(c1S[13CH3])OC)OC 62a_200039450660_200025704644 [0,1,0,0,0,1|0,1,0]=3 1356 B17R1.160507 COc1ccc(c(c1OC)OC)CC(=O)CF 1458a_100000212332_100015361967 [0,1,0,0,0,1|2,0,0]=4 1357 B17R1.160507 COc1ccc(c(c1OC)OC)NC(=O)CO 22a_100000751027_100000210174 [0,1,0,0,0,1|2,0,0]=4 1358 B17R1.160507 COc1ccc(c(c1OC)OC)NC(=O)CO 527a_100000751027_100000210174 [0,1,0,0,0,1|2,0,0]=4 1359 B17R1.173566 CC#CC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000763181_100011890039 [0,1,0,0,0,1|2,0,0]=4 1360 B17R1.173566 CC=CC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000210699_100011890039 [0,1,0,0,0,1|2,0,0]=4 1361 B17R1.173566 CCCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000211992_100011890039 [0,1,0,0,0,1|2,0,0]=4 1362 B17R1.173566 CCCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100012648522_100000210303 [0,1,0,0,0,1|2,0,0]=4 1363 B17R1.173566 CCCC(=O)Cc1ccc(c(c1F)OC)OC 1458a_200010293705_100000210303 [0,1,0,0,0,1|2,0,0]=4 1364 B17R1.173566 CCNC(=O)Cc1ccc(c(c1Cl)OC)OC 11a_100015525214_100012648522 [0,1,0,0,0,1|2,0,0]=4 1365 B17R1.173566 CCNC(=O)Cc1ccc(c(c1Cl)OC)OC 240690a_100015525214_100012648522 [0,1,0,0,0,1|2,0,0]=4 1366 B17R1.173566 CCNC(=O)Cc1ccc(c(c1Cl)OC)OC 527a_100015525214_100012648522 [0,1,0,0,0,1|2,0,0]=4 1367 B17R1.173566 CCNC(=O)Cc1ccc(c(c1F)OC)OC 11a_100015525214_200010293705 [0,1,0,0,0,1|2,0,0]=4 1368 B17R1.173566 CCNC(=O)Cc1ccc(c(c1F)OC)OC 240690a_100015525214_200010293705 [0,1,0,0,0,1|2,0,0]=4 1369 B17R1.173566 CCNC(=O)Cc1ccc(c(c1F)OC)OC 527a_100015525214_200010293705 [0,1,0,0,0,1|2,0,0]=4 1370 B17R1.173566 CNNC(=O)Cc1ccc(c(c1Cl)OC)OC 22a_100016993582_100012648522 [0,1,0,0,0,1|2,0,0]=4 1371 B17R1.173566 CNNC(=O)Cc1ccc(c(c1F)OC)OC 22a_100016993582_200010293705 [0,1,0,0,0,1|2,0,0]=4 1372 B17R1.173566 COCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000210968_100011890039 [0,1,0,0,0,1|1,0,0]=3 1373 B17R1.173566 COc1ccc(c(c1OC)Cl)CC(=O)CCF 1458a_100012648522_100011217306 [0,1,0,0,0,1|2,0,0]=4 1374 B17R1.173566 COc1ccc(c(c1OC)Cl)CC(=O)CCO 1458a_100011216618_100011890039 [0,1,0,0,0,1|2,0,0]=4 1375 B17R1.173566 COc1ccc(c(c1OC)Cl)CC(=O)CCO 1458a_100012648522_100000211926 [0,1,0,0,0,1|2,0,0]=4 1376 B17R1.173566 COc1ccc(c(c1OC)Cl)CC(=O)CSC 1458a_100000184570_100011890039 [0,1,0,0,0,1|1,1,0]=4 1377 B17R1.173566 COc1ccc(c(c1OC)F)CC(=O)CCF 1458a_200010293705_100011217306 [0,1,0,0,0,1|2,0,0]=4 1378 B17R1.173566 COc1ccc(c(c1OC)F)CC(=O)CCO 1458a_200010293705_100000211926 [0,1,0,0,0,1|2,0,0]=4 1379 B17R1.48218 COc1ccc(c(c1OC)OC)C(=C(C)C)C 271570a_200000049429_100011320274 [0,2,0,0,0,0|2,0,0]=4 1380 B17R1.48218 COc1ccc(c(c1OC)OC)C(=O)C(C)C 1458a_100000211208_100000210206 [0,2,0,0,0,0|1,0,0]=3 1381 B17R1.48218 COc1ccc(c(c1OC)OC)C(=O)N(C)C 11a_100102631434_100000211208 [0,2,0,0,0,0|1,0,0]=3 1382 B17R1.48218 COc1ccc(c(c1OC)OC)C(=O)N(C)C 1626a_100102631434_100000211208 [0,2,0,0,0,0|1,0,0]=3 1383 B17R1.48218 COc1ccc(c(c1OC)OC)C(=O)N(C)C 240690a_100102631434_100000211208 [0,2,0,0,0,0|1,0,0]=3 1384 B17R1.48218 COc1ccc(c(c1OC)OC)C(=O)N(C)C 527a_100102631434_100000211208 [0,2,0,0,0,0|1,0,0]=3 1385 B17R1.48280 CCC(=O)c1ccc(c(c1[N+](=O)[O-])OC)OC 1458a_100009992057_100000210202 [0,2,0,0,0,0|1,0,1]=4 1386 B17R1.48280 CNC(=O)c1ccc(c(c1[N+](=O)[O-])OC)OC 11a_106832991635_100009992057 [0,2,0,0,0,0|1,0,1]=4 1387 B17R1.48280 CNC(=O)c1ccc(c(c1[N+](=O)[O-])OC)OC 1626a_100102657272_100009992057 [0,2,0,0,0,0|1,0,1]=4 1388 B17R1.48280 CNC(=O)c1ccc(c(c1[N+](=O)[O-])OC)OC 240690a_100102657272_100009992057 [0,2,0,0,0,0|1,0,1]=4 1389 B17R1.48280 CNC(=O)c1ccc(c(c1[N+](=O)[O-])OC)OC 527a_100102657272_100009992057 [0,2,0,0,0,0|1,0,1]=4 1390 B17R1.128615 C#CCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000184674 [0,2,0,0,0,0|1,0,1]=4 1391 B17R1.128615 C=CCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000210623 [0,2,0,0,0,0|1,0,1]=4 1392 B17R1.128615 CCCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000210303 [0,2,0,0,0,0|1,0,0]=3 1393 B17R1.128615 CCNC(=O)c1ccc(c(c1OC)OC)OC 11a_100015525214_100000211208 [0,2,0,0,0,0|1,0,0]=3 1394 B17R1.128615 CCNC(=O)c1ccc(c(c1OC)OC)OC 240690a_100015525214_100000211208 [0,2,0,0,0,0|1,0,0]=3 1395 B17R1.128615 CCNC(=O)c1ccc(c(c1OC)OC)OC 527a_100015525214_100000211208 [0,2,0,0,0,0|1,0,0]=3 1396 B17R1.128615 CNCC(=O)c1ccc(c(c1OC)OC)OC 2230a_106832991635_200011320270 [0,2,0,0,0,0|1,0,0]=3 1397 B17R1.128615 CNNC(=O)c1ccc(c(c1OC)OC)OC 22a_100016993582_100000211208 [0,2,0,0,0,0|1,0,0]=3 1398 B17R1.128615 COc1ccc(c(c1OC)OC)C(=O)CC#N 1458a_100000211208_100011214920 [0,2,0,0,0,0|1,0,1]=4 1399 B17R1.128615 COc1ccc(c(c1OC)OC)C(=O)CCF 1458a_100000211208_100011217306 [0,2,0,0,0,0|1,0,0]=3 1400 B17R1.128615 COc1ccc(c(c1OC)OC)C(=O)CCO 1458a_100000211208_100000211926 [0,2,0,0,0,0|1,0,0]=3 1401 B17R1.128615 COc1ccc(c(c1OC)OC)C(=O)CSC 62a_200011320270_200000210301 [0,2,0,0,0,0|0,1,0]=3 1402 B17R1.128615 COc1ccc(c(c1OC)OC)C(=O)CS[13CH3] 62a_200011320270_200025704644 [0,2,0,0,0,0|0,1,0]=3 1403 B17R1.48243 COC(=O)c1ccc(c(c1C)C=C(C)C)OC 271570a_100102525489_100010761468 [0,2,0,0,0,0|2,0,0]=4 1404 B17R1.48243 COC(=O)c1ccc(c(c1C)SC(C)C)OC 62a_100000210206_100010761468 [0,2,0,0,0,0|1,1,0]=4 1405 B17R1.48243 COC(=O)c1ccc(c(c1C)SC(C)C)OC 62a_100010761468_100000210206 [0,2,0,0,0,0|1,1,0]=4 1406 B17R1.132923 C#CCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000038162_100010761468 [0,2,0,0,0,0|1,1,0]=4 1407 B17R1.132923 C=CCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000210623_100010761468 [0,2,0,0,0,0|1,1,0]=4 1408 B17R1.132923 C=CCSc1c(ccc(c1C)C(=O)OC)OC 62a_100010761468_100000210623 [0,2,0,0,0,0|1,1,0]=4 1409 B17R1.132923 CCCCc1c(ccc(c1C)C(=O)OC)OC 271570a_100020621405_100010761468 [0,2,0,0,0,0|2,0,0]=4 1410 B17R1.132923 CCCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000210303_100010761468 [0,2,0,0,0,0|1,1,0]=4 1411 B17R1.132923 CCCSc1c(ccc(c1C)C(=O)OC)OC 62a_100010761468_100000210303 [0,2,0,0,0,0|1,1,0]=4 1412 B17R1.132923 COC(=O)c1ccc(c(c1C)SCC#N)OC 62a_100010761468_100011215382 [0,2,0,0,0,0|1,1,0]=4 1413 B17R1.132923 COC(=O)c1ccc(c(c1C)SCC#N)OC 62a_100011215382_100010761468 [0,2,0,0,0,0|1,1,0]=4 1414 B17R1.132923 COC(=O)c1ccc(c(c1C)SCC=O)OC 62a_100010761468_200015260668 [0,2,0,0,0,0|1,1,0]=4 1415 B17R1.132923 COC(=O)c1ccc(c(c1C)SCC=O)OC 62a_200015260668_100010761468 [0,2,0,0,0,0|1,1,0]=4 1416 B17R1.132923 COC(=O)c1ccc(c(c1C)SCCF)OC 62a_100010761468_100011217306 [0,2,0,0,0,0|1,1,0]=4 1417 B17R1.132923 COC(=O)c1ccc(c(c1C)SCCF)OC 62a_100011217306_100010761468 [0,2,0,0,0,0|1,1,0]=4 1418 B17R1.132923 COC(=O)c1ccc(c(c1C)SCCO)OC 62a_100000211926_100010761468 [0,2,0,0,0,0|1,1,0]=4 1419 B17R1.132923 COC(=O)c1ccc(c(c1C)SCCO)OC 62a_100010761468_100000211926 [0,2,0,0,0,0|1,1,0]=4 1420 B17R1.132923 COC(=O)c1ccc(c(c1C)SCSC)OC 62a_100010761468_100011218213 [0,2,0,0,0,0|1,1,0]=4 1421 B17R1.132923 COC(=O)c1ccc(c(c1C)SCSC)OC 62a_100011218213_100010761468 [0,2,0,0,0,0|1,1,0]=4 1422 B17R1.132923 COCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000766300_100010761468 [0,2,0,0,0,0|1,0,0]=3 1423 B17R1.132923 COCSc1c(ccc(c1C)C(=O)OC)OC 62a_100010761468_100000766300 [0,2,0,0,0,0|1,0,0]=3 1424 B17R1.48213 C=C(C)CC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000748629 [0,2,0,0,0,0|2,0,0]=4 1425 B17R1.48213 C=C(C)CC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000748629 [0,2,0,0,0,0|2,0,0]=4 1426 B17R1.48213 C=C(C)CC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000748629 [0,2,0,0,0,0|2,0,0]=4 1427 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)CC(C)C 1458a_100010284110_100000210624 [0,2,0,0,0,0|2,0,0]=4 1428 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)CC(C)O 1458a_100010284110_100011218427 [0,2,0,0,0,0|2,0,0]=4 1429 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)CC(F)F 1458a_100010284110_100011934356 [0,2,0,0,0,0|2,0,0]=4 1430 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)NC(C)C 11a_100138425928_100010284110 [0,2,0,0,0,0|2,0,0]=4 1431 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)NC(C)C 1626a_100138425928_100010284110 [0,2,0,0,0,0|2,0,0]=4 1432 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)NC(C)C 240690a_100138425928_100010284110 [0,2,0,0,0,0|2,0,0]=4 1433 B17R1.48213 COc1ccc(c(c1OC)Br)C(=O)NC(C)C 527a_100138425928_100010284110 [0,2,0,0,0,0|2,0,0]=4 1434 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)CC(C)C 1458a_100000092638_100000210624 [0,2,0,0,0,0|2,0,0]=4 1435 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)CC(C)O 1458a_100000092638_100011218427 [0,2,0,0,0,0|2,0,0]=4 1436 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)CC(F)F 1458a_100000092638_100011934356 [0,2,0,0,0,0|2,0,0]=4 1437 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)NC(C)C 11a_100138425928_100000092638 [0,2,0,0,0,0|2,0,0]=4 1438 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)NC(C)C 1626a_100138425928_100000092638 [0,2,0,0,0,0|2,0,0]=4 1439 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)NC(C)C 240690a_100138425928_100000092638 [0,2,0,0,0,0|2,0,0]=4 1440 B17R1.48213 COc1ccc(c(c1OC)C)C(=O)NC(C)C 527a_100138425928_100000092638 [0,2,0,0,0,0|2,0,0]=4 1441 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)CC(C)C 1458a_100011216413_100000210624 [0,2,0,0,0,0|2,0,0]=4 1442 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)CC(C)O 1458a_100011216413_100011218427 [0,2,0,0,0,0|2,0,0]=4 1443 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)CC(F)F 1458a_100011216413_100011934356 [0,2,0,0,0,0|2,0,0]=4 1444 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)NC(C)C 11a_100138425928_100011216413 [0,2,0,0,0,0|2,0,0]=4 1445 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)NC(C)C 1626a_100138425928_100011216413 [0,2,0,0,0,0|2,0,0]=4 1446 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)NC(C)C 240690a_100138425928_100011216413 [0,2,0,0,0,0|2,0,0]=4 1447 B17R1.48213 COc1ccc(c(c1OC)Cl)C(=O)NC(C)C 527a_100138425928_100011216413 [0,2,0,0,0,0|2,0,0]=4 1448 B17R1.48213 COc1ccc(c(c1OC)O)C(=O)CN(C)C 269982a_100102631434_100135162675 [0,2,0,0,0,0|1,0,0]=3 1449 B17R1.170810 C#CCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000753159 [0,2,0,0,0,0|2,0,0]=4 1450 B17R1.170810 C#CCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000753159 [0,2,0,0,0,0|2,0,0]=4 1451 B17R1.170810 C#CCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000753159 [0,2,0,0,0,0|2,0,0]=4 1452 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Br)OC)OC 11a_100000212058_100010284110 [0,2,0,0,0,0|2,0,0]=4 1453 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Br)OC)OC 1626a_100000212058_100010284110 [0,2,0,0,0,0|2,0,0]=4 1454 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Br)OC)OC 240690a_100000212058_100010284110 [0,2,0,0,0,0|2,0,0]=4 1455 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Br)OC)OC 527a_100000212058_100010284110 [0,2,0,0,0,0|2,0,0]=4 1456 B17R1.170810 C#CCNC(=O)c1ccc(c(c1C)OC)OC 11a_100000212058_100000092638 [0,2,0,0,0,0|2,0,0]=4 1457 B17R1.170810 C#CCNC(=O)c1ccc(c(c1C)OC)OC 1626a_100000212058_100000092638 [0,2,0,0,0,0|2,0,0]=4 1458 B17R1.170810 C#CCNC(=O)c1ccc(c(c1C)OC)OC 240690a_100000212058_100000092638 [0,2,0,0,0,0|2,0,0]=4 1459 B17R1.170810 C#CCNC(=O)c1ccc(c(c1C)OC)OC 527a_100000212058_100000092638 [0,2,0,0,0,0|2,0,0]=4 1460 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Cl)OC)OC 11a_100000212058_100011216413 [0,2,0,0,0,0|2,0,0]=4 1461 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Cl)OC)OC 1626a_100000212058_100011216413 [0,2,0,0,0,0|2,0,0]=4 1462 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Cl)OC)OC 240690a_100000212058_100011216413 [0,2,0,0,0,0|2,0,0]=4 1463 B17R1.170810 C#CCNC(=O)c1ccc(c(c1Cl)OC)OC 527a_100000212058_100011216413 [0,2,0,0,0,0|2,0,0]=4 1464 B17R1.170810 C/C=C/CC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100102629194 [0,2,0,0,0,0|2,0,0]=4 1465 B17R1.170810 C/C=C/CC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100102629194 [0,2,0,0,0,0|2,0,0]=4 1466 B17R1.170810 C/C=C/CC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100102629194 [0,2,0,0,0,0|2,0,0]=4 1467 B17R1.170810 C=CCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000754431 [0,2,0,0,0,0|2,0,0]=4 1468 B17R1.170810 C=CCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000754431 [0,2,0,0,0,0|2,0,0]=4 1469 B17R1.170810 C=CCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000754431 [0,2,0,0,0,0|2,0,0]=4 1470 B17R1.170810 C=CCNC(=O)c1ccc(c(c1Br)OC)OC 1626a_100020586998_100010284110 [0,2,0,0,0,0|2,0,0]=4 1471 B17R1.170810 C=CCNC(=O)c1ccc(c(c1Br)OC)OC 240690a_100020586998_100010284110 [0,2,0,0,0,0|2,0,0]=4 1472 B17R1.170810 C=CCNC(=O)c1ccc(c(c1Br)OC)OC 527a_100020586998_100010284110 [0,2,0,0,0,0|2,0,0]=4 1473 B17R1.170810 C=CCNC(=O)c1ccc(c(c1C)OC)OC 1626a_100020586998_100000092638 [0,2,0,0,0,0|2,0,0]=4 1474 B17R1.170810 C=CCNC(=O)c1ccc(c(c1C)OC)OC 240690a_100020586998_100000092638 [0,2,0,0,0,0|2,0,0]=4 1475 B17R1.170810 C=CCNC(=O)c1ccc(c(c1C)OC)OC 527a_100020586998_100000092638 [0,2,0,0,0,0|2,0,0]=4 1476 B17R1.170810 C=CCNC(=O)c1ccc(c(c1Cl)OC)OC 1626a_100020586998_100011216413 [0,2,0,0,0,0|2,0,0]=4 1477 B17R1.170810 C=CCNC(=O)c1ccc(c(c1Cl)OC)OC 240690a_100020586998_100011216413 [0,2,0,0,0,0|2,0,0]=4 1478 B17R1.170810 C=CCNC(=O)c1ccc(c(c1Cl)OC)OC 527a_100020586998_100011216413 [0,2,0,0,0,0|2,0,0]=4 1479 B17R1.170810 CC#CCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000748600 [0,2,0,0,0,0|2,0,0]=4 1480 B17R1.170810 CC#CCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000748600 [0,2,0,0,0,0|2,0,0]=4 1481 B17R1.170810 CC#CCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000748600 [0,2,0,0,0,0|2,0,0]=4 1482 B17R1.170810 CC=CCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000070051 [0,2,0,0,0,0|2,0,0]=4 1483 B17R1.170810 CC=CCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000070051 [0,2,0,0,0,0|2,0,0]=4 1484 B17R1.170810 CC=CCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000070051 [0,2,0,0,0,0|2,0,0]=4 1485 B17R1.170810 CCCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000210211 [0,2,0,0,0,0|2,0,0]=4 1486 B17R1.170810 CCCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000210211 [0,2,0,0,0,0|2,0,0]=4 1487 B17R1.170810 CCCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000210211 [0,2,0,0,0,0|2,0,0]=4 1488 B17R1.170810 CCCNC(=O)c1ccc(c(c1Br)OC)OC 11a_100020643023_100010284110 [0,2,0,0,0,0|2,0,0]=4 1489 B17R1.170810 CCCNC(=O)c1ccc(c(c1Br)OC)OC 1626a_100020643023_100010284110 [0,2,0,0,0,0|2,0,0]=4 1490 B17R1.170810 CCCNC(=O)c1ccc(c(c1Br)OC)OC 240690a_100020643023_100010284110 [0,2,0,0,0,0|2,0,0]=4 1491 B17R1.170810 CCCNC(=O)c1ccc(c(c1Br)OC)OC 527a_100020643023_100010284110 [0,2,0,0,0,0|2,0,0]=4 1492 B17R1.170810 CCCNC(=O)c1ccc(c(c1C)OC)OC 11a_100020643023_100000092638 [0,2,0,0,0,0|2,0,0]=4 1493 B17R1.170810 CCCNC(=O)c1ccc(c(c1C)OC)OC 1626a_100020643023_100000092638 [0,2,0,0,0,0|2,0,0]=4 1494 B17R1.170810 CCCNC(=O)c1ccc(c(c1C)OC)OC 240690a_100020643023_100000092638 [0,2,0,0,0,0|2,0,0]=4 1495 B17R1.170810 CCCNC(=O)c1ccc(c(c1C)OC)OC 527a_100020643023_100000092638 [0,2,0,0,0,0|2,0,0]=4 1496 B17R1.170810 CCCNC(=O)c1ccc(c(c1Cl)OC)OC 11a_100020643023_100011216413 [0,2,0,0,0,0|2,0,0]=4 1497 B17R1.170810 CCCNC(=O)c1ccc(c(c1Cl)OC)OC 1626a_100020643023_100011216413 [0,2,0,0,0,0|2,0,0]=4 1498 B17R1.170810 CCCNC(=O)c1ccc(c(c1Cl)OC)OC 240690a_100020643023_100011216413 [0,2,0,0,0,0|2,0,0]=4 1499 B17R1.170810 CCCNC(=O)c1ccc(c(c1Cl)OC)OC 527a_100020643023_100011216413 [0,2,0,0,0,0|2,0,0]=4 1500 B17R1.170810 CCNN=C(C)c1ccc(c(c1O)OC)OC 4a_100000756455_100000061221 [0,2,0,0,0,0|2,0,0]=4 1501 B17R1.170810 CCNNC(=O)c1ccc(c(c1Br)OC)OC 22a_100000756455_100010284110 [0,2,0,0,0,0|2,0,0]=4 1502 B17R1.170810 CCNNC(=O)c1ccc(c(c1C)OC)OC 22a_100000756455_100000092638 [0,2,0,0,0,0|2,0,0]=4 1503 B17R1.170810 CCNNC(=O)c1ccc(c(c1Cl)OC)OC 22a_100000756455_100011216413 [0,2,0,0,0,0|2,0,0]=4 1504 B17R1.170810 COCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000233755 [0,2,0,0,0,0|1,0,0]=3 1505 B17R1.170810 COCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000233755 [0,2,0,0,0,0|1,0,0]=3 1506 B17R1.170810 COCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000233755 [0,2,0,0,0,0|1,0,0]=3 1507 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)CCC#N 1458a_100010284110_100011215226 [0,2,0,0,0,0|2,0,0]=4 1508 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)CCCF 1458a_100010284110_100011934791 [0,2,0,0,0,0|2,0,0]=4 1509 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)CCCO 1458a_100010284110_100011215043 [0,2,0,0,0,0|2,0,0]=4 1510 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)CCSC 1458a_100010284110_100000751147 [0,2,0,0,0,0|1,1,0]=4 1511 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCC#N 1626a_100000734998_100010284110 [0,2,0,0,0,0|2,0,0]=4 1512 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCC#N 527a_100000734998_100010284110 [0,2,0,0,0,0|2,0,0]=4 1513 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCCF 11a_100000724931_100010284110 [0,2,0,0,0,0|2,0,0]=4 1514 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCCF 1626a_100000724931_100010284110 [0,2,0,0,0,0|2,0,0]=4 1515 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCCF 240690a_100000724931_100010284110 [0,2,0,0,0,0|2,0,0]=4 1516 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCCF 527a_100000724931_100010284110 [0,2,0,0,0,0|2,0,0]=4 1517 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCCO 240690a_100000210304_100010284110 [0,2,0,0,0,0|2,0,0]=4 1518 B17R1.170810 COc1ccc(c(c1OC)Br)C(=O)NCCO 527a_100000210304_100010284110 [0,2,0,0,0,0|2,0,0]=4 1519 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)CCC#N 1458a_100000092638_100011215226 [0,2,0,0,0,0|2,0,0]=4 1520 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)CCCF 1458a_100000092638_100011934791 [0,2,0,0,0,0|2,0,0]=4 1521 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)CCCO 1458a_100000092638_100011215043 [0,2,0,0,0,0|2,0,0]=4 1522 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)CCSC 1458a_100000092638_100000751147 [0,2,0,0,0,0|1,1,0]=4 1523 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCC#N 1626a_100000734998_100000092638 [0,2,0,0,0,0|2,0,0]=4 1524 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCC#N 527a_100000734998_100000092638 [0,2,0,0,0,0|2,0,0]=4 1525 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCCF 11a_100000724931_100000092638 [0,2,0,0,0,0|2,0,0]=4 1526 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCCF 1626a_100000724931_100000092638 [0,2,0,0,0,0|2,0,0]=4 1527 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCCF 240690a_100000724931_100000092638 [0,2,0,0,0,0|2,0,0]=4 1528 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCCF 527a_100000724931_100000092638 [0,2,0,0,0,0|2,0,0]=4 1529 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCCO 240690a_100000210304_100000092638 [0,2,0,0,0,0|2,0,0]=4 1530 B17R1.170810 COc1ccc(c(c1OC)C)C(=O)NCCO 527a_100000210304_100000092638 [0,2,0,0,0,0|2,0,0]=4 1531 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)CCC#N 1458a_100011216413_100011215226 [0,2,0,0,0,0|2,0,0]=4 1532 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)CCCF 1458a_100011216413_100011934791 [0,2,0,0,0,0|2,0,0]=4 1533 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)CCCO 1458a_100011216413_100011215043 [0,2,0,0,0,0|2,0,0]=4 1534 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)CCSC 1458a_100011216413_100000751147 [0,2,0,0,0,0|1,1,0]=4 1535 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCC#N 1626a_100000734998_100011216413 [0,2,0,0,0,0|2,0,0]=4 1536 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCC#N 527a_100000734998_100011216413 [0,2,0,0,0,0|2,0,0]=4 1537 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCCF 11a_100000724931_100011216413 [0,2,0,0,0,0|2,0,0]=4 1538 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCCF 1626a_100000724931_100011216413 [0,2,0,0,0,0|2,0,0]=4 1539 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCCF 240690a_100000724931_100011216413 [0,2,0,0,0,0|2,0,0]=4 1540 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCCF 527a_100000724931_100011216413 [0,2,0,0,0,0|2,0,0]=4 1541 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCCO 240690a_100000210304_100011216413 [0,2,0,0,0,0|2,0,0]=4 1542 B17R1.170810 COc1ccc(c(c1OC)Cl)C(=O)NCCO 527a_100000210304_100011216413 [0,2,0,0,0,0|2,0,0]=4 1543 B15R1.9232 CC=Cc1cc(ccc1C(=O)OC)OC 271570a_100016259895_100009815674 [0,0,1,1,0,0|2,0,0]=4 1544 B15R1.9232 CC=Cc1nc(ccc1C(=O)OC)OC 271570a_100016259895_100010136187 [0,0,1,1,0,0|2,0,0]=4 1545 B15R1.9232 COCc1cc(ccc1C(=O)OC)OC 34a_100138415774_100010138730 [0,0,1,1,0,0|1,0,1]=4 1546 B15R1.27362 CC=Cc1cc(c(cc1C)O)C(=O)OC 271570a_100016259895_100010233952 [0,0,1,1,0,0|2,0,0]=4 1547 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC 34a_100000074908_200000210301 [0,0,1,1,0,0|1,0,1]=4 1548 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC 34a_100009869222_200000210301 [0,0,1,1,0,0|1,0,1]=4 1549 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)O[13CH3] 34a_100000074908_200025704644 [0,0,1,1,0,0|1,0,1]=4 1550 B15R1.3769 COC(=O)Cc1ccc(c(c1)O[13CH3])OC 34a_100009869222_200025704644 [0,0,1,1,0,0|1,0,1]=4 1551 B15R2.1601 CCC(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_100000210202 [1,0,0,1,0,0|2,0,0]=4 1552 B15R2.1601 CCC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210202 [1,0,0,1,0,0|1,0,0]=3 1553 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 11a_106832991635_100011398765 [1,0,0,1,0,0|2,0,0]=4 1554 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 1626a_100102657272_100011398765 [1,0,0,1,0,0|2,0,0]=4 1555 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 240690a_100102657272_100011398765 [1,0,0,1,0,0|2,0,0]=4 1556 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 527a_100102657272_100011398765 [1,0,0,1,0,0|2,0,0]=4 1557 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 11a_106832991635_100000182659 [1,0,0,1,0,0|1,0,0]=3 1558 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 1626a_100102657272_100000182659 [1,0,0,1,0,0|1,0,0]=3 1559 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 240690a_100102657272_100000182659 [1,0,0,1,0,0|1,0,0]=3 1560 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 527a_100102657272_100000182659 [1,0,0,1,0,0|1,0,0]=3 1561 B15R2.1601 O=C(CF)c1ccc2c(c1)OCCO2 1458a_100000182659_100015361967 [1,0,0,1,0,0|2,0,0]=4 1562 B15R2.21574 COc1cc2c(cc1SC)C(=O)CC2 62a_200000210301_200010010916 [1,0,0,1,0,0|1,1,0]=4 1563 B15R2.21574 COc1cc2c(cc1SC)C(=O)CC2 62a_200010010916_200000210301 [1,0,0,1,0,0|1,1,0]=4 1564 B15R2.21574 COc1cc2c(cc1SC)CCC2=O 62a_100010233615_200000210301 [1,0,0,1,0,0|1,1,0]=4 1565 B15R2.21574 COc1cc2c(cc1SC)CCC2=O 62a_200000210301_100010233615 [1,0,0,1,0,0|1,1,0]=4 1566 B15R2.21574 COc1cc2c(cc1S[13CH3])C(=O)CC2 62a_200010010916_200025704644 [1,0,0,1,0,0|1,1,0]=4 1567 B15R2.21574 COc1cc2c(cc1S[13CH3])C(=O)CC2 62a_200025704644_200010010916 [1,0,0,1,0,0|1,1,0]=4 1568 B15R2.21574 COc1cc2c(cc1S[13CH3])CCC2=O 62a_100010233615_200025704644 [1,0,0,1,0,0|1,1,0]=4 1569 B15R2.21574 COc1cc2c(cc1S[13CH3])CCC2=O 62a_200025704644_100010233615 [1,0,0,1,0,0|1,1,0]=4 1570 B15R2.22325 COc1ccc2c(c1SC)CCC2=O 62a_100010212354_200000210301 [1,0,0,1,0,0|1,1,0]=4 1571 B15R2.22325 COc1ccc2c(c1SC)CCC2=O 62a_200000210301_100010212354 [1,0,0,1,0,0|1,1,0]=4 1572 B15R2.22325 COc1ccc2c(c1S[13CH3])CCC2=O 62a_100010212354_200025704644 [1,0,0,1,0,0|1,1,0]=4 1573 B15R2.22325 COc1ccc2c(c1S[13CH3])CCC2=O 62a_200025704644_100010212354 [1,0,0,1,0,0|1,1,0]=4 1574 B15R2.627 C=C(C)c1ccc2c(c1C)OCCO2 271570a_100000694244_100010072848 [1,0,0,1,0,0|2,0,0]=4 1575 B15R2.22219 C=Cc1ccc(c2c1OCO2)C(=O)C 271570a_100011290941_100021123059 [1,0,0,1,0,0|1,0,1]=4 1576 B15R2.22219 CC(=O)c1ccc(c2c1CCC2)O[13CH3] 34a_100010637159_200025704644 [1,0,0,1,0,0|2,0,0]=4 1577 B15R2.22219 CC(=O)c1ccc(c2c1CCC2)O[13CH3] 7a_100010637159_200025704644 [1,0,0,1,0,0|2,0,0]=4 1578 B15R2.22219 CC(=O)c1ccc(c2c1OCO2)S[13CH3] 62a_100021123059_200025704644 [1,0,0,1,0,0|0,1,0]=3 1579 B15R2.22219 COc1ccc(c2c1CCC2)C(=O)C 34a_100010637159_200000210301 [1,0,0,1,0,0|2,0,0]=4 1580 B15R2.22219 COc1ccc(c2c1CCC2)C(=O)C 7a_100010637159_200000210301 [1,0,0,1,0,0|2,0,0]=4 1581 B15R2.22219 CSc1ccc(c2c1OCO2)C(=O)C 62a_100021123059_200000210301 [1,0,0,1,0,0|0,1,0]=3 1582 B15R2.1586 CCC(=O)c1ccc2c(c1C)OCO2 1458a_100009908537_100000210202 [1,0,0,1,0,0|2,0,0]=4 1583 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 11a_106832991635_100009908537 [1,0,0,1,0,0|2,0,0]=4 1584 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 1626a_100102657272_100009908537 [1,0,0,1,0,0|2,0,0]=4 1585 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 240690a_100102657272_100009908537 [1,0,0,1,0,0|2,0,0]=4 1586 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 527a_100102657272_100009908537 [1,0,0,1,0,0|2,0,0]=4 1587 B15R2.22378 COc1ccc2c(c1C)OCCC2=O 34a_100000113194_200000210301 [1,0,0,1,0,0|1,0,0]=3 1588 B15R2.22378 COc1ccc2c(c1C)OCCC2=O 7a_100000113194_200000210301 [1,0,0,1,0,0|1,0,0]=3 1589 B15R2.22378 Cc1c(ccc2c1OCCC2=O)O[13CH3] 34a_100000113194_200025704644 [1,0,0,1,0,0|1,0,0]=3 1590 B15R2.22378 Cc1c(ccc2c1OCCC2=O)O[13CH3] 7a_100000113194_200025704644 [1,0,0,1,0,0|1,0,0]=3 1591 B15R2.5778 COc1c(ccc2c1CCCC2=O)C 34a_100009872817_200000210301 [1,0,0,1,0,0|2,0,0]=4 1592 B15R2.5778 COc1c(ccc2c1CCCC2=O)C 7a_100009872817_200000210301 [1,0,0,1,0,0|2,0,0]=4 1593 B15R2.5778 Cc1ccc2c(c1O[13CH3])CCCC2=O 34a_100009872817_200025704644 [1,0,0,1,0,0|2,0,0]=4 1594 B15R2.5778 Cc1ccc2c(c1O[13CH3])CCCC2=O 7a_100009872817_200025704644 [1,0,0,1,0,0|2,0,0]=4 1595 B15R2.2220 CC=Cc1ccc2c(c1C)OCCO2 271570a_100016259895_100010072848 [1,0,0,1,0,0|2,0,0]=4 1596 B17R2.12316 COc1ccc(c(c1OC)C)C2=CCOC2 271570a_100009872500_100010000156 [0,1,0,1,0,0|2,0,0]=4 1597 B17R2.12316 COc1ccc(c(c1OC)C)C2=COCC2 271570a_100000118173_100010000156 [0,1,0,1,0,0|2,0,0]=4 1598 B17R2.73360 COC(=O)c1ccc(c(c1C)C2CC2)OC 271570a_100011220607_100010761468 [0,1,0,1,0,0|2,0,0]=4 1599 B17R2.356959 COC(=O)c1cc(c2c(c1O)CCCC2)O 271570a_203496583355_100010113800 [0,1,0,1,0,0|2,0,0]=4 1600 B13R1.2067 COC(=O)c1cc(c(s1)OC)SC 62a_100134754287_200000210301 [1,0,0,0,1,0|1,1,0]=4 1601 B13R1.2067 COC(=O)c1cc(c(s1)OC)SC 62a_200000210301_100134754287 [1,0,0,0,1,0|1,1,0]=4 1602 B13R1.2067 COC(=O)c1cc(c(s1)OC)S[13CH3] 62a_100134754287_200025704644 [1,0,0,0,1,0|1,1,0]=4 1603 B13R1.2067 COC(=O)c1cc(c(s1)OC)S[13CH3] 62a_200025704644_100134754287 [1,0,0,0,1,0|1,1,0]=4 1604 B13R1.3099 COC(=O)c1csc(c1OC)SC 62a_200000210301_100010277438 [1,0,0,0,1,0|1,1,0]=4 1605 B13R1.3099 COC(=O)c1csc(c1OC)S[13CH3] 62a_200025704644_100010277438 [1,0,0,0,1,0|1,1,0]=4 1606 B15R1.1846 CCC(=O)Nc1ccc(c(c1C)C)OC 11a_100025755787_100000210414 [1,0,0,0,0,1|2,0,0]=4 1607 B15R1.1846 CCC(=O)Nc1ccc(c(c1C)C)OC 1626a_100025755787_100000210414 [1,0,0,0,0,1|2,0,0]=4 1608 B15R1.1846 CCC(=O)Nc1ccc(c(c1C)C)OC 22a_100025755787_100000210414 [1,0,0,0,0,1|2,0,0]=4 1609 B15R1.1846 CCC(=O)Nc1ccc(c(c1C)C)OC 527a_100025755787_100000210414 [1,0,0,0,0,1|2,0,0]=4 1610 B15R1.1846 CNC(=O)Nc1ccc(c(c1C)C)OC 2430a_100025755787_100102657272 [1,0,0,0,0,1|2,0,0]=4 1611 B15R1.695 C=Cc1cc(c(c(c1)C(=O)OC)O)OC 271570a_100011290941_100010164242 [0,0,0,0,1,1|1,0,1]=4 1612 B17R1.48215 CCC(=O)C=Cc1ccc(c(c1Cl)OC)OC 1458a_200020587463_100000210202 [0,0,0,0,0,2|2,0,0]=4 1613 B17R1.48215 CCC(=O)C=Cc1ccc(c(c1I)OC)OC 6a_100010191550_100000211110 [0,0,0,0,0,2|2,0,0]=4 1614 B17R1.48215 CCC(=O)CCc1ccc(c(c1C)OC)OC 1458a_200010008019_100000210202 [0,0,0,0,0,2|2,0,0]=4 1615 B17R1.48215 CCC(=O)CSc1ccc(c(c1C)OC)OC 62a_100000747405_100010000156 [0,0,0,0,0,2|2,0,0]=4 1616 B17R1.48215 CCC(=O)NCc1ccc(c(c1Cl)OC)OC 11a_102515433231_100000210414 [0,0,0,0,0,2|2,0,0]=4 1617 B17R1.48215 CCC(=O)NCc1ccc(c(c1Cl)OC)OC 1626a_102515433231_100000210414 [0,0,0,0,0,2|2,0,0]=4 1618 B17R1.48215 CCC(=O)NCc1ccc(c(c1Cl)OC)OC 240690a_102515433231_100000210414 [0,0,0,0,0,2|2,0,0]=4 1619 B17R1.48215 CCC(=O)NCc1ccc(c(c1Cl)OC)OC 527a_102515433231_100000210414 [0,0,0,0,0,2|2,0,0]=4 1620 B17R1.48215 CNC(=O)C=Cc1ccc(c(c1Cl)OC)OC 11a_106832991635_200020587463 [0,0,0,0,0,2|2,0,0]=4 1621 B17R1.48215 CNC(=O)C=Cc1ccc(c(c1Cl)OC)OC 1626a_100102657272_200020587463 [0,0,0,0,0,2|2,0,0]=4 1622 B17R1.48215 CNC(=O)C=Cc1ccc(c(c1Cl)OC)OC 240690a_100102657272_200020587463 [0,0,0,0,0,2|2,0,0]=4 1623 B17R1.48215 CNC(=O)CCc1ccc(c(c1C)OC)OC 11a_106832991635_200010008019 [0,0,0,0,0,2|2,0,0]=4 1624 B17R1.48215 CNC(=O)CCc1ccc(c(c1C)OC)OC 1626a_100102657272_200010008019 [0,0,0,0,0,2|2,0,0]=4 1625 B17R1.48215 CNC(=O)CCc1ccc(c(c1C)OC)OC 240690a_100102657272_200010008019 [0,0,0,0,0,2|2,0,0]=4 1626 B17R1.48215 CNC(=O)CCc1ccc(c(c1C)OC)OC 527a_100102657272_200010008019 [0,0,0,0,0,2|2,0,0]=4 1627 B17R1.48215 CNC(=O)CSc1ccc(c(c1C)OC)OC 62a_100000183359_100010000156 [0,0,0,0,0,2|2,0,0]=4 1628 B17R1.48215 CNC(=O)NCc1ccc(c(c1Cl)OC)OC 2708a_100102657272_102515433231 [0,0,0,0,0,2|2,0,0]=4 1629 B17R1.48215 CNC(=O)NCc1ccc(c(c1Cl)OC)OC 2708a_102515433231_106832991635 [0,0,0,0,0,2|2,0,0]=4 1630 B17R1.48215 CNC(=O)NCc1ccc(c(c1Cl)OC)OC 273464a_100102657272_102515433231 [0,0,0,0,0,2|2,0,0]=4 1631 B17R1.48215 CNC(=O)NCc1ccc(c(c1Cl)OC)OC 273464a_102515433231_100102657272 [0,0,0,0,0,2|2,0,0]=4 1632 B17R1.48215 CNC(=O)NCc1ccc(c(c1Cl)OC)OC 512a_102515433231_100102657272 [0,0,0,0,0,2|2,0,0]=4 1633 B17R1.48215 CNC(=O)NCc1ccc(c(c1Cl)OC)OC 512a_106832991638_102515433231 [0,0,0,0,0,2|2,0,0]=4 1634 B17R1.48215 COC(=O)CSc1ccc(c(c1C)OC)OC 62a_100000747449_100010000156 [0,0,0,0,0,2|1,0,0]=3 1635 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [3,0,0,0,0,0|1,0,0]=4 1636 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [3,0,0,0,0,0|1,0,0]=4 1637 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [3,0,0,0,0,0|0,0,0]=3 1638 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [3,0,0,0,0,0|0,0,0]=3 1639 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [3,0,0,0,0,0|1,0,0]=4 1640 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [3,0,0,0,0,0|1,0,0]=4 1641 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_100011934287_200025704644 [3,0,0,0,0,0|0,1,0]=4 1642 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100011934287 [3,0,0,0,0,0|0,1,0]=4 1643 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [3,0,0,0,0,0|0,1,0]=4 1644 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [3,0,0,0,0,0|1,0,0]=4 1645 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [3,0,0,0,0,0|1,0,0]=4 1646 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [3,0,0,0,0,0|0,0,0]=3 1647 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [3,0,0,0,0,0|0,0,0]=3 1648 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [3,0,0,0,0,0|0,0,0]=3 1649 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [3,0,0,0,0,0|0,0,0]=3 1650 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [3,0,0,0,0,0|1,0,0]=4 1651 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [3,0,0,0,0,0|1,0,0]=4 1652 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [3,0,0,0,0,0|1,0,0]=4 1653 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [3,0,0,0,0,0|1,0,0]=4 1654 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [3,0,0,0,0,0|1,0,0]=4 1655 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [3,0,0,0,0,0|1,0,0]=4 1656 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [3,0,0,0,0,0|1,0,0]=4 1657 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [3,0,0,0,0,0|1,0,0]=4 1658 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [3,0,0,0,0,0|0,0,0]=3 1659 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [3,0,0,0,0,0|0,0,0]=3 1660 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [3,0,0,0,0,0|1,0,0]=4 1661 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [3,0,0,0,0,0|0,0,0]=3 1662 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_100011934287_200000210301 [3,0,0,0,0,0|0,1,0]=4 1663 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_200000210301_100011934287 [3,0,0,0,0,0|0,1,0]=4 1664 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [3,0,0,0,0,0|0,1,0]=4 1665 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [3,0,0,0,0,0|1,0,0]=4 1666 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [3,0,0,0,0,0|1,0,0]=4 1667 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [3,0,0,0,0,0|0,0,1]=4 1668 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [3,0,0,0,0,0|0,0,1]=4 1669 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [3,0,0,0,0,0|0,0,1]=4 1670 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [3,0,0,0,0,0|0,0,1]=4 1671 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [3,0,0,0,0,0|1,0,0]=4 1672 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [3,0,0,0,0,0|1,0,0]=4 1673 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [3,0,0,0,0,0|1,0,0]=4 1674 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [3,0,0,0,0,0|1,0,0]=4 1675 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [3,0,0,0,0,0|1,0,0]=4 1676 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 11a_106832991635_100000210898 [3,0,0,0,0,0|1,0,0]=4 1677 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 1626a_100102657272_100000210898 [3,0,0,0,0,0|1,0,0]=4 1678 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 240690a_100102657272_100000210898 [3,0,0,0,0,0|1,0,0]=4 1679 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 527a_100102657272_100000210898 [3,0,0,0,0,0|1,0,0]=4 1680 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [3,0,0,0,0,0|1,0,0]=4 1681 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [3,0,0,0,0,0|1,0,0]=4 1682 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [3,0,0,0,0,0|1,0,0]=4 1683 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [3,0,0,0,0,0|1,0,0]=4 1684 B12R1.367 COC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100010080863 [3,0,0,0,0,0|1,0,0]=4 1685 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [3,0,0,0,0,0|1,0,0]=4 1686 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [3,0,0,0,0,0|0,0,0]=3 1687 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [3,0,0,0,0,0|1,0,0]=4 1688 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [3,0,0,0,0,0|1,0,0]=4 1689 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [3,0,0,0,0,0|1,0,0]=4 1690 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [3,0,0,0,0,0|1,0,0]=4 1691 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [3,0,0,0,0,0|0,0,0]=3 1692 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [3,0,0,0,0,0|1,0,0]=4 1693 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [3,0,0,0,0,0|1,0,0]=4 1694 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [3,0,0,0,0,0|1,0,0]=4 1695 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [3,0,0,0,0,0|0,0,0]=3 1696 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [3,0,0,0,0,0|0,0,0]=3 1697 B12R1.367 COC(=O)c1ccc(c(n1)C)O 271570a_203496583355_100010207261 [3,0,0,0,0,0|1,0,0]=4 1698 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [3,0,0,0,0,0|1,0,0]=4 1699 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189637 [3,0,0,0,0,0|1,0,0]=4 1700 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_200009815348 [3,0,0,0,0,0|1,0,0]=4 1701 B12R1.367 COC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009862495 [3,0,0,0,0,0|1,0,0]=4 1702 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010109663 [3,0,0,0,0,0|1,0,0]=4 1703 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010999399 [3,0,0,0,0,0|1,0,0]=4 1704 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [3,0,0,0,0,0|1,0,0]=4 1705 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [3,0,0,0,0,0|1,0,0]=4 1706 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [3,0,0,0,0,0|1,0,0]=4 1707 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [3,0,0,0,0,0|1,0,0]=4 1708 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [3,0,0,0,0,0|1,0,0]=4 1709 B12R1.435 CNC(=O)c1cccc(c1)OC 11a_106832991635_100000188888 [3,0,0,0,0,0|1,0,0]=4 1710 B12R1.435 CNC(=O)c1cccc(c1)OC 1626a_100102657272_100000188888 [3,0,0,0,0,0|1,0,0]=4 1711 B12R1.435 CNC(=O)c1cccc(c1)OC 240690a_100102657272_100000188888 [3,0,0,0,0,0|1,0,0]=4 1712 B12R1.435 CNC(=O)c1cccc(c1)OC 34a_100000159807_200000210301 [3,0,0,0,0,0|1,0,0]=4 1713 B12R1.435 CNC(=O)c1cccc(c1)OC 527a_100102657272_100000188888 [3,0,0,0,0,0|1,0,0]=4 1714 B12R1.435 CNC(=O)c1cccc(c1)OC 7a_100000159807_200000210301 [3,0,0,0,0,0|1,0,0]=4 1715 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 34a_100000159807_200025704644 [3,0,0,0,0,0|1,0,0]=4 1716 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 7a_100000159807_200025704644 [3,0,0,0,0,0|1,0,0]=4 1717 B12R1.435 COC(=O)c1cc(ccn1)OC 34a_200020638413_200000210301 [3,0,0,0,0,0|1,0,0]=4 1718 B12R1.435 COC(=O)c1cc(ccn1)O[13CH3] 34a_200020638413_200025704644 [3,0,0,0,0,0|1,0,0]=4 1719 B12R1.435 COC(=O)c1cccc(c1)OC 34a_100000150331_200000210301 [3,0,0,0,0,0|0,0,0]=3 1720 B12R1.435 COC(=O)c1cccc(c1)OC 7a_100000150331_200000210301 [3,0,0,0,0,0|0,0,0]=3 1721 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 34a_100000150331_200025704644 [3,0,0,0,0,0|0,0,0]=3 1722 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 7a_100000150331_200025704644 [3,0,0,0,0,0|0,0,0]=3 1723 B12R1.435 COC(=O)c1cccc(c1)SC 62a_100000148848_200000210301 [3,0,0,0,0,0|0,1,0]=4 1724 B12R1.435 COC(=O)c1cccc(c1)SC 62a_200000210301_100000148848 [3,0,0,0,0,0|0,1,0]=4 1725 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_100000148848_200025704644 [3,0,0,0,0,0|0,1,0]=4 1726 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000148848 [3,0,0,0,0,0|0,1,0]=4 1727 B12R1.435 COC(=O)c1ccnc(c1)OC 34a_100138552365_200000210301 [3,0,0,0,0,0|1,0,0]=4 1728 B12R1.435 COC(=O)c1ccnc(c1)O[13CH3] 34a_100138552365_200025704644 [3,0,0,0,0,0|1,0,0]=4 1729 B12R1.435 COC(=O)c1cncc(c1)OC 34a_100000687108_200000210301 [3,0,0,0,0,0|1,0,0]=4 1730 B12R1.435 COC(=O)c1cncc(c1)OC 7a_100000687108_200000210301 [3,0,0,0,0,0|1,0,0]=4 1731 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 34a_100000687108_200025704644 [3,0,0,0,0,0|1,0,0]=4 1732 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 7a_100000687108_200025704644 [3,0,0,0,0,0|1,0,0]=4 1733 B12R1.78 C=Cc1ccc(c(c1)OC)OC 271570a_100011290941_100000187503 [3,0,0,0,0,0|0,0,1]=4 1734 B12R1.78 C=Cc1ccc(c(c1)OC)OC 34a_100011217988_200000210301 [3,0,0,0,0,0|0,0,1]=4 1735 B12R1.78 C=Cc1ccc(c(c1)OC)O[13CH3] 34a_100011217988_200025704644 [3,0,0,0,0,0|0,0,1]=4 1736 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100000186467_200000210301 [3,0,0,0,0,0|0,0,1]=4 1737 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100009844796_200000210301 [3,0,0,0,0,0|0,0,1]=4 1738 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100000186467_200000210301 [3,0,0,0,0,0|0,0,1]=4 1739 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100009844796_200000210301 [3,0,0,0,0,0|0,0,1]=4 1740 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 34a_100000186467_200025704644 [3,0,0,0,0,0|0,0,1]=4 1741 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 7a_100000186467_200025704644 [3,0,0,0,0,0|0,0,1]=4 1742 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 34a_100009844796_200025704644 [3,0,0,0,0,0|0,0,1]=4 1743 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 7a_100009844796_200025704644 [3,0,0,0,0,0|0,0,1]=4 1744 B12R1.78 CNc1cc(ccc1OC)OC 2230a_100000184736_200000210301 [3,0,0,0,0,0|1,0,0]=4 1745 B12R1.78 CNc1cc(ccc1OC)OC 34a_100000184736_200000210301 [3,0,0,0,0,0|1,0,0]=4 1746 B12R1.78 CNc1ccc(c(c1)OC)OC 34a_100000187404_200000210301 [3,0,0,0,0,0|1,0,0]=4 1747 B12R1.78 CNc1ccc(cc1OC)OC 2230a_100000211191_200000210301 [3,0,0,0,0,0|1,0,0]=4 1748 B12R1.78 CNc1ccc(cc1OC)OC 34a_100000211191_200000210301 [3,0,0,0,0,0|1,0,0]=4 1749 B12R1.78 COc1cc(ccc1SC)C=O 62a_100010244714_200000210301 [3,0,0,0,0,0|0,1,0]=4 1750 B12R1.78 COc1cc(ccc1SC)C=O 62a_200000210301_100010244714 [3,0,0,0,0,0|0,1,0]=4 1751 B12R1.78 COc1cc(ccc1S[13CH3])C=O 62a_100010244714_200025704644 [3,0,0,0,0,0|0,1,0]=4 1752 B12R1.78 COc1cc(ccc1S[13CH3])C=O 62a_200025704644_100010244714 [3,0,0,0,0,0|0,1,0]=4 1753 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 2230a_100000184736_200025704644 [3,0,0,0,0,0|1,0,0]=4 1754 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 34a_100000184736_200025704644 [3,0,0,0,0,0|1,0,0]=4 1755 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 2230a_100000211191_200025704644 [3,0,0,0,0,0|1,0,0]=4 1756 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 34a_100000211191_200025704644 [3,0,0,0,0,0|1,0,0]=4 1757 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000039706_200000210301 [3,0,0,0,0,0|0,0,0]=3 1758 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000074795_200000210301 [3,0,0,0,0,0|0,0,0]=3 1759 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100009840267_200000210301 [3,0,0,0,0,0|0,0,0]=3 1760 B12R1.78 COc1ccc(c(c1)OC)O[13CH3] 34a_100009840267_200025704644 [3,0,0,0,0,0|0,0,0]=3 1761 B12R1.78 COc1ccc(c(c1)OC)SC 62a_100000750026_200000210301 [3,0,0,0,0,0|0,1,0]=4 1762 B12R1.78 COc1ccc(c(c1)OC)SC 62a_200000210301_100000750026 [3,0,0,0,0,0|0,1,0]=4 1763 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_100000750026_200025704644 [3,0,0,0,0,0|0,1,0]=4 1764 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100000750026 [3,0,0,0,0,0|0,1,0]=4 1765 B12R1.78 COc1ccc(c(c1)O[13CH3])OC 34a_100000074795_200025704644 [3,0,0,0,0,0|0,0,0]=3 1766 B12R1.78 COc1ccc(c(c1)SC)OC 62a_100011215452_200000210301 [3,0,0,0,0,0|0,1,0]=4 1767 B12R1.78 COc1ccc(c(c1)SC)OC 62a_200000210301_100011215452 [3,0,0,0,0,0|0,1,0]=4 1768 B12R1.78 COc1ccc(c(c1)S[13CH3])OC 62a_100011215452_200025704644 [3,0,0,0,0,0|0,1,0]=4 1769 B12R1.78 COc1ccc(c(c1)S[13CH3])OC 62a_200025704644_100011215452 [3,0,0,0,0,0|0,1,0]=4 1770 B12R1.78 COc1ccc(c(n1)OC)OC 34a_100000085135_200000210301 [3,0,0,0,0,0|1,0,0]=4 1771 B12R1.78 COc1ccc(c(n1)OC)O[13CH3] 34a_100000085135_200025704644 [3,0,0,0,0,0|1,0,0]=4 1772 B12R1.78 COc1ccc(cc1OC)CO 34a_100011215239_200000210301 [3,0,0,0,0,0|0,0,1]=4 1773 B12R1.78 COc1ccc(cc1OC)N[13CH3] 34a_100000187404_200025704644 [3,0,0,0,0,0|1,0,0]=4 1774 B12R1.78 COc1ccc(cc1OC)O[13CH3] 34a_100000039706_200025704644 [3,0,0,0,0,0|0,0,0]=3 1775 B12R1.78 COc1ccc(cc1OC)SC 62a_200000210301_100011356967 [3,0,0,0,0,0|0,1,0]=4 1776 B12R1.78 COc1ccc(cc1OC)S[13CH3] 62a_200025704644_100011356967 [3,0,0,0,0,0|0,1,0]=4 1777 B12R1.78 COc1ccc(cc1O[13CH3])CO 34a_100011215239_200025704644 [3,0,0,0,0,0|0,0,1]=4 1778 B12R1.78 COc1ccc(cc1SC)C=O 62a_100000173361_200000210301 [3,0,0,0,0,0|0,1,0]=4 1779 B12R1.78 COc1ccc(cc1SC)C=O 62a_200000210301_100000173361 [3,0,0,0,0,0|0,1,0]=4 1780 B12R1.78 COc1ccc(cc1S[13CH3])C=O 62a_100000173361_200025704644 [3,0,0,0,0,0|0,1,0]=4 1781 B12R1.78 COc1ccc(cc1S[13CH3])C=O 62a_200025704644_100000173361 [3,0,0,0,0,0|0,1,0]=4 1782 B12R1.288 CC=Cc1ccc(c(c1)C)OC 271570a_100016259895_100011219705 [3,0,0,0,0,0|1,0,0]=4 1783 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [3,0,0,0,0,0|1,0,0]=4 1784 B12R1.288 COCc1ccc(c(c1)C)OC 34a_100138415774_200011290836 [3,0,0,0,0,0|0,0,1]=4 1785 B12R1.288 COCc1ccc(c(c1)C)OC 34a_200011290855_200000210301 [3,0,0,0,0,0|0,0,1]=4 1786 B12R1.288 COCc1ccc(c(c1)C)OC 7a_200011290855_200000210301 [3,0,0,0,0,0|0,0,1]=4 1787 B12R1.288 COc1ccc(cc1C)CO[13CH3] 34a_200011290855_200025704644 [3,0,0,0,0,0|0,0,1]=4 1788 B12R1.288 COc1ccc(cc1C)CO[13CH3] 7a_200011290855_200025704644 [3,0,0,0,0,0|0,0,1]=4 1789 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [3,0,0,0,0,0|1,0,0]=4 1790 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [3,0,0,0,0,0|1,0,0]=4 1791 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [3,0,0,0,0,0|1,0,0]=4 1792 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [3,0,0,0,0,0|1,0,0]=4 1793 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [3,0,0,0,0,0|1,0,0]=4 1794 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [3,0,0,0,0,0|1,0,0]=4 1795 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [3,0,0,0,0,0|1,0,0]=4 1796 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [3,0,0,0,0,0|1,0,0]=4 1797 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [3,0,0,0,0,0|1,0,0]=4 1798 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [3,0,0,0,0,0|1,0,0]=4 1799 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [3,0,0,0,0,0|1,0,0]=4 1800 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [3,0,0,0,0,0|1,0,0]=4 1801 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [3,0,0,0,0,0|1,0,0]=4 1802 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [3,0,0,0,0,0|0,0,0]=3 1803 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [3,0,0,0,0,0|0,0,0]=3 1804 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [3,0,0,0,0,0|0,0,0]=3 1805 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [3,0,0,0,0,0|0,0,0]=3 1806 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_100000150774_200000210301 [3,0,0,0,0,0|0,1,0]=4 1807 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_200000210301_100000150774 [3,0,0,0,0,0|0,1,0]=4 1808 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_100000150774_200025704644 [3,0,0,0,0,0|0,1,0]=4 1809 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000150774 [3,0,0,0,0,0|0,1,0]=4 1810 B12R1.5 COC(=O)c1ccc(cn1)OC 34a_100011997255_200000210301 [3,0,0,0,0,0|1,0,0]=4 1811 B12R1.5 COC(=O)c1ccc(cn1)OC 7a_100011997255_200000210301 [3,0,0,0,0,0|1,0,0]=4 1812 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 34a_100011997255_200025704644 [3,0,0,0,0,0|1,0,0]=4 1813 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 7a_100011997255_200025704644 [3,0,0,0,0,0|1,0,0]=4 1814 B12R1.48 C=C(C)c1ccc(c(c1)C)OC 271570a_100000694244_100011219705 [3,0,0,0,0,0|1,0,0]=4 1815 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [3,0,0,0,0,0|1,0,0]=4 1816 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [3,0,0,0,0,0|1,0,0]=4 1817 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [3,0,0,0,0,0|1,0,0]=4 1818 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [3,0,0,0,0,0|0,0,0]=3 1819 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [3,0,0,0,0,0|0,0,0]=3 1820 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100000697869_200025704644 [3,0,0,0,0,0|0,1,0]=4 1821 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000697869 [3,0,0,0,0,0|0,1,0]=4 1822 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [3,0,0,0,0,0|1,0,0]=4 1823 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [3,0,0,0,0,0|1,0,0]=4 1824 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [3,0,0,0,0,0|1,0,0]=4 1825 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [3,0,0,0,0,0|1,0,0]=4 1826 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [3,0,0,0,0,0|1,0,0]=4 1827 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [3,0,0,0,0,0|1,0,0]=4 1828 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [3,0,0,0,0,0|1,0,0]=4 1829 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [3,0,0,0,0,0|1,0,0]=4 1830 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [3,0,0,0,0,0|1,0,0]=4 1831 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [3,0,0,0,0,0|1,0,0]=4 1832 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [3,0,0,0,0,0|1,0,0]=4 1833 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [3,0,0,0,0,0|1,0,0]=4 1834 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [3,0,0,0,0,0|0,0,0]=3 1835 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [3,0,0,0,0,0|0,0,0]=3 1836 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [3,0,0,0,0,0|0,0,0]=3 1837 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [3,0,0,0,0,0|0,0,0]=3 1838 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [3,0,0,0,0,0|1,0,0]=4 1839 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [3,0,0,0,0,0|1,0,0]=4 1840 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [3,0,0,0,0,0|1,0,0]=4 1841 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [3,0,0,0,0,0|1,0,0]=4 1842 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [3,0,0,0,0,0|1,0,0]=4 1843 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [3,0,0,0,0,0|1,0,0]=4 1844 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [3,0,0,0,0,0|1,0,0]=4 1845 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [3,0,0,0,0,0|1,0,0]=4 1846 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [3,0,0,0,0,0|1,0,0]=4 1847 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [3,0,0,0,0,0|1,0,0]=4 1848 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [3,0,0,0,0,0|1,0,0]=4 1849 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [3,0,0,0,0,0|1,0,0]=4 1850 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [3,0,0,0,0,0|0,0,0]=3 1851 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [3,0,0,0,0,0|0,0,0]=3 1852 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [3,0,0,0,0,0|0,0,0]=3 1853 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_100000697869_200000210301 [3,0,0,0,0,0|0,1,0]=4 1854 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_200000210301_100000697869 [3,0,0,0,0,0|0,1,0]=4 1855 B12R1.652 COc1ccc(c(c1OC)C)O 271570a_203496583355_100010000156 [3,0,0,0,0,0|1,0,0]=4 1856 B12R1.653 COc1ccc(c(c1O)F)OC 271570a_203496583355_200016180952 [3,0,0,0,0,0|1,0,0]=4 1857 B12R1.654 COc1c(ccc(c1F)C=O)O 271570a_203496583355_200010981996 [3,0,0,0,0,0|1,0,0]=4 1858 B12R1.654 COc1ccc(c(c1C)OC)O 271570a_203496583355_100010234078 [3,0,0,0,0,0|1,0,0]=4 1859 B12R1.654 COc1ccc(c(c1F)OC)O 271570a_203496583355_200010341284 [3,0,0,0,0,0|1,0,0]=4 1860 B12R1.452 C=C(C)c1ccc(cc1O)OC 271570a_100000694244_100000719091 [3,0,0,0,0,0|1,0,0]=4 1861 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 34a_100012340537_200025704644 [3,0,0,0,0,0|1,0,0]=4 1862 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 7a_100012340537_200025704644 [3,0,0,0,0,0|1,0,0]=4 1863 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 34a_100000702595_200025704644 [3,0,0,0,0,0|1,0,0]=4 1864 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 7a_100000702595_200025704644 [3,0,0,0,0,0|1,0,0]=4 1865 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100011933989_200025704644 [3,0,0,0,0,0|1,0,0]=4 1866 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100011933989_200025704644 [3,0,0,0,0,0|1,0,0]=4 1867 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 34a_100000752407_200025704644 [3,0,0,0,0,0|1,0,0]=4 1868 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 7a_100000752407_200025704644 [3,0,0,0,0,0|1,0,0]=4 1869 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1458a_100000748873_200000210301 [3,0,0,0,0,0|1,0,0]=4 1870 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_200000210301 [3,0,0,0,0,0|1,0,0]=4 1871 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_200000210301 [3,0,0,0,0,0|1,0,0]=4 1872 B12R1.452 COc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000748873_200025704644 [3,0,0,0,0,0|1,0,0]=4 1873 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1458a_100000763155_200000210301 [3,0,0,0,0,0|1,0,0]=4 1874 B12R1.452 COc1ccc(c(c1)C)C(=O)C 34a_100000702595_200000210301 [3,0,0,0,0,0|1,0,0]=4 1875 B12R1.452 COc1ccc(c(c1)C)C(=O)C 7a_100000702595_200000210301 [3,0,0,0,0,0|1,0,0]=4 1876 B12R1.452 COc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000763155_200025704644 [3,0,0,0,0,0|1,0,0]=4 1877 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1458a_100000753557_200000210301 [3,0,0,0,0,0|1,0,0]=4 1878 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_200000210301 [3,0,0,0,0,0|1,0,0]=4 1879 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_200000210301 [3,0,0,0,0,0|1,0,0]=4 1880 B12R1.452 COc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000753557_200025704644 [3,0,0,0,0,0|1,0,0]=4 1881 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1458a_100000198494_200000210301 [3,0,0,0,0,0|1,0,0]=4 1882 B12R1.452 COc1ccc(c(c1)F)C(=O)C 34a_100000752407_200000210301 [3,0,0,0,0,0|1,0,0]=4 1883 B12R1.452 COc1ccc(c(c1)F)C(=O)C 7a_100000752407_200000210301 [3,0,0,0,0,0|1,0,0]=4 1884 B12R1.452 COc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000198494_200025704644 [3,0,0,0,0,0|1,0,0]=4 1885 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1458a_100000688016_200000210301 [3,0,0,0,0,0|1,0,0]=4 1886 B12R1.452 COc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100000688016_200025704644 [3,0,0,0,0,0|1,0,0]=4 1887 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1458a_100000212123_200000210301 [3,0,0,0,0,0|0,0,0]=3 1888 B12R1.452 COc1ccc(c(c1)O)C(=O)C 271570a_203496583355_100000697255 [3,0,0,0,0,0|0,0,0]=3 1889 B12R1.452 COc1ccc(c(c1)O)C(=O)N 271570a_203496583355_200009815664 [3,0,0,0,0,0|1,0,0]=4 1890 B12R1.452 COc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212123_200025704644 [3,0,0,0,0,0|0,0,0]=3 1891 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [3,0,0,0,0,0|1,0,0]=4 1892 B12R1.893 CC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_200000210301 [3,0,0,0,0,0|1,0,0]=4 1893 B12R1.893 CC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_200000210301 [3,0,0,0,0,0|1,0,0]=4 1894 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [3,0,0,0,0,0|0,0,0]=3 1895 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [3,0,0,0,0,0|0,0,0]=3 1896 B12R1.893 Cc1ccc(c(c1C)F)C(=O)[13CH3] 1458a_100010768504_200025704644 [3,0,0,0,0,0|1,0,0]=4 1897 B12R1.893 Cc1ccc(c(c1C)I)C(=O)[13CH3] 1458a_100010188221_200025704644 [3,0,0,0,0,0|1,0,0]=4 1898 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [3,0,0,0,0,0|0,0,0]=3 1899 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [3,0,0,0,0,0|1,0,0]=4 1900 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [3,0,0,0,0,0|0,0,0]=3 1901 B12R1.440 C=C(C)c1cccc(c1O)OC 271570a_100000694244_100000686866 [3,0,0,0,0,0|1,0,0]=4 1902 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 34a_200009877264_200025704644 [3,0,0,0,0,0|1,0,0]=4 1903 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 7a_200009877264_200025704644 [3,0,0,0,0,0|1,0,0]=4 1904 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 34a_100009856408_200025704644 [3,0,0,0,0,0|1,0,0]=4 1905 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 7a_100009856408_200025704644 [3,0,0,0,0,0|1,0,0]=4 1906 B12R1.440 CC(=O)c1cccc(c1N)O[13CH3] 7a_100000036053_200025704644 [3,0,0,0,0,0|1,0,0]=4 1907 B12R1.440 COc1cccc(c1Br)C(=O)C 1458a_100010245468_200000210301 [3,0,0,0,0,0|1,0,0]=4 1908 B12R1.440 COc1cccc(c1Br)C(=O)[13CH3] 1458a_100010245468_200025704644 [3,0,0,0,0,0|1,0,0]=4 1909 B12R1.440 COc1cccc(c1C)C(=O)C 1458a_100011217801_200000210301 [3,0,0,0,0,0|1,0,0]=4 1910 B12R1.440 COc1cccc(c1C)C(=O)C 34a_200009877264_200000210301 [3,0,0,0,0,0|1,0,0]=4 1911 B12R1.440 COc1cccc(c1C)C(=O)C 7a_200009877264_200000210301 [3,0,0,0,0,0|1,0,0]=4 1912 B12R1.440 COc1cccc(c1C)C(=O)[13CH3] 1458a_100011217801_200025704644 [3,0,0,0,0,0|1,0,0]=4 1913 B12R1.440 COc1cccc(c1Cl)C(=O)C 1458a_100000068443_200000210301 [3,0,0,0,0,0|1,0,0]=4 1914 B12R1.440 COc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000068443_200025704644 [3,0,0,0,0,0|1,0,0]=4 1915 B12R1.440 COc1cccc(c1F)C(=O)C 1458a_100000766180_200000210301 [3,0,0,0,0,0|1,0,0]=4 1916 B12R1.440 COc1cccc(c1F)C(=O)C 34a_100009856408_200000210301 [3,0,0,0,0,0|1,0,0]=4 1917 B12R1.440 COc1cccc(c1F)C(=O)C 7a_100009856408_200000210301 [3,0,0,0,0,0|1,0,0]=4 1918 B12R1.440 COc1cccc(c1F)C(=O)[13CH3] 1458a_100000766180_200025704644 [3,0,0,0,0,0|1,0,0]=4 1919 B12R1.440 COc1cccc(c1I)C(=O)C 1458a_100010075502_200000210301 [3,0,0,0,0,0|1,0,0]=4 1920 B12R1.440 COc1cccc(c1I)C(=O)[13CH3] 1458a_100010075502_200025704644 [3,0,0,0,0,0|1,0,0]=4 1921 B12R1.440 COc1cccc(c1N)C(=O)C 7a_100000036053_200000210301 [3,0,0,0,0,0|1,0,0]=4 1922 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [3,0,0,0,0,0|0,0,0]=3 1923 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [3,0,0,0,0,0|0,0,0]=3 1924 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [3,0,0,0,0,0|1,0,0]=4 1925 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [3,0,0,0,0,0|1,0,0]=4 1926 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [3,0,0,0,0,0|1,0,0]=4 1927 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [3,0,0,0,0,0|1,0,0]=4 1928 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [3,0,0,0,0,0|1,0,0]=4 1929 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [3,0,0,0,0,0|1,0,0]=4 1930 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [3,0,0,0,0,0|1,0,0]=4 1931 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [3,0,0,0,0,0|1,0,0]=4 1932 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [3,0,0,0,0,0|1,0,0]=4 1933 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [3,0,0,0,0,0|1,0,0]=4 1934 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [3,0,0,0,0,0|1,0,0]=4 1935 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [3,0,0,0,0,0|1,0,0]=4 1936 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [3,0,0,0,0,0|1,0,0]=4 1937 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [3,0,0,0,0,0|0,0,0]=3 1938 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [3,0,0,0,0,0|1,0,0]=4 1939 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [3,0,0,0,0,0|1,0,0]=4 1940 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [3,0,0,0,0,0|1,0,0]=4 1941 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [3,0,0,0,0,0|0,0,0]=3 1942 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [3,0,0,0,0,0|0,0,0]=3 1943 B12R1.1703 COC(=O)c1ccc(nc1O)C 271570a_203496583355_100000054099 [3,0,0,0,0,0|1,0,0]=4 1944 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100015962272 [3,0,0,0,0,0|1,0,0]=4 1945 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100016008356 [3,0,0,0,0,0|1,0,0]=4 1946 B12R1.1703 COC(=O)c1cnc(cc1O)C 271570a_203496583355_100011998247 [3,0,0,0,0,0|1,0,0]=4 1947 B12R1.1703 COC(=O)c1ncc(cc1O)C 271570a_203496583355_100010167497 [3,0,0,0,0,0|1,0,0]=4 1948 B12R1.1703 COC(=O)c1ncc(cc1O)O 271570a_203496583355_100010071521 [3,0,0,0,0,0|1,0,0]=4 1949 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [3,0,0,0,0,0|1,0,0]=4 1950 B12R1.24 CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210202 [3,0,0,0,0,0|1,0,0]=4 1951 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [3,0,0,0,0,0|1,0,0]=4 1952 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [3,0,0,0,0,0|1,0,0]=4 1953 B12R1.24 CNC(=O)c1cccc(c1O)O 527a_100102657272_100000690420 [3,0,0,0,0,0|1,0,0]=4 1954 B12R1.24 COC(=O)c1cccc(c1Br)O 271570a_203496583355_100010240208 [3,0,0,0,0,0|1,0,0]=4 1955 B12R1.24 COC(=O)c1cccc(c1C)O 271570a_203496583355_100012298220 [3,0,0,0,0,0|1,0,0]=4 1956 B12R1.24 COC(=O)c1cccc(c1F)O 271570a_203496583355_100012355674 [3,0,0,0,0,0|1,0,0]=4 1957 B12R1.24 COC(=O)c1cccc(c1N)O 271570a_203496583355_100011356556 [3,0,0,0,0,0|1,0,0]=4 1958 B12R1.24 COC(=O)c1cccc(c1O)Br 271570a_203496583355_100010150843 [3,0,0,0,0,0|1,0,0]=4 1959 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [3,0,0,0,0,0|0,0,0]=3 1960 B12R1.24 COC(=O)c1cccc(c1O)F 271570a_203496583355_100012357630 [3,0,0,0,0,0|1,0,0]=4 1961 B12R1.24 COC(=O)c1cccc(c1O)N 271570a_203496583355_100000719424 [3,0,0,0,0,0|1,0,0]=4 1962 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_100009816214 [3,0,0,0,0,0|0,0,0]=3 1963 B12R1.24 COC(=O)c1cccc(c1O)O 271570a_203496583355_200010230364 [3,0,0,0,0,0|0,0,0]=3 1964 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [3,0,0,0,0,0|1,0,0]=4 1965 B14R1.41 COc1cc(ccc1C)C(=O)C(C)C 1458a_100000212341_100000210206 [2,1,0,0,0,0|1,0,0]=4 1966 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 11a_100102631434_100000212341 [2,1,0,0,0,0|1,0,0]=4 1967 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 1626a_100102631434_100000212341 [2,1,0,0,0,0|1,0,0]=4 1968 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 240690a_100102631434_100000212341 [2,1,0,0,0,0|1,0,0]=4 1969 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 527a_100102631434_100000212341 [2,1,0,0,0,0|1,0,0]=4 1970 B14R1.41 COc1cc(ccc1O)C(=O)C(C)C 1458a_100000687070_100000210206 [2,1,0,0,0,0|1,0,0]=4 1971 B14R1.41 COc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100000687070 [2,1,0,0,0,0|1,0,0]=4 1972 B14R1.358 CCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000210202 [2,1,0,0,0,0|1,0,0]=4 1973 B14R1.358 CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000210202 [2,1,0,0,0,0|1,0,0]=4 1974 B14R1.358 CNC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100102657272_100000209947 [2,1,0,0,0,0|1,0,0]=4 1975 B14R1.358 COC(=O)c1cc(c(c(c1)OC)C)F 34a_100000101006_200000210301 [2,1,0,0,0,0|0,0,0]=3 1976 B14R1.358 COC(=O)c1cc(c(c(c1)OC)C)F 7a_100000101006_200000210301 [2,1,0,0,0,0|0,0,0]=3 1977 B14R1.358 COC(=O)c1cc(c(c(c1)OC)Cl)Br 34a_200020639753_200000210301 [2,1,0,0,0,0|1,0,0]=4 1978 B14R1.358 COC(=O)c1cc(c(c(c1)OC)Cl)Br 7a_200020639753_200000210301 [2,1,0,0,0,0|1,0,0]=4 1979 B14R1.358 COC(=O)c1cc(c(c(c1)OC)N)O 271570a_203496583355_100010236038 [2,1,0,0,0,0|1,0,0]=4 1980 B14R1.358 COC(=O)c1cc(c(c(c1)OC)O)O 271570a_203496583355_200009811556 [2,1,0,0,0,0|0,0,0]=3 1981 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])C)F 34a_100000101006_200025704644 [2,1,0,0,0,0|0,0,0]=3 1982 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])C)F 7a_100000101006_200025704644 [2,1,0,0,0,0|0,0,0]=3 1983 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])Cl)Br 34a_200020639753_200025704644 [2,1,0,0,0,0|1,0,0]=4 1984 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])Cl)Br 7a_200020639753_200025704644 [2,1,0,0,0,0|1,0,0]=4 1985 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)Cl 62a_100012360618_200000210301 [2,1,0,0,0,0|0,1,0]=4 1986 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)Cl 62a_200000210301_100012360618 [2,1,0,0,0,0|0,1,0]=4 1987 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)F 62a_100012920391_200000210301 [2,1,0,0,0,0|0,1,0]=4 1988 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)F 62a_200000210301_100012920391 [2,1,0,0,0,0|0,1,0]=4 1989 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)N 62a_100012353609_200000210301 [2,1,0,0,0,0|0,1,0]=4 1990 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)N 62a_200000210301_100012353609 [2,1,0,0,0,0|0,1,0]=4 1991 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)Cl 62a_100135280131_200000210301 [2,1,0,0,0,0|0,1,0]=4 1992 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)Cl 62a_200000210301_100135280131 [2,1,0,0,0,0|0,1,0]=4 1993 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)N 62a_100010372079_200000210301 [2,1,0,0,0,0|0,1,0]=4 1994 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)N 62a_200000210301_100010372079 [2,1,0,0,0,0|0,1,0]=4 1995 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)Cl 62a_100012360618_200025704644 [2,1,0,0,0,0|0,1,0]=4 1996 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)Cl 62a_200025704644_100012360618 [2,1,0,0,0,0|0,1,0]=4 1997 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)F 62a_100012920391_200025704644 [2,1,0,0,0,0|0,1,0]=4 1998 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)F 62a_200025704644_100012920391 [2,1,0,0,0,0|0,1,0]=4 1999 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)N 62a_100012353609_200025704644 [2,1,0,0,0,0|0,1,0]=4 2000 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)N 62a_200025704644_100012353609 [2,1,0,0,0,0|0,1,0]=4 2001 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)Cl 62a_100135280131_200025704644 [2,1,0,0,0,0|0,1,0]=4 2002 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)Cl 62a_200025704644_100135280131 [2,1,0,0,0,0|0,1,0]=4 2003 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)N 62a_100010372079_200025704644 [2,1,0,0,0,0|0,1,0]=4 2004 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)N 62a_200025704644_100010372079 [2,1,0,0,0,0|0,1,0]=4 2005 B14R1.436 CC=Cc1cc(ccc1C)C(=O)OC 271570a_100016259895_100011218856 [2,1,0,0,0,0|1,0,0]=4 2006 B14R1.436 CC=Cc1cc(ccc1O)C(=O)OC 271570a_100016259895_100000216328 [2,1,0,0,0,0|1,0,0]=4 2007 B14R1.436 CCOc1cc(ccc1Br)C(=O)OC 34a_100011934688_100000210202 [2,1,0,0,0,0|1,0,0]=4 2008 B14R1.436 CCOc1cc(ccc1Br)C(=O)OC 7a_100011934688_100000210202 [2,1,0,0,0,0|1,0,0]=4 2009 B14R1.436 CCOc1cc(ccc1C)C(=O)CC 1458a_100000238212_100000210202 [2,1,0,0,0,0|1,0,0]=4 2010 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 11a_106832991635_100000238212 [2,1,0,0,0,0|1,0,0]=4 2011 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 1626a_100102657272_100000238212 [2,1,0,0,0,0|1,0,0]=4 2012 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 240690a_100102657272_100000238212 [2,1,0,0,0,0|1,0,0]=4 2013 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 527a_100102657272_100000238212 [2,1,0,0,0,0|1,0,0]=4 2014 B14R1.436 CCOc1cc(ccc1C)C(=O)OC 34a_100000736511_100000210202 [2,1,0,0,0,0|0,0,0]=3 2015 B14R1.436 CCOc1cc(ccc1C)C(=O)OC 7a_100000736511_100000210202 [2,1,0,0,0,0|0,0,0]=3 2016 B14R1.436 CCOc1cc(ccc1Cl)C(=O)OC 34a_100000103815_100000210202 [2,1,0,0,0,0|1,0,0]=4 2017 B14R1.436 CCOc1cc(ccc1Cl)C(=O)OC 7a_100000103815_100000210202 [2,1,0,0,0,0|1,0,0]=4 2018 B14R1.436 CCOc1cc(ccc1F)C(=O)OC 34a_100000062259_100000210202 [2,1,0,0,0,0|1,0,0]=4 2019 B14R1.436 CCOc1cc(ccc1F)C(=O)OC 7a_100000062259_100000210202 [2,1,0,0,0,0|1,0,0]=4 2020 B14R1.436 CCOc1cc(ccc1I)C(=O)OC 34a_100012350776_100000210202 [2,1,0,0,0,0|1,0,0]=4 2021 B14R1.436 CCOc1cc(ccc1I)C(=O)OC 7a_100012350776_100000210202 [2,1,0,0,0,0|1,0,0]=4 2022 B14R1.436 CCOc1cc(ccc1N)C(=O)OC 34a_100000757247_100000210202 [2,1,0,0,0,0|1,0,0]=4 2023 B14R1.436 CCOc1cc(ccc1N)C(=O)OC 7a_100000757247_100000210202 [2,1,0,0,0,0|1,0,0]=4 2024 B14R1.436 CCOc1cc(ccc1O)C(=O)CC 1458a_100011260950_100000210202 [2,1,0,0,0,0|1,0,0]=4 2025 B14R1.436 CCOc1cc(ccc1O)C(=O)NC 240690a_100102657272_100011260950 [2,1,0,0,0,0|1,0,0]=4 2026 B14R1.436 CCSc1cc(ccc1C)C(=O)OC 62a_100000210202_100000723194 [2,1,0,0,0,0|0,1,0]=4 2027 B14R1.436 CCSc1cc(ccc1C)C(=O)OC 62a_100000723194_100000210202 [2,1,0,0,0,0|0,1,0]=4 2028 B14R1.436 CCSc1cc(ccc1O)C(=O)OC 62a_100000210202_100000216328 [2,1,0,0,0,0|0,1,0]=4 2029 B14R1.436 CCSc1cc(ccc1O)C(=O)OC 62a_100000216328_100000210202 [2,1,0,0,0,0|0,1,0]=4 2030 B14R1.436 CNCc1cc(ccc1C)C(=O)OC 270004a_106832991635_100010624047 [2,1,0,0,0,0|1,0,0]=4 2031 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])Br 34a_100010201863_200025704644 [2,1,0,0,0,0|1,0,0]=4 2032 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])Br 7a_100010201863_200025704644 [2,1,0,0,0,0|1,0,0]=4 2033 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])N 34a_200015838792_200025704644 [2,1,0,0,0,0|1,0,0]=4 2034 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])N 7a_200015838792_200025704644 [2,1,0,0,0,0|1,0,0]=4 2035 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Br 34a_100011934688_100015361967 [2,1,0,0,0,0|1,0,0]=4 2036 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Br 7a_100011934688_100015361967 [2,1,0,0,0,0|1,0,0]=4 2037 B14R1.436 COC(=O)c1ccc(c(c1)OCF)C 34a_100000736511_100015361967 [2,1,0,0,0,0|0,0,0]=3 2038 B14R1.436 COC(=O)c1ccc(c(c1)OCF)C 7a_100000736511_100015361967 [2,1,0,0,0,0|0,0,0]=3 2039 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Cl 34a_100000103815_100015361967 [2,1,0,0,0,0|1,0,0]=4 2040 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Cl 7a_100000103815_100015361967 [2,1,0,0,0,0|1,0,0]=4 2041 B14R1.436 COC(=O)c1ccc(c(c1)OCF)F 34a_100000062259_100015361967 [2,1,0,0,0,0|1,0,0]=4 2042 B14R1.436 COC(=O)c1ccc(c(c1)OCF)F 7a_100000062259_100015361967 [2,1,0,0,0,0|1,0,0]=4 2043 B14R1.436 COC(=O)c1ccc(c(c1)OCF)I 34a_100012350776_100015361967 [2,1,0,0,0,0|1,0,0]=4 2044 B14R1.436 COC(=O)c1ccc(c(c1)OCF)I 7a_100012350776_100015361967 [2,1,0,0,0,0|1,0,0]=4 2045 B14R1.436 COC(=O)c1ccc(c(c1)OCF)N 34a_100000757247_100015361967 [2,1,0,0,0,0|1,0,0]=4 2046 B14R1.436 COC(=O)c1ccc(c(c1)OCF)N 7a_100000757247_100015361967 [2,1,0,0,0,0|1,0,0]=4 2047 B14R1.436 COC(=O)c1ccc(c(c1)SCF)C 62a_100000723194_100015361967 [2,1,0,0,0,0|0,1,0]=4 2048 B14R1.436 COC(=O)c1ccc(c(c1)SCF)C 62a_100015361967_100000723194 [2,1,0,0,0,0|0,1,0]=4 2049 B14R1.436 COC(=O)c1ccc(c(c1)SCF)O 62a_100000216328_100015361967 [2,1,0,0,0,0|0,1,0]=4 2050 B14R1.436 COC(=O)c1ccc(c(c1)SCF)O 62a_100015361967_100000216328 [2,1,0,0,0,0|0,1,0]=4 2051 B14R1.436 COCc1cc(ccc1Br)C(=O)OC 34a_100010201863_200000210301 [2,1,0,0,0,0|1,0,0]=4 2052 B14R1.436 COCc1cc(ccc1Br)C(=O)OC 34a_100138415774_100012232407 [2,1,0,0,0,0|1,0,0]=4 2053 B14R1.436 COCc1cc(ccc1Br)C(=O)OC 7a_100010201863_200000210301 [2,1,0,0,0,0|1,0,0]=4 2054 B14R1.436 COCc1cc(ccc1N)C(=O)OC 34a_200015838792_200000210301 [2,1,0,0,0,0|1,0,0]=4 2055 B14R1.436 COCc1cc(ccc1N)C(=O)OC 7a_200015838792_200000210301 [2,1,0,0,0,0|1,0,0]=4 2056 B14R1.436 COCc1cc(ccc1O)C(=O)OC 271570a_203496583355_200010890493 [2,1,0,0,0,0|0,0,0]=3 2057 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210303 [2,1,0,0,0,0|1,0,0]=4 2058 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210303 [2,1,0,0,0,0|1,0,0]=4 2059 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 11a_100015525214_100000212341 [2,1,0,0,0,0|1,0,0]=4 2060 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 240690a_100015525214_100000212341 [2,1,0,0,0,0|1,0,0]=4 2061 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 527a_100015525214_100000212341 [2,1,0,0,0,0|1,0,0]=4 2062 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)O 240690a_100015525214_100000687070 [2,1,0,0,0,0|1,0,0]=4 2063 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)Br 7a_100012355281_200000210301 [2,1,0,0,0,0|1,0,0]=4 2064 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F 34a_200009842343_200000210301 [2,1,0,0,0,0|1,0,0]=4 2065 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F 7a_200009842343_200000210301 [2,1,0,0,0,0|1,0,0]=4 2066 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)N 7a_100000756704_200000210301 [2,1,0,0,0,0|1,0,0]=4 2067 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100010189661 [2,1,0,0,0,0|0,0,0]=3 2068 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100012355281_200025704644 [2,1,0,0,0,0|1,0,0]=4 2069 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])F 34a_200009842343_200025704644 [2,1,0,0,0,0|1,0,0]=4 2070 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])F 7a_200009842343_200025704644 [2,1,0,0,0,0|1,0,0]=4 2071 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000756704_200025704644 [2,1,0,0,0,0|1,0,0]=4 2072 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)C 62a_100012359631_200000210301 [2,1,0,0,0,0|0,1,0]=4 2073 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)C 62a_200000210301_100012359631 [2,1,0,0,0,0|0,1,0]=4 2074 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100009812659 [2,1,0,0,0,0|0,1,0]=4 2075 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])C 62a_100012359631_200025704644 [2,1,0,0,0,0|0,1,0]=4 2076 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100012359631 [2,1,0,0,0,0|0,1,0]=4 2077 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100009812659 [2,1,0,0,0,0|0,1,0]=4 2078 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)O 7a_106832991635_100010206313 [2,1,0,0,0,0|1,0,0]=4 2079 B14R1.626 CNNC(=O)c1ccc(c(c1)OC)C 22a_100016993582_100000212341 [2,1,0,0,0,0|1,0,0]=4 2080 B14R1.626 CNNC(=O)c1ccc(c(c1)OC)O 22a_100016993582_100000687070 [2,1,0,0,0,0|1,0,0]=4 2081 B14R1.626 COCC(=O)c1ccc(c(c1)OC)Br 34a_100138415774_200010710740 [2,1,0,0,0,0|1,0,0]=4 2082 B14R1.626 COCC(=O)c1ccc(c(c1)OC)F 34a_100138415774_200012348595 [2,1,0,0,0,0|1,0,0]=4 2083 B14R1.626 COc1cc(ccc1C)C(=O)CCF 1458a_100000212341_100011217306 [2,1,0,0,0,0|1,0,0]=4 2084 B14R1.626 COc1cc(ccc1C)C(=O)CCO 1458a_100000212341_100000211926 [2,1,0,0,0,0|1,0,0]=4 2085 B14R1.626 COc1cc(ccc1O)C(=O)CCF 1458a_100000687070_100011217306 [2,1,0,0,0,0|1,0,0]=4 2086 B14R1.626 COc1cc(ccc1O)C(=O)CCO 1458a_100000687070_100000211926 [2,1,0,0,0,0|1,0,0]=4 2087 B14R1.626 COc1cc(ccc1O)C(=O)CSC 62a_100010206313_200000210301 [2,1,0,0,0,0|0,1,0]=4 2088 B14R1.626 COc1cc(ccc1O)C(=O)CS[13CH3] 62a_100010206313_200025704644 [2,1,0,0,0,0|0,1,0]=4 2089 B14R1.748 C=C(C)c1cc(ccc1C)C(=O)OC 271570a_100000694244_100011218856 [2,1,0,0,0,0|1,0,0]=4 2090 B14R1.748 C=C(C)c1cc(ccc1O)C(=O)OC 271570a_100000694244_100000216328 [2,1,0,0,0,0|1,0,0]=4 2091 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)O 271570a_203496583355_200016005208 [2,1,0,0,0,0|1,0,0]=4 2092 B14R1.748 COC(=O)c1ccc(c(c1)C(C)C)O 271570a_203496583355_200025703530 [2,1,0,0,0,0|1,0,0]=4 2093 B14R1.2283 CCC(=O)c1cc(c(cc1Br)C)OC 1458a_100010289115_100000210202 [2,1,0,0,0,0|1,0,0]=4 2094 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 11a_106832991635_100010289115 [2,1,0,0,0,0|1,0,0]=4 2095 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 1626a_100102657272_100010289115 [2,1,0,0,0,0|1,0,0]=4 2096 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 240690a_100102657272_100010289115 [2,1,0,0,0,0|1,0,0]=4 2097 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 527a_100102657272_100010289115 [2,1,0,0,0,0|1,0,0]=4 2098 B14R1.2283 COC(=O)c1cc(c(cc1C)C)SC 62a_200000210301_200012360129 [2,1,0,0,0,0|0,1,0]=4 2099 B14R1.2283 COC(=O)c1cc(c(cc1C)C)SC 62a_200012360129_200000210301 [2,1,0,0,0,0|0,1,0]=4 2100 B14R1.2283 COC(=O)c1cc(c(cc1C)C)S[13CH3] 62a_200012360129_200025704644 [2,1,0,0,0,0|0,1,0]=4 2101 B14R1.2283 COC(=O)c1cc(c(cc1C)C)S[13CH3] 62a_200025704644_200012360129 [2,1,0,0,0,0|0,1,0]=4 2102 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)SC 62a_100014124666_200000210301 [2,1,0,0,0,0|0,1,0]=4 2103 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)SC 62a_200000210301_100014124666 [2,1,0,0,0,0|0,1,0]=4 2104 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)S[13CH3] 62a_100014124666_200025704644 [2,1,0,0,0,0|0,1,0]=4 2105 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)S[13CH3] 62a_200025704644_100014124666 [2,1,0,0,0,0|0,1,0]=4 2106 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)OC 34a_100010071070_200000210301 [2,1,0,0,0,0|1,0,0]=4 2107 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)OC 7a_100010071070_200000210301 [2,1,0,0,0,0|1,0,0]=4 2108 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)O[13CH3] 34a_100010071070_200025704644 [2,1,0,0,0,0|1,0,0]=4 2109 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)O[13CH3] 7a_100010071070_200025704644 [2,1,0,0,0,0|1,0,0]=4 2110 B14R1.2283 COC(=O)c1cc(c(cc1F)C)OC 34a_100009839768_200000210301 [2,1,0,0,0,0|0,0,0]=3 2111 B14R1.2283 COC(=O)c1cc(c(cc1F)C)OC 7a_100009839768_200000210301 [2,1,0,0,0,0|0,0,0]=3 2112 B14R1.2283 COC(=O)c1cc(c(cc1F)C)O[13CH3] 34a_100009839768_200025704644 [2,1,0,0,0,0|0,0,0]=3 2113 B14R1.2283 COC(=O)c1cc(c(cc1F)C)O[13CH3] 7a_100009839768_200025704644 [2,1,0,0,0,0|0,0,0]=3 2114 B14R1.2283 COC(=O)c1cc(c(cc1F)C)SC 62a_100012920548_200000210301 [2,1,0,0,0,0|0,1,0]=4 2115 B14R1.2283 COC(=O)c1cc(c(cc1F)C)SC 62a_200000210301_100012920548 [2,1,0,0,0,0|0,1,0]=4 2116 B14R1.2283 COC(=O)c1cc(c(cc1F)C)S[13CH3] 62a_100012920548_200025704644 [2,1,0,0,0,0|0,1,0]=4 2117 B14R1.2283 COC(=O)c1cc(c(cc1F)C)S[13CH3] 62a_200025704644_100012920548 [2,1,0,0,0,0|0,1,0]=4 2118 B14R1.2283 COC(=O)c1cc(c(cc1N)C)SC 62a_100010892302_200000210301 [2,1,0,0,0,0|0,1,0]=4 2119 B14R1.2283 COC(=O)c1cc(c(cc1N)C)SC 62a_200000210301_100010892302 [2,1,0,0,0,0|0,1,0]=4 2120 B14R1.2283 COC(=O)c1cc(c(cc1N)C)S[13CH3] 62a_100010892302_200025704644 [2,1,0,0,0,0|0,1,0]=4 2121 B14R1.2283 COC(=O)c1cc(c(cc1N)C)S[13CH3] 62a_200025704644_100010892302 [2,1,0,0,0,0|0,1,0]=4 2122 B14R1.2283 COC(=O)c1cc(c(cc1N)F)OC 34a_100011586606_200000210301 [2,1,0,0,0,0|1,0,0]=4 2123 B14R1.2283 COC(=O)c1cc(c(cc1N)F)OC 7a_100011586606_200000210301 [2,1,0,0,0,0|1,0,0]=4 2124 B14R1.2283 COC(=O)c1cc(c(cc1N)F)O[13CH3] 34a_100011586606_200025704644 [2,1,0,0,0,0|1,0,0]=4 2125 B14R1.2283 COC(=O)c1cc(c(cc1N)F)O[13CH3] 7a_100011586606_200025704644 [2,1,0,0,0,0|1,0,0]=4 2126 B14R1.2283 COC(=O)c1cc(c(cc1N)O)OC 271570a_203496583355_100014686525 [2,1,0,0,0,0|0,0,0]=3 2127 B14R1.2283 COC(=O)c1cc(c(cc1O)C)SC 62a_100010233952_200000210301 [2,1,0,0,0,0|0,1,0]=4 2128 B14R1.2283 COC(=O)c1cc(c(cc1O)C)SC 62a_200000210301_100010233952 [2,1,0,0,0,0|0,1,0]=4 2129 B14R1.2283 COC(=O)c1cc(c(cc1O)C)S[13CH3] 62a_100010233952_200025704644 [2,1,0,0,0,0|0,1,0]=4 2130 B14R1.2283 COC(=O)c1cc(c(cc1O)C)S[13CH3] 62a_200025704644_100010233952 [2,1,0,0,0,0|0,1,0]=4 2131 B14R1.2283 COC(=O)c1cc(c(cc1O)F)OC 271570a_203496583355_100010269054 [2,1,0,0,0,0|1,0,0]=4 2132 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000083705_200000210301 [2,1,0,0,0,0|0,0,1]=4 2133 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000210929_100000210202 [2,1,0,0,0,0|0,0,1]=4 2134 B14R1.793 CCOCc1ccc(c(c1)OC)OC 7a_100000083705_200000210301 [2,1,0,0,0,0|0,0,1]=4 2135 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 34a_100000083705_200025704644 [2,1,0,0,0,0|0,0,1]=4 2136 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 7a_100000083705_200025704644 [2,1,0,0,0,0|0,0,1]=4 2137 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100011215274_200000210301 [2,1,0,0,0,0|0,0,1]=4 2138 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100138415774_100011273988 [2,1,0,0,0,0|0,0,1]=4 2139 B14R1.793 COCSc1ccc(c(c1)OC)OC 62a_100000766300_100011356967 [2,1,0,0,0,0|0,0,1]=4 2140 B14R1.793 COc1cc(ccc1O[13CH3])/C=C\CO 34a_100016294963_200025704644 [2,1,0,0,0,0|1,0,0]=4 2141 B14R1.793 COc1ccc(cc1OC)/C=C/CO 34a_100102524974_200000210301 [2,1,0,0,0,0|1,0,0]=4 2142 B14R1.793 COc1ccc(cc1OC)/C=C\CO 34a_100016294963_200000210301 [2,1,0,0,0,0|1,0,0]=4 2143 B14R1.793 COc1ccc(cc1OC)CCO[13CH3] 34a_100011215274_200025704644 [2,1,0,0,0,0|0,0,1]=4 2144 B14R1.793 COc1ccc(cc1OC)COCF 34a_100000210929_100015361967 [2,1,0,0,0,0|0,0,1]=4 2145 B14R1.793 COc1ccc(cc1O[13CH3])/C=C/CO 34a_100102524974_200025704644 [2,1,0,0,0,0|1,0,0]=4 2146 B14R1.3237 COCc1cc(c(c(c1)OC)OC)Br 34a_200000215730_200000210301 [2,1,0,0,0,0|0,0,1]=4 2147 B14R1.3237 COc1cc(cc(c1OC)Br)CO[13CH3] 34a_200000215730_200025704644 [2,1,0,0,0,0|0,0,1]=4 2148 B14R1.3651 COc1ccc(cc1OC)C=C(C)C 271570a_100102525489_100000187503 [2,1,0,0,0,0|1,0,0]=4 2149 B14R1.6787 CC=Cc1ccc(c(c1)COC)OC 271570a_100016259895_200011493686 [2,1,0,0,0,0|1,0,0]=4 2150 B14R1.6787 CC=Cc1ccc(c(c1)OCC)OC 271570a_100016259895_200010219349 [2,1,0,0,0,0|1,0,0]=4 2151 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 271570a_100016259895_200012344064 [2,1,0,0,0,0|1,0,0]=4 2152 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 34a_100000057189_200000210301 [2,1,0,0,0,0|1,0,0]=4 2153 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 34a_100015195088_100000210202 [2,1,0,0,0,0|1,0,0]=4 2154 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 7a_100000057189_200000210301 [2,1,0,0,0,0|1,0,0]=4 2155 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCF 34a_100015195088_100015361967 [2,1,0,0,0,0|1,0,0]=4 2156 B14R1.6788 CC=Cc1ccc(c(c1)O[13CH3])OCC 34a_100000057189_200025704644 [2,1,0,0,0,0|1,0,0]=4 2157 B14R1.6788 CC=Cc1ccc(c(c1)O[13CH3])OCC 7a_100000057189_200025704644 [2,1,0,0,0,0|1,0,0]=4 2158 B14R1.6788 CCOc1ccc(cc1OC)COC 34a_100000184821_200000210301 [2,1,0,0,0,0|0,0,1]=4 2159 B14R1.6788 CCOc1ccc(cc1OC)CO[13CH3] 34a_100000184821_200025704644 [2,1,0,0,0,0|0,0,1]=4 2160 B14R1.14946 CC=Cc1cc(c(cc1F)OC)OC 271570a_100016259895_200011765842 [2,1,0,0,0,0|1,0,0]=4 2161 B14R1.14946 COCc1cc(c(cc1Br)OC)OC 34a_100138415774_100011375086 [2,1,0,0,0,0|0,0,1]=4 2162 B14R1.14946 COCc1cc(c(cc1Br)OC)OC 34a_200000246283_200000210301 [2,1,0,0,0,0|0,0,1]=4 2163 B14R1.14946 COCc1cc(c(cc1Br)OC)OC 7a_200000246283_200000210301 [2,1,0,0,0,0|0,0,1]=4 2164 B14R1.14946 COc1cc(c(cc1OC)CO[13CH3])Br 34a_200000246283_200025704644 [2,1,0,0,0,0|0,0,1]=4 2165 B14R1.14946 COc1cc(c(cc1OC)CO[13CH3])Br 7a_200000246283_200025704644 [2,1,0,0,0,0|0,0,1]=4 2166 B14R1.628 CCCC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000210303 [2,1,0,0,0,0|1,0,0]=4 2167 B14R1.628 CCCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210303 [2,1,0,0,0,0|1,0,0]=4 2168 B14R1.628 CCNC(=O)c1ccc(c(c1)C)OC 11a_100015525214_100011202886 [2,1,0,0,0,0|1,0,0]=4 2169 B14R1.628 CCNC(=O)c1ccc(c(c1)C)OC 240690a_100015525214_100011202886 [2,1,0,0,0,0|1,0,0]=4 2170 B14R1.628 CCNC(=O)c1ccc(c(c1)C)OC 527a_100015525214_100011202886 [2,1,0,0,0,0|1,0,0]=4 2171 B14R1.628 CCNC(=O)c1ccc(c(c1)O)OC 240690a_100015525214_100000766810 [2,1,0,0,0,0|1,0,0]=4 2172 B14R1.628 CCNC(=O)c1ccc(c(c1)O)OC 527a_100015525214_100000766810 [2,1,0,0,0,0|1,0,0]=4 2173 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)OC 7a_100009812659_200000210301 [2,1,0,0,0,0|1,0,0]=4 2174 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100009812659_200025704644 [2,1,0,0,0,0|1,0,0]=4 2175 B14R1.628 CCOC(=O)c1ccc(c(c1)C)SC 62a_100012229600_200000210301 [2,1,0,0,0,0|0,1,0]=4 2176 B14R1.628 CCOC(=O)c1ccc(c(c1)C)SC 62a_200000210301_100012229600 [2,1,0,0,0,0|0,1,0]=4 2177 B14R1.628 CCOC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100012229600_200025704644 [2,1,0,0,0,0|0,1,0]=4 2178 B14R1.628 CCOC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100012229600 [2,1,0,0,0,0|0,1,0]=4 2179 B14R1.628 CCOC(=O)c1ccc(c(c1)F)OC 34a_200000082637_200000210301 [2,1,0,0,0,0|1,0,0]=4 2180 B14R1.628 CCOC(=O)c1ccc(c(c1)F)OC 7a_200000082637_200000210301 [2,1,0,0,0,0|1,0,0]=4 2181 B14R1.628 CCOC(=O)c1ccc(c(c1)F)O[13CH3] 34a_200000082637_200025704644 [2,1,0,0,0,0|1,0,0]=4 2182 B14R1.628 CCOC(=O)c1ccc(c(c1)F)O[13CH3] 7a_200000082637_200025704644 [2,1,0,0,0,0|1,0,0]=4 2183 B14R1.628 CCOC(=O)c1ccc(c(c1)I)OC 7a_200010236255_200000210301 [2,1,0,0,0,0|1,0,0]=4 2184 B14R1.628 CCOC(=O)c1ccc(c(c1)I)O[13CH3] 7a_200010236255_200025704644 [2,1,0,0,0,0|1,0,0]=4 2185 B14R1.628 CCOC(=O)c1ccc(c(c1)N)OC 7a_100011450745_200000210301 [2,1,0,0,0,0|1,0,0]=4 2186 B14R1.628 CCOC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100011450745_200025704644 [2,1,0,0,0,0|1,0,0]=4 2187 B14R1.628 CCOC(=O)c1ccc(c(c1)O)CC 271570a_203496583355_200012360145 [2,1,0,0,0,0|1,0,0]=4 2188 B14R1.628 CCOC(=O)c1ccc(c(c1)O)OC 271570a_203496583355_100012360133 [2,1,0,0,0,0|0,0,0]=3 2189 B14R1.628 CCOC(=O)c1ccc(c(c1)O)SC 62a_200000210301_100012355281 [2,1,0,0,0,0|0,1,0]=4 2190 B14R1.628 CCOC(=O)c1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012355281 [2,1,0,0,0,0|0,1,0]=4 2191 B14R1.628 CCOC(=O)c1cnc(c(c1)C)OC 7a_100010269686_200000210301 [2,1,0,0,0,0|1,0,0]=4 2192 B14R1.628 CCOC(=O)c1cnc(c(c1)C)O[13CH3] 7a_100010269686_200025704644 [2,1,0,0,0,0|1,0,0]=4 2193 B14R1.628 CNNC(=O)c1ccc(c(c1)C)OC 22a_100016993582_100011202886 [2,1,0,0,0,0|1,0,0]=4 2194 B14R1.628 CNNC(=O)c1ccc(c(c1)O)OC 22a_100016993582_100000766810 [2,1,0,0,0,0|1,0,0]=4 2195 B14R1.628 COCC(=O)c1ccc(c(c1)Br)OC 34a_100138415774_100011262385 [2,1,0,0,0,0|1,0,0]=4 2196 B14R1.628 COCC(=O)c1ccc(c(c1)F)OC 34a_100138415774_100000195436 [2,1,0,0,0,0|1,0,0]=4 2197 B14R1.628 COc1ccc(cc1C)C(=O)CCF 1458a_100011202886_100011217306 [2,1,0,0,0,0|1,0,0]=4 2198 B14R1.628 COc1ccc(cc1C)C(=O)CCO 1458a_100011202886_100000211926 [2,1,0,0,0,0|1,0,0]=4 2199 B14R1.628 COc1ccc(cc1O)C(=O)CCF 1458a_100000766810_100011217306 [2,1,0,0,0,0|1,0,0]=4 2200 B14R1.628 COc1ccc(cc1O)C(=O)CCO 1458a_100000766810_100000211926 [2,1,0,0,0,0|1,0,0]=4 2201 B14R1.747 C=C(C)c1ccc(cc1C)C(=O)OC 271570a_100000694244_100011215878 [2,1,0,0,0,0|1,0,0]=4 2202 B14R1.747 C=C(C)c1ccc(cc1O)C(=O)OC 271570a_100000694244_100012350776 [2,1,0,0,0,0|1,0,0]=4 2203 B14R1.747 COC(=O)c1ccc(c(c1)O)C(=O)C 1458a_100000101776_200000210301 [2,1,0,0,0,0|1,0,0]=4 2204 B14R1.747 COC(=O)c1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000101776_200025704644 [2,1,0,0,0,0|1,0,0]=4 2205 B14R1.747 COC(=O)c1ccc(c(c1)O)C(C)C 271570a_203496583355_200010236285 [2,1,0,0,0,0|1,0,0]=4 2206 B14R1.2294 CCC(=O)c1cc(c(cc1Br)OC)O 1458a_100010074811_100000210202 [2,1,0,0,0,0|1,0,0]=4 2207 B14R1.2294 CCC(=O)c1cc(c(cc1C)OC)C 1458a_100011996352_100000210202 [2,1,0,0,0,0|1,0,0]=4 2208 B14R1.2294 CNC(=O)c1cc(c(cc1Br)OC)O 240690a_100102657272_100010074811 [2,1,0,0,0,0|1,0,0]=4 2209 B14R1.2294 CNC(=O)c1cc(c(cc1C)OC)C 11a_106832991635_100011996352 [2,1,0,0,0,0|1,0,0]=4 2210 B14R1.2294 CNC(=O)c1cc(c(cc1C)OC)C 1626a_100102657272_100011996352 [2,1,0,0,0,0|1,0,0]=4 2211 B14R1.2294 CNC(=O)c1cc(c(cc1C)OC)C 240690a_100102657272_100011996352 [2,1,0,0,0,0|1,0,0]=4 2212 B14R1.2294 CNC(=O)c1cc(c(cc1C)OC)C 527a_100102657272_100011996352 [2,1,0,0,0,0|1,0,0]=4 2213 B14R1.2294 COC(=O)c1cc(c(cc1C)OC)O 271570a_203496583355_100010236281 [2,1,0,0,0,0|0,0,0]=3 2214 B14R1.2294 COC(=O)c1cc(c(cc1F)OC)Cl 34a_100010366841_200000210301 [2,1,0,0,0,0|1,0,0]=4 2215 B14R1.2294 COC(=O)c1cc(c(cc1F)OC)Cl 7a_100010366841_200000210301 [2,1,0,0,0,0|1,0,0]=4 2216 B14R1.2294 COC(=O)c1cc(c(cc1F)OC)O 271570a_203496583355_100015648668 [2,1,0,0,0,0|0,0,0]=3 2217 B14R1.2294 COC(=O)c1cc(c(cc1F)O[13CH3])Cl 34a_100010366841_200025704644 [2,1,0,0,0,0|1,0,0]=4 2218 B14R1.2294 COC(=O)c1cc(c(cc1F)O[13CH3])Cl 7a_100010366841_200025704644 [2,1,0,0,0,0|1,0,0]=4 2219 B14R1.2294 COC(=O)c1cc(c(cc1N)OC)O 271570a_203496583355_100000730826 [2,1,0,0,0,0|0,0,0]=3 2220 B14R1.2294 COC(=O)c1cc(c(cc1O)OC)O 271570a_203496583355_200010007936 [2,1,0,0,0,0|0,0,0]=3 2221 B14R1.3652 COc1ccc(cc1C)C(=O)C(C)C 1458a_100011202886_100000210206 [2,1,0,0,0,0|1,0,0]=4 2222 B14R1.3652 COc1ccc(cc1C)C(=O)N(C)C 11a_100102631434_100011202886 [2,1,0,0,0,0|1,0,0]=4 2223 B14R1.3652 COc1ccc(cc1C)C(=O)N(C)C 1626a_100102631434_100011202886 [2,1,0,0,0,0|1,0,0]=4 2224 B14R1.3652 COc1ccc(cc1C)C(=O)N(C)C 240690a_100102631434_100011202886 [2,1,0,0,0,0|1,0,0]=4 2225 B14R1.3652 COc1ccc(cc1C)C(=O)N(C)C 527a_100102631434_100011202886 [2,1,0,0,0,0|1,0,0]=4 2226 B14R1.3652 COc1ccc(cc1O)C(=O)C(C)C 1458a_100000766810_100000210206 [2,1,0,0,0,0|1,0,0]=4 2227 B14R1.3652 COc1ccc(cc1O)C(=O)N(C)C 240690a_100102631434_100000766810 [2,1,0,0,0,0|1,0,0]=4 2228 B14R1.3652 COc1ccc(cc1O)C(=O)N(C)C 527a_100102631434_100000766810 [2,1,0,0,0,0|1,0,0]=4 2229 B14R1.6720 CC=Cc1ccc(cc1C)C(=O)OC 271570a_100016259895_100011215878 [2,1,0,0,0,0|1,0,0]=4 2230 B14R1.6720 CC=Cc1ccc(cc1O)C(=O)OC 271570a_100016259895_100012350776 [2,1,0,0,0,0|1,0,0]=4 2231 B14R1.6720 CCOc1ccc(cc1Br)C(=O)OC 34a_100000216328_100000210202 [2,1,0,0,0,0|1,0,0]=4 2232 B14R1.6720 CCOc1ccc(cc1Br)C(=O)OC 7a_100000216328_100000210202 [2,1,0,0,0,0|1,0,0]=4 2233 B14R1.6720 CCOc1ccc(cc1C)C(=O)OC 34a_100011997373_100000210202 [2,1,0,0,0,0|0,0,0]=3 2234 B14R1.6720 CCOc1ccc(cc1C)C(=O)OC 7a_100011997373_100000210202 [2,1,0,0,0,0|0,0,0]=3 2235 B14R1.6720 CCOc1ccc(cc1Cl)C(=O)OC 34a_100000151454_100000210202 [2,1,0,0,0,0|1,0,0]=4 2236 B14R1.6720 CCOc1ccc(cc1Cl)C(=O)OC 7a_100000151454_100000210202 [2,1,0,0,0,0|1,0,0]=4 2237 B14R1.6720 CCOc1ccc(cc1F)C(=O)OC 34a_100000075456_100000210202 [2,1,0,0,0,0|1,0,0]=4 2238 B14R1.6720 CCOc1ccc(cc1F)C(=O)OC 7a_100000075456_100000210202 [2,1,0,0,0,0|1,0,0]=4 2239 B14R1.6720 CCOc1ccc(cc1I)C(=O)OC 34a_100010162523_100000210202 [2,1,0,0,0,0|1,0,0]=4 2240 B14R1.6720 CCOc1ccc(cc1I)C(=O)OC 7a_100010162523_100000210202 [2,1,0,0,0,0|1,0,0]=4 2241 B14R1.6720 CCOc1ccc(cc1N)C(=O)OC 34a_100000724433_100000210202 [2,1,0,0,0,0|1,0,0]=4 2242 B14R1.6720 CCOc1ccc(cc1N)C(=O)OC 7a_100000724433_100000210202 [2,1,0,0,0,0|1,0,0]=4 2243 B14R1.6720 CCSc1ccc(cc1C)C(=O)OC 62a_100000210202_100011215878 [2,1,0,0,0,0|0,1,0]=4 2244 B14R1.6720 CCSc1ccc(cc1C)C(=O)OC 62a_100011215878_100000210202 [2,1,0,0,0,0|0,1,0]=4 2245 B14R1.6720 CCSc1ccc(cc1O)C(=O)OC 62a_100000210202_100012350776 [2,1,0,0,0,0|0,1,0]=4 2246 B14R1.6720 CCSc1ccc(cc1O)C(=O)OC 62a_100012350776_100000210202 [2,1,0,0,0,0|0,1,0]=4 2247 B14R1.6720 CNCc1ccc(cc1C)C(=O)OC 270004a_106832991635_100010289884 [2,1,0,0,0,0|1,0,0]=4 2248 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CO[13CH3] 34a_100012355398_200025704644 [2,1,0,0,0,0|1,0,0]=4 2249 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CO[13CH3] 7a_100012355398_200025704644 [2,1,0,0,0,0|1,0,0]=4 2250 B14R1.6720 COC(=O)c1ccc(c(c1)Br)OCF 34a_100000216328_100015361967 [2,1,0,0,0,0|1,0,0]=4 2251 B14R1.6720 COC(=O)c1ccc(c(c1)Br)OCF 7a_100000216328_100015361967 [2,1,0,0,0,0|1,0,0]=4 2252 B14R1.6720 COC(=O)c1ccc(c(c1)C)OCF 34a_100011997373_100015361967 [2,1,0,0,0,0|0,0,0]=3 2253 B14R1.6720 COC(=O)c1ccc(c(c1)C)OCF 7a_100011997373_100015361967 [2,1,0,0,0,0|0,0,0]=3 2254 B14R1.6720 COC(=O)c1ccc(c(c1)C)SCF 62a_100011215878_100015361967 [2,1,0,0,0,0|0,1,0]=4 2255 B14R1.6720 COC(=O)c1ccc(c(c1)C)SCF 62a_100015361967_100011215878 [2,1,0,0,0,0|0,1,0]=4 2256 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)OCF 34a_100000151454_100015361967 [2,1,0,0,0,0|1,0,0]=4 2257 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)OCF 7a_100000151454_100015361967 [2,1,0,0,0,0|1,0,0]=4 2258 B14R1.6720 COC(=O)c1ccc(c(c1)F)CO[13CH3] 34a_100000094453_200025704644 [2,1,0,0,0,0|1,0,0]=4 2259 B14R1.6720 COC(=O)c1ccc(c(c1)F)CO[13CH3] 7a_100000094453_200025704644 [2,1,0,0,0,0|1,0,0]=4 2260 B14R1.6720 COC(=O)c1ccc(c(c1)F)OCF 34a_100000075456_100015361967 [2,1,0,0,0,0|1,0,0]=4 2261 B14R1.6720 COC(=O)c1ccc(c(c1)F)OCF 7a_100000075456_100015361967 [2,1,0,0,0,0|1,0,0]=4 2262 B14R1.6720 COC(=O)c1ccc(c(c1)I)OCF 34a_100010162523_100015361967 [2,1,0,0,0,0|1,0,0]=4 2263 B14R1.6720 COC(=O)c1ccc(c(c1)I)OCF 7a_100010162523_100015361967 [2,1,0,0,0,0|1,0,0]=4 2264 B14R1.6720 COC(=O)c1ccc(c(c1)N)OCF 34a_100000724433_100015361967 [2,1,0,0,0,0|1,0,0]=4 2265 B14R1.6720 COC(=O)c1ccc(c(c1)N)OCF 7a_100000724433_100015361967 [2,1,0,0,0,0|1,0,0]=4 2266 B14R1.6720 COC(=O)c1ccc(c(c1)O)SCF 62a_100012350776_100015361967 [2,1,0,0,0,0|0,1,0]=4 2267 B14R1.6720 COC(=O)c1ccc(c(c1)O)SCF 62a_100015361967_100012350776 [2,1,0,0,0,0|0,1,0]=4 2268 B14R1.6720 COCc1ccc(cc1Br)C(=O)OC 34a_100012355398_200000210301 [2,1,0,0,0,0|1,0,0]=4 2269 B14R1.6720 COCc1ccc(cc1Br)C(=O)OC 34a_100138415774_100010201862 [2,1,0,0,0,0|1,0,0]=4 2270 B14R1.6720 COCc1ccc(cc1Br)C(=O)OC 7a_100012355398_200000210301 [2,1,0,0,0,0|1,0,0]=4 2271 B14R1.6720 COCc1ccc(cc1Cl)C(=O)OC 34a_100138415774_100012194053 [2,1,0,0,0,0|1,0,0]=4 2272 B14R1.6720 COCc1ccc(cc1F)C(=O)OC 34a_100000094453_200000210301 [2,1,0,0,0,0|1,0,0]=4 2273 B14R1.6720 COCc1ccc(cc1F)C(=O)OC 34a_100138415774_100000694138 [2,1,0,0,0,0|1,0,0]=4 2274 B14R1.6720 COCc1ccc(cc1F)C(=O)OC 7a_100000094453_200000210301 [2,1,0,0,0,0|1,0,0]=4 2275 B14R1.12512 CCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000210202 [2,1,0,0,0,0|1,0,0]=4 2276 B14R1.12512 CCC(=O)c1cc(c(c(c1)C)OC)C 1458a_100000696790_100000210202 [2,1,0,0,0,0|1,0,0]=4 2277 B14R1.12512 CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000210202 [2,1,0,0,0,0|1,0,0]=4 2278 B14R1.12512 CNC(=O)c1cc(c(c(c1)Br)OC)O 240690a_100102657272_100010760816 [2,1,0,0,0,0|1,0,0]=4 2279 B14R1.12512 CNC(=O)c1cc(c(c(c1)Br)OC)O 527a_100102657272_100010760816 [2,1,0,0,0,0|1,0,0]=4 2280 B14R1.12512 CNC(=O)c1cc(c(c(c1)C)OC)C 11a_106832991635_100000696790 [2,1,0,0,0,0|1,0,0]=4 2281 B14R1.12512 CNC(=O)c1cc(c(c(c1)C)OC)C 1626a_100102657272_100000696790 [2,1,0,0,0,0|1,0,0]=4 2282 B14R1.12512 CNC(=O)c1cc(c(c(c1)C)OC)C 240690a_100102657272_100000696790 [2,1,0,0,0,0|1,0,0]=4 2283 B14R1.12512 CNC(=O)c1cc(c(c(c1)C)OC)C 527a_100102657272_100000696790 [2,1,0,0,0,0|1,0,0]=4 2284 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Br 34a_100009813172_200000210301 [2,1,0,0,0,0|1,0,0]=4 2285 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Br 7a_100009813172_200000210301 [2,1,0,0,0,0|1,0,0]=4 2286 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Cl 34a_100010873366_200000210301 [2,1,0,0,0,0|1,0,0]=4 2287 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Cl 7a_100010873366_200000210301 [2,1,0,0,0,0|1,0,0]=4 2288 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)N 34a_100010372079_200000210301 [2,1,0,0,0,0|1,0,0]=4 2289 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)N 7a_100010372079_200000210301 [2,1,0,0,0,0|1,0,0]=4 2290 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Br 34a_100009813172_200025704644 [2,1,0,0,0,0|1,0,0]=4 2291 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Br 7a_100009813172_200025704644 [2,1,0,0,0,0|1,0,0]=4 2292 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Cl 34a_100010873366_200025704644 [2,1,0,0,0,0|1,0,0]=4 2293 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Cl 7a_100010873366_200025704644 [2,1,0,0,0,0|1,0,0]=4 2294 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])N 34a_100010372079_200025704644 [2,1,0,0,0,0|1,0,0]=4 2295 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])N 7a_100010372079_200025704644 [2,1,0,0,0,0|1,0,0]=4 2296 B14R1.12512 COC(=O)c1cc(c(c(c1)C)SC)C 62a_100010209423_200000210301 [2,1,0,0,0,0|0,1,0]=4 2297 B14R1.12512 COC(=O)c1cc(c(c(c1)C)SC)C 62a_200000210301_100010209423 [2,1,0,0,0,0|0,1,0]=4 2298 B14R1.12512 COC(=O)c1cc(c(c(c1)C)S[13CH3])C 62a_100010209423_200025704644 [2,1,0,0,0,0|0,1,0]=4 2299 B14R1.12512 COC(=O)c1cc(c(c(c1)C)S[13CH3])C 62a_200025704644_100010209423 [2,1,0,0,0,0|0,1,0]=4 2300 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)Cl 34a_100000148585_200000210301 [2,1,0,0,0,0|1,0,0]=4 2301 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)Cl 7a_100000148585_200000210301 [2,1,0,0,0,0|1,0,0]=4 2302 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)N 34a_100010571316_200000210301 [2,1,0,0,0,0|1,0,0]=4 2303 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)N 7a_100010571316_200000210301 [2,1,0,0,0,0|1,0,0]=4 2304 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])Cl 34a_100000148585_200025704644 [2,1,0,0,0,0|1,0,0]=4 2305 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])Cl 7a_100000148585_200025704644 [2,1,0,0,0,0|1,0,0]=4 2306 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])N 34a_100010571316_200025704644 [2,1,0,0,0,0|1,0,0]=4 2307 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])N 7a_100010571316_200025704644 [2,1,0,0,0,0|1,0,0]=4 2308 B14R1.12512 COC(=O)c1cc(c(c(c1)F)OC)F 34a_100009871777_200000210301 [2,1,0,0,0,0|1,0,0]=4 2309 B14R1.12512 COC(=O)c1cc(c(c(c1)F)OC)F 7a_100009871777_200000210301 [2,1,0,0,0,0|1,0,0]=4 2310 B14R1.12512 COC(=O)c1cc(c(c(c1)F)O[13CH3])F 34a_100009871777_200025704644 [2,1,0,0,0,0|1,0,0]=4 2311 B14R1.12512 COC(=O)c1cc(c(c(c1)F)O[13CH3])F 7a_100009871777_200025704644 [2,1,0,0,0,0|1,0,0]=4 2312 B14R1.12512 COC(=O)c1cc(c(c(c1)I)OC)Cl 34a_100135280131_200000210301 [2,1,0,0,0,0|1,0,0]=4 2313 B14R1.12512 COC(=O)c1cc(c(c(c1)I)OC)Cl 7a_100135280131_200000210301 [2,1,0,0,0,0|1,0,0]=4 2314 B14R1.12512 COC(=O)c1cc(c(c(c1)I)OC)I 7a_100010007818_200000210301 [2,1,0,0,0,0|1,0,0]=4 2315 B14R1.12512 COC(=O)c1cc(c(c(c1)I)O[13CH3])Cl 34a_100135280131_200025704644 [2,1,0,0,0,0|1,0,0]=4 2316 B14R1.12512 COC(=O)c1cc(c(c(c1)I)O[13CH3])Cl 7a_100135280131_200025704644 [2,1,0,0,0,0|1,0,0]=4 2317 B14R1.12512 COC(=O)c1cc(c(c(c1)I)O[13CH3])I 7a_100010007818_200025704644 [2,1,0,0,0,0|1,0,0]=4 2318 B14R1.12512 COC(=O)c1cc(c(c(c1)O)SC)O 62a_200000210301_100010192586 [2,1,0,0,0,0|0,1,0]=4 2319 B14R1.12512 COC(=O)c1cc(c(c(c1)O)S[13CH3])O 62a_200025704644_100010192586 [2,1,0,0,0,0|0,1,0]=4 2320 B14R1.31 C=C(C)c1cc(ccc1OC)C(=O)C 271570a_100000694244_100000185153 [2,1,0,0,0,0|1,0,0]=4 2321 B14R1.43 C=C(C)c1ccc(cc1OC)C(=O)C 271570a_100000694244_100010110075 [2,1,0,0,0,0|1,0,0]=4 2322 B14R1.350 COc1cc(cc(c1OC)Cl)C(=O)C 1458a_100000180162_200000210301 [2,1,0,0,0,0|0,0,0]=3 2323 B14R1.350 COc1cc(cc(c1OC)Cl)C(=O)[13CH3] 1458a_100000180162_200025704644 [2,1,0,0,0,0|0,0,0]=3 2324 B14R1.350 COc1cc(cc(c1OC)O)C(=O)C 1458a_100000032013_200000210301 [2,1,0,0,0,0|0,0,0]=3 2325 B14R1.350 COc1cc(cc(c1OC)O)C(=O)[13CH3] 1458a_100000032013_200025704644 [2,1,0,0,0,0|0,0,0]=3 2326 B14R1.441 C=C(C)c1ccc(c(c1)COC)OC 271570a_100000694244_200011493686 [2,1,0,0,0,0|1,0,0]=4 2327 B14R1.441 C=C(C)c1ccc(c(c1)OCC)OC 271570a_100000694244_200010219349 [2,1,0,0,0,0|1,0,0]=4 2328 B14R1.441 CC=Cc1cc(ccc1OC)C(=O)C 271570a_100016259895_100000185153 [2,1,0,0,0,0|1,0,0]=4 2329 B14R1.441 CCOc1cc(ccc1OC)C(=O)C 1458a_100000181421_200000210301 [2,1,0,0,0,0|0,0,0]=3 2330 B14R1.441 CCOc1cc(ccc1OC)C(=O)C 34a_100000732934_100000210202 [2,1,0,0,0,0|0,0,0]=3 2331 B14R1.441 CCOc1cc(ccc1OC)C(=O)C 7a_100000732934_100000210202 [2,1,0,0,0,0|0,0,0]=3 2332 B14R1.441 CCOc1cc(ccc1OC)C(=O)[13CH3] 1458a_100000181421_200025704644 [2,1,0,0,0,0|0,0,0]=3 2333 B14R1.441 CCSc1cc(ccc1OC)C(=O)C 62a_100000185153_100000210202 [2,1,0,0,0,0|0,1,0]=4 2334 B14R1.441 CCSc1cc(ccc1OC)C(=O)C 62a_100000210202_100000039561 [2,1,0,0,0,0|0,1,0]=4 2335 B14R1.441 CNCc1cc(ccc1OC)C(=O)C 2230a_106832991635_100000199119 [2,1,0,0,0,0|1,0,0]=4 2336 B14R1.441 CNCc1cc(ccc1OC)C(=O)C 26a_100102657272_100000732934 [2,1,0,0,0,0|1,0,0]=4 2337 B14R1.441 CNCc1cc(ccc1OC)C(=O)C 34a_100102657272_100000199119 [2,1,0,0,0,0|1,0,0]=4 2338 B14R1.441 CNCc1cc(ccc1OC)C(=O)C 7a_106832991635_100000199119 [2,1,0,0,0,0|1,0,0]=4 2339 B14R1.441 COCc1cc(ccc1OC)C(=O)C 34a_100138415774_100000199119 [2,1,0,0,0,0|0,0,0]=3 2340 B14R1.441 COCc1cc(ccc1OC)C(=O)C 7a_100000246370_200000210301 [2,1,0,0,0,0|0,0,0]=3 2341 B14R1.441 COc1ccc(cc1CO[13CH3])C(=O)C 7a_100000246370_200025704644 [2,1,0,0,0,0|0,0,0]=3 2342 B14R1.441 COc1ccc(cc1CSC)C(=O)C 62a_100000199119_200000210301 [2,1,0,0,0,0|0,1,0]=4 2343 B14R1.441 COc1ccc(cc1CSC)C(=O)C 62a_200000210301_100000199119 [2,1,0,0,0,0|0,1,0]=4 2344 B14R1.441 COc1ccc(cc1CS[13CH3])C(=O)C 62a_100000199119_200025704644 [2,1,0,0,0,0|0,1,0]=4 2345 B14R1.441 COc1ccc(cc1CS[13CH3])C(=O)C 62a_200025704644_100000199119 [2,1,0,0,0,0|0,1,0]=4 2346 B14R1.441 COc1ccc(cc1OCF)C(=O)C 34a_100000732934_100015361967 [2,1,0,0,0,0|0,0,0]=3 2347 B14R1.441 COc1ccc(cc1OCF)C(=O)C 7a_100000732934_100015361967 [2,1,0,0,0,0|0,0,0]=3 2348 B14R1.441 COc1ccc(cc1SCF)C(=O)C 62a_100000185153_100015361967 [2,1,0,0,0,0|0,1,0]=4 2349 B14R1.441 COc1ccc(cc1SCF)C(=O)C 62a_100015361967_100000039561 [2,1,0,0,0,0|0,1,0]=4 2350 B14R1.1851 C=C(C)c1cc(c(cc1F)OC)OC 271570a_100000694244_200011765842 [2,1,0,0,0,0|1,0,0]=4 2351 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)Br 1458a_100011217046_200000210301 [2,1,0,0,0,0|0,0,0]=3 2352 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)C 1458a_100000765401_200000210301 [2,1,0,0,0,0|0,0,0]=3 2353 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)C 34a_100010659216_200000210301 [2,1,0,0,0,0|0,0,0]=3 2354 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)C 7a_100010659216_200000210301 [2,1,0,0,0,0|0,0,0]=3 2355 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)Cl 1458a_100000692841_200000210301 [2,1,0,0,0,0|0,0,0]=3 2356 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)F 1458a_100000687845_200000210301 [2,1,0,0,0,0|0,0,0]=3 2357 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)F 34a_100000070333_200000210301 [2,1,0,0,0,0|0,0,0]=3 2358 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)F 7a_100000070333_200000210301 [2,1,0,0,0,0|0,0,0]=3 2359 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)I 1458a_100000749224_200000210301 [2,1,0,0,0,0|0,0,0]=3 2360 B14R1.1851 COc1cc(c(cc1OC)C(=O)C)O 1458a_100012177203_200000210301 [2,1,0,0,0,0|0,0,0]=3 2361 B14R1.1851 COc1cc(c(cc1OC)C(=O)[13CH3])Br 1458a_100011217046_200025704644 [2,1,0,0,0,0|0,0,0]=3 2362 B14R1.1851 COc1cc(c(cc1OC)C(=O)[13CH3])C 1458a_100000765401_200025704644 [2,1,0,0,0,0|0,0,0]=3 2363 B14R1.1851 COc1cc(c(cc1OC)C(=O)[13CH3])Cl 1458a_100000692841_200025704644 [2,1,0,0,0,0|0,0,0]=3 2364 B14R1.1851 COc1cc(c(cc1OC)C(=O)[13CH3])F 1458a_100000687845_200025704644 [2,1,0,0,0,0|0,0,0]=3 2365 B14R1.1851 COc1cc(c(cc1OC)C(=O)[13CH3])I 1458a_100000749224_200025704644 [2,1,0,0,0,0|0,0,0]=3 2366 B14R1.1851 COc1cc(c(cc1OC)C(=O)[13CH3])O 1458a_100012177203_200025704644 [2,1,0,0,0,0|0,0,0]=3 2367 B14R1.1851 COc1cc(c(cc1O[13CH3])C(=O)C)C 34a_100010659216_200025704644 [2,1,0,0,0,0|0,0,0]=3 2368 B14R1.1851 COc1cc(c(cc1O[13CH3])C(=O)C)C 7a_100010659216_200025704644 [2,1,0,0,0,0|0,0,0]=3 2369 B14R1.1851 COc1cc(c(cc1O[13CH3])F)C(=O)C 34a_100000070333_200025704644 [2,1,0,0,0,0|0,0,0]=3 2370 B14R1.1851 COc1cc(c(cc1O[13CH3])F)C(=O)C 7a_100000070333_200025704644 [2,1,0,0,0,0|0,0,0]=3 2371 B14R1.6723 C=C(C)c1ccc(c(c1)OC)OCC 271570a_100000694244_200012344064 [2,1,0,0,0,0|1,0,0]=4 2372 B14R1.6723 CC=Cc1ccc(cc1OC)C(=O)C 271570a_100016259895_100010110075 [2,1,0,0,0,0|1,0,0]=4 2373 B14R1.6723 CCOc1ccc(cc1OC)C(=O)C 1458a_100000184834_200000210301 [2,1,0,0,0,0|0,0,0]=3 2374 B14R1.6723 CCOc1ccc(cc1OC)C(=O)C 34a_100000186468_100000210202 [2,1,0,0,0,0|0,0,0]=3 2375 B14R1.6723 CCOc1ccc(cc1OC)C(=O)C 7a_100000186468_100000210202 [2,1,0,0,0,0|0,0,0]=3 2376 B14R1.6723 CCOc1ccc(cc1OC)C(=O)[13CH3] 1458a_100000184834_200025704644 [2,1,0,0,0,0|0,0,0]=3 2377 B14R1.6723 CCSc1ccc(cc1OC)C(=O)C 62a_100010110075_100000210202 [2,1,0,0,0,0|0,1,0]=4 2378 B14R1.6723 CCc1cc(ccc1COC)C(=O)C 7a_100009829543_200000210301 [2,1,0,0,0,0|1,0,0]=4 2379 B14R1.6723 CCc1cc(ccc1CO[13CH3])C(=O)C 7a_100009829543_200025704644 [2,1,0,0,0,0|1,0,0]=4 2380 B14R1.6723 CNCc1ccc(cc1OC)C(=O)C 26a_100102657272_100000186468 [2,1,0,0,0,0|1,0,0]=4 2381 B14R1.6723 COc1cc(ccc1OCF)C(=O)C 34a_100000186468_100015361967 [2,1,0,0,0,0|0,0,0]=3 2382 B14R1.6723 COc1cc(ccc1OCF)C(=O)C 7a_100000186468_100015361967 [2,1,0,0,0,0|0,0,0]=3 2383 B14R1.6723 COc1cc(ccc1SCF)C(=O)C 62a_100010110075_100015361967 [2,1,0,0,0,0|0,1,0]=4 2384 B14R1.2310 C=Cc1c(ccc(c1OC)OC)C=O 271570a_100011290941_100009814707 [2,1,0,0,0,0|1,0,0]=4 2385 B14R1.2310 C=Cc1ccc(c(c1OC)OC)OC 271570a_100011290941_100011320274 [2,1,0,0,0,0|0,0,1]=4 2386 B14R1.2310 CNc1ccc(c(c1OC)OC)OC 34a_100000751027_200000210301 [2,1,0,0,0,0|1,0,0]=4 2387 B14R1.2310 COc1ccc(c(c1OC)OC)N[13CH3] 34a_100000751027_200025704644 [2,1,0,0,0,0|1,0,0]=4 2388 B14R1.2310 COc1ccc(c(c1OC)OC)OC 34a_100000074623_200000210301 [2,1,0,0,0,0|0,0,0]=3 2389 B14R1.2310 COc1ccc(c(c1OC)OC)O[13CH3] 34a_100000074623_200025704644 [2,1,0,0,0,0|0,0,0]=3 2390 B14R1.2310 COc1ccc(c(c1OC)SC)C=O 62a_100009814707_200000210301 [2,1,0,0,0,0|0,1,0]=4 2391 B14R1.2310 COc1ccc(c(c1OC)S[13CH3])C=O 62a_100009814707_200025704644 [2,1,0,0,0,0|0,1,0]=4 2392 B14R1.5210 COCc1ccc(c(c1OC)C)OC 34a_200000022523_200000210301 [2,1,0,0,0,0|1,0,0]=4 2393 B14R1.5210 COCc1ccc(c(c1OC)C)OC 7a_200000022523_200000210301 [2,1,0,0,0,0|1,0,0]=4 2394 B14R1.5210 COc1ccc(c(c1C)OC)CO[13CH3] 34a_200000022523_200025704644 [2,1,0,0,0,0|1,0,0]=4 2395 B14R1.5210 COc1ccc(c(c1C)OC)CO[13CH3] 7a_200000022523_200025704644 [2,1,0,0,0,0|1,0,0]=4 2396 B14R1.9401 CCSc1c(ccc(c1O)C=O)OC 62a_100000210202_100016072024 [2,1,0,0,0,0|0,1,0]=4 2397 B14R1.9401 COc1ccc(c(c1SCF)O)C=O 62a_100015361967_100016072024 [2,1,0,0,0,0|0,1,0]=4 2398 B14R1.570 COc1cc(c(c(c1O)Cl)C(=O)C)Cl 1458a_100010164187_200000210301 [2,1,0,0,0,0|1,0,0]=4 2399 B14R1.570 COc1cc(c(c(c1O)Cl)C(=O)[13CH3])Cl 1458a_100010164187_200025704644 [2,1,0,0,0,0|1,0,0]=4 2400 B14R1.102 COc1ccc(c(c1)O)C(=O)C(C)C 1458a_100000212123_100000210206 [2,1,0,0,0,0|1,0,0]=4 2401 B14R1.102 COc1ccc(c(c1)O)C(=O)N(C)C 11a_100102631434_100000212123 [2,1,0,0,0,0|1,0,0]=4 2402 B14R1.102 COc1ccc(c(c1)O)C(=O)N(C)C 240690a_100102631434_100000212123 [2,1,0,0,0,0|1,0,0]=4 2403 B14R1.102 COc1ccc(c(c1)O)C(=O)N(C)C 527a_100102631434_100000212123 [2,1,0,0,0,0|1,0,0]=4 2404 B14R1.487 CC=Cc1ccc(c(c1)O)C(=O)OC 271570a_100016259895_100000062286 [2,1,0,0,0,0|1,0,0]=4 2405 B14R1.487 CCOc1ccc(c(c1)Br)C(=O)OC 34a_100010150825_100000210202 [2,1,0,0,0,0|1,0,0]=4 2406 B14R1.487 CCOc1ccc(c(c1)Br)C(=O)OC 7a_100010150825_100000210202 [2,1,0,0,0,0|1,0,0]=4 2407 B14R1.487 CCOc1ccc(c(c1)C)C(=O)OC 34a_100012000157_100000210202 [2,1,0,0,0,0|1,0,0]=4 2408 B14R1.487 CCOc1ccc(c(c1)C)C(=O)OC 7a_100012000157_100000210202 [2,1,0,0,0,0|1,0,0]=4 2409 B14R1.487 CCOc1ccc(c(c1)Cl)C(=O)OC 34a_100000081488_100000210202 [2,1,0,0,0,0|1,0,0]=4 2410 B14R1.487 CCOc1ccc(c(c1)Cl)C(=O)OC 7a_100000081488_100000210202 [2,1,0,0,0,0|1,0,0]=4 2411 B14R1.487 CCOc1ccc(c(c1)F)C(=O)OC 34a_100011999631_100000210202 [2,1,0,0,0,0|1,0,0]=4 2412 B14R1.487 CCOc1ccc(c(c1)F)C(=O)OC 7a_100011999631_100000210202 [2,1,0,0,0,0|1,0,0]=4 2413 B14R1.487 CCOc1ccc(c(c1)N)C(=O)OC 34a_100000701581_100000210202 [2,1,0,0,0,0|1,0,0]=4 2414 B14R1.487 CCOc1ccc(c(c1)N)C(=O)OC 7a_100000701581_100000210202 [2,1,0,0,0,0|1,0,0]=4 2415 B14R1.487 CCOc1ccc(c(c1)O)C(=O)CC 1458a_200000049073_100000210202 [2,1,0,0,0,0|1,0,0]=4 2416 B14R1.487 CCOc1ccc(c(c1)O)C(=O)NC 240690a_100102657272_200000049073 [2,1,0,0,0,0|1,0,0]=4 2417 B14R1.487 CCOc1ccc(c(c1)O)C(=O)NC 527a_100102657272_200000049073 [2,1,0,0,0,0|1,0,0]=4 2418 B14R1.487 CCSc1ccc(c(c1)O)C(=O)OC 62a_100000210202_100000062286 [2,1,0,0,0,0|0,1,0]=4 2419 B14R1.487 COC(=O)c1ccc(cc1Br)OCF 34a_100010150825_100015361967 [2,1,0,0,0,0|1,0,0]=4 2420 B14R1.487 COC(=O)c1ccc(cc1Br)OCF 7a_100010150825_100015361967 [2,1,0,0,0,0|1,0,0]=4 2421 B14R1.487 COC(=O)c1ccc(cc1C)OCF 34a_100012000157_100015361967 [2,1,0,0,0,0|1,0,0]=4 2422 B14R1.487 COC(=O)c1ccc(cc1C)OCF 7a_100012000157_100015361967 [2,1,0,0,0,0|1,0,0]=4 2423 B14R1.487 COC(=O)c1ccc(cc1Cl)OCF 34a_100000081488_100015361967 [2,1,0,0,0,0|1,0,0]=4 2424 B14R1.487 COC(=O)c1ccc(cc1Cl)OCF 7a_100000081488_100015361967 [2,1,0,0,0,0|1,0,0]=4 2425 B14R1.487 COC(=O)c1ccc(cc1F)CO[13CH3] 34a_100012183857_200025704644 [2,1,0,0,0,0|1,0,0]=4 2426 B14R1.487 COC(=O)c1ccc(cc1F)CO[13CH3] 7a_100012183857_200025704644 [2,1,0,0,0,0|1,0,0]=4 2427 B14R1.487 COC(=O)c1ccc(cc1F)OCF 34a_100011999631_100015361967 [2,1,0,0,0,0|1,0,0]=4 2428 B14R1.487 COC(=O)c1ccc(cc1F)OCF 7a_100011999631_100015361967 [2,1,0,0,0,0|1,0,0]=4 2429 B14R1.487 COC(=O)c1ccc(cc1N)OCF 34a_100000701581_100015361967 [2,1,0,0,0,0|1,0,0]=4 2430 B14R1.487 COC(=O)c1ccc(cc1N)OCF 7a_100000701581_100015361967 [2,1,0,0,0,0|1,0,0]=4 2431 B14R1.487 COC(=O)c1ccc(cc1O)SCF 62a_100015361967_100000062286 [2,1,0,0,0,0|0,1,0]=4 2432 B14R1.487 COCc1ccc(c(c1)Br)C(=O)OC 34a_100138415774_100012340598 [2,1,0,0,0,0|1,0,0]=4 2433 B14R1.487 COCc1ccc(c(c1)C)C(=O)OC 34a_100138415774_100010991300 [2,1,0,0,0,0|1,0,0]=4 2434 B14R1.487 COCc1ccc(c(c1)Cl)C(=O)OC 34a_100138415774_100010128985 [2,1,0,0,0,0|1,0,0]=4 2435 B14R1.487 COCc1ccc(c(c1)F)C(=O)OC 34a_100012183857_200000210301 [2,1,0,0,0,0|1,0,0]=4 2436 B14R1.487 COCc1ccc(c(c1)F)C(=O)OC 34a_100138415774_100000686969 [2,1,0,0,0,0|1,0,0]=4 2437 B14R1.487 COCc1ccc(c(c1)F)C(=O)OC 7a_100012183857_200000210301 [2,1,0,0,0,0|1,0,0]=4 2438 B14R1.579 COC(=O)c1c(cc(cc1C)OC)C 34a_100009884286_200000210301 [2,1,0,0,0,0|1,0,0]=4 2439 B14R1.579 COC(=O)c1c(cc(cc1C)OC)C 7a_100009884286_200000210301 [2,1,0,0,0,0|1,0,0]=4 2440 B14R1.579 COC(=O)c1c(cc(cc1C)O[13CH3])C 34a_100009884286_200025704644 [2,1,0,0,0,0|1,0,0]=4 2441 B14R1.579 COC(=O)c1c(cc(cc1C)O[13CH3])C 7a_100009884286_200025704644 [2,1,0,0,0,0|1,0,0]=4 2442 B14R1.579 COC(=O)c1c(cc(cc1F)OC)F 34a_100000101002_200000210301 [2,1,0,0,0,0|1,0,0]=4 2443 B14R1.579 COC(=O)c1c(cc(cc1F)OC)F 7a_100000101002_200000210301 [2,1,0,0,0,0|1,0,0]=4 2444 B14R1.579 COC(=O)c1c(cc(cc1F)O[13CH3])F 34a_100000101002_200025704644 [2,1,0,0,0,0|1,0,0]=4 2445 B14R1.579 COC(=O)c1c(cc(cc1F)O[13CH3])F 7a_100000101002_200025704644 [2,1,0,0,0,0|1,0,0]=4 2446 B14R1.579 COC(=O)c1c(cc(cc1F)SC)O 62a_200000210301_100010889199 [2,1,0,0,0,0|0,1,0]=4 2447 B14R1.579 COC(=O)c1c(cc(cc1F)S[13CH3])O 62a_200025704644_100010889199 [2,1,0,0,0,0|0,1,0]=4 2448 B14R1.1128 C=C(C)c1ccc(c(c1)O)C(=O)OC 271570a_100000694244_100000062286 [2,1,0,0,0,0|1,0,0]=4 2449 B14R1.1128 COC(=O)c1ccc(cc1O)C(=O)C 1458a_100000704390_200000210301 [2,1,0,0,0,0|1,0,0]=4 2450 B14R1.1128 COC(=O)c1ccc(cc1O)C(=O)[13CH3] 1458a_100000704390_200025704644 [2,1,0,0,0,0|1,0,0]=4 2451 B14R1.2334 C=Cc1cc(ccc1C(=O)OC)OC 271570a_100011290941_100009815674 [2,1,0,0,0,0|1,0,0]=4 2452 B14R1.2334 CCC(=O)c1ccc(cc1OC)OC 1458a_100000210807_100000210202 [2,1,0,0,0,0|1,0,0]=4 2453 B14R1.2334 CCC(=O)c1ccc(cc1OC)OC 7a_200000067515_200000210301 [2,1,0,0,0,0|1,0,0]=4 2454 B14R1.2334 CCC(=O)c1ccc(cc1O[13CH3])OC 7a_200000067515_200025704644 [2,1,0,0,0,0|1,0,0]=4 2455 B14R1.2334 CNC(=O)c1ccc(cc1OC)OC 11a_106832991635_100000210807 [2,1,0,0,0,0|1,0,0]=4 2456 B14R1.2334 CNC(=O)c1ccc(cc1OC)OC 1626a_100102657272_100000210807 [2,1,0,0,0,0|1,0,0]=4 2457 B14R1.2334 CNC(=O)c1ccc(cc1OC)OC 240690a_100102657272_100000210807 [2,1,0,0,0,0|1,0,0]=4 2458 B14R1.2334 CNC(=O)c1ccc(cc1OC)OC 527a_100102657272_100000210807 [2,1,0,0,0,0|1,0,0]=4 2459 B14R1.2334 COC(=O)c1ccc(cc1OC)OC 34a_100000082606_200000210301 [2,1,0,0,0,0|0,0,0]=3 2460 B14R1.2334 COC(=O)c1ccc(cc1OC)OC 34a_100000151117_200000210301 [2,1,0,0,0,0|0,0,0]=3 2461 B14R1.2334 COC(=O)c1ccc(cc1OC)OC 7a_100000082606_200000210301 [2,1,0,0,0,0|0,0,0]=3 2462 B14R1.2334 COC(=O)c1ccc(cc1OC)OC 7a_100000151117_200000210301 [2,1,0,0,0,0|0,0,0]=3 2463 B14R1.2334 COC(=O)c1ccc(cc1OC)O[13CH3] 34a_100000082606_200025704644 [2,1,0,0,0,0|0,0,0]=3 2464 B14R1.2334 COC(=O)c1ccc(cc1OC)O[13CH3] 7a_100000082606_200025704644 [2,1,0,0,0,0|0,0,0]=3 2465 B14R1.2334 COC(=O)c1ccc(cc1OC)SC 62a_100000708095_200000210301 [2,1,0,0,0,0|0,1,0]=4 2466 B14R1.2334 COC(=O)c1ccc(cc1OC)S[13CH3] 62a_100000708095_200025704644 [2,1,0,0,0,0|0,1,0]=4 2467 B14R1.2334 COC(=O)c1ccc(cc1O[13CH3])OC 34a_100000151117_200025704644 [2,1,0,0,0,0|0,0,0]=3 2468 B14R1.2334 COC(=O)c1ccc(cc1O[13CH3])OC 7a_100000151117_200025704644 [2,1,0,0,0,0|0,0,0]=3 2469 B14R1.2334 COC(=O)c1ccc(cc1SC)OC 62a_100009815674_200000210301 [2,1,0,0,0,0|0,1,0]=4 2470 B14R1.2334 COC(=O)c1ccc(cc1SC)OC 62a_200000210301_100009815674 [2,1,0,0,0,0|0,1,0]=4 2471 B14R1.2334 COC(=O)c1ccc(cc1S[13CH3])OC 62a_100009815674_200025704644 [2,1,0,0,0,0|0,1,0]=4 2472 B14R1.2334 COC(=O)c1ccc(cc1S[13CH3])OC 62a_200025704644_100009815674 [2,1,0,0,0,0|0,1,0]=4 2473 B14R1.7234 CCCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000210303 [2,1,0,0,0,0|1,0,0]=4 2474 B14R1.7234 CCNC(=O)c1ccc(cc1O)OC 11a_100015525214_100000212123 [2,1,0,0,0,0|1,0,0]=4 2475 B14R1.7234 CCNC(=O)c1ccc(cc1O)OC 240690a_100015525214_100000212123 [2,1,0,0,0,0|1,0,0]=4 2476 B14R1.7234 CCNC(=O)c1ccc(cc1O)OC 527a_100015525214_100000212123 [2,1,0,0,0,0|1,0,0]=4 2477 B14R1.7234 CCOC(=O)c1ccc(cc1C)OC 7a_100012184494_200000210301 [2,1,0,0,0,0|1,0,0]=4 2478 B14R1.7234 CCOC(=O)c1ccc(cc1C)O[13CH3] 7a_100012184494_200025704644 [2,1,0,0,0,0|1,0,0]=4 2479 B14R1.7234 CNNC(=O)c1ccc(cc1O)OC 22a_100016993582_100000212123 [2,1,0,0,0,0|1,0,0]=4 2480 B14R1.7234 COCC(=O)c1ccc(cc1F)OC 34a_100138415774_100011316493 [2,1,0,0,0,0|1,0,0]=4 2481 B14R1.7234 COc1ccc(c(c1)O)C(=O)CCF 1458a_100000212123_100011217306 [2,1,0,0,0,0|1,0,0]=4 2482 B14R1.7234 COc1ccc(c(c1)O)C(=O)CCO 1458a_100000212123_100000211926 [2,1,0,0,0,0|1,0,0]=4 2483 B14R1.6058 CC(C)C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210206 [2,1,0,0,0,0|1,0,0]=4 2484 B14R1.6058 Cc1ccc(c(c1C)O)C(=O)C(C)C 1458a_100000742916_100000210206 [2,1,0,0,0,0|1,0,0]=4 2485 B14R1.6058 Cc1ccc(c(c1C)O)C(=O)N(C)C 240690a_100102631434_100000742916 [2,1,0,0,0,0|1,0,0]=4 2486 B14R1.6058 Cc1ccc(c(c1C)O)C(=O)N(C)C 527a_100102631434_100000742916 [2,1,0,0,0,0|1,0,0]=4 2487 B14R1.7265 CCCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210303 [2,1,0,0,0,0|1,0,0]=4 2488 B14R1.7265 CCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210303 [2,1,0,0,0,0|1,0,0]=4 2489 B14R1.7265 CCNC(=O)c1ccc(c(c1O)C)C 240690a_100015525214_100000742916 [2,1,0,0,0,0|1,0,0]=4 2490 B14R1.7265 CCNC(=O)c1ccc(c(c1O)C)C 527a_100015525214_100000742916 [2,1,0,0,0,0|1,0,0]=4 2491 B14R1.7265 CNNC(=O)c1ccc(c(c1O)C)C 22a_100016993582_100000742916 [2,1,0,0,0,0|1,0,0]=4 2492 B14R1.7265 Cc1ccc(c(c1C)O)C(=O)CCF 1458a_100000742916_100011217306 [2,1,0,0,0,0|1,0,0]=4 2493 B14R1.7265 Cc1ccc(c(c1C)O)C(=O)CCO 1458a_100000742916_100000211926 [2,1,0,0,0,0|1,0,0]=4 2494 B14R1.7265 O=C(CCF)c1ccc(c(c1O)O)O 1458a_100000037941_100011217306 [2,1,0,0,0,0|1,0,0]=4 2495 B14R1.7265 O=C(CCO)c1ccc(c(c1O)O)O 1458a_100000037941_100000211926 [2,1,0,0,0,0|1,0,0]=4 2496 B14R1.384 CCC(=O)c1cc(cc(c1O)OC)Br 1458a_100012340195_100000210202 [2,1,0,0,0,0|1,0,0]=4 2497 B14R1.384 CNC(=O)c1cc(cc(c1O)OC)Br 240690a_100102657272_100012340195 [2,1,0,0,0,0|1,0,0]=4 2498 B14R1.384 COC(=O)c1cc(cc(c1C)OC)Br 34a_200011012443_200000210301 [2,1,0,0,0,0|1,0,0]=4 2499 B14R1.384 COC(=O)c1cc(cc(c1C)OC)Br 7a_200011012443_200000210301 [2,1,0,0,0,0|1,0,0]=4 2500 B14R1.384 COC(=O)c1cc(cc(c1C)O[13CH3])Br 34a_200011012443_200025704644 [2,1,0,0,0,0|1,0,0]=4 2501 B14R1.384 COC(=O)c1cc(cc(c1C)O[13CH3])Br 7a_200011012443_200025704644 [2,1,0,0,0,0|1,0,0]=4 2502 B14R1.384 COC(=O)c1cc(cc(c1O)OC)O 271570a_203496583355_100010164242 [2,1,0,0,0,0|0,0,0]=3 2503 B14R1.384 COC(=O)c1cc(cc(c1O)SC)Br 62a_100009996593_200000210301 [2,1,0,0,0,0|0,1,0]=4 2504 B14R1.384 COC(=O)c1cc(cc(c1O)S[13CH3])Br 62a_100009996593_200025704644 [2,1,0,0,0,0|0,1,0]=4 2505 B14R1.473 CC=Cc1cccc(c1O)C(=O)OC 271570a_100016259895_100009816214 [2,1,0,0,0,0|1,0,0]=4 2506 B14R1.473 CCOc1cccc(c1Br)C(=O)OC 34a_200010230364_100000210202 [2,1,0,0,0,0|1,0,0]=4 2507 B14R1.473 CCOc1cccc(c1Br)C(=O)OC 7a_200010230364_100000210202 [2,1,0,0,0,0|1,0,0]=4 2508 B14R1.473 CCOc1cccc(c1C)C(=O)OC 34a_100011999632_100000210202 [2,1,0,0,0,0|1,0,0]=4 2509 B14R1.473 CCOc1cccc(c1C)C(=O)OC 7a_100011999632_100000210202 [2,1,0,0,0,0|1,0,0]=4 2510 B14R1.473 CCOc1cccc(c1Cl)C(=O)OC 34a_100009866855_100000210202 [2,1,0,0,0,0|1,0,0]=4 2511 B14R1.473 CCOc1cccc(c1Cl)C(=O)OC 7a_100009866855_100000210202 [2,1,0,0,0,0|1,0,0]=4 2512 B14R1.473 CCOc1cccc(c1F)C(=O)OC 34a_100009854753_100000210202 [2,1,0,0,0,0|1,0,0]=4 2513 B14R1.473 CCOc1cccc(c1F)C(=O)OC 7a_100009854753_100000210202 [2,1,0,0,0,0|1,0,0]=4 2514 B14R1.473 CCOc1cccc(c1N)C(=O)OC 34a_100015205654_100000210202 [2,1,0,0,0,0|1,0,0]=4 2515 B14R1.473 CCOc1cccc(c1N)C(=O)OC 7a_100015205654_100000210202 [2,1,0,0,0,0|1,0,0]=4 2516 B14R1.473 CCSc1cccc(c1O)C(=O)OC 62a_100009816214_100000210202 [2,1,0,0,0,0|0,1,0]=4 2517 B14R1.473 COC(=O)c1cccc(c1Br)OCF 34a_200010230364_100015361967 [2,1,0,0,0,0|1,0,0]=4 2518 B14R1.473 COC(=O)c1cccc(c1Br)OCF 7a_200010230364_100015361967 [2,1,0,0,0,0|1,0,0]=4 2519 B14R1.473 COC(=O)c1cccc(c1C)OCF 34a_100011999632_100015361967 [2,1,0,0,0,0|1,0,0]=4 2520 B14R1.473 COC(=O)c1cccc(c1C)OCF 7a_100011999632_100015361967 [2,1,0,0,0,0|1,0,0]=4 2521 B14R1.473 COC(=O)c1cccc(c1Cl)OCF 34a_100009866855_100015361967 [2,1,0,0,0,0|1,0,0]=4 2522 B14R1.473 COC(=O)c1cccc(c1Cl)OCF 7a_100009866855_100015361967 [2,1,0,0,0,0|1,0,0]=4 2523 B14R1.473 COC(=O)c1cccc(c1F)OCF 34a_100009854753_100015361967 [2,1,0,0,0,0|1,0,0]=4 2524 B14R1.473 COC(=O)c1cccc(c1F)OCF 7a_100009854753_100015361967 [2,1,0,0,0,0|1,0,0]=4 2525 B14R1.473 COC(=O)c1cccc(c1N)OCF 34a_100015205654_100015361967 [2,1,0,0,0,0|1,0,0]=4 2526 B14R1.473 COC(=O)c1cccc(c1N)OCF 7a_100015205654_100015361967 [2,1,0,0,0,0|1,0,0]=4 2527 B14R1.473 COC(=O)c1cccc(c1O)SCF 62a_100009816214_100015361967 [2,1,0,0,0,0|0,1,0]=4 2528 B14R1.473 COCc1cccc(c1Br)C(=O)OC 34a_100138415774_100010235804 [2,1,0,0,0,0|1,0,0]=4 2529 B14R1.473 COCc1cccc(c1F)C(=O)OC 34a_100138415774_200013328352 [2,1,0,0,0,0|1,0,0]=4 2530 B14R1.618 CCCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210303 [2,1,0,0,0,0|1,0,0]=4 2531 B14R1.618 CCNC(=O)c1cccc(c1O)OC 240690a_100015525214_100000212136 [2,1,0,0,0,0|1,0,0]=4 2532 B14R1.618 CCNC(=O)c1cccc(c1O)OC 527a_100015525214_100000212136 [2,1,0,0,0,0|1,0,0]=4 2533 B14R1.618 CCOC(=O)c1cccc(c1C)OC 7a_100012185227_200000210301 [2,1,0,0,0,0|1,0,0]=4 2534 B14R1.618 CCOC(=O)c1cccc(c1C)O[13CH3] 7a_100012185227_200025704644 [2,1,0,0,0,0|1,0,0]=4 2535 B14R1.618 CCOC(=O)c1cccc(c1N)OC 7a_100012001980_200000210301 [2,1,0,0,0,0|1,0,0]=4 2536 B14R1.618 CCOC(=O)c1cccc(c1N)O[13CH3] 7a_100012001980_200025704644 [2,1,0,0,0,0|1,0,0]=4 2537 B14R1.618 CNNC(=O)c1cccc(c1O)OC 22a_100016993582_100000212136 [2,1,0,0,0,0|1,0,0]=4 2538 B14R1.618 COc1cccc(c1O)C(=O)CCF 1458a_100000212136_100011217306 [2,1,0,0,0,0|1,0,0]=4 2539 B14R1.618 COc1cccc(c1O)C(=O)CCO 1458a_100000212136_100000211926 [2,1,0,0,0,0|1,0,0]=4 2540 B14R1.736 C=C(C)c1cccc(c1O)C(=O)OC 271570a_100000694244_100009816214 [2,1,0,0,0,0|1,0,0]=4 2541 B14R1.1728 COc1cccc(c1O)C(=O)C(C)C 1458a_100000212136_100000210206 [2,1,0,0,0,0|1,0,0]=4 2542 B14R1.1728 COc1cccc(c1O)C(=O)N(C)C 240690a_100102631434_100000212136 [2,1,0,0,0,0|1,0,0]=4 2543 B14R1.1728 COc1cccc(c1O)C(=O)N(C)C 527a_100102631434_100000212136 [2,1,0,0,0,0|1,0,0]=4 2544 B14R1.2171 C=Cc1c(cccc1C(=O)OC)OC 271570a_100011290941_100010189551 [2,1,0,0,0,0|1,0,0]=4 2545 B14R1.2171 CCC(=O)c1cccc(c1OC)OC 1458a_100000210806_100000210202 [2,1,0,0,0,0|1,0,0]=4 2546 B14R1.2171 CCc1c(cccc1C(=O)OC)OC 34a_200010668476_200000210301 [2,1,0,0,0,0|1,0,0]=4 2547 B14R1.2171 CCc1c(cccc1C(=O)OC)OC 7a_200010668476_200000210301 [2,1,0,0,0,0|1,0,0]=4 2548 B14R1.2171 CCc1c(cccc1C(=O)OC)O[13CH3] 34a_200010668476_200025704644 [2,1,0,0,0,0|1,0,0]=4 2549 B14R1.2171 CCc1c(cccc1C(=O)OC)O[13CH3] 7a_200010668476_200025704644 [2,1,0,0,0,0|1,0,0]=4 2550 B14R1.2171 CNC(=O)c1cccc(c1OC)OC 11a_106832991635_100000210806 [2,1,0,0,0,0|1,0,0]=4 2551 B14R1.2171 CNC(=O)c1cccc(c1OC)OC 1626a_100102657272_100000210806 [2,1,0,0,0,0|1,0,0]=4 2552 B14R1.2171 CNC(=O)c1cccc(c1OC)OC 240690a_100102657272_100000210806 [2,1,0,0,0,0|1,0,0]=4 2553 B14R1.2171 CNC(=O)c1cccc(c1OC)OC 527a_100102657272_100000210806 [2,1,0,0,0,0|1,0,0]=4 2554 B14R1.2171 COC(=O)c1cccc(c1OC)SC 62a_100010233336_200000210301 [2,1,0,0,0,0|0,1,0]=4 2555 B14R1.2171 COC(=O)c1cccc(c1OC)S[13CH3] 62a_100010233336_200025704644 [2,1,0,0,0,0|0,1,0]=4 2556 B14R1.2171 COC(=O)c1cccc(c1SC)OC 62a_100010189551_200000210301 [2,1,0,0,0,0|0,1,0]=4 2557 B14R1.2171 COC(=O)c1cccc(c1SC)OC 62a_200000210301_100010189551 [2,1,0,0,0,0|0,1,0]=4 2558 B14R1.2171 COC(=O)c1cccc(c1S[13CH3])OC 62a_100010189551_200025704644 [2,1,0,0,0,0|0,1,0]=4 2559 B14R1.2171 COC(=O)c1cccc(c1S[13CH3])OC 62a_200025704644_100010189551 [2,1,0,0,0,0|0,1,0]=4 2560 B14R1.2341 COC(=O)c1c(ccc(c1C)OC)Br 34a_100010074912_200000210301 [2,1,0,0,0,0|1,0,0]=4 2561 B14R1.2341 COC(=O)c1c(ccc(c1C)OC)Br 7a_100010074912_200000210301 [2,1,0,0,0,0|1,0,0]=4 2562 B14R1.2341 COC(=O)c1c(ccc(c1C)OC)O 271570a_203496583355_100010074911 [2,1,0,0,0,0|1,0,0]=4 2563 B14R1.2341 COC(=O)c1c(ccc(c1C)O[13CH3])Br 34a_100010074912_200025704644 [2,1,0,0,0,0|1,0,0]=4 2564 B14R1.2341 COC(=O)c1c(ccc(c1C)O[13CH3])Br 7a_100010074912_200025704644 [2,1,0,0,0,0|1,0,0]=4 2565 B14R1.2341 COC(=O)c1c(ccc(c1F)OC)O 271570a_203496583355_100010269058 [2,1,0,0,0,0|1,0,0]=4 2566 B16R1.2195 COCC(=O)Nc1ccc(c(c1C)C)OC 11a_100025755787_100000210968 [1,1,0,0,0,1|1,0,0]=4 2567 B16R1.2195 COCC(=O)Nc1ccc(c(c1C)C)OC 1626a_100025755787_100000210968 [1,1,0,0,0,1|1,0,0]=4 2568 B16R1.2195 COCC(=O)Nc1ccc(c(c1C)C)OC 22a_100025755787_100000210968 [1,1,0,0,0,1|1,0,0]=4 2569 B16R1.2195 COCC(=O)Nc1ccc(c(c1C)C)OC 527a_100025755787_100000210968 [1,1,0,0,0,1|1,0,0]=4 2570 B16R1.413 COc1cc(cc(c1OC)Cl)C(=O)C(C)C 1458a_100000180162_100000210206 [1,2,0,0,0,0|1,0,0]=4 2571 B16R1.413 COc1cc(cc(c1OC)Cl)C(=O)N(C)C 11a_100102631434_100000180162 [1,2,0,0,0,0|1,0,0]=4 2572 B16R1.413 COc1cc(cc(c1OC)Cl)C(=O)N(C)C 1626a_100102631434_100000180162 [1,2,0,0,0,0|1,0,0]=4 2573 B16R1.413 COc1cc(cc(c1OC)Cl)C(=O)N(C)C 240690a_100102631434_100000180162 [1,2,0,0,0,0|1,0,0]=4 2574 B16R1.413 COc1cc(cc(c1OC)Cl)C(=O)N(C)C 527a_100102631434_100000180162 [1,2,0,0,0,0|1,0,0]=4 2575 B16R1.413 COc1cc(cc(c1OC)O)C(=O)C(C)C 1458a_100000032013_100000210206 [1,2,0,0,0,0|1,0,0]=4 2576 B16R1.413 COc1cc(cc(c1OC)O)C(=O)N(C)C 240690a_100102631434_100000032013 [1,2,0,0,0,0|1,0,0]=4 2577 B16R1.413 COc1cc(cc(c1OC)O)C(=O)N(C)C 527a_100102631434_100000032013 [1,2,0,0,0,0|1,0,0]=4 2578 B16R1.4015 CCOc1cc(cc(c1OC)F)C(=O)OC 34a_200010080224_100000210202 [1,2,0,0,0,0|0,0,0]=3 2579 B16R1.4015 CCOc1cc(cc(c1OC)F)C(=O)OC 7a_200010080224_100000210202 [1,2,0,0,0,0|0,0,0]=3 2580 B16R1.4015 CNCc1cc(cc(c1OC)F)C(=O)OC 26a_100102657272_200010080224 [1,2,0,0,0,0|1,0,0]=4 2581 B16R1.4015 COC(=O)c1cc(c(c(c1)OCF)OC)F 34a_200010080224_100015361967 [1,2,0,0,0,0|0,0,0]=3 2582 B16R1.4015 COC(=O)c1cc(c(c(c1)OCF)OC)F 7a_200010080224_100015361967 [1,2,0,0,0,0|0,0,0]=3 2583 B16R1.11459 C=Cc1cc(cc(c1OC)OC)C(=O)OC 271570a_100011290941_100000727075 [1,2,0,0,0,0|0,0,0]=3 2584 B16R1.11459 CCC(=O)c1cc(c(c(c1)OC)OC)OC 1458a_100000210649_100000210202 [1,2,0,0,0,0|1,0,0]=4 2585 B16R1.11459 CNC(=O)c1cc(c(c(c1)OC)OC)OC 11a_106832991635_100000210649 [1,2,0,0,0,0|1,0,0]=4 2586 B16R1.11459 CNC(=O)c1cc(c(c(c1)OC)OC)OC 1626a_100102657272_100000210649 [1,2,0,0,0,0|1,0,0]=4 2587 B16R1.11459 CNC(=O)c1cc(c(c(c1)OC)OC)OC 240690a_100102657272_100000210649 [1,2,0,0,0,0|1,0,0]=4 2588 B16R1.11459 CNC(=O)c1cc(c(c(c1)OC)OC)OC 527a_100102657272_100000210649 [1,2,0,0,0,0|1,0,0]=4 2589 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)OC)OC 34a_100000034562_200000210301 [1,2,0,0,0,0|0,0,0]=3 2590 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)OC)OC 34a_200000066220_200000210301 [1,2,0,0,0,0|0,0,0]=3 2591 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)OC)OC 7a_100000034562_200000210301 [1,2,0,0,0,0|0,0,0]=3 2592 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)OC)OC 7a_200000066220_200000210301 [1,2,0,0,0,0|0,0,0]=3 2593 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)O[13CH3])OC 34a_100000034562_200025704644 [1,2,0,0,0,0|0,0,0]=3 2594 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)O[13CH3])OC 7a_100000034562_200025704644 [1,2,0,0,0,0|0,0,0]=3 2595 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)SC)OC 62a_100000216665_200000210301 [1,2,0,0,0,0|0,1,0]=4 2596 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)SC)OC 62a_200000210301_100000216665 [1,2,0,0,0,0|0,1,0]=4 2597 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)S[13CH3])OC 62a_100000216665_200025704644 [1,2,0,0,0,0|0,1,0]=4 2598 B16R1.11459 COC(=O)c1cc(c(c(c1)OC)S[13CH3])OC 62a_200025704644_100000216665 [1,2,0,0,0,0|0,1,0]=4 2599 B16R1.11459 COC(=O)c1cc(c(c(c1)O[13CH3])OC)OC 34a_200000066220_200025704644 [1,2,0,0,0,0|0,0,0]=3 2600 B16R1.11459 COC(=O)c1cc(c(c(c1)O[13CH3])OC)OC 7a_200000066220_200025704644 [1,2,0,0,0,0|0,0,0]=3 2601 B16R1.11459 COC(=O)c1cc(c(c(c1)SC)OC)OC 62a_100000727075_200000210301 [1,2,0,0,0,0|0,0,0]=3 2602 B16R1.11459 COC(=O)c1cc(c(c(c1)SC)OC)OC 62a_200000210301_100000727075 [1,2,0,0,0,0|0,0,0]=3 2603 B16R1.11459 COC(=O)c1cc(c(c(c1)S[13CH3])OC)OC 62a_100000727075_200025704644 [1,2,0,0,0,0|0,0,0]=3 2604 B16R1.11459 COC(=O)c1cc(c(c(c1)S[13CH3])OC)OC 62a_200025704644_100000727075 [1,2,0,0,0,0|0,0,0]=3 2605 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)CC)Br 1458a_200000183745_100000210202 [1,2,0,0,0,0|1,0,0]=4 2606 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)NC)Br 11a_106832991635_200000183745 [1,2,0,0,0,0|1,0,0]=4 2607 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)NC)Br 1626a_100102657272_200000183745 [1,2,0,0,0,0|1,0,0]=4 2608 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)NC)Br 240690a_100102657272_200000183745 [1,2,0,0,0,0|1,0,0]=4 2609 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)NC)Br 527a_100102657272_200000183745 [1,2,0,0,0,0|1,0,0]=4 2610 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)OC)Br 34a_200009811556_100000210202 [1,2,0,0,0,0|0,0,0]=3 2611 B16R1.47450 CCOc1c(cc(cc1OC)C(=O)OC)Br 7a_200009811556_100000210202 [1,2,0,0,0,0|0,0,0]=3 2612 B16R1.47450 CNCc1c(cc(cc1OC)C(=O)OC)Br 26a_100102657272_200009811556 [1,2,0,0,0,0|1,0,0]=4 2613 B16R1.47450 COC(=O)c1cc(c(c(c1)OC)OCF)Br 34a_200009811556_100015361967 [1,2,0,0,0,0|0,0,0]=3 2614 B16R1.47450 COC(=O)c1cc(c(c(c1)OC)OCF)Br 7a_200009811556_100015361967 [1,2,0,0,0,0|0,0,0]=3 2615 B16R1.64536 CCCC(=O)c1cc(c(c(c1)OC)OC)Cl 1458a_100000180162_100000210303 [1,2,0,0,0,0|1,0,0]=4 2616 B16R1.64536 CCCC(=O)c1cc(c(c(c1)OC)OC)O 1458a_100000032013_100000210303 [1,2,0,0,0,0|1,0,0]=4 2617 B16R1.64536 CCNC(=O)c1cc(c(c(c1)OC)OC)Cl 11a_100015525214_100000180162 [1,2,0,0,0,0|1,0,0]=4 2618 B16R1.64536 CCNC(=O)c1cc(c(c(c1)OC)OC)Cl 240690a_100015525214_100000180162 [1,2,0,0,0,0|1,0,0]=4 2619 B16R1.64536 CCNC(=O)c1cc(c(c(c1)OC)OC)Cl 527a_100015525214_100000180162 [1,2,0,0,0,0|1,0,0]=4 2620 B16R1.64536 CCNC(=O)c1cc(c(c(c1)OC)OC)O 240690a_100015525214_100000032013 [1,2,0,0,0,0|1,0,0]=4 2621 B16R1.64536 CCNC(=O)c1cc(c(c(c1)OC)OC)O 527a_100015525214_100000032013 [1,2,0,0,0,0|1,0,0]=4 2622 B16R1.64536 CNNC(=O)c1cc(c(c(c1)OC)OC)Cl 22a_100016993582_100000180162 [1,2,0,0,0,0|1,0,0]=4 2623 B16R1.64536 CNNC(=O)c1cc(c(c(c1)OC)OC)O 22a_100016993582_100000032013 [1,2,0,0,0,0|1,0,0]=4 2624 B16R1.64536 COc1cc(cc(c1OC)Cl)C(=O)CCF 1458a_100000180162_100011217306 [1,2,0,0,0,0|1,0,0]=4 2625 B16R1.64536 COc1cc(cc(c1OC)Cl)C(=O)CCO 1458a_100000180162_100000211926 [1,2,0,0,0,0|1,0,0]=4 2626 B16R1.64536 COc1cc(cc(c1OC)O)C(=O)CCF 1458a_100000032013_100011217306 [1,2,0,0,0,0|1,0,0]=4 2627 B16R1.64536 COc1cc(cc(c1OC)O)C(=O)CCO 1458a_100000032013_100000211926 [1,2,0,0,0,0|1,0,0]=4 2628 B16R1.969 C=C(C)c1ccc(cc1OC)C(=O)OCC 271570a_100000694244_100010189661 [1,2,0,0,0,0|1,0,0]=4 2629 B16R1.1504 C#CCCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000753159 [1,2,0,0,0,0|1,0,0]=4 2630 B16R1.1504 C#CCNC(=O)c1ccc(c(c1)OC)OC 11a_100000212058_100000211223 [1,2,0,0,0,0|1,0,0]=4 2631 B16R1.1504 C#CCNC(=O)c1ccc(c(c1)OC)OC 1626a_100000212058_100000211223 [1,2,0,0,0,0|1,0,0]=4 2632 B16R1.1504 C#CCNC(=O)c1ccc(c(c1)OC)OC 240690a_100000212058_100000211223 [1,2,0,0,0,0|1,0,0]=4 2633 B16R1.1504 C#CCNC(=O)c1ccc(c(c1)OC)OC 527a_100000212058_100000211223 [1,2,0,0,0,0|1,0,0]=4 2634 B16R1.1504 C/C=C/CC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100102629194 [1,2,0,0,0,0|1,0,0]=4 2635 B16R1.1504 C=CCCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000754431 [1,2,0,0,0,0|1,0,0]=4 2636 B16R1.1504 C=CCNC(=O)c1ccc(c(c1)OC)OC 1626a_100020586998_100000211223 [1,2,0,0,0,0|1,0,0]=4 2637 B16R1.1504 C=CCNC(=O)c1ccc(c(c1)OC)OC 240690a_100020586998_100000211223 [1,2,0,0,0,0|1,0,0]=4 2638 B16R1.1504 C=CCNC(=O)c1ccc(c(c1)OC)OC 527a_100020586998_100000211223 [1,2,0,0,0,0|1,0,0]=4 2639 B16R1.1504 CC#CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000748600 [1,2,0,0,0,0|1,0,0]=4 2640 B16R1.1504 CC=CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000070051 [1,2,0,0,0,0|1,0,0]=4 2641 B16R1.1504 CC=NNC(=O)c1ccc(c(c1)OC)OC 4a_100000183082_200000210099 [1,2,0,0,0,0|1,0,0]=4 2642 B16R1.1504 CCCCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000210211 [1,2,0,0,0,0|1,0,0]=4 2643 B16R1.1504 CCCNC(=O)c1ccc(c(c1)OC)OC 11a_100020643023_100000211223 [1,2,0,0,0,0|1,0,0]=4 2644 B16R1.1504 CCCNC(=O)c1ccc(c(c1)OC)OC 1626a_100020643023_100000211223 [1,2,0,0,0,0|1,0,0]=4 2645 B16R1.1504 CCCNC(=O)c1ccc(c(c1)OC)OC 240690a_100020643023_100000211223 [1,2,0,0,0,0|1,0,0]=4 2646 B16R1.1504 CCCNC(=O)c1ccc(c(c1)OC)OC 527a_100020643023_100000211223 [1,2,0,0,0,0|1,0,0]=4 2647 B16R1.1504 CCNCC(=O)c1ccc(c(c1)OC)OC 2230a_100015525214_100000184214 [1,2,0,0,0,0|1,0,0]=4 2648 B16R1.1504 CCNNC(=O)c1ccc(c(c1)OC)OC 22a_100000756455_100000211223 [1,2,0,0,0,0|1,0,0]=4 2649 B16R1.1504 CCSCC(=O)c1ccc(c(c1)OC)OC 62a_100000184214_100000210202 [1,2,0,0,0,0|0,1,0]=4 2650 B16R1.1504 CNCCC(=O)c1ccc(c(c1)OC)OC 2230a_106832991635_100012339670 [1,2,0,0,0,0|1,0,0]=4 2651 B16R1.1504 CNCCC(=O)c1ccc(c(c1)OC)OC 7a_106832991635_100012339670 [1,2,0,0,0,0|1,0,0]=4 2652 B16R1.1504 COCCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000233755 [1,2,0,0,0,0|0,0,0]=3 2653 B16R1.1504 COc1ccc(cc1OC)C(=O)CCC#N 1458a_100000211223_100011215226 [1,2,0,0,0,0|1,0,0]=4 2654 B16R1.1504 COc1ccc(cc1OC)C(=O)CCCF 1458a_100000211223_100011934791 [1,2,0,0,0,0|1,0,0]=4 2655 B16R1.1504 COc1ccc(cc1OC)C(=O)CCCO 1458a_100000211223_100011215043 [1,2,0,0,0,0|1,0,0]=4 2656 B16R1.1504 COc1ccc(cc1OC)C(=O)CCSC 1458a_100000211223_100000751147 [1,2,0,0,0,0|0,1,0]=4 2657 B16R1.1504 COc1ccc(cc1OC)C(=O)CCSC 62a_200000210301_100012339670 [1,2,0,0,0,0|0,1,0]=4 2658 B16R1.1504 COc1ccc(cc1OC)C(=O)CCS[13CH3] 62a_200025704644_100012339670 [1,2,0,0,0,0|0,1,0]=4 2659 B16R1.1504 COc1ccc(cc1OC)C(=O)CSCF 62a_100000184214_100015361967 [1,2,0,0,0,0|0,1,0]=4 2660 B16R1.1504 COc1ccc(cc1OC)C(=O)NCC#N 1626a_100000734998_100000211223 [1,2,0,0,0,0|1,0,0]=4 2661 B16R1.1504 COc1ccc(cc1OC)C(=O)NCC#N 527a_100000734998_100000211223 [1,2,0,0,0,0|1,0,0]=4 2662 B16R1.1504 COc1ccc(cc1OC)C(=O)NCCF 11a_100000724931_100000211223 [1,2,0,0,0,0|1,0,0]=4 2663 B16R1.1504 COc1ccc(cc1OC)C(=O)NCCF 1626a_100000724931_100000211223 [1,2,0,0,0,0|1,0,0]=4 2664 B16R1.1504 COc1ccc(cc1OC)C(=O)NCCF 240690a_100000724931_100000211223 [1,2,0,0,0,0|1,0,0]=4 2665 B16R1.1504 COc1ccc(cc1OC)C(=O)NCCF 527a_100000724931_100000211223 [1,2,0,0,0,0|1,0,0]=4 2666 B16R1.1504 COc1ccc(cc1OC)C(=O)NCCO 240690a_100000210304_100000211223 [1,2,0,0,0,0|1,0,0]=4 2667 B16R1.1504 COc1ccc(cc1OC)C(=O)NCCO 527a_100000210304_100000211223 [1,2,0,0,0,0|1,0,0]=4 2668 B16R1.4273 C=C(C)CC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000748629 [1,2,0,0,0,0|1,0,0]=4 2669 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)C 1458a_100000070787_100000184214 [1,2,0,0,0,0|1,0,0]=4 2670 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(C)C 1458a_100000211223_100000210624 [1,2,0,0,0,0|1,0,0]=4 2671 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(C)O 1458a_100000211223_100011218427 [1,2,0,0,0,0|1,0,0]=4 2672 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(F)F 1458a_100000211223_100011934356 [1,2,0,0,0,0|1,0,0]=4 2673 B16R1.4273 COc1ccc(cc1OC)C(=O)CN(C)C 2230a_100102631434_100000184214 [1,2,0,0,0,0|1,0,0]=4 2674 B16R1.4273 COc1ccc(cc1OC)C(=O)CN(C)C 269982a_100102631434_100000184214 [1,2,0,0,0,0|1,0,0]=4 2675 B16R1.4273 COc1ccc(cc1OC)C(=O)NC(C)C 11a_100138425928_100000211223 [1,2,0,0,0,0|1,0,0]=4 2676 B16R1.4273 COc1ccc(cc1OC)C(=O)NC(C)C 1626a_100138425928_100000211223 [1,2,0,0,0,0|1,0,0]=4 2677 B16R1.4273 COc1ccc(cc1OC)C(=O)NC(C)C 240690a_100138425928_100000211223 [1,2,0,0,0,0|1,0,0]=4 2678 B16R1.4273 COc1ccc(cc1OC)C(=O)NC(C)C 527a_100138425928_100000211223 [1,2,0,0,0,0|1,0,0]=4 2679 B16R1.4273 COc1ccc(cc1SC)C(=O)OC(C)C 62a_200000210301_200000240844 [1,2,0,0,0,0|0,1,0]=4 2680 B16R1.4273 COc1ccc(cc1SC)C(=O)OC(C)C 62a_200000240844_200000210301 [1,2,0,0,0,0|0,1,0]=4 2681 B16R1.4273 COc1ccc(cc1S[13CH3])C(=O)OC(C)C 62a_200000240844_200025704644 [1,2,0,0,0,0|0,1,0]=4 2682 B16R1.4273 COc1ccc(cc1S[13CH3])C(=O)OC(C)C 62a_200025704644_200000240844 [1,2,0,0,0,0|0,1,0]=4 2683 B16R1.4278 C#CC(C)C(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_200000035995 [1,2,0,0,0,0|1,0,0]=4 2684 B16R1.4278 CCC(C)C(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000758301 [1,2,0,0,0,0|1,0,0]=4 2685 B16R1.4278 CCN(C)C(=O)c1ccc(c(c1)OC)OC 11a_100000225621_100000211223 [1,2,0,0,0,0|1,0,0]=4 2686 B16R1.4278 CCN(C)C(=O)c1ccc(c(c1)OC)OC 1626a_100000225621_100000211223 [1,2,0,0,0,0|1,0,0]=4 2687 B16R1.4278 CCN(C)C(=O)c1ccc(c(c1)OC)OC 240690a_100000225621_100000211223 [1,2,0,0,0,0|1,0,0]=4 2688 B16R1.4278 CCN(C)C(=O)c1ccc(c(c1)OC)OC 527a_100000225621_100000211223 [1,2,0,0,0,0|1,0,0]=4 2689 B16R1.4278 COc1ccc(cc1OC)C(=O)C(C)C#N 1458a_100000211223_100000703298 [1,2,0,0,0,0|1,0,0]=4 2690 B16R1.7130 CC=Cc1ccc(cc1OC)C(=O)OCC 271570a_100016259895_100010189661 [1,2,0,0,0,0|1,0,0]=4 2691 B16R1.7130 CCCC(=O)c1ccc(c(c1)OC)OCC 1458a_100000184834_100000210303 [1,2,0,0,0,0|1,0,0]=4 2692 B16R1.7130 CCCC(=O)c1ccc(c(c1)OC)OCC 34a_200010659475_100000210202 [1,2,0,0,0,0|1,0,0]=4 2693 B16R1.7130 CCCC(=O)c1ccc(c(c1)OC)OCC 7a_200010659475_100000210202 [1,2,0,0,0,0|1,0,0]=4 2694 B16R1.7130 CCCC(=O)c1ccc(c(c1)OC)OCF 34a_200010659475_100015361967 [1,2,0,0,0,0|1,0,0]=4 2695 B16R1.7130 CCCC(=O)c1ccc(c(c1)OC)OCF 7a_200010659475_100015361967 [1,2,0,0,0,0|1,0,0]=4 2696 B16R1.7130 CCNC(=O)c1ccc(c(c1)OC)OCC 11a_100015525214_100000184834 [1,2,0,0,0,0|1,0,0]=4 2697 B16R1.7130 CCNC(=O)c1ccc(c(c1)OC)OCC 240690a_100015525214_100000184834 [1,2,0,0,0,0|1,0,0]=4 2698 B16R1.7130 CCNC(=O)c1ccc(c(c1)OC)OCC 527a_100015525214_100000184834 [1,2,0,0,0,0|1,0,0]=4 2699 B16R1.7130 CCOC(=O)c1ccc(c(c1)OC)OCC 7a_100000038551_100000210202 [1,2,0,0,0,0|0,0,0]=3 2700 B16R1.7130 CCOC(=O)c1ccc(c(c1)OC)OCF 7a_100000038551_100015361967 [1,2,0,0,0,0|0,0,0]=3 2701 B16R1.7130 CCOC(=O)c1ccc(c(c1)OC)SCC 62a_100000210202_100010189661 [1,2,0,0,0,0|0,1,0]=4 2702 B16R1.7130 CCOC(=O)c1ccc(c(c1)OC)SCC 62a_100010189661_100000210202 [1,2,0,0,0,0|0,1,0]=4 2703 B16R1.7130 CCOC(=O)c1ccc(c(c1)OC)SCF 62a_100010189661_100015361967 [1,2,0,0,0,0|0,1,0]=4 2704 B16R1.7130 CCOC(=O)c1ccc(c(c1)OC)SCF 62a_100015361967_100010189661 [1,2,0,0,0,0|0,1,0]=4 2705 B16R1.7130 CCOc1ccc(cc1OC)C(=O)CCF 1458a_100000184834_100011217306 [1,2,0,0,0,0|1,0,0]=4 2706 B16R1.7130 CCOc1ccc(cc1OC)C(=O)CCO 1458a_100000184834_100000211926 [1,2,0,0,0,0|1,0,0]=4 2707 B16R1.7130 CCOc1ccc(cc1OC)C(=O)NNC 22a_100016993582_100000184834 [1,2,0,0,0,0|1,0,0]=4 2708 B16R1.12747 CC=Cc1cc(ccc1OC)C(=O)OCC 271570a_100016259895_100012360133 [1,2,0,0,0,0|1,0,0]=4 2709 B16R1.12747 CCCC(=O)c1ccc(c(c1)OCC)OC 1458a_100000181421_100000210303 [1,2,0,0,0,0|1,0,0]=4 2710 B16R1.12747 CCNC(=O)c1ccc(c(c1)OCC)OC 11a_100015525214_100000181421 [1,2,0,0,0,0|1,0,0]=4 2711 B16R1.12747 CCNC(=O)c1ccc(c(c1)OCC)OC 240690a_100015525214_100000181421 [1,2,0,0,0,0|1,0,0]=4 2712 B16R1.12747 CCNC(=O)c1ccc(c(c1)OCC)OC 527a_100015525214_100000181421 [1,2,0,0,0,0|1,0,0]=4 2713 B16R1.12747 CCOC(=O)c1ccc(c(c1)SCC)OC 62a_100000210202_100012360133 [1,2,0,0,0,0|0,1,0]=4 2714 B16R1.12747 CCOC(=O)c1ccc(c(c1)SCC)OC 62a_100012360133_100000210202 [1,2,0,0,0,0|0,1,0]=4 2715 B16R1.12747 CCOC(=O)c1ccc(c(c1)SCF)OC 62a_100012360133_100015361967 [1,2,0,0,0,0|0,1,0]=4 2716 B16R1.12747 CCOC(=O)c1ccc(c(c1)SCF)OC 62a_100015361967_100012360133 [1,2,0,0,0,0|0,1,0]=4 2717 B16R1.12747 CCOc1cc(ccc1OC)C(=O)CCF 1458a_100000181421_100011217306 [1,2,0,0,0,0|1,0,0]=4 2718 B16R1.12747 CCOc1cc(ccc1OC)C(=O)CCO 1458a_100000181421_100000211926 [1,2,0,0,0,0|1,0,0]=4 2719 B16R1.12747 CCOc1cc(ccc1OC)C(=O)NNC 22a_100016993582_100000181421 [1,2,0,0,0,0|1,0,0]=4 2720 B16R1.15503 C=C(C)c1cc(ccc1OC)C(=O)OCC 271570a_100000694244_100012360133 [1,2,0,0,0,0|1,0,0]=4 2721 B16R1.70643 CCCC(=O)c1cc(c(cc1Br)OC)OC 1458a_100011217046_100000210303 [1,2,0,0,0,0|1,0,0]=4 2722 B16R1.70643 CCCC(=O)c1cc(c(cc1C)OC)OC 1458a_100000765401_100000210303 [1,2,0,0,0,0|1,0,0]=4 2723 B16R1.70643 CCCC(=O)c1cc(c(cc1Cl)OC)OC 1458a_100000692841_100000210303 [1,2,0,0,0,0|1,0,0]=4 2724 B16R1.70643 CCCC(=O)c1cc(c(cc1F)OC)OC 1458a_100000687845_100000210303 [1,2,0,0,0,0|1,0,0]=4 2725 B16R1.70643 CCCC(=O)c1cc(c(cc1I)OC)OC 1458a_100000749224_100000210303 [1,2,0,0,0,0|1,0,0]=4 2726 B16R1.70643 CCCC(=O)c1cc(c(cc1O)OC)OC 1458a_100012177203_100000210303 [1,2,0,0,0,0|1,0,0]=4 2727 B16R1.70643 CCNC(=O)c1cc(c(cc1Br)OC)OC 11a_100015525214_100011217046 [1,2,0,0,0,0|1,0,0]=4 2728 B16R1.70643 CCNC(=O)c1cc(c(cc1Br)OC)OC 240690a_100015525214_100011217046 [1,2,0,0,0,0|1,0,0]=4 2729 B16R1.70643 CCNC(=O)c1cc(c(cc1Br)OC)OC 527a_100015525214_100011217046 [1,2,0,0,0,0|1,0,0]=4 2730 B16R1.70643 CCNC(=O)c1cc(c(cc1C)OC)OC 11a_100015525214_100000765401 [1,2,0,0,0,0|1,0,0]=4 2731 B16R1.70643 CCNC(=O)c1cc(c(cc1C)OC)OC 240690a_100015525214_100000765401 [1,2,0,0,0,0|1,0,0]=4 2732 B16R1.70643 CCNC(=O)c1cc(c(cc1C)OC)OC 527a_100015525214_100000765401 [1,2,0,0,0,0|1,0,0]=4 2733 B16R1.70643 CCNC(=O)c1cc(c(cc1Cl)OC)OC 11a_100015525214_100000692841 [1,2,0,0,0,0|1,0,0]=4 2734 B16R1.70643 CCNC(=O)c1cc(c(cc1Cl)OC)OC 240690a_100015525214_100000692841 [1,2,0,0,0,0|1,0,0]=4 2735 B16R1.70643 CCNC(=O)c1cc(c(cc1Cl)OC)OC 527a_100015525214_100000692841 [1,2,0,0,0,0|1,0,0]=4 2736 B16R1.70643 CCNC(=O)c1cc(c(cc1F)OC)OC 11a_100015525214_100000687845 [1,2,0,0,0,0|1,0,0]=4 2737 B16R1.70643 CCNC(=O)c1cc(c(cc1F)OC)OC 240690a_100015525214_100000687845 [1,2,0,0,0,0|1,0,0]=4 2738 B16R1.70643 CCNC(=O)c1cc(c(cc1F)OC)OC 527a_100015525214_100000687845 [1,2,0,0,0,0|1,0,0]=4 2739 B16R1.70643 CCNC(=O)c1cc(c(cc1I)OC)OC 11a_100015525214_100000749224 [1,2,0,0,0,0|1,0,0]=4 2740 B16R1.70643 CCNC(=O)c1cc(c(cc1I)OC)OC 240690a_100015525214_100000749224 [1,2,0,0,0,0|1,0,0]=4 2741 B16R1.70643 CCNC(=O)c1cc(c(cc1I)OC)OC 527a_100015525214_100000749224 [1,2,0,0,0,0|1,0,0]=4 2742 B16R1.70643 CCNC(=O)c1cc(c(cc1O)OC)OC 240690a_100015525214_100012177203 [1,2,0,0,0,0|1,0,0]=4 2743 B16R1.70643 CNNC(=O)c1cc(c(cc1Br)OC)OC 22a_100016993582_100011217046 [1,2,0,0,0,0|1,0,0]=4 2744 B16R1.70643 CNNC(=O)c1cc(c(cc1C)OC)OC 22a_100016993582_100000765401 [1,2,0,0,0,0|1,0,0]=4 2745 B16R1.70643 CNNC(=O)c1cc(c(cc1Cl)OC)OC 22a_100016993582_100000692841 [1,2,0,0,0,0|1,0,0]=4 2746 B16R1.70643 CNNC(=O)c1cc(c(cc1F)OC)OC 22a_100016993582_100000687845 [1,2,0,0,0,0|1,0,0]=4 2747 B16R1.70643 CNNC(=O)c1cc(c(cc1I)OC)OC 22a_100016993582_100000749224 [1,2,0,0,0,0|1,0,0]=4 2748 B16R1.70643 CNNC(=O)c1cc(c(cc1O)OC)OC 22a_100016993582_100012177203 [1,2,0,0,0,0|1,0,0]=4 2749 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCF)Br 1458a_100011217046_100011217306 [1,2,0,0,0,0|1,0,0]=4 2750 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCF)C 1458a_100000765401_100011217306 [1,2,0,0,0,0|1,0,0]=4 2751 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCF)Cl 1458a_100000692841_100011217306 [1,2,0,0,0,0|1,0,0]=4 2752 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCF)F 1458a_100000687845_100011217306 [1,2,0,0,0,0|1,0,0]=4 2753 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCF)I 1458a_100000749224_100011217306 [1,2,0,0,0,0|1,0,0]=4 2754 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCF)O 1458a_100012177203_100011217306 [1,2,0,0,0,0|1,0,0]=4 2755 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCO)Br 1458a_100011217046_100000211926 [1,2,0,0,0,0|1,0,0]=4 2756 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCO)C 1458a_100000765401_100000211926 [1,2,0,0,0,0|1,0,0]=4 2757 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCO)Cl 1458a_100000692841_100000211926 [1,2,0,0,0,0|1,0,0]=4 2758 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCO)F 1458a_100000687845_100000211926 [1,2,0,0,0,0|1,0,0]=4 2759 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCO)I 1458a_100000749224_100000211926 [1,2,0,0,0,0|1,0,0]=4 2760 B16R1.70643 COc1cc(c(cc1OC)C(=O)CCO)O 1458a_100012177203_100000211926 [1,2,0,0,0,0|1,0,0]=4 2761 B16R1.20068 C=C(C)c1cc(c(cc1OC)C)C(=O)OC 271570a_100000694244_100010236281 [1,2,0,0,0,0|1,0,0]=4 2762 B16R1.20068 C=C(C)c1cc(c(cc1OC)F)C(=O)OC 271570a_100000694244_100015648668 [1,2,0,0,0,0|1,0,0]=4 2763 B16R1.20068 C=C(C)c1cc(c(cc1OC)N)C(=O)OC 271570a_100000694244_100000730826 [1,2,0,0,0,0|1,0,0]=4 2764 B16R1.20068 C=C(C)c1cc(c(cc1OC)O)C(=O)OC 271570a_100000694244_200010007936 [1,2,0,0,0,0|1,0,0]=4 2765 B16R1.20089 C=C(C)c1cc(c(cc1OC)C(=O)OC)N 271570a_100000694244_100014686525 [1,2,0,0,0,0|1,0,0]=4 2766 B16R1.20099 C=Cc1cc(c(cc1C(=O)OC)OC)OC 271570a_100011290941_100000058957 [1,2,0,0,0,0|0,0,0]=3 2767 B16R1.20099 CCC(=O)c1cc(c(cc1OC)OC)OC 1458a_100000211247_100000210202 [1,2,0,0,0,0|1,0,0]=4 2768 B16R1.20099 CNC(=O)c1cc(c(cc1OC)OC)OC 11a_106832991635_100000211247 [1,2,0,0,0,0|1,0,0]=4 2769 B16R1.20099 CNC(=O)c1cc(c(cc1OC)OC)OC 1626a_100102657272_100000211247 [1,2,0,0,0,0|1,0,0]=4 2770 B16R1.20099 CNC(=O)c1cc(c(cc1OC)OC)OC 240690a_100102657272_100000211247 [1,2,0,0,0,0|1,0,0]=4 2771 B16R1.20099 CNC(=O)c1cc(c(cc1OC)OC)OC 527a_100102657272_100000211247 [1,2,0,0,0,0|1,0,0]=4 2772 B16R1.20099 COC(=O)c1cc(c(cc1OC)OC)SC 62a_100012350237_200000210301 [1,2,0,0,0,0|0,1,0]=4 2773 B16R1.20099 COC(=O)c1cc(c(cc1OC)OC)S[13CH3] 62a_100012350237_200025704644 [1,2,0,0,0,0|0,1,0]=4 2774 B16R1.20099 COC(=O)c1cc(c(cc1SC)OC)OC 62a_200009990419_200000210301 [1,2,0,0,0,0|0,0,0]=3 2775 B16R1.20099 COC(=O)c1cc(c(cc1S[13CH3])OC)OC 62a_200009990419_200025704644 [1,2,0,0,0,0|0,0,0]=3 2776 B16R1.20100 COc1cc(c(cc1OC)C(=O)C(C)C)Br 1458a_100011217046_100000210206 [1,2,0,0,0,0|1,0,0]=4 2777 B16R1.20100 COc1cc(c(cc1OC)C(=O)C(C)C)C 1458a_100000765401_100000210206 [1,2,0,0,0,0|1,0,0]=4 2778 B16R1.20100 COc1cc(c(cc1OC)C(=O)C(C)C)Cl 1458a_100000692841_100000210206 [1,2,0,0,0,0|1,0,0]=4 2779 B16R1.20100 COc1cc(c(cc1OC)C(=O)C(C)C)F 1458a_100000687845_100000210206 [1,2,0,0,0,0|1,0,0]=4 2780 B16R1.20100 COc1cc(c(cc1OC)C(=O)C(C)C)I 1458a_100000749224_100000210206 [1,2,0,0,0,0|1,0,0]=4 2781 B16R1.20100 COc1cc(c(cc1OC)C(=O)C(C)C)O 1458a_100012177203_100000210206 [1,2,0,0,0,0|1,0,0]=4 2782 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Br 11a_100102631434_100011217046 [1,2,0,0,0,0|1,0,0]=4 2783 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Br 1626a_100102631434_100011217046 [1,2,0,0,0,0|1,0,0]=4 2784 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Br 240690a_100102631434_100011217046 [1,2,0,0,0,0|1,0,0]=4 2785 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Br 527a_100102631434_100011217046 [1,2,0,0,0,0|1,0,0]=4 2786 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)C 11a_100102631434_100000765401 [1,2,0,0,0,0|1,0,0]=4 2787 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)C 1626a_100102631434_100000765401 [1,2,0,0,0,0|1,0,0]=4 2788 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)C 240690a_100102631434_100000765401 [1,2,0,0,0,0|1,0,0]=4 2789 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)C 527a_100102631434_100000765401 [1,2,0,0,0,0|1,0,0]=4 2790 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Cl 11a_100102631434_100000692841 [1,2,0,0,0,0|1,0,0]=4 2791 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Cl 1626a_100102631434_100000692841 [1,2,0,0,0,0|1,0,0]=4 2792 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Cl 240690a_100102631434_100000692841 [1,2,0,0,0,0|1,0,0]=4 2793 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)Cl 527a_100102631434_100000692841 [1,2,0,0,0,0|1,0,0]=4 2794 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)F 11a_100102631434_100000687845 [1,2,0,0,0,0|1,0,0]=4 2795 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)F 1626a_100102631434_100000687845 [1,2,0,0,0,0|1,0,0]=4 2796 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)F 240690a_100102631434_100000687845 [1,2,0,0,0,0|1,0,0]=4 2797 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)F 527a_100102631434_100000687845 [1,2,0,0,0,0|1,0,0]=4 2798 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)I 11a_100102631434_100000749224 [1,2,0,0,0,0|1,0,0]=4 2799 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)I 1626a_100102631434_100000749224 [1,2,0,0,0,0|1,0,0]=4 2800 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)I 240690a_100102631434_100000749224 [1,2,0,0,0,0|1,0,0]=4 2801 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)I 527a_100102631434_100000749224 [1,2,0,0,0,0|1,0,0]=4 2802 B16R1.20100 COc1cc(c(cc1OC)C(=O)N(C)C)O 240690a_100102631434_100012177203 [1,2,0,0,0,0|1,0,0]=4 2803 B16R1.25765 CC=Cc1cc(c(cc1OC)C(=O)OC)N 271570a_100016259895_100014686525 [1,2,0,0,0,0|1,0,0]=4 2804 B16R1.25765 CCSc1cc(c(cc1OC)C(=O)OC)N 62a_100014686525_100000210202 [1,2,0,0,0,0|0,1,0]=4 2805 B16R1.25765 COC(=O)c1cc(c(cc1N)SCF)OC 62a_100014686525_100015361967 [1,2,0,0,0,0|0,1,0]=4 2806 B16R1.49263 CC=Cc1cc(c(cc1OC)C)C(=O)OC 271570a_100016259895_100010236281 [1,2,0,0,0,0|1,0,0]=4 2807 B16R1.49263 CC=Cc1cc(c(cc1OC)F)C(=O)OC 271570a_100016259895_100015648668 [1,2,0,0,0,0|1,0,0]=4 2808 B16R1.49263 CC=Cc1cc(c(cc1OC)N)C(=O)OC 271570a_100016259895_100000730826 [1,2,0,0,0,0|1,0,0]=4 2809 B16R1.49263 CC=Cc1cc(c(cc1OC)O)C(=O)OC 271570a_100016259895_200010007936 [1,2,0,0,0,0|1,0,0]=4 2810 B16R1.49263 CCOc1cc(c(cc1OC)N)C(=O)OC 34a_100009867527_100000210202 [1,2,0,0,0,0|0,0,0]=3 2811 B16R1.49263 CCOc1cc(c(cc1OC)N)C(=O)OC 7a_100009867527_100000210202 [1,2,0,0,0,0|0,0,0]=3 2812 B16R1.49263 CCSc1cc(c(cc1OC)C)C(=O)OC 62a_100000210202_100010236281 [1,2,0,0,0,0|0,1,0]=4 2813 B16R1.49263 CCSc1cc(c(cc1OC)C)C(=O)OC 62a_100010236281_100000210202 [1,2,0,0,0,0|0,1,0]=4 2814 B16R1.49263 CCSc1cc(c(cc1OC)F)C(=O)OC 62a_100000210202_100015648668 [1,2,0,0,0,0|0,1,0]=4 2815 B16R1.49263 CCSc1cc(c(cc1OC)F)C(=O)OC 62a_100015648668_100000210202 [1,2,0,0,0,0|0,1,0]=4 2816 B16R1.49263 CCSc1cc(c(cc1OC)N)C(=O)OC 62a_100000730826_100000210202 [1,2,0,0,0,0|0,1,0]=4 2817 B16R1.49263 COC(=O)c1cc(c(cc1C)OC)SCF 62a_100010236281_100015361967 [1,2,0,0,0,0|0,1,0]=4 2818 B16R1.49263 COC(=O)c1cc(c(cc1C)OC)SCF 62a_100015361967_100010236281 [1,2,0,0,0,0|0,1,0]=4 2819 B16R1.49263 COC(=O)c1cc(c(cc1F)OC)SCF 62a_100015361967_100015648668 [1,2,0,0,0,0|0,1,0]=4 2820 B16R1.49263 COC(=O)c1cc(c(cc1F)OC)SCF 62a_100015648668_100015361967 [1,2,0,0,0,0|0,1,0]=4 2821 B16R1.49263 COC(=O)c1cc(c(cc1N)OC)OCF 34a_100009867527_100015361967 [1,2,0,0,0,0|0,0,0]=3 2822 B16R1.49263 COC(=O)c1cc(c(cc1N)OC)OCF 7a_100009867527_100015361967 [1,2,0,0,0,0|0,0,0]=3 2823 B16R1.49263 COC(=O)c1cc(c(cc1N)OC)SCF 62a_100000730826_100015361967 [1,2,0,0,0,0|0,1,0]=4 2824 B16R1.4360 COC(=O)c1ccc(c(c1)C(=O)OC)OC 34a_100000010551_200000210301 [1,2,0,0,0,0|0,0,0]=3 2825 B16R1.4360 COC(=O)c1ccc(c(c1)C(=O)OC)OC 7a_100000010551_200000210301 [1,2,0,0,0,0|0,0,0]=3 2826 B16R1.4360 COC(=O)c1ccc(c(c1)C(=O)OC)O[13CH3] 34a_100000010551_200025704644 [1,2,0,0,0,0|0,0,0]=3 2827 B16R1.4360 COC(=O)c1ccc(c(c1)C(=O)OC)O[13CH3] 7a_100000010551_200025704644 [1,2,0,0,0,0|0,0,0]=3 2828 B16R1.4360 COC(=O)c1ccc(c(c1)C(=O)OC)SC 62a_200009991623_200000210301 [1,2,0,0,0,0|0,1,0]=4 2829 B16R1.4360 COC(=O)c1ccc(c(c1)C(=O)OC)S[13CH3] 62a_200009991623_200025704644 [1,2,0,0,0,0|0,1,0]=4 2830 B16R1.7118 CCOc1ccc(cc1C(=O)C)C(=O)OC 7a_100000030976_100000210202 [1,2,0,0,0,0|1,0,0]=4 2831 B16R1.7118 COC(=O)c1ccc(c(c1)C(=O)C)OCF 7a_100000030976_100015361967 [1,2,0,0,0,0|1,0,0]=4 2832 B16R1.4718 COC(=O)c1ccc(c(c1)OC)C(=O)OC 34a_100000069280_200000210301 [1,2,0,0,0,0|0,0,0]=3 2833 B16R1.4718 COC(=O)c1ccc(c(c1)OC)C(=O)OC 7a_100000069280_200000210301 [1,2,0,0,0,0|0,0,0]=3 2834 B16R1.4718 COC(=O)c1ccc(c(c1)O[13CH3])C(=O)OC 34a_100000069280_200025704644 [1,2,0,0,0,0|0,0,0]=3 2835 B16R1.4718 COC(=O)c1ccc(c(c1)O[13CH3])C(=O)OC 7a_100000069280_200025704644 [1,2,0,0,0,0|0,0,0]=3 2836 B16R1.4718 COC(=O)c1ccc(c(c1)SC)C(=O)OC 62a_100012047179_200000210301 [1,2,0,0,0,0|0,1,0]=4 2837 B16R1.4718 COC(=O)c1ccc(c(c1)SC)C(=O)OC 62a_200000210301_200012047180 [1,2,0,0,0,0|0,1,0]=4 2838 B16R1.4718 COC(=O)c1ccc(c(c1)S[13CH3])C(=O)OC 62a_100012047179_200025704644 [1,2,0,0,0,0|0,1,0]=4 2839 B16R1.4718 COC(=O)c1ccc(c(c1)S[13CH3])C(=O)OC 62a_200025704644_200012047180 [1,2,0,0,0,0|0,1,0]=4 2840 B16R1.12759 C=C(C)c1ccc(cc1COC)C(=O)OC 271570a_100000694244_200010890493 [1,2,0,0,0,0|1,0,0]=4 2841 B16R1.4711 CCC(=O)c1ccc(c(c1)OC)OC(C)C 1458a_100000182801_100000210202 [1,2,0,0,0,0|1,0,0]=4 2842 B16R1.4711 CCC(=O)c1ccc(c(c1)OC)OC(C)C 34a_100000012293_100000210206 [1,2,0,0,0,0|1,0,0]=4 2843 B16R1.4711 CCC(=O)c1ccc(c(c1)OC)OC(C)C 7a_100000012293_100000210206 [1,2,0,0,0,0|1,0,0]=4 2844 B16R1.4711 CCC(=O)c1ccc(c(c1)OC)OC(F)F 1458a_100000183218_100000210202 [1,2,0,0,0,0|1,0,0]=4 2845 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(=O)C 11a_106832991635_100000056858 [1,2,0,0,0,0|1,0,0]=4 2846 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(=O)C 1626a_100102657272_100000056858 [1,2,0,0,0,0|1,0,0]=4 2847 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(=O)C 240690a_100102657272_100000056858 [1,2,0,0,0,0|1,0,0]=4 2848 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(C)C 11a_106832991635_100000182801 [1,2,0,0,0,0|1,0,0]=4 2849 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(C)C 1626a_100102657272_100000182801 [1,2,0,0,0,0|1,0,0]=4 2850 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(C)C 240690a_100102657272_100000182801 [1,2,0,0,0,0|1,0,0]=4 2851 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(C)C 527a_100102657272_100000182801 [1,2,0,0,0,0|1,0,0]=4 2852 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(F)F 11a_106832991635_100000183218 [1,2,0,0,0,0|1,0,0]=4 2853 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(F)F 1626a_100102657272_100000183218 [1,2,0,0,0,0|1,0,0]=4 2854 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(F)F 240690a_100102657272_100000183218 [1,2,0,0,0,0|1,0,0]=4 2855 B16R1.4711 CNC(=O)c1ccc(c(c1)OC)OC(F)F 527a_100102657272_100000183218 [1,2,0,0,0,0|1,0,0]=4 2856 B16R1.4711 COC(=O)c1ccc(c(c1)OC)C=C(C)C 271570a_100102525489_100009816954 [1,2,0,0,0,0|1,0,0]=4 2857 B16R1.4711 COC(=O)c1ccc(c(c1)OC)CC(=O)C 1458a_100000070787_100000765176 [1,2,0,0,0,0|1,0,0]=4 2858 B16R1.4711 COC(=O)c1ccc(c(c1)OC)CN(C)C 2230a_100102631434_100000765176 [1,2,0,0,0,0|1,0,0]=4 2859 B16R1.4711 COC(=O)c1ccc(c(c1)OC)CN(C)C 269982a_100102631434_100000765176 [1,2,0,0,0,0|1,0,0]=4 2860 B16R1.4711 COC(=O)c1ccc(c(c1)OC)CN(C)C 270004a_100102631434_100009848378 [1,2,0,0,0,0|1,0,0]=4 2861 B16R1.4711 COC(=O)c1ccc(c(c1)OC)NC(=O)C 188690a_100000695017_100015343762 [1,2,0,0,0,0|1,0,0]=4 2862 B16R1.4711 COC(=O)c1ccc(c(c1)OC)OC(C)C 34a_100000212147_100000210206 [1,2,0,0,0,0|0,0,0]=3 2863 B16R1.4711 COC(=O)c1ccc(c(c1)OC)OC(C)C 7a_100000212147_100000210206 [1,2,0,0,0,0|0,0,0]=3 2864 B16R1.4711 COC(=O)c1ccc(c(c1)OC)OC(F)F 34a_100010674551_200000210301 [1,2,0,0,0,0|0,0,0]=3 2865 B16R1.4711 COC(=O)c1ccc(c(c1)OC)OC(F)F 7a_100010674551_200000210301 [1,2,0,0,0,0|0,0,0]=3 2866 B16R1.4711 COC(=O)c1ccc(c(c1)OC)SC(C)C 62a_100000210206_100009816954 [1,2,0,0,0,0|0,1,0]=4 2867 B16R1.4711 COC(=O)c1ccc(c(c1)OC)SC(C)C 62a_100009816954_100000210206 [1,2,0,0,0,0|0,1,0]=4 2868 B16R1.4711 COC(=O)c1ccc(c(c1)O[13CH3])OC(F)F 34a_100010674551_200025704644 [1,2,0,0,0,0|0,0,0]=3 2869 B16R1.4711 COC(=O)c1ccc(c(c1)O[13CH3])OC(F)F 7a_100010674551_200025704644 [1,2,0,0,0,0|0,0,0]=3 2870 B16R1.4711 COC(=O)c1ccc(c(c1)SC)OC(C)C 62a_100011213288_200000210301 [1,2,0,0,0,0|0,1,0]=4 2871 B16R1.4711 COC(=O)c1ccc(c(c1)SC)OC(C)C 62a_200000210301_100011213288 [1,2,0,0,0,0|0,1,0]=4 2872 B16R1.4711 COC(=O)c1ccc(c(c1)SC)OC(F)F 62a_200000210301_200012360136 [1,2,0,0,0,0|0,1,0]=4 2873 B16R1.4711 COC(=O)c1ccc(c(c1)SC)OC(F)F 62a_200012360136_200000210301 [1,2,0,0,0,0|0,1,0]=4 2874 B16R1.4711 COC(=O)c1ccc(c(c1)S[13CH3])OC(C)C 62a_100011213288_200025704644 [1,2,0,0,0,0|0,1,0]=4 2875 B16R1.4711 COC(=O)c1ccc(c(c1)S[13CH3])OC(C)C 62a_200025704644_100011213288 [1,2,0,0,0,0|0,1,0]=4 2876 B16R1.4711 COC(=O)c1ccc(c(c1)S[13CH3])OC(F)F 62a_200012360136_200025704644 [1,2,0,0,0,0|0,1,0]=4 2877 B16R1.4711 COC(=O)c1ccc(c(c1)S[13CH3])OC(F)F 62a_200025704644_200012360136 [1,2,0,0,0,0|0,1,0]=4 2878 B16R1.9368 CC=Cc1ccc(cc1COC)C(=O)OC 271570a_100016259895_200010890493 [1,2,0,0,0,0|1,0,0]=4 2879 B16R1.9368 CCOc1ccc(cc1OCC)C(=O)CC 1458a_100000189236_100000210202 [1,2,0,0,0,0|1,0,0]=4 2880 B16R1.9368 CCOc1ccc(cc1OCC)C(=O)NC 11a_106832991635_100000189236 [1,2,0,0,0,0|1,0,0]=4 2881 B16R1.9368 CCOc1ccc(cc1OCC)C(=O)NC 1626a_100102657272_100000189236 [1,2,0,0,0,0|1,0,0]=4 2882 B16R1.9368 CCOc1ccc(cc1OCC)C(=O)NC 240690a_100102657272_100000189236 [1,2,0,0,0,0|1,0,0]=4 2883 B16R1.9368 CCOc1ccc(cc1OCC)C(=O)NC 527a_100102657272_100000189236 [1,2,0,0,0,0|1,0,0]=4 2884 B16R1.9368 CCSc1ccc(cc1COC)C(=O)OC 62a_100000210202_200010890493 [1,2,0,0,0,0|0,1,0]=4 2885 B16R1.9368 CCSc1ccc(cc1COC)C(=O)OC 62a_200010890493_100000210202 [1,2,0,0,0,0|0,1,0]=4 2886 B16R1.9368 COCc1cc(ccc1SCF)C(=O)OC 62a_100015361967_200010890493 [1,2,0,0,0,0|0,1,0]=4 2887 B16R1.9368 COCc1cc(ccc1SCF)C(=O)OC 62a_200010890493_100015361967 [1,2,0,0,0,0|0,1,0]=4 2888 B16R1.9380 CCOc1ccc(cc1OC)C(=O)C(C)C 1458a_100000184834_100000210206 [1,2,0,0,0,0|1,0,0]=4 2889 B16R1.9380 CCOc1ccc(cc1OC)C(=O)N(C)C 11a_100102631434_100000184834 [1,2,0,0,0,0|1,0,0]=4 2890 B16R1.9380 CCOc1ccc(cc1OC)C(=O)N(C)C 1626a_100102631434_100000184834 [1,2,0,0,0,0|1,0,0]=4 2891 B16R1.9380 CCOc1ccc(cc1OC)C(=O)N(C)C 240690a_100102631434_100000184834 [1,2,0,0,0,0|1,0,0]=4 2892 B16R1.9380 CCOc1ccc(cc1OC)C(=O)N(C)C 34a_100009841360_100000210202 [1,2,0,0,0,0|1,0,0]=4 2893 B16R1.9380 CCOc1ccc(cc1OC)C(=O)N(C)C 527a_100102631434_100000184834 [1,2,0,0,0,0|1,0,0]=4 2894 B16R1.9380 CCOc1ccc(cc1OC)C(=O)N(C)C 7a_100009841360_100000210202 [1,2,0,0,0,0|1,0,0]=4 2895 B16R1.9380 COc1cc(ccc1OCF)C(=O)N(C)C 34a_100009841360_100015361967 [1,2,0,0,0,0|1,0,0]=4 2896 B16R1.9380 COc1cc(ccc1OCF)C(=O)N(C)C 7a_100009841360_100015361967 [1,2,0,0,0,0|1,0,0]=4 2897 B16R1.15838 C#CCOc1ccc(cc1OC)C(=O)CC 34a_100000012293_100000184674 [1,2,0,0,0,0|1,0,0]=4 2898 B16R1.15838 C#CCOc1ccc(cc1OC)C(=O)CC 7a_100000012293_100000038162 [1,2,0,0,0,0|1,0,0]=4 2899 B16R1.15838 C#CCOc1ccc(cc1OC)C(=O)OC 34a_100000212147_100000184674 [1,2,0,0,0,0|0,0,0]=3 2900 B16R1.15838 C#CCOc1ccc(cc1OC)C(=O)OC 7a_100000212147_100000038162 [1,2,0,0,0,0|0,0,0]=3 2901 B16R1.15838 C#CCSc1ccc(cc1OC)C(=O)OC 62a_100000038162_100009816954 [1,2,0,0,0,0|0,1,0]=4 2902 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)CC 1458a_100000231769_100000210202 [1,2,0,0,0,0|1,0,0]=4 2903 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)CC 34a_100000012293_100015514636 [1,2,0,0,0,0|1,0,0]=4 2904 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)CC 7a_100000012293_100015514636 [1,2,0,0,0,0|1,0,0]=4 2905 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)NC 11a_106832991635_100000231769 [1,2,0,0,0,0|1,0,0]=4 2906 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)NC 1626a_100102657272_100000231769 [1,2,0,0,0,0|1,0,0]=4 2907 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)NC 240690a_100102657272_100000231769 [1,2,0,0,0,0|1,0,0]=4 2908 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)NC 527a_100102657272_100000231769 [1,2,0,0,0,0|1,0,0]=4 2909 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)OC 34a_100000212147_100015514636 [1,2,0,0,0,0|0,0,0]=3 2910 B16R1.15838 C=CCOc1ccc(cc1OC)C(=O)OC 7a_100000212147_100015514636 [1,2,0,0,0,0|0,0,0]=3 2911 B16R1.15838 C=CCSc1ccc(cc1OC)C(=O)OC 62a_100000210623_100009816954 [1,2,0,0,0,0|0,1,0]=4 2912 B16R1.15838 C=CCSc1ccc(cc1OC)C(=O)OC 62a_100009816954_100000210623 [1,2,0,0,0,0|0,1,0]=4 2913 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCC#N 7a_100000012293_100011215382 [1,2,0,0,0,0|1,0,0]=4 2914 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCC=O 34a_100000012293_200009817547 [1,2,0,0,0,0|1,0,0]=4 2915 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCC=O 7a_100000012293_200015260668 [1,2,0,0,0,0|1,0,0]=4 2916 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCCF 34a_100000012293_100011217306 [1,2,0,0,0,0|1,0,0]=4 2917 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCCF 7a_100000012293_100011217306 [1,2,0,0,0,0|1,0,0]=4 2918 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCCO 34a_100000012293_100000211926 [1,2,0,0,0,0|1,0,0]=4 2919 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCCO 7a_100000012293_100000211926 [1,2,0,0,0,0|1,0,0]=4 2920 B16R1.15838 CCC(=O)c1ccc(c(c1)OC)OCSC 34a_100000012293_100011218213 [1,2,0,0,0,0|1,0,0]=4 2921 B16R1.15838 CCCCc1ccc(cc1OC)C(=O)OC 271570a_100020621405_100009816954 [1,2,0,0,0,0|1,0,0]=4 2922 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)CC 1458a_100000182800_100000210202 [1,2,0,0,0,0|1,0,0]=4 2923 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)CC 34a_100000012293_100000210303 [1,2,0,0,0,0|1,0,0]=4 2924 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)CC 7a_100000012293_100000210303 [1,2,0,0,0,0|1,0,0]=4 2925 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)NC 11a_106832991635_100000182800 [1,2,0,0,0,0|1,0,0]=4 2926 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)NC 1626a_100102657272_100000182800 [1,2,0,0,0,0|1,0,0]=4 2927 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)NC 240690a_100102657272_100000182800 [1,2,0,0,0,0|1,0,0]=4 2928 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)NC 527a_100102657272_100000182800 [1,2,0,0,0,0|1,0,0]=4 2929 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)OC 34a_100000212147_100000210303 [1,2,0,0,0,0|0,0,0]=3 2930 B16R1.15838 CCCOc1ccc(cc1OC)C(=O)OC 7a_100000212147_100000210303 [1,2,0,0,0,0|0,0,0]=3 2931 B16R1.15838 CCCSc1ccc(cc1OC)C(=O)OC 62a_100000210303_100009816954 [1,2,0,0,0,0|0,1,0]=4 2932 B16R1.15838 CCCSc1ccc(cc1OC)C(=O)OC 62a_100009816954_100000210303 [1,2,0,0,0,0|0,1,0]=4 2933 B16R1.15838 CCNCc1ccc(cc1OC)C(=O)OC 2230a_100015525214_100000765176 [1,2,0,0,0,0|1,0,0]=4 2934 B16R1.15838 CCNCc1ccc(cc1OC)C(=O)OC 270004a_100015525214_100009848378 [1,2,0,0,0,0|1,0,0]=4 2935 B16R1.15838 CCOCc1ccc(cc1OC)C(=O)OC 34a_100010744631_100000210202 [1,2,0,0,0,0|0,0,0]=3 2936 B16R1.15838 CCOCc1ccc(cc1OC)C(=O)OC 34a_100121572206_100000765176 [1,2,0,0,0,0|0,0,0]=3 2937 B16R1.15838 CCOCc1ccc(cc1OC)C(=O)OC 7a_100010744631_100000210202 [1,2,0,0,0,0|0,0,0]=3 2938 B16R1.15838 CCSCc1ccc(cc1OC)C(=O)OC 62a_100000210202_100000765176 [1,2,0,0,0,0|0,1,0]=4 2939 B16R1.15838 CCSCc1ccc(cc1OC)C(=O)OC 62a_100000765176_100000210202 [1,2,0,0,0,0|0,1,0]=4 2940 B16R1.15838 CNC(=O)c1ccc(c(c1)OC)NCOC 2230a_100011850465_100000766300 [1,2,0,0,0,0|1,0,0]=4 2941 B16R1.15838 COC(=O)c1ccc(c(c1)OC)COCF 34a_100010744631_100015361967 [1,2,0,0,0,0|0,0,0]=3 2942 B16R1.15838 COC(=O)c1ccc(c(c1)OC)COCF 7a_100010744631_100015361967 [1,2,0,0,0,0|0,0,0]=3 2943 B16R1.15838 COC(=O)c1ccc(c(c1)OC)CSCF 62a_100000765176_100015361967 [1,2,0,0,0,0|0,1,0]=4 2944 B16R1.15838 COC(=O)c1ccc(c(c1)OC)CSCF 62a_100015361967_100000765176 [1,2,0,0,0,0|0,1,0]=4 2945 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCC#N 7a_100000212147_100011215382 [1,2,0,0,0,0|0,0,0]=3 2946 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCC=O 34a_100000212147_200009817547 [1,2,0,0,0,0|0,0,0]=3 2947 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCC=O 7a_100000212147_200015260668 [1,2,0,0,0,0|0,0,0]=3 2948 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCCF 34a_100000212147_100011217306 [1,2,0,0,0,0|0,0,0]=3 2949 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCCF 7a_100000212147_100011217306 [1,2,0,0,0,0|0,0,0]=3 2950 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCCO 34a_100000212147_100000211926 [1,2,0,0,0,0|0,0,0]=3 2951 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCCO 7a_100000212147_100000211926 [1,2,0,0,0,0|0,0,0]=3 2952 B16R1.15838 COC(=O)c1ccc(c(c1)OC)OCSC 34a_100000212147_100011218213 [1,2,0,0,0,0|0,0,0]=3 2953 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCC#N 62a_100009816954_100011215382 [1,2,0,0,0,0|0,1,0]=4 2954 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCC#N 62a_100011215382_100009816954 [1,2,0,0,0,0|0,1,0]=4 2955 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCC=O 62a_100009816954_200015260668 [1,2,0,0,0,0|0,1,0]=4 2956 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCC=O 62a_200015260668_100009816954 [1,2,0,0,0,0|0,1,0]=4 2957 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCCF 62a_100009816954_100011217306 [1,2,0,0,0,0|0,1,0]=4 2958 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCCF 62a_100011217306_100009816954 [1,2,0,0,0,0|0,1,0]=4 2959 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCCO 62a_100000211926_100009816954 [1,2,0,0,0,0|0,1,0]=4 2960 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCCO 62a_100009816954_100000211926 [1,2,0,0,0,0|0,1,0]=4 2961 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCSC 62a_100009816954_100011218213 [1,2,0,0,0,0|0,1,0]=4 2962 B16R1.15838 COC(=O)c1ccc(c(c1)OC)SCSC 62a_100011218213_100009816954 [1,2,0,0,0,0|0,1,0]=4 2963 B16R1.15838 COCSc1ccc(cc1OC)C(=O)OC 62a_100000766300_100009816954 [1,2,0,0,0,0|0,0,0]=3 2964 B16R1.15838 COCSc1ccc(cc1OC)C(=O)OC 62a_100009816954_100000766300 [1,2,0,0,0,0|0,0,0]=3 2965 B16R1.15838 COCSc1ccc(nc1OC)C(=O)OC 62a_100000766300_100010189641 [1,2,0,0,0,0|1,0,0]=4 2966 B16R1.15838 COCSc1ccc(nc1OC)C(=O)OC 62a_100010189641_100000766300 [1,2,0,0,0,0|1,0,0]=4 2967 B16R1.15838 COCSc1cnc(cc1OC)C(=O)OC 62a_100000766300_100010136178 [1,2,0,0,0,0|1,0,0]=4 2968 B16R1.15838 COCSc1cnc(cc1OC)C(=O)OC 62a_100010136178_100000766300 [1,2,0,0,0,0|1,0,0]=4 2969 B16R1.15838 COCSc1ncc(cc1OC)C(=O)OC 62a_100000766300_100010074909 [1,2,0,0,0,0|1,0,0]=4 2970 B16R1.15838 COCSc1ncc(cc1OC)C(=O)OC 62a_100010136190_100000766300 [1,2,0,0,0,0|1,0,0]=4 2971 B16R1.4312 CCC(=O)c1ccc(c(c1)OC(C)C)OC 1458a_100011217381_100000210202 [1,2,0,0,0,0|1,0,0]=4 2972 B16R1.4312 CNC(=O)c1ccc(c(c1)OC(C)C)OC 11a_106832991635_100011217381 [1,2,0,0,0,0|1,0,0]=4 2973 B16R1.4312 CNC(=O)c1ccc(c(c1)OC(C)C)OC 1626a_100102657272_100011217381 [1,2,0,0,0,0|1,0,0]=4 2974 B16R1.4312 CNC(=O)c1ccc(c(c1)OC(C)C)OC 240690a_100102657272_100011217381 [1,2,0,0,0,0|1,0,0]=4 2975 B16R1.4312 CNC(=O)c1ccc(c(c1)OC(C)C)OC 527a_100102657272_100011217381 [1,2,0,0,0,0|1,0,0]=4 2976 B16R1.4312 COC(=O)c1ccc(c(c1)C=C(C)C)OC 271570a_100102525489_100000189012 [1,2,0,0,0,0|1,0,0]=4 2977 B16R1.4312 COC(=O)c1ccc(c(c1)CC(=O)C)OC 1458a_100000070787_200010762020 [1,2,0,0,0,0|1,0,0]=4 2978 B16R1.4312 COC(=O)c1ccc(c(c1)CN(C)C)OC 2230a_100102631434_200010762020 [1,2,0,0,0,0|1,0,0]=4 2979 B16R1.4312 COC(=O)c1ccc(c(c1)CN(C)C)OC 269982a_100102631434_200010762020 [1,2,0,0,0,0|1,0,0]=4 2980 B16R1.4312 COC(=O)c1ccc(c(c1)CN(C)C)OC 270004a_100102631434_100000059354 [1,2,0,0,0,0|1,0,0]=4 2981 B16R1.4312 COC(=O)c1ccc(c(c1)NC(=O)C)OC 188690a_100011217029_100015343762 [1,2,0,0,0,0|1,0,0]=4 2982 B16R1.4312 COC(=O)c1ccc(c(c1)OC(C)C)OC 34a_100011215032_100000210206 [1,2,0,0,0,0|0,0,0]=3 2983 B16R1.4312 COC(=O)c1ccc(c(c1)OC(C)C)OC 7a_100011215032_100000210206 [1,2,0,0,0,0|0,0,0]=3 2984 B16R1.4312 COC(=O)c1ccc(c(c1)OC(F)F)SC 62a_100020588217_200000210301 [1,2,0,0,0,0|0,1,0]=4 2985 B16R1.4312 COC(=O)c1ccc(c(c1)OC(F)F)SC 62a_200000210301_100020588217 [1,2,0,0,0,0|0,1,0]=4 2986 B16R1.4312 COC(=O)c1ccc(c(c1)OC(F)F)S[13CH3] 62a_100020588217_200025704644 [1,2,0,0,0,0|0,1,0]=4 2987 B16R1.4312 COC(=O)c1ccc(c(c1)OC(F)F)S[13CH3] 62a_200025704644_100020588217 [1,2,0,0,0,0|0,1,0]=4 2988 B16R1.4312 COC(=O)c1ccc(c(c1)SC(C)C)OC 62a_100000189012_100000210206 [1,2,0,0,0,0|0,1,0]=4 2989 B16R1.4312 COC(=O)c1ccc(c(c1)SC(C)C)OC 62a_100000210206_100000189012 [1,2,0,0,0,0|0,1,0]=4 2990 B16R1.4312 COC(=O)c1cnc(c(c1)OC(C)C)OC 34a_100009867281_100000210206 [1,2,0,0,0,0|1,0,0]=4 2991 B16R1.10272 CCOc1cc(ccc1OC)C(=O)C(C)C 1458a_100000181421_100000210206 [1,2,0,0,0,0|1,0,0]=4 2992 B16R1.10272 CCOc1cc(ccc1OC)C(=O)N(C)C 11a_100102631434_100000181421 [1,2,0,0,0,0|1,0,0]=4 2993 B16R1.10272 CCOc1cc(ccc1OC)C(=O)N(C)C 1626a_100102631434_100000181421 [1,2,0,0,0,0|1,0,0]=4 2994 B16R1.10272 CCOc1cc(ccc1OC)C(=O)N(C)C 240690a_100102631434_100000181421 [1,2,0,0,0,0|1,0,0]=4 2995 B16R1.10272 CCOc1cc(ccc1OC)C(=O)N(C)C 527a_100102631434_100000181421 [1,2,0,0,0,0|1,0,0]=4 2996 B16R1.16513 C#CCOc1cc(ccc1OC)C(=O)OC 34a_100011215032_100000184674 [1,2,0,0,0,0|0,0,0]=3 2997 B16R1.16513 C#CCOc1cc(ccc1OC)C(=O)OC 7a_100011215032_100000038162 [1,2,0,0,0,0|0,0,0]=3 2998 B16R1.16513 C#CCOc1cc(cnc1OC)C(=O)OC 34a_100009867281_100000184674 [1,2,0,0,0,0|1,0,0]=4 2999 B16R1.16513 C#CCSc1cc(ccc1OC)C(=O)OC 62a_100000038162_100000189012 [1,2,0,0,0,0|0,1,0]=4 3000 B16R1.16513 C=CCOc1cc(ccc1OC)C(=O)OC 34a_100011215032_100015514636 [1,2,0,0,0,0|0,0,0]=3 3001 B16R1.16513 C=CCOc1cc(ccc1OC)C(=O)OC 7a_100011215032_100015514636 [1,2,0,0,0,0|0,0,0]=3 3002 B16R1.16513 C=CCOc1cc(cnc1OC)C(=O)OC 34a_100009867281_100015514636 [1,2,0,0,0,0|1,0,0]=4 3003 B16R1.16513 C=CCSc1cc(ccc1OC)C(=O)OC 62a_100000189012_100000210623 [1,2,0,0,0,0|0,1,0]=4 3004 B16R1.16513 C=CCSc1cc(ccc1OC)C(=O)OC 62a_100000210623_100000189012 [1,2,0,0,0,0|0,1,0]=4 3005 B16R1.16513 CCCCc1cc(ccc1OC)C(=O)OC 271570a_100020621405_100000189012 [1,2,0,0,0,0|1,0,0]=4 3006 B16R1.16513 CCCOc1cc(ccc1OC)C(=O)OC 34a_100011215032_100000210303 [1,2,0,0,0,0|0,0,0]=3 3007 B16R1.16513 CCCOc1cc(ccc1OC)C(=O)OC 7a_100011215032_100000210303 [1,2,0,0,0,0|0,0,0]=3 3008 B16R1.16513 CCCOc1cc(cnc1OC)C(=O)OC 34a_100009867281_100000210303 [1,2,0,0,0,0|1,0,0]=4 3009 B16R1.16513 CCCSc1cc(ccc1OC)C(=O)OC 62a_100000189012_100000210303 [1,2,0,0,0,0|0,1,0]=4 3010 B16R1.16513 CCCSc1cc(ccc1OC)C(=O)OC 62a_100000210303_100000189012 [1,2,0,0,0,0|0,1,0]=4 3011 B16R1.16513 CCNCc1cc(ccc1OC)C(=O)OC 2230a_100015525214_200010762020 [1,2,0,0,0,0|1,0,0]=4 3012 B16R1.16513 CCNCc1cc(ccc1OC)C(=O)OC 270004a_100015525214_100000059354 [1,2,0,0,0,0|1,0,0]=4 3013 B16R1.16513 CCOCc1cc(ccc1OC)C(=O)OC 34a_100121572206_200010762020 [1,2,0,0,0,0|0,0,0]=3 3014 B16R1.16513 CCSCc1cc(ccc1OC)C(=O)OC 62a_100000210202_200010762020 [1,2,0,0,0,0|0,1,0]=4 3015 B16R1.16513 CCSCc1cc(ccc1OC)C(=O)OC 62a_200010762020_100000210202 [1,2,0,0,0,0|0,1,0]=4 3016 B16R1.16513 CCc1ccc(cc1SCOC)C(=O)OC 62a_100000766300_200012360130 [1,2,0,0,0,0|1,0,0]=4 3017 B16R1.16513 CCc1ccc(cc1SCOC)C(=O)OC 62a_200012360130_100000766300 [1,2,0,0,0,0|1,0,0]=4 3018 B16R1.16513 CNC(=O)c1ccc(c(c1)NCOC)OC 2230a_100000740754_100000766300 [1,2,0,0,0,0|1,0,0]=4 3019 B16R1.16513 COC(=O)c1ccc(c(c1)CSCF)OC 62a_100015361967_200010762020 [1,2,0,0,0,0|0,1,0]=4 3020 B16R1.16513 COC(=O)c1ccc(c(c1)CSCF)OC 62a_200010762020_100015361967 [1,2,0,0,0,0|0,1,0]=4 3021 B16R1.16513 COC(=O)c1ccc(c(c1)OCC#N)OC 7a_100011215032_100011215382 [1,2,0,0,0,0|0,0,0]=3 3022 B16R1.16513 COC(=O)c1ccc(c(c1)OCC=O)OC 34a_100011215032_200009817547 [1,2,0,0,0,0|0,0,0]=3 3023 B16R1.16513 COC(=O)c1ccc(c(c1)OCC=O)OC 7a_100011215032_200015260668 [1,2,0,0,0,0|0,0,0]=3 3024 B16R1.16513 COC(=O)c1ccc(c(c1)OCCF)OC 34a_100011215032_100011217306 [1,2,0,0,0,0|0,0,0]=3 3025 B16R1.16513 COC(=O)c1ccc(c(c1)OCCF)OC 7a_100011215032_100011217306 [1,2,0,0,0,0|0,0,0]=3 3026 B16R1.16513 COC(=O)c1ccc(c(c1)OCCO)OC 34a_100011215032_100000211926 [1,2,0,0,0,0|0,0,0]=3 3027 B16R1.16513 COC(=O)c1ccc(c(c1)OCCO)OC 7a_100011215032_100000211926 [1,2,0,0,0,0|0,0,0]=3 3028 B16R1.16513 COC(=O)c1ccc(c(c1)OCSC)OC 34a_100011215032_100011218213 [1,2,0,0,0,0|0,0,0]=3 3029 B16R1.16513 COC(=O)c1ccc(c(c1)SCC#N)OC 62a_100000189012_100011215382 [1,2,0,0,0,0|0,1,0]=4 3030 B16R1.16513 COC(=O)c1ccc(c(c1)SCC#N)OC 62a_100011215382_100000189012 [1,2,0,0,0,0|0,1,0]=4 3031 B16R1.16513 COC(=O)c1ccc(c(c1)SCC=O)OC 62a_100000189012_200015260668 [1,2,0,0,0,0|0,1,0]=4 3032 B16R1.16513 COC(=O)c1ccc(c(c1)SCC=O)OC 62a_200015260668_100000189012 [1,2,0,0,0,0|0,1,0]=4 3033 B16R1.16513 COC(=O)c1ccc(c(c1)SCCF)OC 62a_100000189012_100011217306 [1,2,0,0,0,0|0,1,0]=4 3034 B16R1.16513 COC(=O)c1ccc(c(c1)SCCF)OC 62a_100011217306_100000189012 [1,2,0,0,0,0|0,1,0]=4 3035 B16R1.16513 COC(=O)c1ccc(c(c1)SCCO)OC 62a_100000189012_100000211926 [1,2,0,0,0,0|0,1,0]=4 3036 B16R1.16513 COC(=O)c1ccc(c(c1)SCCO)OC 62a_100000211926_100000189012 [1,2,0,0,0,0|0,1,0]=4 3037 B16R1.16513 COC(=O)c1ccc(c(c1)SCSC)OC 62a_100000189012_100011218213 [1,2,0,0,0,0|0,1,0]=4 3038 B16R1.16513 COC(=O)c1ccc(c(c1)SCSC)OC 62a_100011218213_100000189012 [1,2,0,0,0,0|0,1,0]=4 3039 B16R1.16513 COC(=O)c1cnc(c(c1)OCC=O)OC 34a_100009867281_200009817547 [1,2,0,0,0,0|1,0,0]=4 3040 B16R1.16513 COC(=O)c1cnc(c(c1)OCCF)OC 34a_100009867281_100011217306 [1,2,0,0,0,0|1,0,0]=4 3041 B16R1.16513 COC(=O)c1cnc(c(c1)OCCO)OC 34a_100009867281_100000211926 [1,2,0,0,0,0|1,0,0]=4 3042 B16R1.16513 COC(=O)c1cnc(c(c1)OCSC)OC 34a_100009867281_100011218213 [1,2,0,0,0,0|1,0,0]=4 3043 B16R1.16513 COCSc1cc(ccc1OC)C(=O)OC 62a_100000189012_100000766300 [1,2,0,0,0,0|0,0,0]=3 3044 B16R1.16513 COCSc1cc(ccc1OC)C(=O)OC 62a_100000766300_100000189012 [1,2,0,0,0,0|0,0,0]=3 3045 B16R1.16513 COCSc1cc(cnc1OC)C(=O)OC 62a_100000766300_100010189640 [1,2,0,0,0,0|1,0,0]=4 3046 B16R1.16513 COCSc1cc(cnc1OC)C(=O)OC 62a_100010189640_100000766300 [1,2,0,0,0,0|1,0,0]=4 3047 B16R1.16513 COCSc1cc(ncc1OC)C(=O)OC 62a_100000766300_200010136175 [1,2,0,0,0,0|1,0,0]=4 3048 B16R1.16513 COCSc1cc(ncc1OC)C(=O)OC 62a_200010136175_100000766300 [1,2,0,0,0,0|1,0,0]=4 3049 B16R1.16513 COCSc1nc(ccc1OC)C(=O)OC 62a_100000766300_100010205418 [1,2,0,0,0,0|1,0,0]=4 3050 B16R1.16513 COCSc1nc(ccc1OC)C(=O)OC 62a_100010205418_100000766300 [1,2,0,0,0,0|1,0,0]=4 3051 B16R1.20128 COc1ccc(c(c1OC)[N+](=O)[O-])C(=O)C 1458a_100009992057_200000210301 [1,2,0,0,0,0|0,0,1]=4 3052 B16R1.20128 COc1ccc(c(c1OC)[N+](=O)[O-])C(=O)[13CH3] 1458a_100009992057_200025704644 [1,2,0,0,0,0|0,0,1]=4 3053 B16R1.36413 COCSc1c(ccc(c1N)C(=O)C)OC 62a_100010236346_100000766300 [1,2,0,0,0,0|1,0,0]=4 3054 B16R1.1816 C#CCCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000753159 [1,2,0,0,0,0|1,0,0]=4 3055 B16R1.1816 C/C=C/CC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100102629194 [1,2,0,0,0,0|1,0,0]=4 3056 B16R1.1816 C=CCCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000754431 [1,2,0,0,0,0|1,0,0]=4 3057 B16R1.1816 CC#CCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000748600 [1,2,0,0,0,0|1,0,0]=4 3058 B16R1.1816 CC=CCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000070051 [1,2,0,0,0,0|1,0,0]=4 3059 B16R1.1816 CCCCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000210211 [1,2,0,0,0,0|1,0,0]=4 3060 B16R1.1816 CCNNC(=O)c1ccc(c(c1O)O)OC 22a_100000756455_100000045701 [1,2,0,0,0,0|1,0,0]=4 3061 B16R1.1816 COCCC(=O)c1ccc(c(c1C)C)OC 1458a_200000082569_100000233755 [1,2,0,0,0,0|1,0,0]=4 3062 B16R1.1816 COCCC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000233755 [1,2,0,0,0,0|0,0,0]=3 3063 B16R1.1816 COc1ccc(c(c1O)O)C(=O)CCC#N 1458a_100000045701_100011215226 [1,2,0,0,0,0|1,0,0]=4 3064 B16R1.1816 COc1ccc(c(c1O)O)C(=O)CCCF 1458a_100000045701_100011934791 [1,2,0,0,0,0|1,0,0]=4 3065 B16R1.1816 COc1ccc(c(c1O)O)C(=O)CCCO 1458a_100000045701_100011215043 [1,2,0,0,0,0|1,0,0]=4 3066 B16R1.1816 COc1ccc(c(c1O)O)C(=O)CCSC 1458a_100000045701_100000751147 [1,2,0,0,0,0|0,1,0]=4 3067 B16R1.20117 C=C(C)CC(=O)c1ccc(c(c1O)O)OC 1458a_100000045701_100000748629 [1,2,0,0,0,0|1,0,0]=4 3068 B16R1.20117 COc1ccc(c(c1O)O)C(=O)CC(C)C 1458a_100000045701_100000210624 [1,2,0,0,0,0|1,0,0]=4 3069 B16R1.20117 COc1ccc(c(c1O)O)C(=O)CC(C)O 1458a_100000045701_100011218427 [1,2,0,0,0,0|1,0,0]=4 3070 B16R1.20117 COc1ccc(c(c1O)O)C(=O)CC(F)F 1458a_100000045701_100011934356 [1,2,0,0,0,0|1,0,0]=4 3071 B16R1.39545 COCSc1ccc(c(c1C)C)C(=O)OC 62a_100000766300_100010761469 [1,2,0,0,0,0|1,0,0]=4 3072 B16R1.39545 COCSc1ccc(c(c1C)C)C(=O)OC 62a_100010761469_100000766300 [1,2,0,0,0,0|1,0,0]=4 3073 B16R1.39545 COCSc1ccc(c(c1C)F)C(=O)OC 62a_100000766300_100010172522 [1,2,0,0,0,0|1,0,0]=4 3074 B16R1.39545 COCSc1ccc(c(c1C)F)C(=O)OC 62a_100010172522_100000766300 [1,2,0,0,0,0|1,0,0]=4 3075 B16R1.39545 COCSc1ccc(c(c1C)N)C(=O)OC 62a_100000764893_100000766300 [1,2,0,0,0,0|1,0,0]=4 3076 B16R1.39545 COCSc1ccc(c(c1O)C)C(=O)OC 62a_100000766300_100010889012 [1,2,0,0,0,0|1,0,0]=4 3077 B16R1.39545 COCSc1ccc(c(c1O)C)C(=O)OC 62a_100010889012_100000766300 [1,2,0,0,0,0|1,0,0]=4 3078 B16R1.39545 COCSc1ccc(c(c1O)F)C(=O)OC 62a_100000766300_100011096176 [1,2,0,0,0,0|1,0,0]=4 3079 B16R1.39545 COCSc1ccc(c(c1O)F)C(=O)OC 62a_100011096176_100000766300 [1,2,0,0,0,0|1,0,0]=4 3080 B16R1.73111 COCSc1c(ccc(c1C)C(=O)OC)C 62a_100000766300_200010734123 [1,2,0,0,0,0|1,0,0]=4 3081 B16R1.73111 COCSc1c(ccc(c1C)C(=O)OC)C 62a_200010734123_100000766300 [1,2,0,0,0,0|1,0,0]=4 3082 B16R1.20125 COc1ccc(c(c1OC)OC)C=C(C)C 271570a_100102525489_100011320274 [1,2,0,0,0,0|1,0,0]=4 3083 B16R1.39536 CCOCc1ccc(c(c1OC)OC)OC 34a_100011216276_100000210202 [1,2,0,0,0,0|0,0,1]=4 3084 B16R1.39536 COc1ccc(c(c1OC)OC)COCF 34a_100011216276_100015361967 [1,2,0,0,0,0|0,0,1]=4 3085 B16R1.29987 CCNN=Cc1ccc(c(c1O)OC)OC 4a_100000756455_100000073574 [1,2,0,0,0,0|1,0,0]=4 3086 B16R1.29987 CCOC=Cc1ccc(c(c1C)OC)OC 271570a_100016256518_100010000156 [1,2,0,0,0,0|1,0,0]=4 3087 B16R1.29987 COCC=Cc1ccc(c(c1C)OC)OC 271570a_100016286323_100010000156 [1,2,0,0,0,0|1,0,0]=4 3088 B16R1.428 C=C(C)c1cc(c(c(c1)C(=O)OC)O)OC 271570a_100000694244_100010164242 [0,1,0,0,1,1|1,0,0]=4 3089 B16R1.4160 CC=Cc1cc(c(c(c1)C(=O)OC)O)OC 271570a_100016259895_100010164242 [0,1,0,0,1,1|1,0,0]=4 3090 B18R1.73605 COC(=O)C(C)Sc1ccc(c(c1C)OC)OC 62a_100000211248_100010000156 [0,1,0,0,0,2|1,0,0]=4 3091 B18R1.217071 CCOC(=O)C=Cc1ccc(c(c1C)OC)OC 271570a_100010199719_100010000156 [0,1,0,0,0,2|1,0,0]=4 3092 B18R1.217071 CCOC(=O)CSc1ccc(c(c1C)OC)OC 62a_100000188475_100010000156 [0,1,0,0,0,2|1,0,0]=4 3093 B18R1.217071 COCC(=O)C=Cc1ccc(c(c1I)OC)OC 6a_100010191550_100000211753 [0,1,0,0,0,2|1,0,0]=4 3094 B18R1.217071 COCC(=O)NCc1ccc(c(c1Cl)OC)OC 11a_102515433231_100000210968 [0,1,0,0,0,2|1,0,0]=4 3095 B18R1.217071 COCC(=O)NCc1ccc(c(c1Cl)OC)OC 1626a_102515433231_100000210968 [0,1,0,0,0,2|1,0,0]=4 3096 B18R1.217071 COCC(=O)NCc1ccc(c(c1Cl)OC)OC 240690a_102515433231_100000210968 [0,1,0,0,0,2|1,0,0]=4 3097 B18R1.217071 COCC(=O)NCc1ccc(c(c1Cl)OC)OC 527a_102515433231_100000210968 [0,1,0,0,0,2|1,0,0]=4 3098 B18R1.282917 CCC(=O)C=Cc1ccc(c(c1OC)OC)OC 1458a_100000262426_100000210202 [0,1,0,0,0,2|1,0,0]=4 3099 B18R1.282917 CCC(=O)CCc1ccc(c(c1OC)OC)OC 1458a_100000299705_100000210202 [0,1,0,0,0,2|1,0,0]=4 3100 B18R1.282917 CCC(=O)NCc1ccc(c(c1OC)OC)OC 11a_100000737524_100000210414 [0,1,0,0,0,2|1,0,0]=4 3101 B18R1.282917 CCC(=O)NCc1ccc(c(c1OC)OC)OC 1626a_100000737524_100000210414 [0,1,0,0,0,2|1,0,0]=4 3102 B18R1.282917 CCC(=O)NCc1ccc(c(c1OC)OC)OC 240690a_100000737524_100000210414 [0,1,0,0,0,2|1,0,0]=4 3103 B18R1.282917 CCC(=O)NCc1ccc(c(c1OC)OC)OC 527a_100000737524_100000210414 [0,1,0,0,0,2|1,0,0]=4 3104 B18R1.282917 CNC(=O)C=Cc1ccc(c(c1OC)OC)OC 11a_106832991635_100000262426 [0,1,0,0,0,2|1,0,0]=4 3105 B18R1.282917 CNC(=O)C=Cc1ccc(c(c1OC)OC)OC 1626a_100102657272_100000262426 [0,1,0,0,0,2|1,0,0]=4 3106 B18R1.282917 CNC(=O)CCc1ccc(c(c1OC)OC)OC 11a_106832991635_100000299705 [0,1,0,0,0,2|1,0,0]=4 3107 B18R1.282917 CNC(=O)CCc1ccc(c(c1OC)OC)OC 1626a_100102657272_100000299705 [0,1,0,0,0,2|1,0,0]=4 3108 B18R1.282917 CNC(=O)CCc1ccc(c(c1OC)OC)OC 240690a_100102657272_100000299705 [0,1,0,0,0,2|1,0,0]=4 3109 B18R1.282917 CNC(=O)CCc1ccc(c(c1OC)OC)OC 527a_100102657272_100000299705 [0,1,0,0,0,2|1,0,0]=4 3110 B18R1.282917 CNC(=O)CNc1ccc(c(c1OC)OC)OC 34a_100000751027_100000183359 [0,1,0,0,0,2|1,0,0]=4 3111 B18R1.282917 CNC(=O)COc1ccc(c(c1OC)OC)OC 34a_100000074623_100000183359 [0,1,0,0,0,2|1,0,0]=4 3112 B18R1.282917 CNC(=O)NCc1ccc(c(c1OC)OC)OC 2708a_100000737524_106832991635 [0,1,0,0,0,2|1,0,0]=4 3113 B18R1.282917 CNC(=O)NCc1ccc(c(c1OC)OC)OC 2708a_100102657272_100000737524 [0,1,0,0,0,2|1,0,0]=4 3114 B18R1.282917 CNC(=O)NCc1ccc(c(c1OC)OC)OC 273464a_100000737524_100102657272 [0,1,0,0,0,2|1,0,0]=4 3115 B18R1.282917 CNC(=O)NCc1ccc(c(c1OC)OC)OC 273464a_100102657272_100000737524 [0,1,0,0,0,2|1,0,0]=4 3116 B18R1.282917 CNC(=O)NCc1ccc(c(c1OC)OC)OC 512a_100000737524_100102657272 [0,1,0,0,0,2|1,0,0]=4 3117 B18R1.282917 CNC(=O)NCc1ccc(c(c1OC)OC)OC 512a_106832991638_100000737524 [0,1,0,0,0,2|1,0,0]=4 3118 B18R1.282917 COC(=O)CNc1ccc(c(c1OC)OC)OC 34a_100000751027_100000747449 [0,1,0,0,0,2|0,0,0]=3 3119 B18R1.282917 COC(=O)COc1ccc(c(c1OC)OC)OC 34a_100000074623_100000747449 [0,1,0,0,0,2|0,0,0]=3 3120 B18R1.282931 COC(=O)CC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000747449 [0,1,0,0,0,2|1,0,0]=4 3121 B18R1.282931 COC(=O)CC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000747449 [0,1,0,0,0,2|1,0,0]=4 3122 B18R1.282931 COC(=O)CC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000747449 [0,1,0,0,0,2|1,0,0]=4 3123 B18R1.282915 C=C(C)C(=O)Nc1ccc(c(c1OC)OC)OC 11a_100000751027_100000185857 [0,2,0,0,0,1|1,0,0]=4 3124 B18R1.282915 C=C(C)C(=O)Nc1ccc(c(c1OC)OC)OC 1626a_100000751027_100000185857 [0,2,0,0,0,1|1,0,0]=4 3125 B18R1.282915 C=C(C)C(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000185857 [0,2,0,0,0,1|1,0,0]=4 3126 B18R1.282915 COc1ccc(c(c1OC)OC)CC(=O)C(C)C 1458a_100000212332_100000210206 [0,2,0,0,0,1|1,0,0]=4 3127 B18R1.282915 COc1ccc(c(c1OC)OC)CC(=O)N(C)C 11a_100102631434_100000212332 [0,2,0,0,0,1|1,0,0]=4 3128 B18R1.282915 COc1ccc(c(c1OC)OC)CC(=O)N(C)C 1626a_100102631434_100000212332 [0,2,0,0,0,1|1,0,0]=4 3129 B18R1.282915 COc1ccc(c(c1OC)OC)CC(=O)N(C)C 240690a_100102631434_100000212332 [0,2,0,0,0,1|1,0,0]=4 3130 B18R1.282915 COc1ccc(c(c1OC)OC)CC(=O)N(C)C 527a_100102631434_100000212332 [0,2,0,0,0,1|1,0,0]=4 3131 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)C 11a_100000751027_100000210198 [0,2,0,0,0,1|1,0,0]=4 3132 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)C 1626a_100000751027_100000210198 [0,2,0,0,0,1|1,0,0]=4 3133 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)C 22a_100000751027_100000210198 [0,2,0,0,0,1|1,0,0]=4 3134 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)C 527a_100000751027_100000210198 [0,2,0,0,0,1|1,0,0]=4 3135 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)F 11a_100000751027_100000062450 [0,2,0,0,0,1|1,0,0]=4 3136 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)F 1626a_100000751027_100000062450 [0,2,0,0,0,1|1,0,0]=4 3137 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)F 22a_100000751027_100000062450 [0,2,0,0,0,1|1,0,0]=4 3138 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)C(C)F 527a_100000751027_100000062450 [0,2,0,0,0,1|1,0,0]=4 3139 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)N(C)C 2430a_100000751027_100102631434 [0,2,0,0,0,1|1,0,0]=4 3140 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)[C@@H](C)O 22a_100000751027_100000717761 [0,2,0,0,0,1|1,0,0]=4 3141 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)[C@H](C)O 1626a_100000751027_217856618621 [0,2,0,0,0,1|1,0,0]=4 3142 B18R1.282915 COc1ccc(c(c1OC)OC)NC(=O)[C@H](C)O 22a_100000751027_217856618621 [0,2,0,0,0,1|1,0,0]=4 3143 B18R1.131151 C=C=Cc1c(ccc(c1OC)OC)CC(=O)OC 271570a_100015277604_200039450660 [0,2,0,0,0,1|1,0,0]=4 3144 B18R1.131151 CC=Cc1c(ccc(c1OC)OC)CC(=O)OC 271570a_100016259895_200039450660 [0,2,0,0,0,1|1,0,0]=4 3145 B18R1.131151 CCSc1c(ccc(c1OC)OC)CC(=O)OC 62a_200039450660_100000210202 [0,2,0,0,0,1|0,1,0]=4 3146 B18R1.131151 COC(=O)Cc1ccc(c(c1SCF)OC)OC 62a_200039450660_100015361967 [0,2,0,0,0,1|0,1,0]=4 3147 B18R1.282948 C=C(C)c1c(ccc(c1OC)OC)CC(=O)OC 271570a_100000694244_200039450660 [0,2,0,0,0,1|1,0,0]=4 3148 B18R1.309773 CC#CC(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000763181 [0,2,0,0,0,1|1,0,0]=4 3149 B18R1.309773 CC=CC(=O)Nc1ccc(c(c1OC)OC)OC 11a_100000751027_100000210699 [0,2,0,0,0,1|1,0,0]=4 3150 B18R1.309773 CC=CC(=O)Nc1ccc(c(c1OC)OC)OC 1626a_100000751027_100000210699 [0,2,0,0,0,1|1,0,0]=4 3151 B18R1.309773 CC=CC(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000210699 [0,2,0,0,0,1|1,0,0]=4 3152 B18R1.309773 CCCC(=O)Cc1ccc(c(c1OC)OC)OC 1458a_100000212332_100000210303 [0,2,0,0,0,1|1,0,0]=4 3153 B18R1.309773 CCCC(=O)Nc1ccc(c(c1OC)OC)OC 11a_100000751027_100000211992 [0,2,0,0,0,1|1,0,0]=4 3154 B18R1.309773 CCCC(=O)Nc1ccc(c(c1OC)OC)OC 1626a_100000751027_100000211992 [0,2,0,0,0,1|1,0,0]=4 3155 B18R1.309773 CCCC(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000211992 [0,2,0,0,0,1|1,0,0]=4 3156 B18R1.309773 CCCC(=O)Nc1ccc(c(c1OC)OC)OC 527a_100000751027_100000211992 [0,2,0,0,0,1|1,0,0]=4 3157 B18R1.309773 CCNC(=O)Cc1ccc(c(c1OC)OC)OC 11a_100015525214_100000212332 [0,2,0,0,0,1|1,0,0]=4 3158 B18R1.309773 CCNC(=O)Cc1ccc(c(c1OC)OC)OC 240690a_100015525214_100000212332 [0,2,0,0,0,1|1,0,0]=4 3159 B18R1.309773 CCNC(=O)Cc1ccc(c(c1OC)OC)OC 527a_100015525214_100000212332 [0,2,0,0,0,1|1,0,0]=4 3160 B18R1.309773 CCNC(=O)Nc1ccc(c(c1OC)OC)OC 2430a_100000751027_100015525214 [0,2,0,0,0,1|1,0,0]=4 3161 B18R1.309773 CCNC(=O)Nc1ccc(c(c1OC)OC)OC 512a_100000751027_100015525214 [0,2,0,0,0,1|1,0,0]=4 3162 B18R1.309773 CNNC(=O)Cc1ccc(c(c1OC)OC)OC 22a_100016993582_100000212332 [0,2,0,0,0,1|1,0,0]=4 3163 B18R1.309773 CNNC(=O)Nc1ccc(c(c1OC)OC)OC 512a_100000751027_100016993582 [0,2,0,0,0,1|1,0,0]=4 3164 B18R1.309773 COCC(=O)Nc1ccc(c(c1OC)OC)OC 11a_100000751027_100000210968 [0,2,0,0,0,1|0,0,0]=3 3165 B18R1.309773 COCC(=O)Nc1ccc(c(c1OC)OC)OC 1626a_100000751027_100000210968 [0,2,0,0,0,1|0,0,0]=3 3166 B18R1.309773 COCC(=O)Nc1ccc(c(c1OC)OC)OC 22a_100000751027_100000210968 [0,2,0,0,0,1|0,0,0]=3 3167 B18R1.309773 COCC(=O)Nc1ccc(c(c1OC)OC)OC 527a_100000751027_100000210968 [0,2,0,0,0,1|0,0,0]=3 3168 B18R1.309773 COc1ccc(c(c1OC)OC)CC(=O)CCF 1458a_100000212332_100011217306 [0,2,0,0,0,1|1,0,0]=4 3169 B18R1.309773 COc1ccc(c(c1OC)OC)CC(=O)CCO 1458a_100000212332_100000211926 [0,2,0,0,0,1|1,0,0]=4 3170 B18R1.309773 COc1ccc(c(c1OC)OC)NC(=O)CCO 22a_100000751027_100011216618 [0,2,0,0,0,1|1,0,0]=4 3171 B18R1.309773 COc1ccc(c(c1OC)OC)NC(=O)CSC 11a_100000751027_100000184570 [0,2,0,0,0,1|0,1,0]=4 3172 B18R1.309773 COc1ccc(c(c1OC)OC)NC(=O)CSC 1626a_100000751027_100000184570 [0,2,0,0,0,1|0,1,0]=4 3173 B18R1.309773 COc1ccc(c(c1OC)OC)NC(=O)CSC 22a_100000751027_100000184570 [0,2,0,0,0,1|0,1,0]=4 3174 B18R1.309773 COc1ccc(c(c1OC)OC)NC(=O)CSC 527a_100000751027_100000184570 [0,2,0,0,0,1|0,1,0]=4 3175 B18R1.523584 CCOCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000211967_100011890039 [0,2,0,0,0,1|1,0,0]=4 3176 B18R1.523584 COC=CC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100016268678_100011890039 [0,2,0,0,0,1|1,0,0]=4 3177 B18R1.523584 COCCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100000749529_100011890039 [0,2,0,0,0,1|1,0,0]=4 3178 B18R1.523584 COCCC(=O)Cc1ccc(c(c1Cl)OC)OC 1458a_100012648522_100000233755 [0,2,0,0,0,1|1,0,0]=4 3179 B18R1.523584 COCCC(=O)Cc1ccc(c(c1F)OC)OC 1458a_200010293705_100000233755 [0,2,0,0,0,1|1,0,0]=4 3180 B18R1.282914 C=C(C)CC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000748629 [0,3,0,0,0,0|1,0,0]=4 3181 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)CC(C)C 1458a_100000211208_100000210624 [0,3,0,0,0,0|1,0,0]=4 3182 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)CC(C)O 1458a_100000211208_100011218427 [0,3,0,0,0,0|1,0,0]=4 3183 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)CC(F)F 1458a_100000211208_100011934356 [0,3,0,0,0,0|1,0,0]=4 3184 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)CN(C)C 2230a_100102631434_200011320270 [0,3,0,0,0,0|1,0,0]=4 3185 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)CN(C)C 269982a_100102631434_200011320270 [0,3,0,0,0,0|1,0,0]=4 3186 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)NC(C)C 11a_100138425928_100000211208 [0,3,0,0,0,0|1,0,0]=4 3187 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)NC(C)C 1626a_100138425928_100000211208 [0,3,0,0,0,0|1,0,0]=4 3188 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)NC(C)C 240690a_100138425928_100000211208 [0,3,0,0,0,0|1,0,0]=4 3189 B18R1.282914 COc1ccc(c(c1OC)OC)C(=O)NC(C)C 527a_100138425928_100000211208 [0,3,0,0,0,0|1,0,0]=4 3190 B18R1.303961 C#CCCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000753159 [0,3,0,0,0,0|1,0,0]=4 3191 B18R1.303961 C#CCNC(=O)c1ccc(c(c1OC)OC)OC 11a_100000212058_100000211208 [0,3,0,0,0,0|1,0,0]=4 3192 B18R1.303961 C#CCNC(=O)c1ccc(c(c1OC)OC)OC 1626a_100000212058_100000211208 [0,3,0,0,0,0|1,0,0]=4 3193 B18R1.303961 C#CCNC(=O)c1ccc(c(c1OC)OC)OC 240690a_100000212058_100000211208 [0,3,0,0,0,0|1,0,0]=4 3194 B18R1.303961 C#CCNC(=O)c1ccc(c(c1OC)OC)OC 527a_100000212058_100000211208 [0,3,0,0,0,0|1,0,0]=4 3195 B18R1.303961 C/C=C/CC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100102629194 [0,3,0,0,0,0|1,0,0]=4 3196 B18R1.303961 C=CCCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000754431 [0,3,0,0,0,0|1,0,0]=4 3197 B18R1.303961 C=CCNC(=O)c1ccc(c(c1OC)OC)OC 1626a_100020586998_100000211208 [0,3,0,0,0,0|1,0,0]=4 3198 B18R1.303961 C=CCNC(=O)c1ccc(c(c1OC)OC)OC 240690a_100020586998_100000211208 [0,3,0,0,0,0|1,0,0]=4 3199 B18R1.303961 C=CCNC(=O)c1ccc(c(c1OC)OC)OC 527a_100020586998_100000211208 [0,3,0,0,0,0|1,0,0]=4 3200 B18R1.303961 CC#CCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000748600 [0,3,0,0,0,0|1,0,0]=4 3201 B18R1.303961 CC=CCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000070051 [0,3,0,0,0,0|1,0,0]=4 3202 B18R1.303961 CCCCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000210211 [0,3,0,0,0,0|1,0,0]=4 3203 B18R1.303961 CCCNC(=O)c1ccc(c(c1OC)OC)OC 11a_100020643023_100000211208 [0,3,0,0,0,0|1,0,0]=4 3204 B18R1.303961 CCCNC(=O)c1ccc(c(c1OC)OC)OC 1626a_100020643023_100000211208 [0,3,0,0,0,0|1,0,0]=4 3205 B18R1.303961 CCCNC(=O)c1ccc(c(c1OC)OC)OC 240690a_100020643023_100000211208 [0,3,0,0,0,0|1,0,0]=4 3206 B18R1.303961 CCCNC(=O)c1ccc(c(c1OC)OC)OC 527a_100020643023_100000211208 [0,3,0,0,0,0|1,0,0]=4 3207 B18R1.303961 CCNCC(=O)c1ccc(c(c1OC)OC)OC 2230a_100015525214_200011320270 [0,3,0,0,0,0|1,0,0]=4 3208 B18R1.303961 CCNNC(=O)c1ccc(c(c1OC)OC)OC 22a_100000756455_100000211208 [0,3,0,0,0,0|1,0,0]=4 3209 B18R1.303961 CCSCC(=O)c1ccc(c(c1OC)OC)OC 62a_200011320270_100000210202 [0,3,0,0,0,0|0,1,0]=4 3210 B18R1.303961 COCCC(=O)c1ccc(c(c1OC)OC)OC 1458a_100000211208_100000233755 [0,3,0,0,0,0|0,0,0]=3 3211 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)CCC#N 1458a_100000211208_100011215226 [0,3,0,0,0,0|1,0,0]=4 3212 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)CCCF 1458a_100000211208_100011934791 [0,3,0,0,0,0|1,0,0]=4 3213 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)CCCO 1458a_100000211208_100011215043 [0,3,0,0,0,0|1,0,0]=4 3214 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)CCSC 1458a_100000211208_100000751147 [0,3,0,0,0,0|0,1,0]=4 3215 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)CSCF 62a_200011320270_100015361967 [0,3,0,0,0,0|0,1,0]=4 3216 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCC#N 1626a_100000734998_100000211208 [0,3,0,0,0,0|1,0,0]=4 3217 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCC#N 527a_100000734998_100000211208 [0,3,0,0,0,0|1,0,0]=4 3218 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCCF 11a_100000724931_100000211208 [0,3,0,0,0,0|1,0,0]=4 3219 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCCF 1626a_100000724931_100000211208 [0,3,0,0,0,0|1,0,0]=4 3220 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCCF 240690a_100000724931_100000211208 [0,3,0,0,0,0|1,0,0]=4 3221 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCCF 527a_100000724931_100000211208 [0,3,0,0,0,0|1,0,0]=4 3222 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCCO 240690a_100000210304_100000211208 [0,3,0,0,0,0|1,0,0]=4 3223 B18R1.303961 COc1ccc(c(c1OC)OC)C(=O)NCCO 527a_100000210304_100000211208 [0,3,0,0,0,0|1,0,0]=4 3224 B18R1.291875 COC(=O)c1ccc(c(c1C)SC(C)OC)OC 62a_100009879195_100010761468 [0,3,0,0,0,0|1,0,0]=4 3225 B18R1.291875 COC(=O)c1ccc(c(c1C)SC(C)OC)OC 62a_100010761468_100009879195 [0,3,0,0,0,0|1,0,0]=4 3226 B18R1.387320 CCOC=Cc1c(ccc(c1C)C(=O)OC)OC 271570a_100016256518_100010761468 [0,3,0,0,0,0|1,0,0]=4 3227 B18R1.387320 CCOCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000739092_100010761468 [0,3,0,0,0,0|1,0,0]=4 3228 B18R1.387320 CCOCSc1c(ccc(c1C)C(=O)OC)OC 62a_100010761468_100000739092 [0,3,0,0,0,0|1,0,0]=4 3229 B18R1.387320 COCC=Cc1c(ccc(c1C)C(=O)OC)OC 271570a_100016286323_100010761468 [0,3,0,0,0,0|1,0,0]=4 3230 B18R1.387320 COCCSc1c(ccc(c1C)C(=O)OC)OC 62a_100000233755_100010761468 [0,3,0,0,0,0|1,0,0]=4 3231 B18R1.387320 COCCSc1c(ccc(c1C)C(=O)OC)OC 62a_100010761468_100000233755 [0,3,0,0,0,0|1,0,0]=4 3232 B18R1.332591 CCOCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100011215890 [0,3,0,0,0,0|1,0,0]=4 3233 B18R1.332591 CCOCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100011215890 [0,3,0,0,0,0|1,0,0]=4 3234 B18R1.332591 CCOCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100011215890 [0,3,0,0,0,0|1,0,0]=4 3235 B18R1.332591 COCCCC(=O)c1ccc(c(c1Br)OC)OC 1458a_100010284110_100000740836 [0,3,0,0,0,0|1,0,0]=4 3236 B18R1.332591 COCCCC(=O)c1ccc(c(c1C)OC)OC 1458a_100000092638_100000740836 [0,3,0,0,0,0|1,0,0]=4 3237 B18R1.332591 COCCCC(=O)c1ccc(c(c1Cl)OC)OC 1458a_100011216413_100000740836 [0,3,0,0,0,0|1,0,0]=4 3238 B18R1.332591 COCCNC(=O)c1ccc(c(c1Br)OC)OC 1626a_100000209980_100010284110 [0,3,0,0,0,0|1,0,0]=4 3239 B18R1.332591 COCCNC(=O)c1ccc(c(c1Br)OC)OC 240690a_100000209980_100010284110 [0,3,0,0,0,0|1,0,0]=4 3240 B18R1.332591 COCCNC(=O)c1ccc(c(c1Br)OC)OC 527a_100000209980_100010284110 [0,3,0,0,0,0|1,0,0]=4 3241 B18R1.332591 COCCNC(=O)c1ccc(c(c1C)OC)OC 1626a_100000209980_100000092638 [0,3,0,0,0,0|1,0,0]=4 3242 B18R1.332591 COCCNC(=O)c1ccc(c(c1C)OC)OC 240690a_100000209980_100000092638 [0,3,0,0,0,0|1,0,0]=4 3243 B18R1.332591 COCCNC(=O)c1ccc(c(c1C)OC)OC 527a_100000209980_100000092638 [0,3,0,0,0,0|1,0,0]=4 3244 B18R1.332591 COCCNC(=O)c1ccc(c(c1Cl)OC)OC 1626a_100000209980_100011216413 [0,3,0,0,0,0|1,0,0]=4 3245 B18R1.332591 COCCNC(=O)c1ccc(c(c1Cl)OC)OC 240690a_100000209980_100011216413 [0,3,0,0,0,0|1,0,0]=4 3246 B18R1.332591 COCCNC(=O)c1ccc(c(c1Cl)OC)OC 527a_100000209980_100011216413 [0,3,0,0,0,0|1,0,0]=4 3247 B14R1.2282 C=Cc1cc(c(cc1OC)OC)OC 271570a_100011290941_100000050122 [1,0,1,1,0,0|1,0,0]=4 3248 B14R2.966 CCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210202 [2,0,0,1,0,0|1,0,0]=4 3249 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 11a_106832991635_100000210863 [2,0,0,1,0,0|1,0,0]=4 3250 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 1626a_100102657272_100000210863 [2,0,0,1,0,0|1,0,0]=4 3251 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 240690a_100102657272_100000210863 [2,0,0,1,0,0|1,0,0]=4 3252 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 527a_100102657272_100000210863 [2,0,0,1,0,0|1,0,0]=4 3253 B14R2.2167 COc1cc2c(cc1C)COC2=O 7a_200010662192_200000210301 [2,0,0,1,0,0|0,0,0]=3 3254 B14R2.2167 COc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010233615 [2,0,0,1,0,0|1,0,0]=4 3255 B14R2.2167 Cc1cc2c(cc1O[13CH3])C(=O)OC2 7a_200010662192_200025704644 [2,0,0,1,0,0|0,0,0]=3 3256 B14R2.3818 COc1c(ccc2c1CCC2=O)C 34a_100009867297_200000210301 [2,0,0,1,0,0|1,0,0]=4 3257 B14R2.3818 COc1c(ccc2c1CCC2=O)C 7a_100009867297_200000210301 [2,0,0,1,0,0|1,0,0]=4 3258 B14R2.3818 Cc1ccc2c(c1O[13CH3])CCC2=O 34a_100009867297_200025704644 [2,0,0,1,0,0|1,0,0]=4 3259 B14R2.3818 Cc1ccc2c(c1O[13CH3])CCC2=O 7a_100009867297_200025704644 [2,0,0,1,0,0|1,0,0]=4 3260 B14R2.112 CC=Cc1ccc2c(c1)OCCO2 271570a_100016259895_100000184379 [2,0,0,1,0,0|1,0,0]=4 3261 B14R2.112 COCc1ccc2c(c1)OCCO2 34a_100000745213_200000210301 [2,0,0,1,0,0|0,0,1]=4 3262 B14R2.112 [13CH3]OCc1ccc2c(c1)OCCO2 34a_100000745213_200025704644 [2,0,0,1,0,0|0,0,1]=4 3263 B14R2.1416 COc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_200010010916 [2,0,0,1,0,0|1,0,0]=4 3264 B14R2.1802 COc1ccc2c(c1C)COC2=O 7a_100010675704_200000210301 [2,0,0,1,0,0|0,0,0]=3 3265 B14R2.1802 COc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010212354 [2,0,0,1,0,0|1,0,0]=4 3266 B14R2.1802 CSc1ccc2c(c1C)COC2=O 62a_100010986288_200000210301 [2,0,0,1,0,0|0,1,0]=4 3267 B14R2.1802 Cc1c(ccc2c1COC2=O)O[13CH3] 7a_100010675704_200025704644 [2,0,0,1,0,0|0,0,0]=3 3268 B14R2.1802 Cc1c(ccc2c1COC2=O)S[13CH3] 62a_100010986288_200025704644 [2,0,0,1,0,0|0,1,0]=4 3269 B14R2.781 C=C(C)c1ccc2c(c1)OCCO2 271570a_100000694244_100000184379 [2,0,0,1,0,0|1,0,0]=4 3270 B14R2.781 CC(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_200000210301 [2,0,0,1,0,0|1,0,0]=4 3271 B14R2.781 CC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_200000210301 [2,0,0,1,0,0|0,0,0]=3 3272 B14R2.781 [13CH3]C(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_200025704644 [2,0,0,1,0,0|1,0,0]=4 3273 B14R2.781 [13CH3]C(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_200025704644 [2,0,0,1,0,0|0,0,0]=3 3274 B14R2.5998 CC(=O)c1ccc2c(c1C)OCO2 1458a_100009908537_200000210301 [2,0,0,1,0,0|1,0,0]=4 3275 B14R2.5998 Cc1c(ccc2c1OCO2)C(=O)[13CH3] 1458a_100009908537_200025704644 [2,0,0,1,0,0|1,0,0]=4 3276 B14R2.8653 CC(=O)c1ccc(c2c1OCO2)O 271570a_203496583355_100021123059 [2,0,0,1,0,0|0,0,0]=3 3277 B14R2.1801 COc1ccc2c(c1)OCCC2=O 34a_100000089553_200000210301 [2,0,0,1,0,0|1,0,0]=4 3278 B14R2.1801 COc1ccc2c(c1)OCCC2=O 7a_100000089553_200000210301 [2,0,0,1,0,0|1,0,0]=4 3279 B14R2.1801 [13CH3]Oc1ccc2c(c1)OCCC2=O 34a_100000089553_200025704644 [2,0,0,1,0,0|1,0,0]=4 3280 B14R2.1801 [13CH3]Oc1ccc2c(c1)OCCC2=O 7a_100000089553_200025704644 [2,0,0,1,0,0|1,0,0]=4 3281 B14R2.1078 COc1cccc2c1OCCC2=O 34a_100009867664_200000210301 [2,0,0,1,0,0|1,0,0]=4 3282 B14R2.1078 COc1cccc2c1OCCC2=O 7a_100009867664_200000210301 [2,0,0,1,0,0|1,0,0]=4 3283 B14R2.1078 [13CH3]Oc1cccc2c1OCCC2=O 34a_100009867664_200025704644 [2,0,0,1,0,0|1,0,0]=4 3284 B14R2.1078 [13CH3]Oc1cccc2c1OCCC2=O 7a_100009867664_200025704644 [2,0,0,1,0,0|1,0,0]=4 3285 B14R2.10782 CCC(=O)c1cccc2c1OCO2 1458a_100000048783_100000210202 [2,0,0,1,0,0|1,0,0]=4 3286 B14R2.10782 CNC(=O)c1cccc2c1OCO2 11a_106832991635_100000048783 [2,0,0,1,0,0|1,0,0]=4 3287 B14R2.10782 CNC(=O)c1cccc2c1OCO2 1626a_100102657272_100000048783 [2,0,0,1,0,0|1,0,0]=4 3288 B14R2.10782 CNC(=O)c1cccc2c1OCO2 240690a_100102657272_100000048783 [2,0,0,1,0,0|1,0,0]=4 3289 B14R2.10782 CNC(=O)c1cccc2c1OCO2 527a_100102657272_100000048783 [2,0,0,1,0,0|1,0,0]=4 3290 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)OC 34a_100000149373_200000210301 [0,0,1,1,0,1|1,0,0]=4 3291 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)OC 34a_100000724557_200000210301 [0,0,1,1,0,1|1,0,0]=4 3292 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)O[13CH3] 34a_100000149373_200025704644 [0,0,1,1,0,1|1,0,0]=4 3293 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)O[13CH3])OC 34a_100000724557_200025704644 [0,0,1,1,0,1|1,0,0]=4 3294 B16R1.20152 COC(=O)c1ccc(cc1C(=O)OC)OC 34a_100009991906_200000210301 [0,1,1,1,0,0|1,0,0]=4 3295 B16R1.20152 COC(=O)c1ccc(cc1C(=O)OC)OC 7a_100009991906_200000210301 [0,1,1,1,0,0|1,0,0]=4 3296 B16R1.20152 COC(=O)c1ccc(cc1C(=O)OC)O[13CH3] 34a_100009991906_200025704644 [0,1,1,1,0,0|1,0,0]=4 3297 B16R1.20152 COC(=O)c1ccc(cc1C(=O)OC)O[13CH3] 7a_100009991906_200025704644 [0,1,1,1,0,0|1,0,0]=4 3298 B16R1.20042 COC(=O)Cc1cc(c(cc1O)OC)OC 271570a_203496583355_200009812594 [0,1,1,1,0,0|0,0,1]=4 3299 B16R2.148 COC(=O)c1ccoc1C2=CCCCO2 271570a_100010177797_100011935261 [0,0,1,2,0,0|1,0,0]=4 3300 B16R2.148 COC(=O)c1ccoc1C2=COCCC2 271570a_100010175576_100011935261 [0,0,1,2,0,0|1,0,0]=4 3301 B16R2.40075 CCC(=O)c1cc(c2c(c1)OCO2)OC 1458a_100011218003_100000210202 [1,1,0,1,0,0|1,0,0]=4 3302 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 11a_106832991635_100011218003 [1,1,0,1,0,0|1,0,0]=4 3303 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 1626a_100102657272_100011218003 [1,1,0,1,0,0|1,0,0]=4 3304 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 240690a_100102657272_100011218003 [1,1,0,1,0,0|1,0,0]=4 3305 B16R2.40075 CNC(=O)c1cc(c2c(c1)OCO2)OC 527a_100102657272_100011218003 [1,1,0,1,0,0|1,0,0]=4 3306 B16R2.40075 COC(=O)c1cc2c(c(c1)SC)OCC2 62a_100021627132_200000210301 [1,1,0,1,0,0|0,1,0]=4 3307 B16R2.40075 COC(=O)c1cc2c(c(c1)SC)OCC2 62a_200000210301_100021627132 [1,1,0,1,0,0|0,1,0]=4 3308 B16R2.40075 COC(=O)c1cc2c(c(c1)S[13CH3])OCC2 62a_100021627132_200025704644 [1,1,0,1,0,0|0,1,0]=4 3309 B16R2.40075 COC(=O)c1cc2c(c(c1)S[13CH3])OCC2 62a_200025704644_100021627132 [1,1,0,1,0,0|0,1,0]=4 3310 B16R2.767 CCCC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210303 [1,1,0,1,0,0|1,0,0]=4 3311 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 11a_100015525214_100000182659 [1,1,0,1,0,0|1,0,0]=4 3312 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 240690a_100015525214_100000182659 [1,1,0,1,0,0|1,0,0]=4 3313 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 527a_100015525214_100000182659 [1,1,0,1,0,0|1,0,0]=4 3314 B16R2.767 CNCC(=O)c1ccc2c(c1)OCCO2 2230a_106832991635_100000185173 [1,1,0,1,0,0|1,0,0]=4 3315 B16R2.767 CNCC(=O)c1ccc2c(c1)OCCO2 34a_100102657272_100000185173 [1,1,0,1,0,0|1,0,0]=4 3316 B16R2.767 CNCC(=O)c1ccc2c(c1)OCCO2 7a_106832991635_100000185173 [1,1,0,1,0,0|1,0,0]=4 3317 B16R2.767 CNNC(=O)c1ccc2c(c1)OCCO2 22a_100016993582_100000182659 [1,1,0,1,0,0|1,0,0]=4 3318 B16R2.767 COCC(=O)c1ccc2c(c1)OCCO2 34a_100138415774_100000185173 [1,1,0,1,0,0|0,0,0]=3 3319 B16R2.767 CSCC(=O)c1ccc2c(c1)OCCO2 62a_100000185173_200000210301 [1,1,0,1,0,0|0,1,0]=4 3320 B16R2.767 CSCC(=O)c1ccc2c(c1)OCCO2 62a_200000210301_100000185173 [1,1,0,1,0,0|0,1,0]=4 3321 B16R2.767 O=C(CCF)c1ccc2c(c1)OCCO2 1458a_100000182659_100011217306 [1,1,0,1,0,0|1,0,0]=4 3322 B16R2.767 O=C(CCO)c1ccc2c(c1)OCCO2 1458a_100000182659_100000211926 [1,1,0,1,0,0|1,0,0]=4 3323 B16R2.767 [13CH3]SCC(=O)c1ccc2c(c1)OCCO2 62a_100000185173_200025704644 [1,1,0,1,0,0|0,1,0]=4 3324 B16R2.767 [13CH3]SCC(=O)c1ccc2c(c1)OCCO2 62a_200025704644_100000185173 [1,1,0,1,0,0|0,1,0]=4 3325 B16R2.2275 COc1ccc(cc1OC)C2=CCOC2 271570a_100009872500_100000187503 [1,1,0,1,0,0|1,0,0]=4 3326 B16R2.2275 COc1ccc(cc1OC)C2=COCC2 271570a_100000118173_100000187503 [1,1,0,1,0,0|1,0,0]=4 3327 B16R2.6461 COC(=O)c1ccc(c(c1)C2CC2)OC 271570a_100011220607_100000189012 [1,1,0,1,0,0|1,0,0]=4 3328 B16R2.6891 COC(=O)c1ccc(c(c1)OC)C2CC2 271570a_100011220607_100009816954 [1,1,0,1,0,0|1,0,0]=4 3329 B16R2.171832 CCC(=O)c1ccc2c(c1)OCCCO2 1458a_100000198587_100000210202 [1,1,0,1,0,0|1,0,0]=4 3330 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 11a_106832991635_100000198587 [1,1,0,1,0,0|1,0,0]=4 3331 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 1626a_100102657272_100000198587 [1,1,0,1,0,0|1,0,0]=4 3332 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 240690a_100102657272_100000198587 [1,1,0,1,0,0|1,0,0]=4 3333 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 527a_100102657272_100000198587 [1,1,0,1,0,0|1,0,0]=4 3334 B16R2.6284 CC(C)C(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210206 [1,1,0,1,0,0|1,0,0]=4 3335 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 11a_100102631434_100000182659 [1,1,0,1,0,0|1,0,0]=4 3336 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 1626a_100102631434_100000182659 [1,1,0,1,0,0|1,0,0]=4 3337 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 240690a_100102631434_100000182659 [1,1,0,1,0,0|1,0,0]=4 3338 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 527a_100102631434_100000182659 [1,1,0,1,0,0|1,0,0]=4 3339 B16R2.51551 CC(=O)c1ccc(c2c1OCO2)SCF 62a_100021123059_100015361967 [1,1,0,1,0,0|0,1,0]=4 3340 B16R2.51551 CC=Cc1ccc(c2c1OCO2)C(=O)C 271570a_100016259895_100021123059 [1,1,0,1,0,0|1,0,0]=4 3341 B16R2.51551 CCSc1ccc(c2c1OCO2)C(=O)C 62a_100021123059_100000210202 [1,1,0,1,0,0|0,1,0]=4 3342 B16R2.145582 C=C(C)c1ccc(c2c1OCO2)C(=O)C 271570a_100000694244_100021123059 [1,1,0,1,0,0|1,0,0]=4 3343 B18R2.9347 COC(=O)CSc1ccc2c(c1C)OCCO2 62a_100000747449_100010072848 [0,0,0,1,0,2|1,0,0]=4 3344 B18R2.9347 COC(=O)CSc1ccc2c(c1C)OCCO2 62a_100010072848_100000747449 [0,0,0,1,0,2|1,0,0]=4 3345 B18R2.834402 COc1ccc(c(c1OC)Cl)CC(=O)C2CO2 1458a_100000701028_100011890039 [0,1,0,1,0,1|1,0,0]=4 3346 B18R2.114350 COc1ccc(c(c1OC)OC)C2=CCOC2 271570a_100009872500_100011320274 [0,2,0,1,0,0|1,0,0]=4 3347 B18R2.114350 COc1ccc(c(c1OC)OC)C2=COCC2 271570a_100000118173_100011320274 [0,2,0,1,0,0|1,0,0]=4 3348 B18R2.867462 COc1ccc(c(c1OC)Br)C(=O)CC2CO2 1458a_100010284110_100011216344 [0,2,0,1,0,0|1,0,0]=4 3349 B18R2.867462 COc1ccc(c(c1OC)Br)C(=O)C[C@@H]2CO2 1458a_100010284110_100000745022 [0,2,0,1,0,0|1,0,0]=4 3350 B18R2.867462 COc1ccc(c(c1OC)C)C(=O)CC2CO2 1458a_100000092638_100011216344 [0,2,0,1,0,0|1,0,0]=4 3351 B18R2.867462 COc1ccc(c(c1OC)C)C(=O)C[C@@H]2CO2 1458a_100000092638_100000745022 [0,2,0,1,0,0|1,0,0]=4 3352 B18R2.867462 COc1ccc(c(c1OC)Cl)C(=O)CC2CO2 1458a_100011216413_100011216344 [0,2,0,1,0,0|1,0,0]=4 3353 B18R2.867462 COc1ccc(c(c1OC)Cl)C(=O)C[C@@H]2CO2 1458a_100011216413_100000745022 [0,2,0,1,0,0|1,0,0]=4 3354 B12R1.63 COC(=O)c1cc(c(s1)OC)O 271570a_203496583355_100134754287 [2,0,0,0,1,0|1,0,0]=4 3355 B12R1.743 COC(=O)c1csc(c1OC)O 271570a_203496583355_100010277438 [2,0,0,0,1,0|1,0,0]=4 3356 B12R1.743 COC(=O)c1scc(c1OC)O 271570a_203496583355_200009814288 [2,0,0,0,1,0|1,0,0]=4 3357 B14R1.3714 CCC(=O)Nc1ccc(cc1O)OC 22a_100016989039_100000210414 [2,0,0,0,0,1|1,0,0]=4 3358 B14R1.3714 CCC(=O)Nc1ccc(cc1O)OC 527a_100016989039_100000210414 [2,0,0,0,0,1|1,0,0]=4 3359 B14R1.3714 CNC(=O)Nc1ccc(cc1O)OC 2430a_100016989039_100102657272 [2,0,0,0,0,1|1,0,0]=4 3360 B14R1.3714 COC(=O)Cc1ccc(cc1F)OC 34a_100009869613_200000210301 [2,0,0,0,0,1|1,0,0]=4 3361 B14R1.3714 COC(=O)Cc1ccc(cc1F)OC 7a_100009869613_200000210301 [2,0,0,0,0,1|1,0,0]=4 3362 B14R1.3714 COC(=O)Cc1ccc(cc1F)O[13CH3] 34a_100009869613_200025704644 [2,0,0,0,0,1|1,0,0]=4 3363 B14R1.3714 COC(=O)Cc1ccc(cc1F)O[13CH3] 7a_100009869613_200025704644 [2,0,0,0,0,1|1,0,0]=4 3364 B14R1.3714 COC(=O)Cc1ccc(cc1O)SC 62a_100010150832_200000210301 [2,0,0,0,0,1|0,1,0]=4 3365 B14R1.3714 COC(=O)Cc1ccc(cc1O)SC 62a_200000210301_100010150832 [2,0,0,0,0,1|0,1,0]=4 3366 B14R1.3714 COC(=O)Cc1ccc(cc1O)S[13CH3] 62a_100010150832_200025704644 [2,0,0,0,0,1|0,1,0]=4 3367 B14R1.3714 COC(=O)Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100010150832 [2,0,0,0,0,1|0,1,0]=4 3368 B14R1.357 CCC(=O)c1cc(cc(c1)OC)OC 1458a_100000210870_100000210202 [1,0,0,0,1,1|1,0,0]=4 3369 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 11a_106832991635_100000210870 [1,0,0,0,1,1|1,0,0]=4 3370 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 1626a_100102657272_100000210870 [1,0,0,0,1,1|1,0,0]=4 3371 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 240690a_100102657272_100000210870 [1,0,0,0,1,1|1,0,0]=4 3372 B14R1.357 CNC(=O)c1cc(cc(c1)OC)OC 527a_100102657272_100000210870 [1,0,0,0,1,1|1,0,0]=4 3373 B14R1.357 COC(=O)c1cc(cc(c1)OC)OC 34a_100000076322_200000210301 [1,0,0,0,1,1|0,0,0]=3 3374 B14R1.357 COC(=O)c1cc(cc(c1)OC)OC 7a_100000076322_200000210301 [1,0,0,0,1,1|0,0,0]=3 3375 B14R1.357 COC(=O)c1cc(cc(c1)O[13CH3])OC 34a_100000076322_200025704644 [1,0,0,0,1,1|0,0,0]=3 3376 B14R1.357 COC(=O)c1cc(cc(c1)O[13CH3])OC 7a_100000076322_200025704644 [1,0,0,0,1,1|0,0,0]=3 3377 B14R1.357 COC(=O)c1cc(cc(c1)SC)OC 62a_200000210301_200010233337 [1,0,0,0,1,1|0,1,0]=4 3378 B14R1.357 COC(=O)c1cc(cc(c1)SC)OC 62a_200010233337_200000210301 [1,0,0,0,1,1|0,1,0]=4 3379 B14R1.357 COC(=O)c1cc(cc(c1)S[13CH3])OC 62a_200010233337_200025704644 [1,0,0,0,1,1|0,1,0]=4 3380 B14R1.357 COC(=O)c1cc(cc(c1)S[13CH3])OC 62a_200025704644_200010233337 [1,0,0,0,1,1|0,1,0]=4 3381 B14R1.357 COC(=O)c1cc(nc(c1)SC)OC 62a_100009994165_200000210301 [1,0,0,0,1,1|0,1,0]=4 3382 B14R1.357 COC(=O)c1cc(nc(c1)SC)OC 62a_200000210301_100009994165 [1,0,0,0,1,1|0,1,0]=4 3383 B14R1.357 COC(=O)c1cc(nc(c1)S[13CH3])OC 62a_100009994165_200025704644 [1,0,0,0,1,1|0,1,0]=4 3384 B14R1.357 COC(=O)c1cc(nc(c1)S[13CH3])OC 62a_200025704644_100009994165 [1,0,0,0,1,1|0,1,0]=4 3385 B16R1.20120 COC(=O)CNc1ccc(c(c1C)C)OC 2230a_100025755787_100000747449 [1,0,0,0,0,2|1,0,0]=4 3386 B16R1.20120 COC(=O)CNc1ccc(c(c1C)C)OC 34a_100025755787_100000747449 [1,0,0,0,0,2|1,0,0]=4 3387 B16R1.20120 COC(=O)CNc1ccc(c(c1C)C)OC 7a_100025755787_100000747449 [1,0,0,0,0,2|1,0,0]=4 3388 B16R1.20120 COC(=O)CSc1ccc(c(c1C)C)OC 62a_100000049725_100000747449 [1,0,0,0,0,2|1,0,0]=4 3389 B16R1.20120 COC(=O)CSc1ccc(c(c1C)C)OC 62a_100000747449_100000049725 [1,0,0,0,0,2|1,0,0]=4 3390 B18R1.291448 CCC(=O)NN=Cc1ccc(c(c1O)OC)OC 4a_100000183195_100000073574 [0,0,0,0,0,3|1,0,0]=4 3391 B18R1.291448 COC(=O)CCSc1ccc(c(c1C)OC)OC 62a_100000204255_100010000156 [0,0,0,0,0,3|1,0,0]=4 3392 B18R1.291448 COC(=O)CNCc1ccc(c(c1Cl)OC)OC 34a_102515433231_100000747449 [0,0,0,0,0,3|1,0,0]=4 3393 B18R1.291448 COC(=O)COCc1ccc(c(c1Cl)OC)OC 34a_100011218542_100000747449 [0,0,0,0,0,3|1,0,0]=4 3394 B18R1.291448 COC(=O)COCc1ccc(c(c1Cl)OC)OC 7a_100011218542_100000747449 [0,0,0,0,0,3|1,0,0]=4 3395 B18R1.291448 COC(=O)CSCc1ccc(c(c1Cl)OC)OC 62a_100000747449_100011890039 [0,0,0,0,0,3|1,0,0]=4