0 B13R1.45 C=C(C)CCC(=O)c1ccccc1 1458a_100000185807_100000730704 [0,0,0,0,0,0|1,0,2]=3 1 B13R1.45 C=C(C)CNC(=O)c1ccccc1 11a_100000765925_100000185807 [0,0,0,0,0,0|1,0,2]=3 2 B13R1.45 C=C(C)CNC(=O)c1ccccc1 1626a_100000765925_100000185807 [0,0,0,0,0,0|1,0,2]=3 3 B13R1.45 C=C(C)CNC(=O)c1ccccc1 240690a_100000765925_100000185807 [0,0,0,0,0,0|1,0,2]=3 4 B13R1.45 C=C(C)CNC(=O)c1ccccc1 527a_100000765925_100000185807 [0,0,0,0,0,0|1,0,2]=3 5 B13R1.45 C=C(C)COC(C)c1ccccc1 34a_100000210245_100000211855 [0,0,0,0,0,0|1,0,3]=4 6 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000748629 [0,0,0,0,0,0|1,0,3]=4 7 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000748629 [0,0,0,0,0,0|1,0,3]=4 8 B13R1.45 CC(=CCC(=O)c1ccccc1)C 1458a_100000185807_100000761012 [0,0,0,0,0,0|1,0,2]=3 9 B13R1.45 CC(=NNC(C)C)c1ccccc1 4a_100000741168_100000185851 [0,0,0,0,0,0|3,0,0]=3 10 B13R1.45 CC(=NNC(C)C)c1ccccn1 4a_100000741168_100000210467 [0,0,0,0,0,0|4,0,0]=4 11 B13R1.45 CC(=NNC(C)C)c1cccnc1 4a_100000741168_100000210468 [0,0,0,0,0,0|4,0,0]=4 12 B13R1.45 CC(=NNC(C)C)c1ccncc1 4a_100000741168_100000185792 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.45 CC(=O)CCC(=O)c1ccccc1 1458a_100000070787_100000750707 [0,0,0,0,0,0|2,0,1]=3 14 B13R1.45 CC(=O)CNC(=O)c1ccccc1 1458a_100000182045_200000210301 [0,0,0,0,0,0|2,0,1]=3 15 B13R1.45 CC(=O)CNC(=O)c1cccnc1 1458a_100000688122_200000210301 [0,0,0,0,0,0|3,0,1]=4 16 B13R1.45 CC(=O)COC(=O)c1ccccc1 1458a_100000070787_100000073877 [0,0,0,0,0,0|1,0,1]=2 17 B13R1.45 CC(=O)COC(C)c1ccccc1 34a_100000211253_100000211855 [0,0,0,0,0,0|2,0,2]=4 18 B13R1.45 CC(=O)CSC(=S)c1ccccc1 1458a_100000043459_200000210301 [0,0,0,0,0,0|1,2,1]=4 19 B13R1.45 CC(=O)NNC(=O)c1ccccc1 22a_100000184135_100000070787 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.45 CC(=O)NNC(=O)c1ccccc1 22a_100000189765_100000185807 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.45 CC(Br)COC(C)c1ccccc1 34a_100012180447_100000211855 [0,0,0,0,0,0|2,0,1]=3 22 B13R1.45 CC(C)CCC(=O)c1ccccc1 1458a_100000185807_100000210312 [0,0,0,0,0,0|1,0,0]=1 23 B13R1.45 CC(C)CCN(C)c1ccccc1 2230a_100000210012_100000210312 [0,0,0,0,0,0|3,0,0]=3 24 B13R1.45 CC(C)CCN(C)c1ccccc1 269982a_100000210012_100000210312 [0,0,0,0,0,0|3,0,0]=3 25 B13R1.45 CC(C)CCN(C)c1ccccc1 34a_100000210012_100000210312 [0,0,0,0,0,0|3,0,0]=3 26 B13R1.45 CC(C)CNC(=O)c1ccccc1 11a_100000210953_100000185807 [0,0,0,0,0,0|1,0,0]=1 27 B13R1.45 CC(C)CNC(=O)c1ccccc1 1626a_100000210953_100000185807 [0,0,0,0,0,0|1,0,0]=1 28 B13R1.45 CC(C)CNC(=O)c1ccccc1 240690a_100000210953_100000185807 [0,0,0,0,0,0|1,0,0]=1 29 B13R1.45 CC(C)CNC(=O)c1ccccc1 527a_100000210953_100000185807 [0,0,0,0,0,0|1,0,0]=1 30 B13R1.45 CC(C)CNC(C)c1ccccc1 2230a_100000210953_100000230085 [0,0,0,0,0,0|2,0,1]=3 31 B13R1.45 CC(C)CNC(C)c1ccccc1 269862a_100000210953_100000185851 [0,0,0,0,0,0|2,0,1]=3 32 B13R1.45 CC(C)CNC(C)c1ccccc1 34a_100000210953_100000211855 [0,0,0,0,0,0|2,0,1]=3 33 B13R1.45 CC(C)CNC(C)c1ccccn1 2230a_100000181244_100000210760 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.45 CC(C)CNC(C)c1ccccn1 269862a_100000210953_100000210467 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.45 CC(C)CNC(C)c1ccccn1 270004a_100000181244_100000210432 [0,0,0,0,0,0|3,0,1]=4 36 B13R1.45 CC(C)CNC(C)c1cccnc1 2230a_100000195435_100000210760 [0,0,0,0,0,0|3,0,1]=4 37 B13R1.45 CC(C)CNC(C)c1cccnc1 269862a_100000210953_100000210468 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.45 CC(C)CNC(C)c1cccnc1 270004a_100000195435_100000210432 [0,0,0,0,0,0|3,0,1]=4 39 B13R1.45 CC(C)CNC(C)c1ccncc1 2230a_100000181269_100000210760 [0,0,0,0,0,0|3,0,1]=4 40 B13R1.45 CC(C)CNC(C)c1ccncc1 269862a_100000210953_100000185792 [0,0,0,0,0,0|3,0,1]=4 41 B13R1.45 CC(C)CNC(C)c1ccncc1 270004a_100000181269_100000210432 [0,0,0,0,0,0|3,0,1]=4 42 B13R1.45 CC(C)CN[C@H](C)c1ccccc1 2230a_100000751104_100000210760 [0,0,0,0,0,0|2,0,1]=3 43 B13R1.45 CC(C)CN[C@H](C)c1ccccc1 270004a_100000751104_100000210432 [0,0,0,0,0,0|2,0,1]=3 44 B13R1.45 CC(C)COC(C)c1ccccc1 34a_100000210257_100000211855 [0,0,0,0,0,0|1,0,1]=2 45 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000210624 [0,0,0,0,0,0|1,0,1]=2 46 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000210760 [0,0,0,0,0,0|1,0,1]=2 47 B13R1.45 CC(C)CSC(C)c1ccccc1 62a_100000210624_100000230085 [0,0,0,0,0,0|1,1,1]=3 48 B13R1.45 CC(C)CSC(C)c1ccccc1 62a_100000230085_100000210760 [0,0,0,0,0,0|1,1,1]=3 49 B13R1.45 CC(C)NCC(=O)c1ccccn1 34a_100138425928_100000027445 [0,0,0,0,0,0|3,0,0]=3 50 B13R1.45 CC(C)NCC(C)c1ccccc1 2230a_100000701038_100000210206 [0,0,0,0,0,0|3,0,1]=4 51 B13R1.45 CC(C)NCC(C)c1ccccc1 2230a_100138425928_100000756946 [0,0,0,0,0,0|3,0,1]=4 52 B13R1.45 CC(C)NCC(C)c1ccccc1 34a_100000701038_100000210206 [0,0,0,0,0,0|3,0,1]=4 53 B13R1.45 CC(C)NCC(C)c1ccccc1 34a_100138425928_100000756946 [0,0,0,0,0,0|3,0,1]=4 54 B13R1.45 CC(C)NCC(O)c1ccccc1 2230a_100000210709_100000210206 [0,0,0,0,0,0|2,0,2]=4 55 B13R1.45 CC(C)NCC(O)c1ccccc1 2230a_100138425928_100000185958 [0,0,0,0,0,0|2,0,2]=4 56 B13R1.45 CC(C)NCC(O)c1ccccc1 34a_100138425928_100000185958 [0,0,0,0,0,0|2,0,2]=4 57 B13R1.45 CC(C)NC[C@@H](O)c1ccccc1 2230a_100138425928_100011933945 [0,0,0,0,0,0|2,0,2]=4 58 B13R1.45 CC(C)NC[C@@H](O)c1ccccc1 34a_100138425928_100011933945 [0,0,0,0,0,0|2,0,2]=4 59 B13R1.45 CC(C)NNC(=O)c1ccccc1 22a_100000741168_100000185807 [0,0,0,0,0,0|2,0,0]=2 60 B13R1.45 CC(C)OCC(=O)c1ccccn1 34a_100000212225_100000027445 [0,0,0,0,0,0|3,0,0]=3 61 B13R1.45 CC(C)OCC(C)c1ccccc1 34a_100000212225_100000756946 [0,0,0,0,0,0|3,0,1]=4 62 B13R1.45 CC(C)OCC(C)c1ccccc1 34a_100011215166_100000210206 [0,0,0,0,0,0|3,0,1]=4 63 B13R1.45 CC(C)OCC(C)c1ccccc1 7a_100011215166_100000210206 [0,0,0,0,0,0|3,0,1]=4 64 B13R1.45 CC(C)OCC(O)c1ccccc1 34a_100000212225_100000185958 [0,0,0,0,0,0|2,0,2]=4 65 B13R1.45 CC(C)OCN(C)c1ccccc1 2230a_100000210012_100000709892 [0,0,0,0,0,0|4,0,0]=4 66 B13R1.45 CC(C)OCN(C)c1ccccc1 269982a_100000210012_100000709892 [0,0,0,0,0,0|4,0,0]=4 67 B13R1.45 CC(C)OCN(C)c1ccccc1 34a_100000210012_100000709892 [0,0,0,0,0,0|4,0,0]=4 68 B13R1.45 CC(C)OC[C@@H](N)c1ccccc1 34a_100000751927_100000210206 [0,0,0,0,0,0|3,0,1]=4 69 B13R1.45 CC(C)OC[C@@H](O)c1ccccc1 34a_100000212225_100011933945 [0,0,0,0,0,0|2,0,2]=4 70 B13R1.45 CC(C)SCC(=O)c1ccccc1 62a_100000210206_100000211460 [0,0,0,0,0,0|2,0,0]=2 71 B13R1.45 CC(C)SCC(=O)c1ccccc1 62a_100000211460_100000210206 [0,0,0,0,0,0|2,0,0]=2 72 B13R1.45 CC(C)SCC(=O)c1ccccn1 62a_100000027445_100000210206 [0,0,0,0,0,0|3,0,0]=3 73 B13R1.45 CC(C)SCC(=O)c1ccccn1 62a_100000210206_100000027445 [0,0,0,0,0,0|3,0,0]=3 74 B13R1.45 CC(C)SCC(=O)c1cccnc1 62a_100000210206_100000757877 [0,0,0,0,0,0|3,0,0]=3 75 B13R1.45 CC(C)SCC(=O)c1cccnc1 62a_100000757877_100000210206 [0,0,0,0,0,0|3,0,0]=3 76 B13R1.45 CC(C)SCC(=O)c1ccncc1 62a_100000027454_100000210206 [0,0,0,0,0,0|3,0,0]=3 77 B13R1.45 CC(C)SCC(=O)c1ccncc1 62a_100000210206_100000027454 [0,0,0,0,0,0|3,0,0]=3 78 B13R1.45 CC(C)SCC(=O)c1ncccn1 62a_100000210206_100020636365 [0,0,0,0,0,0|4,0,0]=4 79 B13R1.45 CC(C)SCC(=O)c1ncccn1 62a_100020636365_100000210206 [0,0,0,0,0,0|4,0,0]=4 80 B13R1.45 CC(C)SCC(C)c1ccccc1 62a_100000210206_100000756946 [0,0,0,0,0,0|3,0,1]=4 81 B13R1.45 CC(C)SCC(C)c1ccccc1 62a_100000756946_100000210206 [0,0,0,0,0,0|3,0,1]=4 82 B13R1.45 CC(C)SCC(O)c1ccccc1 62a_100000185958_100000210206 [0,0,0,0,0,0|2,0,2]=4 83 B13R1.45 CC(C)SCC(O)c1ccccc1 62a_100000210206_100000185958 [0,0,0,0,0,0|2,0,2]=4 84 B13R1.45 CC(C)SCS(=O)c1ccccc1 62a_100000210206_100000031784 [0,0,0,0,0,0|3,0,0]=3 85 B13R1.45 CC(C)SC[C@@H](O)c1ccccc1 62a_100000210206_100011933945 [0,0,0,0,0,0|2,0,2]=4 86 B13R1.45 CC(C)SC[C@@H](O)c1ccccc1 62a_100011933945_100000210206 [0,0,0,0,0,0|2,0,2]=4 87 B13R1.45 CC(CCN(C)C)c1ccccc1 270004a_100102631434_100000189432 [0,0,0,0,0,0|3,0,1]=4 88 B13R1.45 CC(F)COC(C)c1ccccc1 34a_100015925927_100000211855 [0,0,0,0,0,0|2,0,1]=3 89 B13R1.45 CC(O)CCC(=O)c1ccccc1 1458a_100000185807_100012276601 [0,0,0,0,0,0|2,0,0]=2 90 B13R1.45 CC(O)CCN(C)c1ccccc1 2230a_100000210012_100012276601 [0,0,0,0,0,0|4,0,0]=4 91 B13R1.45 CC(O)CCN(C)c1ccccc1 269982a_100000210012_100012276601 [0,0,0,0,0,0|4,0,0]=4 92 B13R1.45 CC(O)CCN(C)c1ccccc1 34a_100000210012_100012276601 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.45 CC(O)CNC(=O)c1ccccc1 11a_100000210904_100000185807 [0,0,0,0,0,0|2,0,0]=2 94 B13R1.45 CC(O)CNC(=O)c1ccccc1 240690a_100000210904_100000185807 [0,0,0,0,0,0|2,0,0]=2 95 B13R1.45 CC(O)CNC(=O)c1ccccc1 527a_100000210904_100000185807 [0,0,0,0,0,0|2,0,0]=2 96 B13R1.45 CC(O)CNC(C)c1ccccc1 2230a_100000210904_100000230085 [0,0,0,0,0,0|3,0,1]=4 97 B13R1.45 CC(O)CNC(C)c1ccccc1 269862a_100000210904_100000185851 [0,0,0,0,0,0|3,0,1]=4 98 B13R1.45 CC(O)CNC(C)c1ccccc1 34a_100000210904_100000211855 [0,0,0,0,0,0|3,0,1]=4 99 B13R1.45 CC(O)CN[C@H](C)c1ccccc1 2230a_100000751104_100011218427 [0,0,0,0,0,0|3,0,1]=4 100 B13R1.45 CC(O)CO[C@H](C)c1ccccc1 34a_100000761318_100011218427 [0,0,0,0,0,0|2,0,1]=3 101 B13R1.45 CC(O)CO[C@H](C)c1ccccc1 7a_100000761318_100011218427 [0,0,0,0,0,0|2,0,1]=3 102 B13R1.45 CC(O)CSC(C)c1ccccc1 62a_100000230085_100011218427 [0,0,0,0,0,0|2,1,1]=4 103 B13R1.45 CC(O)CSC(C)c1ccccc1 62a_100011218427_100000230085 [0,0,0,0,0,0|2,1,1]=4 104 B13R1.45 CC(OCC(F)F)c1ccccc1 34a_100000743014_100000211855 [0,0,0,0,0,0|3,0,1]=4 105 B13R1.45 CC(OC[C@@H](C)Cl)c1ccccc1 34a_100016084084_100000211855 [0,0,0,0,0,0|2,0,1]=3 106 B13R1.45 CC(OC[C@@H](C)N)c1ccccc1 34a_100000737577_100000211855 [0,0,0,0,0,0|2,0,1]=3 107 B13R1.45 CC(SC[C@@H](C)O)c1ccccc1 62a_100000230085_100009817552 [0,0,0,0,0,0|2,1,1]=4 108 B13R1.45 CC(SC[C@@H](C)O)c1ccccc1 62a_100009817552_100000230085 [0,0,0,0,0,0|2,1,1]=4 109 B13R1.45 CN(C)CCC(=O)c1ccccc1 2230a_100102631434_100000750707 [0,0,0,0,0,0|2,0,0]=2 110 B13R1.45 CN(C)CCC(=O)c1ccccc1 269982a_100102631434_100000750707 [0,0,0,0,0,0|2,0,0]=2 111 B13R1.45 CN(C)CCC(O)c1ccccc1 2230a_100011218556_200000210301 [0,0,0,0,0,0|2,0,2]=4 112 B13R1.45 CN(C)CCC(O)c1ccccc1 269982a_100011218556_200000210301 [0,0,0,0,0,0|2,0,2]=4 113 B13R1.45 CN(C)CCN(C)c1ccccc1 2230a_106657271745_200000210301 [0,0,0,0,0,0|4,0,0]=4 114 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_100000210012_100000755713 [0,0,0,0,0,0|4,0,0]=4 115 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_106657271745_200000210301 [0,0,0,0,0,0|4,0,0]=4 116 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_200000219566_200000210301 [0,0,0,0,0,0|4,0,0]=4 117 B13R1.45 CN(C)CCN([13CH3])c1ccccc1 269982a_200000219566_200025704644 [0,0,0,0,0,0|4,0,0]=4 118 B13R1.45 CN(C)CCS(=O)c1ccccc1 2230a_100102631434_100000740319 [0,0,0,0,0,0|3,0,0]=3 119 B13R1.45 CN(C)CCS(=O)c1ccccc1 269982a_100102631434_100000740319 [0,0,0,0,0,0|3,0,0]=3 120 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 2230a_100102631434_100000729684 [0,0,0,0,0,0|2,0,2]=4 121 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 269982a_100102631434_100000729684 [0,0,0,0,0,0|2,0,2]=4 122 B13R1.45 CN(C)COC(=O)c1ccccc1 269982a_100102631434_100000073877 [0,0,0,0,0,0|1,0,0]=1 123 B13R1.45 CN([13CH3])CCC(O)c1ccccc1 2230a_100011218556_200025704644 [0,0,0,0,0,0|2,0,2]=4 124 B13R1.45 CN([13CH3])CCC(O)c1ccccc1 269982a_100011218556_200025704644 [0,0,0,0,0,0|2,0,2]=4 125 B13R1.45 CN([13CH3])CCN(C)c1ccccc1 2230a_106657271745_200025704644 [0,0,0,0,0,0|4,0,0]=4 126 B13R1.45 CN([13CH3])CCN(C)c1ccccc1 269982a_106657271745_200025704644 [0,0,0,0,0,0|4,0,0]=4 127 B13R1.45 C[C@@H](O)CN[C@H](C)c1ccccc1 2230a_100000751104_100009817552 [0,0,0,0,0,0|3,0,1]=4 128 B13R1.45 C[C@@H](O)CO[C@H](C)c1ccccc1 34a_100000761318_100009817552 [0,0,0,0,0,0|2,0,1]=3 129 B13R1.45 C[C@@H](O)CO[C@H](C)c1ccccc1 7a_100000761318_100009817552 [0,0,0,0,0,0|2,0,1]=3 130 B13R1.45 C[C@@H](OCC(F)F)c1ccccc1 34a_100000761318_100011934356 [0,0,0,0,0,0|3,0,1]=4 131 B13R1.45 C[C@@H](OCC(F)F)c1ccccc1 7a_100000761318_100011934356 [0,0,0,0,0,0|3,0,1]=4 132 B13R1.45 NC(=O)CNC(=O)c1ccccc1 11a_100000711301_100000185807 [0,0,0,0,0,0|3,0,1]=4 133 B13R1.45 NC(=O)CNC(=O)c1ccccc1 240690a_100000711301_100000185807 [0,0,0,0,0,0|3,0,1]=4 134 B13R1.45 NC(=O)CNC(=O)c1ccccc1 527a_100000711301_100000185807 [0,0,0,0,0,0|3,0,1]=4 135 B13R1.45 O=C(NCC(F)F)c1ccccc1 11a_100000765723_100000185807 [0,0,0,0,0,0|3,0,0]=3 136 B13R1.45 O=C(NCC(F)F)c1ccccc1 1626a_100000765723_100000185807 [0,0,0,0,0,0|3,0,0]=3 137 B13R1.45 O=C(NCC(F)F)c1ccccc1 240690a_100000765723_100000185807 [0,0,0,0,0,0|3,0,0]=3 138 B13R1.45 O=C(NCC(F)F)c1ccccc1 527a_100000765723_100000185807 [0,0,0,0,0,0|3,0,0]=3 139 B13R1.45 [13CH3]C(=O)CNC(=O)c1ccccc1 1458a_100000182045_200025704644 [0,0,0,0,0,0|2,0,1]=3 140 B13R1.45 [13CH3]C(=O)CNC(=O)c1cccnc1 1458a_100000688122_200025704644 [0,0,0,0,0,0|3,0,1]=4 141 B13R1.45 [13CH3]C(=O)CSC(=S)c1ccccc1 1458a_100000043459_200025704644 [0,0,0,0,0,0|1,2,1]=4 142 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [1,0,0,0,0,0|1,0,2]=4 143 B12R1.30 C#CCNC(=O)c1ccccc1 11a_100000212058_100000185807 [1,0,0,0,0,0|1,0,2]=4 144 B12R1.30 C#CCNC(=O)c1ccccc1 1626a_100000212058_100000185807 [1,0,0,0,0,0|1,0,2]=4 145 B12R1.30 C#CCNC(=O)c1ccccc1 240690a_100000212058_100000185807 [1,0,0,0,0,0|1,0,2]=4 146 B12R1.30 C#CCNC(=O)c1ccccc1 527a_100000212058_100000185807 [1,0,0,0,0,0|1,0,2]=4 147 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [1,0,0,0,0,0|1,0,2]=4 148 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [1,0,0,0,0,0|1,0,2]=4 149 B12R1.30 C=CCNC(=O)c1ccccc1 1626a_100020586998_100000185807 [1,0,0,0,0,0|1,0,2]=4 150 B12R1.30 C=CCNC(=O)c1ccccc1 240690a_100020586998_100000185807 [1,0,0,0,0,0|1,0,2]=4 151 B12R1.30 C=CCNC(=O)c1ccccc1 527a_100020586998_100000185807 [1,0,0,0,0,0|1,0,2]=4 152 B12R1.30 CC#CCC(=O)c1ccccc1 1458a_100000185807_100000748600 [1,0,0,0,0,0|1,0,2]=4 153 B12R1.30 CC(OCCBr)c1ccccc1 34a_100000211926_100000211855 [1,0,0,0,0,0|2,0,1]=4 154 B12R1.30 CC(OCCN)c1ccccc1 34a_100000210304_100000211855 [1,0,0,0,0,0|2,0,1]=4 155 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [1,0,0,0,0,0|1,0,2]=4 156 B12R1.30 CC=NNC(=O)c1ccccc1 4a_100000184135_200000210099 [1,0,0,0,0,0|2,0,1]=4 157 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [1,0,0,0,0,0|1,0,0]=2 158 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000210012_100000210211 [1,0,0,0,0,0|3,0,0]=4 159 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000211623_200000210301 [1,0,0,0,0,0|3,0,0]=4 160 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000210012_100000210211 [1,0,0,0,0,0|3,0,0]=4 161 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000211623_200000210301 [1,0,0,0,0,0|3,0,0]=4 162 B12R1.30 CCCCN(C)c1ccccc1 34a_100000210012_100000210210 [1,0,0,0,0,0|3,0,0]=4 163 B12R1.30 CCCCN(C)c1ccccc1 34a_100000211623_200000210301 [1,0,0,0,0,0|3,0,0]=4 164 B12R1.30 CCCCN([13CH3])c1ccccc1 2230a_100000211623_200025704644 [1,0,0,0,0,0|3,0,0]=4 165 B12R1.30 CCCCN([13CH3])c1ccccc1 269982a_100000211623_200025704644 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.30 CCCCN([13CH3])c1ccccc1 34a_100000211623_200025704644 [1,0,0,0,0,0|3,0,0]=4 167 B12R1.30 CCCNC(=O)c1ccccc1 11a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 168 B12R1.30 CCCNC(=O)c1ccccc1 1626a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 169 B12R1.30 CCCNC(=O)c1ccccc1 240690a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 170 B12R1.30 CCCNC(=O)c1ccccc1 527a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 171 B12R1.30 CCCNC(C)c1ccccc1 269862a_100020643023_100000185851 [1,0,0,0,0,0|2,0,1]=4 172 B12R1.30 CCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210303 [1,0,0,0,0,0|2,0,1]=4 173 B12R1.30 CCCOC(C)c1ccccc1 34a_100000210258_100000211855 [1,0,0,0,0,0|1,0,1]=3 174 B12R1.30 CCCO[C@H](C)c1ccccc1 34a_100000761318_100000210303 [1,0,0,0,0,0|1,0,1]=3 175 B12R1.30 CCCO[C@H](C)c1ccccc1 7a_100000761318_100000210303 [1,0,0,0,0,0|1,0,1]=3 176 B12R1.30 CCCSC(C)c1ccccc1 62a_100000210303_100000230085 [1,0,0,0,0,0|1,1,1]=4 177 B12R1.30 CCCSC(C)c1ccccc1 62a_100000230085_100000210303 [1,0,0,0,0,0|1,1,1]=4 178 B12R1.30 CCNN=C(C)c1ccccc1 4a_100000756455_100000185851 [1,0,0,0,0,0|3,0,0]=4 179 B12R1.30 CCNNC(=O)c1ccccc1 22a_100000756455_100000185807 [1,0,0,0,0,0|2,0,0]=3 180 B12R1.30 CCOCC(=O)c1ccccn1 34a_100121572206_100000027445 [1,0,0,0,0,0|3,0,0]=4 181 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000210202_100000211460 [1,0,0,0,0,0|2,0,0]=3 182 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000211460_100000210202 [1,0,0,0,0,0|2,0,0]=3 183 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000027445_100000210202 [1,0,0,0,0,0|3,0,0]=4 184 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000210202_100000027445 [1,0,0,0,0,0|3,0,0]=4 185 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000210202_100000757877 [1,0,0,0,0,0|3,0,0]=4 186 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000757877_100000210202 [1,0,0,0,0,0|3,0,0]=4 187 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000027454_100000210202 [1,0,0,0,0,0|3,0,0]=4 188 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000210202_100000027454 [1,0,0,0,0,0|3,0,0]=4 189 B12R1.30 CCSCS(=O)c1ccccc1 62a_100000210202_100000031784 [1,0,0,0,0,0|3,0,0]=4 190 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [1,0,0,0,0,0|2,0,0]=3 191 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [1,0,0,0,0,0|2,0,0]=3 192 B12R1.30 CNCCS(=O)c1ccccc1 2230a_106832991635_100000740319 [1,0,0,0,0,0|3,0,0]=4 193 B12R1.30 CNCCS(=O)c1ccccc1 7a_106832991635_100000740319 [1,0,0,0,0,0|3,0,0]=4 194 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [1,0,0,0,0,0|1,0,0]=2 195 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [1,0,0,0,0,0|2,0,0]=3 196 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [1,0,0,0,0,0|2,0,0]=3 197 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [1,0,0,0,0,0|2,0,0]=3 198 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [1,0,0,0,0,0|2,0,0]=3 199 B12R1.30 CSCCS(=O)c1ccccc1 62a_200000210301_100000740319 [1,0,0,0,0,0|3,0,0]=4 200 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [1,0,0,0,0,0|1,0,0]=2 201 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [1,0,0,0,0,0|1,0,0]=2 202 B12R1.30 CSCO[C@H](C)c1ccccc1 34a_100000761318_100011218213 [1,0,0,0,0,0|2,0,1]=4 203 B12R1.30 C[C@@H](OCCF)c1ccccc1 34a_100000761318_100011217306 [1,0,0,0,0,0|2,0,1]=4 204 B12R1.30 C[C@@H](OCCF)c1ccccc1 7a_100000761318_100011217306 [1,0,0,0,0,0|2,0,1]=4 205 B12R1.30 C[C@@H](OCCO)c1ccccc1 34a_100000761318_100000211926 [1,0,0,0,0,0|2,0,1]=4 206 B12R1.30 C[C@@H](OCCO)c1ccccc1 7a_100000761318_100000211926 [1,0,0,0,0,0|2,0,1]=4 207 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [1,0,0,0,0,0|2,0,1]=4 208 B12R1.30 N#CCNC(=O)c1ccccc1 1626a_100000734998_100000185807 [1,0,0,0,0,0|2,0,1]=4 209 B12R1.30 N#CCNC(=O)c1ccccc1 527a_100000734998_100000185807 [1,0,0,0,0,0|2,0,1]=4 210 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [1,0,0,0,0,0|2,0,0]=3 211 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [1,0,0,0,0,0|2,0,0]=3 212 B12R1.30 O=C(CSCF)c1ccccc1 62a_100000211460_100015361967 [1,0,0,0,0,0|3,0,0]=4 213 B12R1.30 O=C(CSCF)c1ccccc1 62a_100015361967_100000211460 [1,0,0,0,0,0|3,0,0]=4 214 B12R1.30 O=C(NCCF)c1ccccc1 11a_100000724931_100000185807 [1,0,0,0,0,0|2,0,0]=3 215 B12R1.30 O=C(NCCF)c1ccccc1 1626a_100000724931_100000185807 [1,0,0,0,0,0|2,0,0]=3 216 B12R1.30 O=C(NCCF)c1ccccc1 240690a_100000724931_100000185807 [1,0,0,0,0,0|2,0,0]=3 217 B12R1.30 O=C(NCCF)c1ccccc1 527a_100000724931_100000185807 [1,0,0,0,0,0|2,0,0]=3 218 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [1,0,0,0,0,0|2,0,0]=3 219 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [1,0,0,0,0,0|2,0,0]=3 220 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [1,0,0,0,0,0|2,0,0]=3 221 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [1,0,0,0,0,0|2,0,0]=3 222 B12R1.30 [13CH3]SCCS(=O)c1ccccc1 62a_200025704644_100000740319 [1,0,0,0,0,0|3,0,0]=4 223 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [1,0,0,0,0,0|1,0,0]=2 224 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [1,0,0,0,0,0|1,0,0]=2 225 B12R1.252 C=C(C)COCc1ccccc1 34a_100000210245_100015291786 [1,0,0,0,0,0|0,0,3]=4 226 B12R1.252 C=C(C)COCc1ccccc1 34a_100000210790_100000748629 [1,0,0,0,0,0|0,0,3]=4 227 B12R1.252 C=C(C)COCc1ccccc1 7a_100000210790_100000748629 [1,0,0,0,0,0|0,0,3]=4 228 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [1,0,0,0,0,0|2,0,1]=4 229 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [1,0,0,0,0,0|2,0,1]=4 230 B12R1.252 CC(=O)COCc1ccccc1 1458a_100000230186_200000210301 [1,0,0,0,0,0|1,0,2]=4 231 B12R1.252 CC(=O)COCc1ccccc1 34a_100000211253_100015291786 [1,0,0,0,0,0|1,0,2]=4 232 B12R1.252 CC(Br)COCc1ccccc1 34a_100012180447_100015291786 [1,0,0,0,0,0|1,0,1]=3 233 B12R1.252 CC(Br)COCc1ccccn1 34a_100012180447_100000721315 [1,0,0,0,0,0|2,0,1]=4 234 B12R1.252 CC(Br)COCc1cccnc1 34a_100012180447_100000733263 [1,0,0,0,0,0|2,0,1]=4 235 B12R1.252 CC(C)C=NNc1ccccc1 4a_100015195140_100000210432 [1,0,0,0,0,0|2,0,1]=4 236 B12R1.252 CC(C)CC=Cc1ccccc1 271570a_100016259101_100000210277 [1,0,0,0,0,0|1,0,0]=2 237 B12R1.252 CC(C)CC=Cc1ccccn1 271570a_100016259101_100011216584 [1,0,0,0,0,0|2,0,0]=3 238 B12R1.252 CC(C)CC=Cc1cccnc1 271570a_100016259101_100000752921 [1,0,0,0,0,0|2,0,0]=3 239 B12R1.252 CC(C)CC=Cc1cccnn1 271570a_100016259101_100016991348 [1,0,0,0,0,0|3,0,0]=4 240 B12R1.252 CC(C)CC=Cc1ccncc1 271570a_100016259101_100000035832 [1,0,0,0,0,0|2,0,0]=3 241 B12R1.252 CC(C)CC=Cc1ccncn1 271570a_100016259101_100000703185 [1,0,0,0,0,0|3,0,0]=4 242 B12R1.252 CC(C)CC=Cc1ccnnc1 271570a_100016259101_100000732662 [1,0,0,0,0,0|3,0,0]=4 243 B12R1.252 CC(C)CC=Cc1cnccn1 271570a_100016259101_100000758340 [1,0,0,0,0,0|3,0,0]=4 244 B12R1.252 CC(C)CC=Cc1cncnc1 271570a_100016259101_100011206942 [1,0,0,0,0,0|3,0,0]=4 245 B12R1.252 CC(C)CC=Cc1ncccn1 271570a_100016259101_100000211032 [1,0,0,0,0,0|3,0,0]=4 246 B12R1.252 CC(C)CCNc1ccccc1 34a_100000106764_100000210312 [1,0,0,0,0,0|2,0,0]=3 247 B12R1.252 CC(C)CCOc1ccccc1 34a_100000210340_100000210312 [1,0,0,0,0,0|2,0,0]=3 248 B12R1.252 CC(C)CCOc1ccccc1 7a_100000210340_100000210626 [1,0,0,0,0,0|2,0,0]=3 249 B12R1.252 CC(C)CCOc1cccnc1 34a_100000210849_100000210312 [1,0,0,0,0,0|3,0,0]=4 250 B12R1.252 CC(C)CCOc1cccnc1 7a_100000210849_100000210626 [1,0,0,0,0,0|3,0,0]=4 251 B12R1.252 CC(C)CCOc1ccncc1 34a_100000212176_100000210312 [1,0,0,0,0,0|3,0,0]=4 252 B12R1.252 CC(C)CCSc1ccccc1 62a_100000210312_100000041952 [1,0,0,0,0,0|2,0,0]=3 253 B12R1.252 CC(C)CCSc1ccccc1 62a_100000719477_100000210312 [1,0,0,0,0,0|2,0,0]=3 254 B12R1.252 CC(C)CCSc1ccccn1 62a_100000210312_100011216584 [1,0,0,0,0,0|3,0,0]=4 255 B12R1.252 CC(C)CCSc1ccccn1 62a_100011216584_100000210312 [1,0,0,0,0,0|3,0,0]=4 256 B12R1.252 CC(C)CCSc1cccnc1 62a_100000210063_100000210312 [1,0,0,0,0,0|3,0,0]=4 257 B12R1.252 CC(C)CCSc1cccnc1 62a_100000210312_100000210063 [1,0,0,0,0,0|3,0,0]=4 258 B12R1.252 CC(C)CCSc1ccncc1 62a_100000210312_100000728582 [1,0,0,0,0,0|3,0,0]=4 259 B12R1.252 CC(C)CCSc1ccncc1 62a_100000728582_100000210312 [1,0,0,0,0,0|3,0,0]=4 260 B12R1.252 CC(C)CNCc1ccccc1 207a_100000210953_100015611070 [1,0,0,0,0,0|1,0,1]=3 261 B12R1.252 CC(C)CNCc1ccccc1 2230a_100000210953_100015291786 [1,0,0,0,0,0|1,0,1]=3 262 B12R1.252 CC(C)CNCc1ccccc1 2230a_100015324214_100000210760 [1,0,0,0,0,0|1,0,1]=3 263 B12R1.252 CC(C)CNCc1ccccc1 270004a_100000210953_100015611070 [1,0,0,0,0,0|1,0,1]=3 264 B12R1.252 CC(C)CNCc1ccccc1 270004a_100015324214_100000210432 [1,0,0,0,0,0|1,0,1]=3 265 B12R1.252 CC(C)CNCc1ccccc1 34a_100000210953_100015291786 [1,0,0,0,0,0|1,0,1]=3 266 B12R1.252 CC(C)CNCc1ccccc1 34a_100015324214_100000210624 [1,0,0,0,0,0|1,0,1]=3 267 B12R1.252 CC(C)CNCc1ccccn1 207a_100000210953_100000209966 [1,0,0,0,0,0|2,0,1]=4 268 B12R1.252 CC(C)CNCc1ccccn1 2230a_100000210953_100000721315 [1,0,0,0,0,0|2,0,1]=4 269 B12R1.252 CC(C)CNCc1ccccn1 270004a_100000210449_100000210432 [1,0,0,0,0,0|2,0,1]=4 270 B12R1.252 CC(C)CNCc1ccccn1 270004a_100000210953_100000209966 [1,0,0,0,0,0|2,0,1]=4 271 B12R1.252 CC(C)CNCc1ccccn1 34a_100000210953_100000721315 [1,0,0,0,0,0|2,0,1]=4 272 B12R1.252 CC(C)CNCc1cccnc1 207a_100000210953_100000209961 [1,0,0,0,0,0|2,0,1]=4 273 B12R1.252 CC(C)CNCc1cccnc1 2230a_100000210953_100000741622 [1,0,0,0,0,0|2,0,1]=4 274 B12R1.252 CC(C)CNCc1cccnc1 270004a_100000210453_100000210432 [1,0,0,0,0,0|2,0,1]=4 275 B12R1.252 CC(C)CNCc1cccnc1 270004a_100000210953_100000209961 [1,0,0,0,0,0|2,0,1]=4 276 B12R1.252 CC(C)CNCc1cccnc1 34a_100000210953_100000733263 [1,0,0,0,0,0|2,0,1]=4 277 B12R1.252 CC(C)CNCc1ccncc1 207a_100000210953_100000186114 [1,0,0,0,0,0|2,0,1]=4 278 B12R1.252 CC(C)CNCc1ccncc1 2230a_100000210953_100015193705 [1,0,0,0,0,0|2,0,1]=4 279 B12R1.252 CC(C)COCc1ccccc1 34a_100000210257_100015291786 [1,0,0,0,0,0|0,0,1]=2 280 B12R1.252 CC(C)COCc1ccccc1 34a_100000210790_100000210624 [1,0,0,0,0,0|0,0,1]=2 281 B12R1.252 CC(C)COCc1ccccc1 7a_100000210790_100000210760 [1,0,0,0,0,0|0,0,1]=2 282 B12R1.252 CC(C)COCc1ccccn1 34a_100000210257_100000721315 [1,0,0,0,0,0|1,0,1]=3 283 B12R1.252 CC(C)COCc1cccnc1 34a_100000210257_100000733263 [1,0,0,0,0,0|1,0,1]=3 284 B12R1.252 CC(C)COCc1cccnn1 34a_100000210257_100016990269 [1,0,0,0,0,0|2,0,1]=4 285 B12R1.252 CC(C)COCc1cnccn1 34a_100000210257_100016995436 [1,0,0,0,0,0|2,0,1]=4 286 B12R1.252 CC(C)COCc1cncnc1 34a_100000210257_100015196519 [1,0,0,0,0,0|2,0,1]=4 287 B12R1.252 CC(C)COCc1ncccn1 34a_100000210257_100000703007 [1,0,0,0,0,0|2,0,1]=4 288 B12R1.252 CC(C)CSCc1ccccc1 62a_100000210624_100015291786 [1,0,0,0,0,0|0,1,1]=3 289 B12R1.252 CC(C)CSCc1ccccc1 62a_100000211182_100000210760 [1,0,0,0,0,0|0,1,1]=3 290 B12R1.252 CC(C)CSCc1ccccn1 62a_100000210624_100000721315 [1,0,0,0,0,0|1,1,1]=4 291 B12R1.252 CC(C)CSCc1ccccn1 62a_100000721315_100000210760 [1,0,0,0,0,0|1,1,1]=4 292 B12R1.252 CC(C)CSCc1cccnc1 62a_100000210624_100000741622 [1,0,0,0,0,0|1,1,1]=4 293 B12R1.252 CC(C)CSCc1cccnc1 62a_100000741622_100000210760 [1,0,0,0,0,0|1,1,1]=4 294 B12R1.252 CC(C)CSCc1ccncc1 62a_100000210624_100015193705 [1,0,0,0,0,0|1,1,1]=4 295 B12R1.252 CC(C)CSCc1ccncc1 62a_100015193705_100000210760 [1,0,0,0,0,0|1,1,1]=4 296 B12R1.252 CC(C)NCCc1ccccc1 2230a_100000106460_100000210206 [1,0,0,0,0,0|2,0,1]=4 297 B12R1.252 CC(C)NCCc1ccccc1 2230a_100138425928_100000765856 [1,0,0,0,0,0|2,0,1]=4 298 B12R1.252 CC(C)NCCc1ccccc1 34a_100000106460_100000210206 [1,0,0,0,0,0|2,0,1]=4 299 B12R1.252 CC(C)NCCc1ccccc1 34a_100138425928_100000765856 [1,0,0,0,0,0|2,0,1]=4 300 B12R1.252 CC(C)NCSc1ccccc1 2230a_100138425928_100011218342 [1,0,0,0,0,0|3,0,0]=4 301 B12R1.252 CC(C)NN=Cc1ccccc1 4a_100000741168_100015611070 [1,0,0,0,0,0|2,0,0]=3 302 B12R1.252 CC(C)NN=Cc1ccccn1 4a_100000741168_100000209966 [1,0,0,0,0,0|3,0,0]=4 303 B12R1.252 CC(C)NN=Cc1cccnc1 4a_100000741168_100000209961 [1,0,0,0,0,0|3,0,0]=4 304 B12R1.252 CC(C)NN=Cc1ccncc1 4a_100000741168_100000186114 [1,0,0,0,0,0|3,0,0]=4 305 B12R1.252 CC(C)OCCc1ccccc1 34a_100000210268_100000210206 [1,0,0,0,0,0|2,0,1]=4 306 B12R1.252 CC(C)OCCc1ccccc1 34a_100000212225_100000765856 [1,0,0,0,0,0|2,0,1]=4 307 B12R1.252 CC(C)OCCc1ccccc1 7a_100000210268_100000210206 [1,0,0,0,0,0|2,0,1]=4 308 B12R1.252 CC(C)OCNc1ccccc1 34a_100000106764_100000709892 [1,0,0,0,0,0|3,0,0]=4 309 B12R1.252 CC(C)OCOc1ccccc1 34a_100000210340_100000709892 [1,0,0,0,0,0|3,0,0]=4 310 B12R1.252 CC(C)OCSc1ccccc1 62a_100000709892_100000041952 [1,0,0,0,0,0|3,0,0]=4 311 B12R1.252 CC(C)OCSc1ccccc1 62a_100000719477_100000709892 [1,0,0,0,0,0|3,0,0]=4 312 B12R1.252 CC(C)SCCc1ccccc1 62a_100000210206_100011218657 [1,0,0,0,0,0|2,0,1]=4 313 B12R1.252 CC(C)SCCc1ccccc1 62a_100000765856_100000210206 [1,0,0,0,0,0|2,0,1]=4 314 B12R1.252 CC(C)SCSc1ccccc1 62a_100000210206_100011218342 [1,0,0,0,0,0|3,0,0]=4 315 B12R1.252 CC(C)SCSc1ccccc1 62a_100011218342_100000210206 [1,0,0,0,0,0|3,0,0]=4 316 B12R1.252 CC(F)COCc1ccccc1 34a_100015925927_100015291786 [1,0,0,0,0,0|1,0,1]=3 317 B12R1.252 CC(F)COCc1ccccn1 34a_100015925927_100000721315 [1,0,0,0,0,0|2,0,1]=4 318 B12R1.252 CC(F)COCc1cccnc1 34a_100015925927_100000733263 [1,0,0,0,0,0|2,0,1]=4 319 B12R1.252 CC(O)CCNc1ccccc1 34a_100000106764_100012276601 [1,0,0,0,0,0|3,0,0]=4 320 B12R1.252 CC(O)CCOc1ccccc1 34a_100000210340_100012276601 [1,0,0,0,0,0|3,0,0]=4 321 B12R1.252 CC(O)CCOc1ccccc1 7a_100000210340_100012276601 [1,0,0,0,0,0|3,0,0]=4 322 B12R1.252 CC(O)CCSc1ccccc1 62a_100000719477_100012276601 [1,0,0,0,0,0|3,0,0]=4 323 B12R1.252 CC(O)CCSc1ccccc1 62a_100012276601_100000041952 [1,0,0,0,0,0|3,0,0]=4 324 B12R1.252 CC(O)CNCc1ccccc1 207a_100000210904_100015611070 [1,0,0,0,0,0|2,0,1]=4 325 B12R1.252 CC(O)CNCc1ccccc1 2230a_100000210904_100015291786 [1,0,0,0,0,0|2,0,1]=4 326 B12R1.252 CC(O)CNCc1ccccc1 2230a_100015324214_100011218427 [1,0,0,0,0,0|2,0,1]=4 327 B12R1.252 CC(O)CNCc1ccccc1 270004a_100000210904_100015611070 [1,0,0,0,0,0|2,0,1]=4 328 B12R1.252 CC(O)CNCc1ccccc1 34a_100000210904_100015291786 [1,0,0,0,0,0|2,0,1]=4 329 B12R1.252 CC(O)CNCc1ccccc1 34a_100015324214_100011218427 [1,0,0,0,0,0|2,0,1]=4 330 B12R1.252 CC(O)COCc1ccccc1 34a_100000210790_100011218427 [1,0,0,0,0,0|1,0,1]=3 331 B12R1.252 CC(O)COCc1ccccc1 7a_100000210790_100011218427 [1,0,0,0,0,0|1,0,1]=3 332 B12R1.252 CC(O)CSCc1ccccc1 62a_100000211182_100011218427 [1,0,0,0,0,0|1,1,1]=4 333 B12R1.252 CC(O)CSCc1ccccc1 62a_100011218427_100015291786 [1,0,0,0,0,0|1,1,1]=4 334 B12R1.252 CN(C)C/C=C/c1ccccc1 2230a_100102631434_100016265936 [1,0,0,0,0,0|2,0,0]=3 335 B12R1.252 CN(C)C/C=C/c1ccccc1 269982a_100102631434_100016265936 [1,0,0,0,0,0|2,0,0]=3 336 B12R1.252 CN(C)CC#Cc1ccccc1 2230a_100102631434_100011352542 [1,0,0,0,0,0|2,0,1]=4 337 B12R1.252 CN(C)CC#Cc1ccccc1 269982a_100102631434_100011352542 [1,0,0,0,0,0|2,0,1]=4 338 B12R1.252 CN(C)CC=Cc1ccccc1 270004a_100102631434_100000210105 [1,0,0,0,0,0|2,0,0]=3 339 B12R1.252 CN(C)CCCc1ccccc1 2230a_100000693637_200000210301 [1,0,0,0,0,0|2,0,1]=4 340 B12R1.252 CN(C)CCCc1ccccc1 2230a_100102631434_100000211621 [1,0,0,0,0,0|2,0,1]=4 341 B12R1.252 CN(C)CCCc1ccccc1 269982a_100000693637_200000210301 [1,0,0,0,0,0|2,0,1]=4 342 B12R1.252 CN(C)CCCc1ccccc1 269982a_100102631434_100000211621 [1,0,0,0,0,0|2,0,1]=4 343 B12R1.252 CN(C)CCOc1ccccc1 2230a_100000184383_200000210301 [1,0,0,0,0,0|3,0,0]=4 344 B12R1.252 CN(C)CCOc1ccccc1 2230a_100102631434_100000184471 [1,0,0,0,0,0|3,0,0]=4 345 B12R1.252 CN(C)CCOc1ccccc1 269982a_100000184383_200000210301 [1,0,0,0,0,0|3,0,0]=4 346 B12R1.252 CN(C)CCOc1ccccc1 269982a_100102631434_100000184471 [1,0,0,0,0,0|3,0,0]=4 347 B12R1.252 CN(C)CCOc1ccccc1 270004a_100102631434_100000758736 [1,0,0,0,0,0|3,0,0]=4 348 B12R1.252 CN(C)CCOc1ccccc1 7a_100000210340_100000755713 [1,0,0,0,0,0|3,0,0]=4 349 B12R1.252 CN(C)CCSc1ccccc1 2230a_100102631434_100000246102 [1,0,0,0,0,0|3,0,0]=4 350 B12R1.252 CN(C)CCSc1ccccc1 269982a_100102631434_100000246102 [1,0,0,0,0,0|3,0,0]=4 351 B12R1.252 CN(C)CCSc1ccccc1 62a_100000719477_100000755713 [1,0,0,0,0,0|3,0,0]=4 352 B12R1.252 CN(C)COCc1ccccc1 2230a_100102631434_100000763385 [1,0,0,0,0,0|1,0,1]=3 353 B12R1.252 CN(C)CSCc1ccccc1 2230a_100102631434_200011217039 [1,0,0,0,0,0|1,1,1]=4 354 B12R1.252 CN(C)CSCc1ccccc1 269982a_100102631434_200011217039 [1,0,0,0,0,0|1,1,1]=4 355 B12R1.252 CN([13CH3])CCCc1ccccc1 2230a_100000693637_200025704644 [1,0,0,0,0,0|2,0,1]=4 356 B12R1.252 CN([13CH3])CCCc1ccccc1 269982a_100000693637_200025704644 [1,0,0,0,0,0|2,0,1]=4 357 B12R1.252 CN([13CH3])CCOc1ccccc1 2230a_100000184383_200025704644 [1,0,0,0,0,0|3,0,0]=4 358 B12R1.252 CN([13CH3])CCOc1ccccc1 269982a_100000184383_200025704644 [1,0,0,0,0,0|3,0,0]=4 359 B12R1.252 C[C@@H](Cl)COCc1ccccc1 34a_100016084084_100015291786 [1,0,0,0,0,0|1,0,1]=3 360 B12R1.252 C[C@@H](Cl)COCc1ccccn1 34a_100016084084_100000721315 [1,0,0,0,0,0|2,0,1]=4 361 B12R1.252 C[C@@H](Cl)COCc1cccnc1 34a_100016084084_100000733263 [1,0,0,0,0,0|2,0,1]=4 362 B12R1.252 C[C@@H](N)COCc1ccccc1 34a_100000737577_100015291786 [1,0,0,0,0,0|1,0,1]=3 363 B12R1.252 C[C@@H](N)COCc1ccccn1 34a_100000737577_100000721315 [1,0,0,0,0,0|2,0,1]=4 364 B12R1.252 C[C@@H](N)COCc1cccnc1 34a_100000737577_100000733263 [1,0,0,0,0,0|2,0,1]=4 365 B12R1.252 C[C@@H](O)CNCc1ccccc1 2230a_100015324214_100009817552 [1,0,0,0,0,0|2,0,1]=4 366 B12R1.252 C[C@@H](O)CNCc1ccccc1 34a_100015324214_100009817552 [1,0,0,0,0,0|2,0,1]=4 367 B12R1.252 C[C@@H](O)COCc1ccccc1 34a_100000210790_100009817552 [1,0,0,0,0,0|1,0,1]=3 368 B12R1.252 C[C@@H](O)COCc1ccccc1 7a_100000210790_100009817552 [1,0,0,0,0,0|1,0,1]=3 369 B12R1.252 C[C@@H](O)CSCc1ccccc1 62a_100000211182_100009817552 [1,0,0,0,0,0|1,1,1]=4 370 B12R1.252 C[C@@H](O)CSCc1ccccc1 62a_100009817552_100015291786 [1,0,0,0,0,0|1,1,1]=4 371 B12R1.252 FC(F)COCc1ccccc1 34a_100000210790_100011934356 [1,0,0,0,0,0|2,0,1]=4 372 B12R1.252 FC(F)COCc1ccccc1 34a_100000743014_100015291786 [1,0,0,0,0,0|2,0,1]=4 373 B12R1.252 FC(F)COCc1ccccc1 7a_100000210790_100011934356 [1,0,0,0,0,0|2,0,1]=4 374 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [1,0,0,0,0,0|2,0,1]=4 375 B12R1.252 [13CH3]C(=O)COCc1ccccc1 1458a_100000230186_200025704644 [1,0,0,0,0,0|1,0,2]=4 376 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000730704 [0,1,0,0,0,0|1,0,2]=4 377 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)C 1458a_100000189346_100000730704 [0,1,0,0,0,0|1,0,2]=4 378 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000730704 [0,1,0,0,0,0|1,0,2]=4 379 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_100000730704 [0,1,0,0,0,0|1,0,2]=4 380 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_100000730704 [0,1,0,0,0,0|1,0,2]=4 381 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000730704 [0,1,0,0,0,0|1,0,2]=4 382 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 11a_100000765925_100000210664 [0,1,0,0,0,0|1,0,2]=4 383 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 1626a_100000765925_100000210664 [0,1,0,0,0,0|1,0,2]=4 384 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 240690a_100000765925_100000210664 [0,1,0,0,0,0|1,0,2]=4 385 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Br 527a_100000765925_100000210664 [0,1,0,0,0,0|1,0,2]=4 386 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 11a_100000765925_100000189346 [0,1,0,0,0,0|1,0,2]=4 387 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 1626a_100000765925_100000189346 [0,1,0,0,0,0|1,0,2]=4 388 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 240690a_100000765925_100000189346 [0,1,0,0,0,0|1,0,2]=4 389 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)C 527a_100000765925_100000189346 [0,1,0,0,0,0|1,0,2]=4 390 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 11a_100000765925_100000210390 [0,1,0,0,0,0|1,0,2]=4 391 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 1626a_100000765925_100000210390 [0,1,0,0,0,0|1,0,2]=4 392 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 240690a_100000765925_100000210390 [0,1,0,0,0,0|1,0,2]=4 393 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)Cl 527a_100000765925_100000210390 [0,1,0,0,0,0|1,0,2]=4 394 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 11a_100000765925_100000210950 [0,1,0,0,0,0|1,0,2]=4 395 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 1626a_100000765925_100000210950 [0,1,0,0,0,0|1,0,2]=4 396 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 240690a_100000765925_100000210950 [0,1,0,0,0,0|1,0,2]=4 397 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)F 527a_100000765925_100000210950 [0,1,0,0,0,0|1,0,2]=4 398 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 11a_100000765925_100000184098 [0,1,0,0,0,0|1,0,2]=4 399 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 1626a_100000765925_100000184098 [0,1,0,0,0,0|1,0,2]=4 400 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 240690a_100000765925_100000184098 [0,1,0,0,0,0|1,0,2]=4 401 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)I 527a_100000765925_100000184098 [0,1,0,0,0,0|1,0,2]=4 402 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)O 240690a_100000765925_100000183914 [0,1,0,0,0,0|1,0,2]=4 403 B14R1.149 C=C(C)CNC(=O)c1cccc(c1)O 527a_100000765925_100000183914 [0,1,0,0,0,0|1,0,2]=4 404 B14R1.149 CC(=CCC(=O)c1cccc(c1)Br)C 1458a_100000210664_100000761012 [0,1,0,0,0,0|1,0,2]=4 405 B14R1.149 CC(=CCC(=O)c1cccc(c1)C)C 1458a_100000189346_100000761012 [0,1,0,0,0,0|1,0,2]=4 406 B14R1.149 CC(=CCC(=O)c1cccc(c1)Cl)C 1458a_100000210390_100000761012 [0,1,0,0,0,0|1,0,2]=4 407 B14R1.149 CC(=CCC(=O)c1cccc(c1)F)C 1458a_100000210950_100000761012 [0,1,0,0,0,0|1,0,2]=4 408 B14R1.149 CC(=CCC(=O)c1cccc(c1)I)C 1458a_100000184098_100000761012 [0,1,0,0,0,0|1,0,2]=4 409 B14R1.149 CC(=CCC(=O)c1cccc(c1)O)C 1458a_100000183914_100000761012 [0,1,0,0,0,0|1,0,2]=4 410 B14R1.149 CC(=NNC(C)C)c1cccc(c1)Br 4a_100000741168_100000210093 [0,1,0,0,0,0|3,0,0]=4 411 B14R1.149 CC(=NNC(C)C)c1cccc(c1)C 4a_100000741168_100000211476 [0,1,0,0,0,0|3,0,0]=4 412 B14R1.149 CC(=NNC(C)C)c1cccc(c1)Cl 4a_100000741168_200000210964 [0,1,0,0,0,0|3,0,0]=4 413 B14R1.149 CC(=NNC(C)C)c1cccc(c1)F 4a_100000741168_100000187083 [0,1,0,0,0,0|3,0,0]=4 414 B14R1.149 CC(=NNC(C)C)c1cccc(c1)I 4a_100000741168_100011356966 [0,1,0,0,0,0|3,0,0]=4 415 B14R1.149 CC(=NNC(C)C)c1cccc(c1)O 4a_100000741168_100000211620 [0,1,0,0,0,0|3,0,0]=4 416 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Br 1458a_100000179737_200000210301 [0,1,0,0,0,0|2,0,1]=4 417 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)C 1458a_100000182573_200000210301 [0,1,0,0,0,0|2,0,1]=4 418 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Cl 1458a_100000182572_200000210301 [0,1,0,0,0,0|2,0,1]=4 419 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)F 1458a_100000183068_200000210301 [0,1,0,0,0,0|2,0,1]=4 420 B14R1.149 CC(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210312 [0,1,0,0,0,0|1,0,0]=2 421 B14R1.149 CC(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210312 [0,1,0,0,0,0|1,0,0]=2 422 B14R1.149 CC(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210312 [0,1,0,0,0,0|1,0,0]=2 423 B14R1.149 CC(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210312 [0,1,0,0,0,0|1,0,0]=2 424 B14R1.149 CC(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210312 [0,1,0,0,0,0|1,0,0]=2 425 B14R1.149 CC(C)CCN(C)c1cccc(c1)Br 2230a_100000219648_100000210312 [0,1,0,0,0,0|3,0,0]=4 426 B14R1.149 CC(C)CCN(C)c1cccc(c1)Br 269982a_100000219648_100000210312 [0,1,0,0,0,0|3,0,0]=4 427 B14R1.149 CC(C)CCN(C)c1cccc(c1)Br 34a_100000219648_100000210312 [0,1,0,0,0,0|3,0,0]=4 428 B14R1.149 CC(C)CCN(C)c1cccc(c1)Cl 2230a_100000220044_100000210312 [0,1,0,0,0,0|3,0,0]=4 429 B14R1.149 CC(C)CCN(C)c1cccc(c1)Cl 269982a_100000220044_100000210312 [0,1,0,0,0,0|3,0,0]=4 430 B14R1.149 CC(C)CCN(C)c1cccc(c1)Cl 34a_100000220044_100000210312 [0,1,0,0,0,0|3,0,0]=4 431 B14R1.149 CC(C)CCN(C)c1cccc(c1)F 2230a_100020633736_100000210312 [0,1,0,0,0,0|3,0,0]=4 432 B14R1.149 CC(C)CCN(C)c1cccc(c1)F 269982a_100020633736_100000210312 [0,1,0,0,0,0|3,0,0]=4 433 B14R1.149 CC(C)CCN(C)c1cccc(c1)F 34a_100020633736_100000210312 [0,1,0,0,0,0|3,0,0]=4 434 B14R1.149 CC(C)CCN(C)c1cccc(c1)I 2230a_100000221217_100000210312 [0,1,0,0,0,0|3,0,0]=4 435 B14R1.149 CC(C)CCN(C)c1cccc(c1)I 269982a_100000221217_100000210312 [0,1,0,0,0,0|3,0,0]=4 436 B14R1.149 CC(C)CCN(C)c1cccc(c1)I 34a_100000221217_100000210312 [0,1,0,0,0,0|3,0,0]=4 437 B14R1.149 CC(C)CCN(C)c1cccc(c1)O 2230a_100000756613_100000210312 [0,1,0,0,0,0|3,0,0]=4 438 B14R1.149 CC(C)CCN(C)c1cccc(c1)O 269982a_100000756613_100000210312 [0,1,0,0,0,0|3,0,0]=4 439 B14R1.149 CC(C)CCN(C)c1cccc(c1)O 34a_100000756613_100000210312 [0,1,0,0,0,0|3,0,0]=4 440 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Br 11a_100000210953_100000210664 [0,1,0,0,0,0|1,0,0]=2 441 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Br 1626a_100000210953_100000210664 [0,1,0,0,0,0|1,0,0]=2 442 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Br 240690a_100000210953_100000210664 [0,1,0,0,0,0|1,0,0]=2 443 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Br 527a_100000210953_100000210664 [0,1,0,0,0,0|1,0,0]=2 444 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Cl 11a_100000210953_100000210390 [0,1,0,0,0,0|1,0,0]=2 445 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Cl 1626a_100000210953_100000210390 [0,1,0,0,0,0|1,0,0]=2 446 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Cl 240690a_100000210953_100000210390 [0,1,0,0,0,0|1,0,0]=2 447 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Cl 527a_100000210953_100000210390 [0,1,0,0,0,0|1,0,0]=2 448 B14R1.149 CC(C)CNC(=O)c1cccc(c1)F 11a_100000210953_100000210950 [0,1,0,0,0,0|1,0,0]=2 449 B14R1.149 CC(C)CNC(=O)c1cccc(c1)F 1626a_100000210953_100000210950 [0,1,0,0,0,0|1,0,0]=2 450 B14R1.149 CC(C)CNC(=O)c1cccc(c1)F 240690a_100000210953_100000210950 [0,1,0,0,0,0|1,0,0]=2 451 B14R1.149 CC(C)CNC(=O)c1cccc(c1)F 527a_100000210953_100000210950 [0,1,0,0,0,0|1,0,0]=2 452 B14R1.149 CC(C)CNC(=O)c1cccc(c1)I 11a_100000210953_100000184098 [0,1,0,0,0,0|1,0,0]=2 453 B14R1.149 CC(C)CNC(=O)c1cccc(c1)I 1626a_100000210953_100000184098 [0,1,0,0,0,0|1,0,0]=2 454 B14R1.149 CC(C)CNC(=O)c1cccc(c1)I 240690a_100000210953_100000184098 [0,1,0,0,0,0|1,0,0]=2 455 B14R1.149 CC(C)CNC(=O)c1cccc(c1)I 527a_100000210953_100000184098 [0,1,0,0,0,0|1,0,0]=2 456 B14R1.149 CC(C)CNC(=O)c1cccc(c1)O 240690a_100000210953_100000183914 [0,1,0,0,0,0|1,0,0]=2 457 B14R1.149 CC(C)CNC(=O)c1cccc(c1)O 527a_100000210953_100000183914 [0,1,0,0,0,0|1,0,0]=2 458 B14R1.149 CC(C)CNC(C)c1cccc(c1)Br 2230a_100020642005_100000210760 [0,1,0,0,0,0|2,0,1]=4 459 B14R1.149 CC(C)CNC(C)c1cccc(c1)Br 269862a_100000210953_100000210093 [0,1,0,0,0,0|2,0,1]=4 460 B14R1.149 CC(C)CNC(C)c1cccc(c1)Br 270004a_100020642005_100000210432 [0,1,0,0,0,0|2,0,1]=4 461 B14R1.149 CC(C)CNC(C)c1cccc(c1)Cl 2230a_100102723534_100000210760 [0,1,0,0,0,0|2,0,1]=4 462 B14R1.149 CC(C)CNC(C)c1cccc(c1)Cl 269862a_100000210953_200000210964 [0,1,0,0,0,0|2,0,1]=4 463 B14R1.149 CC(C)CNC(C)c1cccc(c1)Cl 270004a_100102723534_100000210432 [0,1,0,0,0,0|2,0,1]=4 464 B14R1.149 CC(C)CNC(C)c1cccc(c1)Cl 34a_100102723534_100000210624 [0,1,0,0,0,0|2,0,1]=4 465 B14R1.149 CC(C)CNC(C)c1cccc(c1)F 269862a_100000210953_100000187083 [0,1,0,0,0,0|2,0,1]=4 466 B14R1.149 CC(C)CNC(C)c1cccc(c1)I 269862a_100000210953_100011356966 [0,1,0,0,0,0|2,0,1]=4 467 B14R1.149 CC(C)CNC(C)c1cccc(c1)O 2230a_100000740644_100000210760 [0,1,0,0,0,0|2,0,1]=4 468 B14R1.149 CC(C)CNC(C)c1cccc(c1)O 269862a_100000210953_100000211620 [0,1,0,0,0,0|2,0,1]=4 469 B14R1.149 CC(C)CNC(C)c1cccc(c1)O 270004a_100000740644_100000210432 [0,1,0,0,0,0|2,0,1]=4 470 B14R1.149 CC(C)CN[C@H](C)c1cccc(c1)F 2230a_100015193778_100000210760 [0,1,0,0,0,0|2,0,1]=4 471 B14R1.149 CC(C)CN[C@H](C)c1cccc(c1)F 270004a_100015193778_100000210432 [0,1,0,0,0,0|2,0,1]=4 472 B14R1.149 CC(C)CN[C@H](C)c1cccc(c1)F 34a_100015193778_100000210624 [0,1,0,0,0,0|2,0,1]=4 473 B14R1.149 CC(C)COC(C)c1cc(ccn1)Cl 7a_100000144657_100000210760 [0,1,0,0,0,0|2,0,1]=4 474 B14R1.149 CC(C)COC(C)c1cccc(c1)Br 34a_100000246457_100000210624 [0,1,0,0,0,0|1,0,1]=3 475 B14R1.149 CC(C)COC(C)c1cccc(c1)Br 7a_100000246457_100000210760 [0,1,0,0,0,0|1,0,1]=3 476 B14R1.149 CC(C)COC(C)c1cccc(c1)F 34a_100000744526_100000210624 [0,1,0,0,0,0|1,0,1]=3 477 B14R1.149 CC(C)COC(C)c1cccc(c1)F 7a_100000744526_100000210760 [0,1,0,0,0,0|1,0,1]=3 478 B14R1.149 CC(C)COC(C)c1cccc(c1)I 34a_100013085317_100000210624 [0,1,0,0,0,0|1,0,1]=3 479 B14R1.149 CC(C)COC(C)c1cccc(c1)I 7a_100013085317_100000210760 [0,1,0,0,0,0|1,0,1]=3 480 B14R1.149 CC(C)COC(C)c1cccc(c1)N 34a_100011217120_100000210624 [0,1,0,0,0,0|1,0,1]=3 481 B14R1.149 CC(C)COC(C)c1cccc(c1)N 7a_100011217120_100000210760 [0,1,0,0,0,0|1,0,1]=3 482 B14R1.149 CC(C)COC(C)c1cccc(n1)Br 7a_100009820884_100000210760 [0,1,0,0,0,0|2,0,1]=4 483 B14R1.149 CC(C)COC(C)c1cncc(c1)Br 34a_100012351597_100000210624 [0,1,0,0,0,0|2,0,1]=4 484 B14R1.149 CC(C)COC(C)c1cncc(c1)Br 7a_100012351597_100000210760 [0,1,0,0,0,0|2,0,1]=4 485 B14R1.149 CC(C)CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210624 [0,1,0,0,0,0|1,0,1]=3 486 B14R1.149 CC(C)CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210760 [0,1,0,0,0,0|1,0,1]=3 487 B14R1.149 CC(C)NCC(=O)c1cccc(c1)Br 2230a_100138425928_100000212080 [0,1,0,0,0,0|2,0,0]=3 488 B14R1.149 CC(C)NCC(=O)c1cccc(c1)Br 34a_100138425928_100000212080 [0,1,0,0,0,0|2,0,0]=3 489 B14R1.149 CC(C)NCC(=O)c1cccc(c1)Cl 2230a_100138425928_100000211444 [0,1,0,0,0,0|2,0,0]=3 490 B14R1.149 CC(C)NCC(=O)c1cccc(c1)Cl 34a_100138425928_100000211444 [0,1,0,0,0,0|2,0,0]=3 491 B14R1.149 CC(C)NCC(=O)c1cccc(c1)F 2230a_100138425928_100000215616 [0,1,0,0,0,0|2,0,0]=3 492 B14R1.149 CC(C)NCC(=O)c1cccc(c1)F 34a_100138425928_100000215616 [0,1,0,0,0,0|2,0,0]=3 493 B14R1.149 CC(C)NCC(=O)c1cccc(c1)O 34a_100138425928_100009813753 [0,1,0,0,0,0|2,0,0]=3 494 B14R1.149 CC(C)NNC(=O)c1cccc(c1)Br 22a_100000741168_100000210664 [0,1,0,0,0,0|2,0,0]=3 495 B14R1.149 CC(C)NNC(=O)c1cccc(c1)Cl 22a_100000741168_100000210390 [0,1,0,0,0,0|2,0,0]=3 496 B14R1.149 CC(C)NNC(=O)c1cccc(c1)F 22a_100000741168_100000210950 [0,1,0,0,0,0|2,0,0]=3 497 B14R1.149 CC(C)NNC(=O)c1cccc(c1)I 22a_100000741168_100000184098 [0,1,0,0,0,0|2,0,0]=3 498 B14R1.149 CC(C)NNC(=O)c1cccc(c1)O 22a_100000741168_100000183914 [0,1,0,0,0,0|2,0,0]=3 499 B14R1.149 CC(C)OCC(=O)c1cccc(c1)Br 34a_100000212225_100000212080 [0,1,0,0,0,0|2,0,0]=3 500 B14R1.149 CC(C)OCC(=O)c1cccc(c1)Cl 34a_100000212225_100000211444 [0,1,0,0,0,0|2,0,0]=3 501 B14R1.149 CC(C)OCC(=O)c1cccc(c1)Cl 7a_200011592804_100000210206 [0,1,0,0,0,0|2,0,0]=3 502 B14R1.149 CC(C)OCC(=O)c1cccc(c1)F 34a_100000212225_100000215616 [0,1,0,0,0,0|2,0,0]=3 503 B14R1.149 CC(C)OCC(=O)c1cccc(c1)F 34a_100011592800_100000210206 [0,1,0,0,0,0|2,0,0]=3 504 B14R1.149 CC(C)OCC(=O)c1cccc(c1)F 7a_100011592800_100000210206 [0,1,0,0,0,0|2,0,0]=3 505 B14R1.149 CC(C)OCC(=O)c1cccc(c1)O 34a_100000212225_100009813753 [0,1,0,0,0,0|2,0,0]=3 506 B14R1.149 CC(C)SCC(=O)c1cccc(c1)Br 62a_100000210206_100000212080 [0,1,0,0,0,0|2,0,0]=3 507 B14R1.149 CC(C)SCC(=O)c1cccc(c1)Br 62a_100000212080_100000210206 [0,1,0,0,0,0|2,0,0]=3 508 B14R1.149 CC(C)SCC(=O)c1cccc(c1)Cl 62a_100000210206_100000211444 [0,1,0,0,0,0|2,0,0]=3 509 B14R1.149 CC(C)SCC(=O)c1cccc(c1)Cl 62a_100000211444_100000210206 [0,1,0,0,0,0|2,0,0]=3 510 B14R1.149 CC(C)SCC(=O)c1cccc(c1)F 62a_100000210206_100000215616 [0,1,0,0,0,0|2,0,0]=3 511 B14R1.149 CC(C)SCC(=O)c1cccc(c1)F 62a_100000215616_100000210206 [0,1,0,0,0,0|2,0,0]=3 512 B14R1.149 CC(C)SCC(=O)c1cccc(c1)O 62a_100000210206_100009813753 [0,1,0,0,0,0|2,0,0]=3 513 B14R1.149 CC(C)SCC(=O)c1cccc(c1)O 62a_100009813753_100000210206 [0,1,0,0,0,0|2,0,0]=3 514 B14R1.149 CC(C)SCC(=O)c1ccnc(c1)Cl 62a_100000210206_100009817076 [0,1,0,0,0,0|3,0,0]=4 515 B14R1.149 CC(C)SCC(=O)c1ccnc(c1)Cl 62a_100009817076_100000210206 [0,1,0,0,0,0|3,0,0]=4 516 B14R1.149 CC(O)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100012276601 [0,1,0,0,0,0|2,0,0]=3 517 B14R1.149 CC(O)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100012276601 [0,1,0,0,0,0|2,0,0]=3 518 B14R1.149 CC(O)CCC(=O)c1cccc(c1)F 1458a_100000210950_100012276601 [0,1,0,0,0,0|2,0,0]=3 519 B14R1.149 CC(O)CCC(=O)c1cccc(c1)I 1458a_100000184098_100012276601 [0,1,0,0,0,0|2,0,0]=3 520 B14R1.149 CC(O)CCC(=O)c1cccc(c1)O 1458a_100000183914_100012276601 [0,1,0,0,0,0|2,0,0]=3 521 B14R1.149 CC(O)CNC(=O)c1cccc(c1)Br 11a_100000210904_100000210664 [0,1,0,0,0,0|2,0,0]=3 522 B14R1.149 CC(O)CNC(=O)c1cccc(c1)Br 240690a_100000210904_100000210664 [0,1,0,0,0,0|2,0,0]=3 523 B14R1.149 CC(O)CNC(=O)c1cccc(c1)Br 527a_100000210904_100000210664 [0,1,0,0,0,0|2,0,0]=3 524 B14R1.149 CC(O)CNC(=O)c1cccc(c1)Cl 11a_100000210904_100000210390 [0,1,0,0,0,0|2,0,0]=3 525 B14R1.149 CC(O)CNC(=O)c1cccc(c1)Cl 240690a_100000210904_100000210390 [0,1,0,0,0,0|2,0,0]=3 526 B14R1.149 CC(O)CNC(=O)c1cccc(c1)Cl 527a_100000210904_100000210390 [0,1,0,0,0,0|2,0,0]=3 527 B14R1.149 CC(O)CNC(=O)c1cccc(c1)F 11a_100000210904_100000210950 [0,1,0,0,0,0|2,0,0]=3 528 B14R1.149 CC(O)CNC(=O)c1cccc(c1)F 240690a_100000210904_100000210950 [0,1,0,0,0,0|2,0,0]=3 529 B14R1.149 CC(O)CNC(=O)c1cccc(c1)F 527a_100000210904_100000210950 [0,1,0,0,0,0|2,0,0]=3 530 B14R1.149 CC(O)CNC(=O)c1cccc(c1)I 11a_100000210904_100000184098 [0,1,0,0,0,0|2,0,0]=3 531 B14R1.149 CC(O)CNC(=O)c1cccc(c1)I 240690a_100000210904_100000184098 [0,1,0,0,0,0|2,0,0]=3 532 B14R1.149 CC(O)CNC(=O)c1cccc(c1)I 527a_100000210904_100000184098 [0,1,0,0,0,0|2,0,0]=3 533 B14R1.149 CC(O)CNC(=O)c1cccc(c1)O 240690a_100000210904_100000183914 [0,1,0,0,0,0|2,0,0]=3 534 B14R1.149 CC(O)CNC(=O)c1cccc(c1)O 527a_100000210904_100000183914 [0,1,0,0,0,0|2,0,0]=3 535 B14R1.149 CC(O)COC(C)c1cccc(c1)Br 34a_100000246457_100011218427 [0,1,0,0,0,0|2,0,1]=4 536 B14R1.149 CC(O)COC(C)c1cccc(c1)Br 7a_100000246457_100011218427 [0,1,0,0,0,0|2,0,1]=4 537 B14R1.149 CC(O)COC(C)c1cccc(c1)F 34a_100000744526_100011218427 [0,1,0,0,0,0|2,0,1]=4 538 B14R1.149 CC(O)COC(C)c1cccc(c1)F 7a_100000744526_100011218427 [0,1,0,0,0,0|2,0,1]=4 539 B14R1.149 CC(O)COC(C)c1cccc(c1)I 34a_100013085317_100011218427 [0,1,0,0,0,0|2,0,1]=4 540 B14R1.149 CC(O)COC(C)c1cccc(c1)I 7a_100013085317_100011218427 [0,1,0,0,0,0|2,0,1]=4 541 B14R1.149 CC(O)COC(C)c1cccc(c1)N 34a_100011217120_100011218427 [0,1,0,0,0,0|2,0,1]=4 542 B14R1.149 CC(O)COC(C)c1cccc(c1)N 7a_100011217120_100011218427 [0,1,0,0,0,0|2,0,1]=4 543 B14R1.149 CC(O)CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100011218427 [0,1,0,0,0,0|2,0,1]=4 544 B14R1.149 CC(O)CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100011218427 [0,1,0,0,0,0|2,0,1]=4 545 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)Br 34a_100000246457_100009817552 [0,1,0,0,0,0|2,0,1]=4 546 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)Br 7a_100000246457_100009817552 [0,1,0,0,0,0|2,0,1]=4 547 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)F 34a_100000744526_100009817552 [0,1,0,0,0,0|2,0,1]=4 548 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)F 7a_100000744526_100009817552 [0,1,0,0,0,0|2,0,1]=4 549 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)I 34a_100013085317_100009817552 [0,1,0,0,0,0|2,0,1]=4 550 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)I 7a_100013085317_100009817552 [0,1,0,0,0,0|2,0,1]=4 551 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)N 34a_100011217120_100009817552 [0,1,0,0,0,0|2,0,1]=4 552 B14R1.149 CC(OC[C@@H](C)O)c1cccc(c1)N 7a_100011217120_100009817552 [0,1,0,0,0,0|2,0,1]=4 553 B14R1.149 CN(C)/C=C/C(=O)c1cccc(c1)O 271570a_203496583355_200016267342 [0,1,0,0,0,0|2,0,1]=4 554 B14R1.149 C[C@@H](O)CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100009817552 [0,1,0,0,0,0|2,0,1]=4 555 B14R1.149 C[C@@H](O)CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100009817552 [0,1,0,0,0,0|2,0,1]=4 556 B14R1.149 Cc1cccc(c1)C(=O)CCC(C)C 1458a_100000189346_100000210312 [0,1,0,0,0,0|1,0,0]=2 557 B14R1.149 Cc1cccc(c1)C(=O)CCC(C)O 1458a_100000189346_100012276601 [0,1,0,0,0,0|2,0,0]=3 558 B14R1.149 Cc1cccc(c1)C(=O)CNC(C)C 2230a_100138425928_100000739480 [0,1,0,0,0,0|2,0,0]=3 559 B14R1.149 Cc1cccc(c1)C(=O)CNC(C)C 34a_100138425928_100000739480 [0,1,0,0,0,0|2,0,0]=3 560 B14R1.149 Cc1cccc(c1)C(=O)COC(C)C 34a_100000212225_100000739480 [0,1,0,0,0,0|2,0,0]=3 561 B14R1.149 Cc1cccc(c1)C(=O)CSC(C)C 62a_100000210206_100000739480 [0,1,0,0,0,0|2,0,0]=3 562 B14R1.149 Cc1cccc(c1)C(=O)CSC(C)C 62a_100000739480_100000210206 [0,1,0,0,0,0|2,0,0]=3 563 B14R1.149 Cc1cccc(c1)C(=O)NCC(=O)[13CH3] 1458a_100000182573_200025704644 [0,1,0,0,0,0|2,0,1]=4 564 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)C 11a_100000210953_100000189346 [0,1,0,0,0,0|1,0,0]=2 565 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)C 1626a_100000210953_100000189346 [0,1,0,0,0,0|1,0,0]=2 566 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)C 240690a_100000210953_100000189346 [0,1,0,0,0,0|1,0,0]=2 567 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)C 527a_100000210953_100000189346 [0,1,0,0,0,0|1,0,0]=2 568 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)O 11a_100000210904_100000189346 [0,1,0,0,0,0|2,0,0]=3 569 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)O 240690a_100000210904_100000189346 [0,1,0,0,0,0|2,0,0]=3 570 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)O 527a_100000210904_100000189346 [0,1,0,0,0,0|2,0,0]=3 571 B14R1.149 Cc1cccc(c1)C(=O)NCC(F)F 11a_100000765723_100000189346 [0,1,0,0,0,0|3,0,0]=4 572 B14R1.149 Cc1cccc(c1)C(=O)NCC(F)F 1626a_100000765723_100000189346 [0,1,0,0,0,0|3,0,0]=4 573 B14R1.149 Cc1cccc(c1)C(=O)NCC(F)F 240690a_100000765723_100000189346 [0,1,0,0,0,0|3,0,0]=4 574 B14R1.149 Cc1cccc(c1)C(=O)NCC(F)F 527a_100000765723_100000189346 [0,1,0,0,0,0|3,0,0]=4 575 B14R1.149 Cc1cccc(c1)C(=O)NNC(C)C 22a_100000741168_100000189346 [0,1,0,0,0,0|2,0,0]=3 576 B14R1.149 Cc1cccc(c1)C(C)NCC(C)C 269862a_100000210953_100000211476 [0,1,0,0,0,0|2,0,1]=4 577 B14R1.149 Cc1cccc(c1)C(C)OCC(C)C 34a_100000757818_100000210624 [0,1,0,0,0,0|1,0,1]=3 578 B14R1.149 Cc1cccc(c1)C(C)OCC(C)C 7a_100000757818_100000210760 [0,1,0,0,0,0|1,0,1]=3 579 B14R1.149 Cc1cccc(c1)C(C)OCC(C)O 34a_100000757818_100011218427 [0,1,0,0,0,0|2,0,1]=4 580 B14R1.149 Cc1cccc(c1)C(C)OCC(C)O 7a_100000757818_100011218427 [0,1,0,0,0,0|2,0,1]=4 581 B14R1.149 Cc1cccc(c1)C(C)OC[C@@H](C)O 34a_100000757818_100009817552 [0,1,0,0,0,0|2,0,1]=4 582 B14R1.149 Cc1cccc(c1)C(C)OC[C@@H](C)O 7a_100000757818_100009817552 [0,1,0,0,0,0|2,0,1]=4 583 B14R1.149 Cc1cccc(c1)N(C)CCC(C)C 2230a_100000219674_100000210312 [0,1,0,0,0,0|3,0,0]=4 584 B14R1.149 Cc1cccc(c1)N(C)CCC(C)C 269982a_100000219674_100000210312 [0,1,0,0,0,0|3,0,0]=4 585 B14R1.149 Cc1cccc(c1)N(C)CCC(C)C 34a_100000219674_100000210312 [0,1,0,0,0,0|3,0,0]=4 586 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)C 2230a_100000698126_100000210760 [0,1,0,0,0,0|2,0,1]=4 587 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)C 270004a_100000698126_100000210432 [0,1,0,0,0,0|2,0,1]=4 588 B14R1.149 Cc1cccc(c1)[C@@H](C)NCC(C)C 34a_100000698126_100000210624 [0,1,0,0,0,0|2,0,1]=4 589 B14R1.149 Cc1cccc(n1)C(C)OCC(C)C 34a_200011877368_100000210624 [0,1,0,0,0,0|2,0,1]=4 590 B14R1.149 Cc1cccc(n1)C(C)OCC(C)C 7a_200011877368_100000210760 [0,1,0,0,0,0|2,0,1]=4 591 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Br 11a_100000765723_100000210664 [0,1,0,0,0,0|3,0,0]=4 592 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Br 1626a_100000765723_100000210664 [0,1,0,0,0,0|3,0,0]=4 593 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Br 240690a_100000765723_100000210664 [0,1,0,0,0,0|3,0,0]=4 594 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Br 527a_100000765723_100000210664 [0,1,0,0,0,0|3,0,0]=4 595 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Cl 11a_100000765723_100000210390 [0,1,0,0,0,0|3,0,0]=4 596 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Cl 1626a_100000765723_100000210390 [0,1,0,0,0,0|3,0,0]=4 597 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Cl 240690a_100000765723_100000210390 [0,1,0,0,0,0|3,0,0]=4 598 B14R1.149 O=C(NCC(F)F)c1cccc(c1)Cl 527a_100000765723_100000210390 [0,1,0,0,0,0|3,0,0]=4 599 B14R1.149 O=C(NCC(F)F)c1cccc(c1)F 11a_100000765723_100000210950 [0,1,0,0,0,0|3,0,0]=4 600 B14R1.149 O=C(NCC(F)F)c1cccc(c1)F 1626a_100000765723_100000210950 [0,1,0,0,0,0|3,0,0]=4 601 B14R1.149 O=C(NCC(F)F)c1cccc(c1)F 240690a_100000765723_100000210950 [0,1,0,0,0,0|3,0,0]=4 602 B14R1.149 O=C(NCC(F)F)c1cccc(c1)F 527a_100000765723_100000210950 [0,1,0,0,0,0|3,0,0]=4 603 B14R1.149 O=C(NCC(F)F)c1cccc(c1)I 11a_100000765723_100000184098 [0,1,0,0,0,0|3,0,0]=4 604 B14R1.149 O=C(NCC(F)F)c1cccc(c1)I 1626a_100000765723_100000184098 [0,1,0,0,0,0|3,0,0]=4 605 B14R1.149 O=C(NCC(F)F)c1cccc(c1)I 240690a_100000765723_100000184098 [0,1,0,0,0,0|3,0,0]=4 606 B14R1.149 O=C(NCC(F)F)c1cccc(c1)I 527a_100000765723_100000184098 [0,1,0,0,0,0|3,0,0]=4 607 B14R1.149 O=C(NCC(F)F)c1cccc(c1)O 240690a_100000765723_100000183914 [0,1,0,0,0,0|3,0,0]=4 608 B14R1.149 O=C(NCC(F)F)c1cccc(c1)O 527a_100000765723_100000183914 [0,1,0,0,0,0|3,0,0]=4 609 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)Br 1458a_100000179737_200025704644 [0,1,0,0,0,0|2,0,1]=4 610 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)Cl 1458a_100000182572_200025704644 [0,1,0,0,0,0|2,0,1]=4 611 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)F 1458a_100000183068_200025704644 [0,1,0,0,0,0|2,0,1]=4 612 B14R1.160 C=C(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000730704 [0,1,0,0,0,0|1,0,2]=4 613 B14R1.160 C=C(C)CCC(=O)c1ccccc1C 1458a_100000212026_100000730704 [0,1,0,0,0,0|1,0,2]=4 614 B14R1.160 C=C(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000730704 [0,1,0,0,0,0|1,0,2]=4 615 B14R1.160 C=C(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000730704 [0,1,0,0,0,0|1,0,2]=4 616 B14R1.160 C=C(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000730704 [0,1,0,0,0,0|1,0,2]=4 617 B14R1.160 C=C(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000730704 [0,1,0,0,0,0|1,0,2]=4 618 B14R1.160 C=C(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730704 [0,1,0,0,0,0|1,0,2]=4 619 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 11a_100000765925_100000188424 [0,1,0,0,0,0|1,0,2]=4 620 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 1626a_100000765925_100000188424 [0,1,0,0,0,0|1,0,2]=4 621 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 240690a_100000765925_100000188424 [0,1,0,0,0,0|1,0,2]=4 622 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 527a_100000765925_100000188424 [0,1,0,0,0,0|1,0,2]=4 623 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 11a_100000765925_100000212026 [0,1,0,0,0,0|1,0,2]=4 624 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 1626a_100000765925_100000212026 [0,1,0,0,0,0|1,0,2]=4 625 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 240690a_100000765925_100000212026 [0,1,0,0,0,0|1,0,2]=4 626 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 527a_100000765925_100000212026 [0,1,0,0,0,0|1,0,2]=4 627 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 11a_100000765925_100000185844 [0,1,0,0,0,0|1,0,2]=4 628 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 1626a_100000765925_100000185844 [0,1,0,0,0,0|1,0,2]=4 629 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 240690a_100000765925_100000185844 [0,1,0,0,0,0|1,0,2]=4 630 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 527a_100000765925_100000185844 [0,1,0,0,0,0|1,0,2]=4 631 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 11a_100000765925_100000188656 [0,1,0,0,0,0|1,0,2]=4 632 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 1626a_100000765925_100000188656 [0,1,0,0,0,0|1,0,2]=4 633 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 240690a_100000765925_100000188656 [0,1,0,0,0,0|1,0,2]=4 634 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 527a_100000765925_100000188656 [0,1,0,0,0,0|1,0,2]=4 635 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 11a_100000765925_100000187884 [0,1,0,0,0,0|1,0,2]=4 636 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 1626a_100000765925_100000187884 [0,1,0,0,0,0|1,0,2]=4 637 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 240690a_100000765925_100000187884 [0,1,0,0,0,0|1,0,2]=4 638 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 527a_100000765925_100000187884 [0,1,0,0,0,0|1,0,2]=4 639 B14R1.160 C=C(C)CNC(=O)c1ccccc1O 240690a_100000765925_100015234032 [0,1,0,0,0,0|1,0,2]=4 640 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 1626a_100000765925_100009911694 [0,1,0,0,0,0|1,0,2]=4 641 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 240690a_100000765925_100009911694 [0,1,0,0,0,0|1,0,2]=4 642 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 527a_100000765925_100009911694 [0,1,0,0,0,0|1,0,2]=4 643 B14R1.160 CC(=CCC(=O)c1ccccc1Br)C 1458a_100000188424_100000761012 [0,1,0,0,0,0|1,0,2]=4 644 B14R1.160 CC(=CCC(=O)c1ccccc1C)C 1458a_100000212026_100000761012 [0,1,0,0,0,0|1,0,2]=4 645 B14R1.160 CC(=CCC(=O)c1ccccc1Cl)C 1458a_100000185844_100000761012 [0,1,0,0,0,0|1,0,2]=4 646 B14R1.160 CC(=CCC(=O)c1ccccc1F)C 1458a_100000188656_100000761012 [0,1,0,0,0,0|1,0,2]=4 647 B14R1.160 CC(=CCC(=O)c1ccccc1I)C 1458a_100000187884_100000761012 [0,1,0,0,0,0|1,0,2]=4 648 B14R1.160 CC(=CCC(=O)c1ccccc1O)C 1458a_100015234032_100000761012 [0,1,0,0,0,0|1,0,2]=4 649 B14R1.160 CC(=CCC(=O)c1ccccc1[O-])C 1458a_100009911694_100000761012 [0,1,0,0,0,0|1,0,2]=4 650 B14R1.160 CC(=NNC(C)C)c1ccccc1Br 4a_100000741168_100000187085 [0,1,0,0,0,0|3,0,0]=4 651 B14R1.160 CC(=NNC(C)C)c1ccccc1C 4a_100000741168_100000211656 [0,1,0,0,0,0|3,0,0]=4 652 B14R1.160 CC(=NNC(C)C)c1ccccc1Cl 4a_100000741168_100000210134 [0,1,0,0,0,0|3,0,0]=4 653 B14R1.160 CC(=NNC(C)C)c1ccccc1F 4a_100000741168_100000210632 [0,1,0,0,0,0|3,0,0]=4 654 B14R1.160 CC(=NNC(C)C)c1ccccc1I 4a_100000741168_100000751169 [0,1,0,0,0,0|3,0,0]=4 655 B14R1.160 CC(=NNC(C)C)c1ccccc1O 4a_100000741168_100000188907 [0,1,0,0,0,0|3,0,0]=4 656 B14R1.160 CC(=O)CCC(=O)c1ccccc1F 1458a_100000070787_100000086012 [0,1,0,0,0,0|2,0,1]=4 657 B14R1.160 CC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_200000210301 [0,1,0,0,0,0|2,0,1]=4 658 B14R1.160 CC(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_200000210301 [0,1,0,0,0,0|2,0,1]=4 659 B14R1.160 CC(=O)CNC(=O)c1ccccc1F 1458a_100000182453_200000210301 [0,1,0,0,0,0|2,0,1]=4 660 B14R1.160 CC(=O)CNC(=O)c1ccccc1I 1458a_100000194700_200000210301 [0,1,0,0,0,0|2,0,1]=4 661 B14R1.160 CC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200000210301 [0,1,0,0,0,0|2,0,1]=4 662 B14R1.160 CC(=O)COC(=O)c1ccccc1O 271570a_203496583355_201991511838 [0,1,0,0,0,0|1,0,1]=3 663 B14R1.160 CC(Br)COC(C)c1ccccc1F 34a_100012180447_200000741388 [0,1,0,0,0,0|2,0,1]=4 664 B14R1.160 CC(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000210312 [0,1,0,0,0,0|1,0,0]=2 665 B14R1.160 CC(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210312 [0,1,0,0,0,0|1,0,0]=2 666 B14R1.160 CC(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000210312 [0,1,0,0,0,0|1,0,0]=2 667 B14R1.160 CC(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000210312 [0,1,0,0,0,0|1,0,0]=2 668 B14R1.160 CC(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000210312 [0,1,0,0,0,0|1,0,0]=2 669 B14R1.160 CC(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210312 [0,1,0,0,0,0|1,0,0]=2 670 B14R1.160 CC(C)CCN(C)c1ccccc1Br 2230a_100020606079_100000210312 [0,1,0,0,0,0|3,0,0]=4 671 B14R1.160 CC(C)CCN(C)c1ccccc1Br 269982a_100020606079_100000210312 [0,1,0,0,0,0|3,0,0]=4 672 B14R1.160 CC(C)CCN(C)c1ccccc1Br 34a_100020606079_100000210312 [0,1,0,0,0,0|3,0,0]=4 673 B14R1.160 CC(C)CCN(C)c1ccccc1Cl 2230a_100000219374_100000210312 [0,1,0,0,0,0|3,0,0]=4 674 B14R1.160 CC(C)CCN(C)c1ccccc1Cl 269982a_100000219374_100000210312 [0,1,0,0,0,0|3,0,0]=4 675 B14R1.160 CC(C)CCN(C)c1ccccc1Cl 34a_100000219374_100000210312 [0,1,0,0,0,0|3,0,0]=4 676 B14R1.160 CC(C)CCN(C)c1ccccc1F 2230a_100000220357_100000210312 [0,1,0,0,0,0|3,0,0]=4 677 B14R1.160 CC(C)CCN(C)c1ccccc1F 269982a_100000220357_100000210312 [0,1,0,0,0,0|3,0,0]=4 678 B14R1.160 CC(C)CCN(C)c1ccccc1F 34a_100000220357_100000210312 [0,1,0,0,0,0|3,0,0]=4 679 B14R1.160 CC(C)CCN(C)c1ccccc1F 38a_100000220357_100000210312 [0,1,0,0,0,0|3,0,0]=4 680 B14R1.160 CC(C)CCN(C)c1ccccc1O 269982a_100000033821_100000210312 [0,1,0,0,0,0|3,0,0]=4 681 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 11a_100000210953_100000188424 [0,1,0,0,0,0|1,0,0]=2 682 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 1626a_100000210953_100000188424 [0,1,0,0,0,0|1,0,0]=2 683 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 240690a_100000210953_100000188424 [0,1,0,0,0,0|1,0,0]=2 684 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 527a_100000210953_100000188424 [0,1,0,0,0,0|1,0,0]=2 685 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 11a_100000210953_100000185844 [0,1,0,0,0,0|1,0,0]=2 686 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 1626a_100000210953_100000185844 [0,1,0,0,0,0|1,0,0]=2 687 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 240690a_100000210953_100000185844 [0,1,0,0,0,0|1,0,0]=2 688 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 527a_100000210953_100000185844 [0,1,0,0,0,0|1,0,0]=2 689 B14R1.160 CC(C)CNC(=O)c1ccccc1F 11a_100000210953_100000188656 [0,1,0,0,0,0|1,0,0]=2 690 B14R1.160 CC(C)CNC(=O)c1ccccc1F 1626a_100000210953_100000188656 [0,1,0,0,0,0|1,0,0]=2 691 B14R1.160 CC(C)CNC(=O)c1ccccc1F 240690a_100000210953_100000188656 [0,1,0,0,0,0|1,0,0]=2 692 B14R1.160 CC(C)CNC(=O)c1ccccc1F 527a_100000210953_100000188656 [0,1,0,0,0,0|1,0,0]=2 693 B14R1.160 CC(C)CNC(=O)c1ccccc1I 11a_100000210953_100000187884 [0,1,0,0,0,0|1,0,0]=2 694 B14R1.160 CC(C)CNC(=O)c1ccccc1I 1626a_100000210953_100000187884 [0,1,0,0,0,0|1,0,0]=2 695 B14R1.160 CC(C)CNC(=O)c1ccccc1I 240690a_100000210953_100000187884 [0,1,0,0,0,0|1,0,0]=2 696 B14R1.160 CC(C)CNC(=O)c1ccccc1I 527a_100000210953_100000187884 [0,1,0,0,0,0|1,0,0]=2 697 B14R1.160 CC(C)CNC(=O)c1ccccc1O 240690a_100000210953_100015234032 [0,1,0,0,0,0|1,0,0]=2 698 B14R1.160 CC(C)CNC(=O)c1ccccc1O 271570a_203496583355_200000155729 [0,1,0,0,0,0|1,0,0]=2 699 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 1626a_100000210953_100009911694 [0,1,0,0,0,0|1,0,0]=2 700 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 240690a_100000210953_100009911694 [0,1,0,0,0,0|1,0,0]=2 701 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 527a_100000210953_100009911694 [0,1,0,0,0,0|1,0,0]=2 702 B14R1.160 CC(C)CNC(C)c1ccccc1Br 2230a_100000181357_100000210760 [0,1,0,0,0,0|2,0,1]=4 703 B14R1.160 CC(C)CNC(C)c1ccccc1Br 269862a_100000210953_100000187085 [0,1,0,0,0,0|2,0,1]=4 704 B14R1.160 CC(C)CNC(C)c1ccccc1Br 270004a_100000181357_100000210432 [0,1,0,0,0,0|2,0,1]=4 705 B14R1.160 CC(C)CNC(C)c1ccccc1Cl 2230a_100000174978_100000210760 [0,1,0,0,0,0|2,0,1]=4 706 B14R1.160 CC(C)CNC(C)c1ccccc1Cl 2230a_100000210953_100000181259 [0,1,0,0,0,0|2,0,1]=4 707 B14R1.160 CC(C)CNC(C)c1ccccc1Cl 269862a_100000210953_100000210134 [0,1,0,0,0,0|2,0,1]=4 708 B14R1.160 CC(C)CNC(C)c1ccccc1Cl 270004a_100000174978_100000210432 [0,1,0,0,0,0|2,0,1]=4 709 B14R1.160 CC(C)CNC(C)c1ccccc1Cl 34a_100000174978_100000210624 [0,1,0,0,0,0|2,0,1]=4 710 B14R1.160 CC(C)CNC(C)c1ccccc1F 2230a_100000181408_100000210760 [0,1,0,0,0,0|2,0,1]=4 711 B14R1.160 CC(C)CNC(C)c1ccccc1F 2230a_100000210953_200000741388 [0,1,0,0,0,0|2,0,1]=4 712 B14R1.160 CC(C)CNC(C)c1ccccc1F 269862a_100000210953_100000210632 [0,1,0,0,0,0|2,0,1]=4 713 B14R1.160 CC(C)CNC(C)c1ccccc1F 270004a_100000181408_100000210432 [0,1,0,0,0,0|2,0,1]=4 714 B14R1.160 CC(C)CNC(C)c1ccccc1F 34a_100000181408_100000210624 [0,1,0,0,0,0|2,0,1]=4 715 B14R1.160 CC(C)CNC(C)c1ccccc1F 34a_100000210953_200000741388 [0,1,0,0,0,0|2,0,1]=4 716 B14R1.160 CC(C)CNC(C)c1ccccc1I 269862a_100000210953_100000751169 [0,1,0,0,0,0|2,0,1]=4 717 B14R1.160 CC(C)CN[C@H](C)c1ccccc1O 2230a_100025703389_100000210760 [0,1,0,0,0,0|2,0,1]=4 718 B14R1.160 CC(C)CN[C@H](C)c1ccccc1O 270004a_100025703389_100000210432 [0,1,0,0,0,0|2,0,1]=4 719 B14R1.160 CC(C)COC(C)c1ccccc1Br 34a_100000702211_100000210624 [0,1,0,0,0,0|1,0,1]=3 720 B14R1.160 CC(C)COC(C)c1ccccc1Br 7a_100000702211_100000210760 [0,1,0,0,0,0|1,0,1]=3 721 B14R1.160 CC(C)COC(C)c1ccccc1Cl 34a_100000740796_100000210624 [0,1,0,0,0,0|1,0,1]=3 722 B14R1.160 CC(C)COC(C)c1ccccc1Cl 7a_100000740796_100000210760 [0,1,0,0,0,0|1,0,1]=3 723 B14R1.160 CC(C)COC(C)c1ccccc1F 34a_100000210257_200000741388 [0,1,0,0,0,0|1,0,1]=3 724 B14R1.160 CC(C)COC(C)c1ccccc1F 34a_100000697922_100000210624 [0,1,0,0,0,0|1,0,1]=3 725 B14R1.160 CC(C)COC(C)c1ccccc1F 7a_100000697922_100000210760 [0,1,0,0,0,0|1,0,1]=3 726 B14R1.160 CC(C)COC(C)c1ccccc1N 7a_100011405641_100000210760 [0,1,0,0,0,0|1,0,1]=3 727 B14R1.160 CC(C)COC(C)c1cccnc1Cl 34a_100009865335_100000210624 [0,1,0,0,0,0|2,0,1]=4 728 B14R1.160 CC(C)COC(C)c1cccnc1Cl 7a_100009865335_100000210760 [0,1,0,0,0,0|2,0,1]=4 729 B14R1.160 CC(C)COC(C)c1ccncc1F 34a_100012180158_100000210624 [0,1,0,0,0,0|2,0,1]=4 730 B14R1.160 CC(C)CO[C@@H](C)c1ncccc1Br 7a_100013325542_100000210760 [0,1,0,0,0,0|2,0,1]=4 731 B14R1.160 CC(C)CSC(C)c1ccccc1Cl 62a_100000181259_100000210760 [0,1,0,0,0,0|1,1,1]=4 732 B14R1.160 CC(C)CSC(C)c1ccccc1Cl 62a_100000210624_100000181259 [0,1,0,0,0,0|1,1,1]=4 733 B14R1.160 CC(C)CSC(C)c1ccccc1F 62a_100000210624_200000741388 [0,1,0,0,0,0|1,1,1]=4 734 B14R1.160 CC(C)CSC(C)c1ccccc1F 62a_200000741388_100000210760 [0,1,0,0,0,0|1,1,1]=4 735 B14R1.160 CC(C)NCC(=O)c1ccccc1Br 34a_100138425928_100000199116 [0,1,0,0,0,0|2,0,0]=3 736 B14R1.160 CC(C)NCC(=O)c1ccccc1Cl 34a_100138425928_100000211432 [0,1,0,0,0,0|2,0,0]=3 737 B14R1.160 CC(C)NCC(=O)c1ccccc1F 34a_100138425928_100000204681 [0,1,0,0,0,0|2,0,0]=3 738 B14R1.160 CC(C)NNC(=O)c1ccccc1Br 22a_100000741168_100000188424 [0,1,0,0,0,0|2,0,0]=3 739 B14R1.160 CC(C)NNC(=O)c1ccccc1Cl 22a_100000741168_100000185844 [0,1,0,0,0,0|2,0,0]=3 740 B14R1.160 CC(C)NNC(=O)c1ccccc1F 22a_100000741168_100000188656 [0,1,0,0,0,0|2,0,0]=3 741 B14R1.160 CC(C)NNC(=O)c1ccccc1I 22a_100000741168_100000187884 [0,1,0,0,0,0|2,0,0]=3 742 B14R1.160 CC(C)NNC(=O)c1ccccc1O 22a_100000741168_100015234032 [0,1,0,0,0,0|2,0,0]=3 743 B14R1.160 CC(C)NNC(=O)c1ccccc1[O-] 22a_100000741168_100009911694 [0,1,0,0,0,0|2,0,0]=3 744 B14R1.160 CC(C)OCC(=O)c1ccccc1Br 34a_100000212225_100000199116 [0,1,0,0,0,0|2,0,0]=3 745 B14R1.160 CC(C)OCC(=O)c1ccccc1Cl 34a_100000212225_100000211432 [0,1,0,0,0,0|2,0,0]=3 746 B14R1.160 CC(C)OCC(=O)c1ccccc1F 34a_100000212225_100000204681 [0,1,0,0,0,0|2,0,0]=3 747 B14R1.160 CC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000210206 [0,1,0,0,0,0|2,0,0]=3 748 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000210206_100000211432 [0,1,0,0,0,0|2,0,0]=3 749 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000210206 [0,1,0,0,0,0|2,0,0]=3 750 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000210206 [0,1,0,0,0,0|2,0,0]=3 751 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000210206_100000204681 [0,1,0,0,0,0|2,0,0]=3 752 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000210206 [0,1,0,0,0,0|2,0,0]=3 753 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000210206_100000188908 [0,1,0,0,0,0|2,0,0]=3 754 B14R1.160 CC(F)COC(C)c1ccccc1F 34a_100015925927_200000741388 [0,1,0,0,0,0|2,0,1]=4 755 B14R1.160 CC(O)CCC(=O)c1ccccc1Br 1458a_100000188424_100012276601 [0,1,0,0,0,0|2,0,0]=3 756 B14R1.160 CC(O)CCC(=O)c1ccccc1Cl 1458a_100000185844_100012276601 [0,1,0,0,0,0|2,0,0]=3 757 B14R1.160 CC(O)CCC(=O)c1ccccc1F 1458a_100000188656_100012276601 [0,1,0,0,0,0|2,0,0]=3 758 B14R1.160 CC(O)CCC(=O)c1ccccc1I 1458a_100000187884_100012276601 [0,1,0,0,0,0|2,0,0]=3 759 B14R1.160 CC(O)CCC(=O)c1ccccc1O 1458a_100015234032_100012276601 [0,1,0,0,0,0|2,0,0]=3 760 B14R1.160 CC(O)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100012276601 [0,1,0,0,0,0|2,0,0]=3 761 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 11a_100000210904_100000188424 [0,1,0,0,0,0|2,0,0]=3 762 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 240690a_100000210904_100000188424 [0,1,0,0,0,0|2,0,0]=3 763 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 527a_100000210904_100000188424 [0,1,0,0,0,0|2,0,0]=3 764 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 11a_100000210904_100000185844 [0,1,0,0,0,0|2,0,0]=3 765 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 240690a_100000210904_100000185844 [0,1,0,0,0,0|2,0,0]=3 766 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 527a_100000210904_100000185844 [0,1,0,0,0,0|2,0,0]=3 767 B14R1.160 CC(O)CNC(=O)c1ccccc1F 11a_100000210904_100000188656 [0,1,0,0,0,0|2,0,0]=3 768 B14R1.160 CC(O)CNC(=O)c1ccccc1F 240690a_100000210904_100000188656 [0,1,0,0,0,0|2,0,0]=3 769 B14R1.160 CC(O)CNC(=O)c1ccccc1F 527a_100000210904_100000188656 [0,1,0,0,0,0|2,0,0]=3 770 B14R1.160 CC(O)CNC(=O)c1ccccc1I 11a_100000210904_100000187884 [0,1,0,0,0,0|2,0,0]=3 771 B14R1.160 CC(O)CNC(=O)c1ccccc1I 240690a_100000210904_100000187884 [0,1,0,0,0,0|2,0,0]=3 772 B14R1.160 CC(O)CNC(=O)c1ccccc1I 527a_100000210904_100000187884 [0,1,0,0,0,0|2,0,0]=3 773 B14R1.160 CC(O)CNC(=O)c1ccccc1O 240690a_100000210904_100015234032 [0,1,0,0,0,0|2,0,0]=3 774 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 240690a_100000210904_100009911694 [0,1,0,0,0,0|2,0,0]=3 775 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 527a_100000210904_100009911694 [0,1,0,0,0,0|2,0,0]=3 776 B14R1.160 CC(O)COC(C)c1ccccc1Br 34a_100000702211_100011218427 [0,1,0,0,0,0|2,0,1]=4 777 B14R1.160 CC(O)COC(C)c1ccccc1Br 7a_100000702211_100011218427 [0,1,0,0,0,0|2,0,1]=4 778 B14R1.160 CC(O)COC(C)c1ccccc1Cl 34a_100000740796_100011218427 [0,1,0,0,0,0|2,0,1]=4 779 B14R1.160 CC(O)COC(C)c1ccccc1Cl 7a_100000740796_100011218427 [0,1,0,0,0,0|2,0,1]=4 780 B14R1.160 CC(O)COC(C)c1ccccc1F 34a_100000697922_100011218427 [0,1,0,0,0,0|2,0,1]=4 781 B14R1.160 CC(O)COC(C)c1ccccc1F 7a_100000697922_100011218427 [0,1,0,0,0,0|2,0,1]=4 782 B14R1.160 CC(O)COC(C)c1ccccc1N 7a_100011405641_100011218427 [0,1,0,0,0,0|2,0,1]=4 783 B14R1.160 CC(OC[C@@H](C)Cl)c1ccccc1F 34a_100016084084_200000741388 [0,1,0,0,0,0|2,0,1]=4 784 B14R1.160 CC(OC[C@@H](C)N)c1ccccc1F 34a_100000737577_200000741388 [0,1,0,0,0,0|2,0,1]=4 785 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1Br 34a_100000702211_100009817552 [0,1,0,0,0,0|2,0,1]=4 786 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1Br 7a_100000702211_100009817552 [0,1,0,0,0,0|2,0,1]=4 787 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1Cl 34a_100000740796_100009817552 [0,1,0,0,0,0|2,0,1]=4 788 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1Cl 7a_100000740796_100009817552 [0,1,0,0,0,0|2,0,1]=4 789 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1F 34a_100000697922_100009817552 [0,1,0,0,0,0|2,0,1]=4 790 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1F 7a_100000697922_100009817552 [0,1,0,0,0,0|2,0,1]=4 791 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1N 7a_100011405641_100009817552 [0,1,0,0,0,0|2,0,1]=4 792 B14R1.160 CN(C)CCC(=O)c1ccccc1F 2230a_100102631434_100000086012 [0,1,0,0,0,0|2,0,0]=3 793 B14R1.160 CN(C)CCC(=O)c1ccccc1F 269982a_100102631434_100000086012 [0,1,0,0,0,0|2,0,0]=3 794 B14R1.160 CN(C)CCC(=O)c1ccccc1O 269982a_100102631434_100009873196 [0,1,0,0,0,0|2,0,0]=3 795 B14R1.160 Cc1ccccc1C(=O)CCC(C)C 1458a_100000212026_100000210312 [0,1,0,0,0,0|1,0,0]=2 796 B14R1.160 Cc1ccccc1C(=O)CCC(C)O 1458a_100000212026_100012276601 [0,1,0,0,0,0|2,0,0]=3 797 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 2230a_100138425928_100000741374 [0,1,0,0,0,0|2,0,0]=3 798 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000741374 [0,1,0,0,0,0|2,0,0]=3 799 B14R1.160 Cc1ccccc1C(=O)COC(C)C 34a_100000212225_100000741374 [0,1,0,0,0,0|2,0,0]=3 800 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000210206_100000741374 [0,1,0,0,0,0|2,0,0]=3 801 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000741374_100000210206 [0,1,0,0,0,0|2,0,0]=3 802 B14R1.160 Cc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000184812_200025704644 [0,1,0,0,0,0|2,0,1]=4 803 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000212026 [0,1,0,0,0,0|1,0,0]=2 804 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000212026 [0,1,0,0,0,0|1,0,0]=2 805 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000212026 [0,1,0,0,0,0|1,0,0]=2 806 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000212026 [0,1,0,0,0,0|1,0,0]=2 807 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000212026 [0,1,0,0,0,0|2,0,0]=3 808 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000212026 [0,1,0,0,0,0|2,0,0]=3 809 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000212026 [0,1,0,0,0,0|2,0,0]=3 810 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 11a_100000765723_100000212026 [0,1,0,0,0,0|3,0,0]=4 811 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 1626a_100000765723_100000212026 [0,1,0,0,0,0|3,0,0]=4 812 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 240690a_100000765723_100000212026 [0,1,0,0,0,0|3,0,0]=4 813 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 527a_100000765723_100000212026 [0,1,0,0,0,0|3,0,0]=4 814 B14R1.160 Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000212026 [0,1,0,0,0,0|2,0,0]=3 815 B14R1.160 Cc1ccccc1C(C)NCC(C)C 2230a_100000181355_100000210760 [0,1,0,0,0,0|2,0,1]=4 816 B14R1.160 Cc1ccccc1C(C)NCC(C)C 269862a_100000210953_100000211656 [0,1,0,0,0,0|2,0,1]=4 817 B14R1.160 Cc1ccccc1C(C)NCC(C)C 270004a_100000181355_100000210432 [0,1,0,0,0,0|2,0,1]=4 818 B14R1.160 Cc1ccccc1C(C)NCC(C)C 34a_100000181355_100000210624 [0,1,0,0,0,0|2,0,1]=4 819 B14R1.160 Cc1ccccc1C(C)OCC(C)C 34a_100000742021_100000210624 [0,1,0,0,0,0|1,0,1]=3 820 B14R1.160 Cc1ccccc1C(C)OCC(C)C 7a_100000742021_100000210760 [0,1,0,0,0,0|1,0,1]=3 821 B14R1.160 Cc1ccccc1C(C)OCC(C)O 34a_100000742021_100011218427 [0,1,0,0,0,0|2,0,1]=4 822 B14R1.160 Cc1ccccc1C(C)OCC(C)O 7a_100000742021_100011218427 [0,1,0,0,0,0|2,0,1]=4 823 B14R1.160 Cc1ccccc1C(C)OC[C@@H](C)O 34a_100000742021_100009817552 [0,1,0,0,0,0|2,0,1]=4 824 B14R1.160 Cc1ccccc1C(C)OC[C@@H](C)O 7a_100000742021_100009817552 [0,1,0,0,0,0|2,0,1]=4 825 B14R1.160 Cc1ccccc1N(C)CCC(C)C 2230a_100000219699_100000210312 [0,1,0,0,0,0|3,0,0]=4 826 B14R1.160 Cc1ccccc1N(C)CCC(C)C 269982a_100000219699_100000210312 [0,1,0,0,0,0|3,0,0]=4 827 B14R1.160 Cc1ccccc1N(C)CCC(C)C 34a_100000219699_100000210312 [0,1,0,0,0,0|3,0,0]=4 828 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 11a_100000765723_100000188424 [0,1,0,0,0,0|3,0,0]=4 829 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 1626a_100000765723_100000188424 [0,1,0,0,0,0|3,0,0]=4 830 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 240690a_100000765723_100000188424 [0,1,0,0,0,0|3,0,0]=4 831 B14R1.160 O=C(NCC(F)F)c1ccccc1Br 527a_100000765723_100000188424 [0,1,0,0,0,0|3,0,0]=4 832 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 11a_100000765723_100000185844 [0,1,0,0,0,0|3,0,0]=4 833 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 1626a_100000765723_100000185844 [0,1,0,0,0,0|3,0,0]=4 834 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 240690a_100000765723_100000185844 [0,1,0,0,0,0|3,0,0]=4 835 B14R1.160 O=C(NCC(F)F)c1ccccc1Cl 527a_100000765723_100000185844 [0,1,0,0,0,0|3,0,0]=4 836 B14R1.160 O=C(NCC(F)F)c1ccccc1F 11a_100000765723_100000188656 [0,1,0,0,0,0|3,0,0]=4 837 B14R1.160 O=C(NCC(F)F)c1ccccc1F 1626a_100000765723_100000188656 [0,1,0,0,0,0|3,0,0]=4 838 B14R1.160 O=C(NCC(F)F)c1ccccc1F 240690a_100000765723_100000188656 [0,1,0,0,0,0|3,0,0]=4 839 B14R1.160 O=C(NCC(F)F)c1ccccc1F 527a_100000765723_100000188656 [0,1,0,0,0,0|3,0,0]=4 840 B14R1.160 O=C(NCC(F)F)c1ccccc1I 11a_100000765723_100000187884 [0,1,0,0,0,0|3,0,0]=4 841 B14R1.160 O=C(NCC(F)F)c1ccccc1I 1626a_100000765723_100000187884 [0,1,0,0,0,0|3,0,0]=4 842 B14R1.160 O=C(NCC(F)F)c1ccccc1I 240690a_100000765723_100000187884 [0,1,0,0,0,0|3,0,0]=4 843 B14R1.160 O=C(NCC(F)F)c1ccccc1I 527a_100000765723_100000187884 [0,1,0,0,0,0|3,0,0]=4 844 B14R1.160 O=C(NCC(F)F)c1ccccc1O 240690a_100000765723_100015234032 [0,1,0,0,0,0|3,0,0]=4 845 B14R1.160 O=C(NCC(F)F)c1ccccc1[O-] 1626a_100000765723_100009911694 [0,1,0,0,0,0|3,0,0]=4 846 B14R1.160 O=C(NCC(F)F)c1ccccc1[O-] 240690a_100000765723_100009911694 [0,1,0,0,0,0|3,0,0]=4 847 B14R1.160 O=C(NCC(F)F)c1ccccc1[O-] 527a_100000765723_100009911694 [0,1,0,0,0,0|3,0,0]=4 848 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_200025704644 [0,1,0,0,0,0|2,0,1]=4 849 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1F 1458a_100000182453_200025704644 [0,1,0,0,0,0|2,0,1]=4 850 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1I 1458a_100000194700_200025704644 [0,1,0,0,0,0|2,0,1]=4 851 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200025704644 [0,1,0,0,0,0|2,0,1]=4 852 B14R1.163 C#CC(=O)COC(=O)c1ccccc1 1458a_100000211873_100000073877 [0,1,0,0,0,0|1,0,2]=4 853 B14R1.163 C#CC(C)SCC(=O)c1ccccc1 62a_200000035995_100000211460 [0,1,0,0,0,0|2,0,1]=4 854 B14R1.163 C#C[C@@H](C)OCC(=O)c1ccccc1 7a_100009815206_100000211460 [0,1,0,0,0,0|2,0,1]=4 855 B14R1.163 C=CC(=O)COC(=O)c1ccccc1 1458a_100000185746_100000073877 [0,1,0,0,0,0|1,0,2]=4 856 B14R1.163 C=CC(C)COC(C)c1ccccc1 34a_100011215527_100000211855 [0,1,0,0,0,0|1,0,2]=4 857 B14R1.163 C=CC(C)COC(C)c1ccccc1 7a_100011215527_100000230085 [0,1,0,0,0,0|1,0,2]=4 858 B14R1.163 C=CC(C)SCC(=O)c1ccccc1 62a_100011215867_100000211460 [0,1,0,0,0,0|2,0,1]=4 859 B14R1.163 CC(=NNC(=O)c1ccccc1)CF 4a_100000184135_100000039719 [0,1,0,0,0,0|2,0,1]=4 860 B14R1.163 CC(=NNC(=O)c1ccccc1)CO 4a_100000184135_100000211253 [0,1,0,0,0,0|2,0,1]=4 861 B14R1.163 CC(C#N)SCC(=O)c1ccccc1 62a_100000211460_100000703298 [0,1,0,0,0,0|2,0,1]=4 862 B14R1.163 CC(C#N)SCC(=O)c1ccccc1 62a_100000703298_100000211460 [0,1,0,0,0,0|2,0,1]=4 863 B14R1.163 CC(CCC(=O)c1ccccc1)O[13CH3] 7a_200012571355_200025704644 [0,1,0,0,0,0|1,0,0]=2 864 B14R1.163 CC(CF)OCC(=O)c1ccccc1 7a_100016041109_100000211460 [0,1,0,0,0,0|2,0,0]=3 865 B14R1.163 CC(CF)OCC(=O)c1ccccn1 34a_100016041109_100000027445 [0,1,0,0,0,0|3,0,0]=4 866 B14R1.163 CC(CF)OCC(=O)c1ccccn1 7a_100016041109_100000027445 [0,1,0,0,0,0|3,0,0]=4 867 B14R1.163 CC(CF)OCC(=O)c1ccncc1 7a_100016041109_100015248511 [0,1,0,0,0,0|3,0,0]=4 868 B14R1.163 CC(CN)COC(C)c1ccccc1 34a_100000744482_100000211855 [0,1,0,0,0,0|1,0,1]=3 869 B14R1.163 CC(CN)OCC(=O)c1ccccn1 34a_100000210904_100000027445 [0,1,0,0,0,0|3,0,0]=4 870 B14R1.163 CC(CO)CNC(=O)c1ccccc1 240690a_100000744482_100000185807 [0,1,0,0,0,0|1,0,0]=2 871 B14R1.163 CC(CO)CNC(=O)c1ccccc1 527a_100000744482_100000185807 [0,1,0,0,0,0|1,0,0]=2 872 B14R1.163 CC(CO)CNC(C)c1ccccc1 269862a_100000744482_100000185851 [0,1,0,0,0,0|2,0,1]=4 873 B14R1.163 CC(CO)CNC(C)c1ccccc1 34a_100000744482_100000211855 [0,1,0,0,0,0|2,0,1]=4 874 B14R1.163 CC(CO)SCC(=O)c1ccccc1 62a_100012180447_100000211460 [0,1,0,0,0,0|2,0,0]=3 875 B14R1.163 CC(CO)SCC(=O)c1ccccn1 62a_100012180447_100000027445 [0,1,0,0,0,0|3,0,0]=4 876 B14R1.163 CC(CO)SCC(=O)c1cccnc1 62a_100012180447_100000757877 [0,1,0,0,0,0|3,0,0]=4 877 B14R1.163 CC(CO)SCC(=O)c1ccncc1 62a_100012180447_100000027454 [0,1,0,0,0,0|3,0,0]=4 878 B14R1.163 CC(CO)SCS(=O)c1ccccc1 62a_100012180447_100000031784 [0,1,0,0,0,0|3,0,0]=4 879 B14R1.163 CC(OCC(Cl)CCl)c1ccccc1 34a_100000033668_100000211855 [0,1,0,0,0,0|2,0,1]=4 880 B14R1.163 CC(OC[C@H](F)CN)c1ccccc1 34a_100015665980_100000211855 [0,1,0,0,0,0|2,0,1]=4 881 B14R1.163 CC(SC[C@@H](C)CO)c1ccccc1 62a_100000059175_100000230085 [0,1,0,0,0,0|1,1,1]=4 882 B14R1.163 CC(SC[C@@H](C)CO)c1ccccc1 62a_100000230085_100000059175 [0,1,0,0,0,0|1,1,1]=4 883 B14R1.163 CCC(=O)CCC(=O)c1ccccc1 1458a_100000210414_100000750707 [0,1,0,0,0,0|2,0,1]=4 884 B14R1.163 CCC(=O)CNC(=O)c1ccccc1 1458a_100000182045_100000210202 [0,1,0,0,0,0|2,0,1]=4 885 B14R1.163 CCC(=O)COC(=O)c1ccccc1 1458a_100000210414_100000073877 [0,1,0,0,0,0|1,0,1]=3 886 B14R1.163 CCC(C)CNC(=O)c1ccccc1 11a_100020588543_100000185807 [0,1,0,0,0,0|1,0,0]=2 887 B14R1.163 CCC(C)CNC(=O)c1ccccc1 1626a_100020588543_100000185807 [0,1,0,0,0,0|1,0,0]=2 888 B14R1.163 CCC(C)CNC(=O)c1ccccc1 240690a_100020588543_100000185807 [0,1,0,0,0,0|1,0,0]=2 889 B14R1.163 CCC(C)CNC(=O)c1ccccc1 527a_100020588543_100000185807 [0,1,0,0,0,0|1,0,0]=2 890 B14R1.163 CCC(C)CNC(C)c1ccccc1 2230a_100020588543_100000230085 [0,1,0,0,0,0|2,0,1]=4 891 B14R1.163 CCC(C)CNC(C)c1ccccc1 269862a_100020588543_100000185851 [0,1,0,0,0,0|2,0,1]=4 892 B14R1.163 CCC(C)CN[C@H](C)c1ccccc1 2230a_100000751104_100000748023 [0,1,0,0,0,0|2,0,1]=4 893 B14R1.163 CCC(C)CN[C@H](C)c1ccccc1 270004a_100000751104_100000243153 [0,1,0,0,0,0|2,0,1]=4 894 B14R1.163 CCC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000748023 [0,1,0,0,0,0|1,0,1]=3 895 B14R1.163 CCC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000748023 [0,1,0,0,0,0|1,0,1]=3 896 B14R1.163 CCC(C)CSC(C)c1ccccc1 62a_100000230085_100000748023 [0,1,0,0,0,0|1,1,1]=4 897 B14R1.163 CCC(C)CSC(C)c1ccccc1 62a_100000748023_100000230085 [0,1,0,0,0,0|1,1,1]=4 898 B14R1.163 CCC(C)NN=C(C)c1ccccc1 4a_100000718999_100000185851 [0,1,0,0,0,0|3,0,0]=4 899 B14R1.163 CCC(C)NNC(=O)c1ccccc1 22a_100000718999_100000185807 [0,1,0,0,0,0|2,0,0]=3 900 B14R1.163 CCC(C)OCC(=O)c1ccccc1 7a_100000210228_100000211460 [0,1,0,0,0,0|2,0,0]=3 901 B14R1.163 CCC(C)OCC(=O)c1ccccn1 7a_100000210228_100000027445 [0,1,0,0,0,0|3,0,0]=4 902 B14R1.163 CCC(C)OCC(=O)c1ccncc1 7a_100000210228_100015248511 [0,1,0,0,0,0|3,0,0]=4 903 B14R1.163 CCC(C)SCC(=O)c1ccccc1 62a_100000211460_100000758301 [0,1,0,0,0,0|2,0,0]=3 904 B14R1.163 CCC(C)SCC(=O)c1ccccc1 62a_100000758301_100000211460 [0,1,0,0,0,0|2,0,0]=3 905 B14R1.163 CCC(C)SCC(=O)c1ccccn1 62a_100000027445_100000758301 [0,1,0,0,0,0|3,0,0]=4 906 B14R1.163 CCC(C)SCC(=O)c1ccccn1 62a_100000758301_100000027445 [0,1,0,0,0,0|3,0,0]=4 907 B14R1.163 CCC(C)SCC(=O)c1cccnc1 62a_100000757877_100000758301 [0,1,0,0,0,0|3,0,0]=4 908 B14R1.163 CCC(C)SCC(=O)c1cccnc1 62a_100000758301_100000757877 [0,1,0,0,0,0|3,0,0]=4 909 B14R1.163 CCC(C)SCC(=O)c1ccncc1 62a_100000027454_100000758301 [0,1,0,0,0,0|3,0,0]=4 910 B14R1.163 CCC(C)SCC(=O)c1ccncc1 62a_100000758301_100000027454 [0,1,0,0,0,0|3,0,0]=4 911 B14R1.163 CCC(C)SCS(=O)c1ccccc1 62a_100000758301_100000031784 [0,1,0,0,0,0|3,0,0]=4 912 B14R1.163 CCC(O)CNC(=O)c1ccccc1 11a_100011218483_100000185807 [0,1,0,0,0,0|2,0,0]=3 913 B14R1.163 CCC(O)CNC(=O)c1ccccc1 240690a_100011218483_100000185807 [0,1,0,0,0,0|2,0,0]=3 914 B14R1.163 CCC(O)CNC(=O)c1ccccc1 527a_100011218483_100000185807 [0,1,0,0,0,0|2,0,0]=3 915 B14R1.163 CCC(O)CO[C@H](C)c1ccccc1 34a_100000761318_100011218378 [0,1,0,0,0,0|2,0,1]=4 916 B14R1.163 CCC(O)CO[C@H](C)c1ccccc1 7a_100000761318_100011218378 [0,1,0,0,0,0|2,0,1]=4 917 B14R1.163 CCN(C)CCC(=O)c1ccccc1 2230a_100000225621_100000750707 [0,1,0,0,0,0|2,0,0]=3 918 B14R1.163 CCN(C)CCC(=O)c1ccccc1 269982a_100000225621_100000750707 [0,1,0,0,0,0|2,0,0]=3 919 B14R1.163 CCN(C)CCS(=O)c1ccccc1 2230a_100000225621_100000740319 [0,1,0,0,0,0|3,0,0]=4 920 B14R1.163 CCN(C)CCS(=O)c1ccccc1 269982a_100000225621_100000740319 [0,1,0,0,0,0|3,0,0]=4 921 B14R1.163 CCN(C)COC(=O)c1ccccc1 269982a_100000225621_100000073877 [0,1,0,0,0,0|1,0,0]=2 922 B14R1.163 CC[C@H](C)CN[C@H](C)c1ccccc1 2230a_100000751104_100009816398 [0,1,0,0,0,0|2,0,1]=4 923 B14R1.163 CC[C@H](C)COC(C)c1ccccc1 7a_100009816381_100000230085 [0,1,0,0,0,0|1,0,1]=3 924 B14R1.163 CC[C@H](C)CO[C@H](C)c1ccccc1 34a_100000761318_100009816398 [0,1,0,0,0,0|1,0,1]=3 925 B14R1.163 CC[C@H](C)CO[C@H](C)c1ccccc1 7a_100000761318_100009816398 [0,1,0,0,0,0|1,0,1]=3 926 B14R1.163 CC[C@H](C)CSC(C)c1ccccc1 62a_100000230085_100009816398 [0,1,0,0,0,0|1,1,1]=4 927 B14R1.163 CC[C@H](C)CSC(C)c1ccccc1 62a_100009816398_100000230085 [0,1,0,0,0,0|1,1,1]=4 928 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 11a_100000693194_100000185807 [0,1,0,0,0,0|2,0,1]=4 929 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 11a_106832991635_100000182045 [0,1,0,0,0,0|2,0,1]=4 930 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 1626a_100102657272_100000182045 [0,1,0,0,0,0|2,0,1]=4 931 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 240690a_100000693194_100000185807 [0,1,0,0,0,0|2,0,1]=4 932 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 240690a_100102657272_100000182045 [0,1,0,0,0,0|2,0,1]=4 933 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 527a_100000693194_100000185807 [0,1,0,0,0,0|2,0,1]=4 934 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 527a_100102657272_100000182045 [0,1,0,0,0,0|2,0,1]=4 935 B14R1.163 CNC(C)COC(=O)c1ccccc1 270004a_106832991635_100000000904 [0,1,0,0,0,0|0,0,0]=1 936 B14R1.163 COC(=O)CNC(=O)c1ccccc1 188690a_100000185156_100000185807 [0,1,0,0,0,0|2,0,1]=4 937 B14R1.163 COC(C)CCC(=O)c1ccccc1 7a_200012571355_200000210301 [0,1,0,0,0,0|1,0,0]=2 938 B14R1.163 COC(C)COC(C)c1ccccc1 34a_100000690652_100000211855 [0,1,0,0,0,0|1,0,1]=3 939 B14R1.163 COC(C)SCC(=O)c1ccccc1 62a_100000211460_100009879195 [0,1,0,0,0,0|2,0,0]=3 940 B14R1.163 COC(C)SCC(=O)c1ccccc1 62a_100009879195_100000211460 [0,1,0,0,0,0|2,0,0]=3 941 B14R1.163 COC(C)SCC(=O)c1ccccn1 62a_100000027445_100009879195 [0,1,0,0,0,0|3,0,0]=4 942 B14R1.163 COC(C)SCC(=O)c1ccccn1 62a_100009879195_100000027445 [0,1,0,0,0,0|3,0,0]=4 943 B14R1.163 COC(C)SCC(=O)c1cccnc1 62a_100000757877_100009879195 [0,1,0,0,0,0|3,0,0]=4 944 B14R1.163 COC(C)SCC(=O)c1cccnc1 62a_100009879195_100000757877 [0,1,0,0,0,0|3,0,0]=4 945 B14R1.163 COC(C)SCC(=O)c1ccncc1 62a_100000027454_100009879195 [0,1,0,0,0,0|3,0,0]=4 946 B14R1.163 COC(C)SCC(=O)c1ccncc1 62a_100009879195_100000027454 [0,1,0,0,0,0|3,0,0]=4 947 B14R1.163 COC(C)SCS(=O)c1ccccc1 62a_100009879195_100000031784 [0,1,0,0,0,0|3,0,0]=4 948 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 11a_100020591295_100000185807 [0,1,0,0,0,0|1,0,0]=2 949 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 1626a_100020591295_100000185807 [0,1,0,0,0,0|1,0,0]=2 950 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 240690a_100020591295_100000185807 [0,1,0,0,0,0|1,0,0]=2 951 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 527a_100020591295_100000185807 [0,1,0,0,0,0|1,0,0]=2 952 B14R1.163 CO[C@H](C)CNC(C)c1ccccc1 2230a_100020591295_100000230085 [0,1,0,0,0,0|2,0,1]=4 953 B14R1.163 CO[C@H](C)CNC(C)c1ccccc1 269862a_100020591295_100000185851 [0,1,0,0,0,0|2,0,1]=4 954 B14R1.163 C[C@@H](CO)CN[C@H](C)c1ccccc1 2230a_100000751104_100000059175 [0,1,0,0,0,0|2,0,1]=4 955 B14R1.163 C[C@@H](CO)CO[C@H](C)c1ccccc1 34a_100000761318_100000059175 [0,1,0,0,0,0|1,0,1]=3 956 B14R1.163 C[C@@H](CO)CO[C@H](C)c1ccccc1 7a_100000761318_100000059175 [0,1,0,0,0,0|1,0,1]=3 957 B14R1.163 C[C@@H](OCC(O)CO)c1ccccc1 34a_100000761318_100011219619 [0,1,0,0,0,0|2,0,1]=4 958 B14R1.163 C[C@@H](OCC(O)CO)c1ccccc1 7a_100000761318_100011219619 [0,1,0,0,0,0|2,0,1]=4 959 B14R1.163 C[C@@H](OC[C@@H](O)CF)c1ccccc1 34a_100000761318_100015614560 [0,1,0,0,0,0|2,0,1]=4 960 B14R1.163 C[C@@H](OC[C@@H](O)CF)c1ccccc1 7a_100000761318_100015614560 [0,1,0,0,0,0|2,0,1]=4 961 B14R1.163 C[C@@H](OC[C@@H](O)CO)c1ccccc1 34a_100000761318_100009815848 [0,1,0,0,0,0|2,0,1]=4 962 B14R1.163 C[C@@H](OC[C@@H](O)CO)c1ccccc1 7a_100000761318_100009815848 [0,1,0,0,0,0|2,0,1]=4 963 B14R1.163 C[C@H](CO)SCC(=O)c1ccccc1 62a_100000211460_100016084084 [0,1,0,0,0,0|2,0,0]=3 964 B14R1.163 C[C@H](CO)SCC(=O)c1ccccc1 62a_100016084084_100000211460 [0,1,0,0,0,0|2,0,0]=3 965 B14R1.163 C[C@H](CO)SCC(=O)c1ccccn1 62a_100000027445_100016084084 [0,1,0,0,0,0|3,0,0]=4 966 B14R1.163 C[C@H](CO)SCC(=O)c1ccccn1 62a_100016084084_100000027445 [0,1,0,0,0,0|3,0,0]=4 967 B14R1.163 C[C@H](CO)SCC(=O)c1cccnc1 62a_100000757877_100016084084 [0,1,0,0,0,0|3,0,0]=4 968 B14R1.163 C[C@H](CO)SCC(=O)c1cccnc1 62a_100016084084_100000757877 [0,1,0,0,0,0|3,0,0]=4 969 B14R1.163 C[C@H](CO)SCC(=O)c1ccncc1 62a_100000027454_100016084084 [0,1,0,0,0,0|3,0,0]=4 970 B14R1.163 C[C@H](CO)SCC(=O)c1ccncc1 62a_100016084084_100000027454 [0,1,0,0,0,0|3,0,0]=4 971 B14R1.163 C[C@H](CO)SCS(=O)c1ccccc1 62a_100016084084_100000031784 [0,1,0,0,0,0|3,0,0]=4 972 B14R1.163 O=C(CF)CNC(=O)c1ccccc1 1458a_100000182045_100015361967 [0,1,0,0,0,0|2,0,1]=4 973 B14R1.163 O=C(CO)CCC(=O)c1ccccc1 1458a_100000210174_100000750707 [0,1,0,0,0,0|2,0,1]=4 974 B14R1.163 O=C(CO)COC(=O)c1ccccc1 1458a_100000210174_100000073877 [0,1,0,0,0,0|1,0,1]=3 975 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 240690a_100015665980_100000185807 [0,1,0,0,0,0|2,0,0]=3 976 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 527a_100015665980_100000185807 [0,1,0,0,0,0|2,0,0]=3 977 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 240690a_100020644852_100000185807 [0,1,0,0,0,0|2,0,0]=3 978 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 527a_100020644852_100000185807 [0,1,0,0,0,0|2,0,0]=3 979 B14R1.415 CC(=CC(=O)C(C)C)c1ccccc1 1458a_100000743005_100000210206 [0,1,0,0,0,0|2,0,1]=4 980 B14R1.415 CC(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200000210301 [0,1,0,0,0,0|2,0,1]=4 981 B14R1.415 CC(=O)[C@@H](C)NC(=O)c1ccccc1 1458a_100011504567_200000210301 [0,1,0,0,0,0|2,0,1]=4 982 B14R1.415 CC(=O)[C@@H](C)OC(=O)c1ccccc1 1458a_200035542198_200000210301 [0,1,0,0,0,0|1,0,1]=3 983 B14R1.415 CC(C)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100000753385 [0,1,0,0,0,0|1,0,1]=3 984 B14R1.415 CC(C)C(=O)CC(=O)c1ccccc1 1458a_100000210198_100000211460 [0,1,0,0,0,0|1,0,1]=3 985 B14R1.415 CC(C)C(=O)CC(=O)c1ccccn1 1458a_100000210198_100000027445 [0,1,0,0,0,0|2,0,1]=4 986 B14R1.415 CC(C)C(=O)CC(=O)c1cccnc1 1458a_100000210198_100015188593 [0,1,0,0,0,0|2,0,1]=4 987 B14R1.415 CC(C)C(=O)CC(=O)c1ccncc1 1458a_100000210198_100000027454 [0,1,0,0,0,0|2,0,1]=4 988 B14R1.415 CC(C)C(C)NC(=O)c1ccccc1 11a_100000211541_100000185807 [0,1,0,0,0,0|1,0,0]=2 989 B14R1.415 CC(C)C(C)NC(=O)c1ccccc1 1626a_100000211541_100000185807 [0,1,0,0,0,0|1,0,0]=2 990 B14R1.415 CC(C)C(C)NC(=O)c1ccccc1 240690a_100000211541_100000185807 [0,1,0,0,0,0|1,0,0]=2 991 B14R1.415 CC(C)C(C)NC(=O)c1ccccc1 527a_100000211541_100000185807 [0,1,0,0,0,0|1,0,0]=2 992 B14R1.415 CC(C)N(C)CC(=O)c1ccccc1 269982a_200000211004_100000211460 [0,1,0,0,0,0|2,0,0]=3 993 B14R1.415 CC(C)N(C)CC(=O)c1ccccn1 269982a_200000211004_100000027445 [0,1,0,0,0,0|3,0,0]=4 994 B14R1.415 CC(C)N(C)CC(=O)c1cccnc1 269982a_200000211004_100000757877 [0,1,0,0,0,0|3,0,0]=4 995 B14R1.415 CC(C)N(C)CC(=O)c1ccncc1 269982a_200000211004_100000027454 [0,1,0,0,0,0|3,0,0]=4 996 B14R1.415 CC(C)N(C)CS(=O)c1ccccc1 269982a_200000211004_100000031784 [0,1,0,0,0,0|3,0,0]=4 997 B14R1.415 CC(F)C(=O)CC(=O)c1ccccc1 1458a_100000062450_100000211460 [0,1,0,0,0,0|2,0,1]=4 998 B14R1.415 CC(NC(C)C(C)C)c1ccccc1 2230a_100000211541_100000230085 [0,1,0,0,0,0|2,0,1]=4 999 B14R1.415 CC(NC(C)C(C)C)c1ccccc1 269862a_100000211541_100000185851 [0,1,0,0,0,0|2,0,1]=4 1000 B14R1.415 CC(OC(C)C(C)C)c1ccccc1 7a_100000748068_100000230085 [0,1,0,0,0,0|1,0,1]=3 1001 B14R1.415 CN(C)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100000185267 [0,1,0,0,0,0|2,0,1]=4 1002 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)[13CH3] 1458a_100011504567_200025704644 [0,1,0,0,0,0|2,0,1]=4 1003 B14R1.415 C[C@@H](O)C(=O)CC(=O)c1ccccc1 1458a_100000717761_100000211460 [0,1,0,0,0,0|2,0,1]=4 1004 B14R1.415 C[C@@H](OC(=O)c1ccccc1)C(=O)[13CH3] 1458a_200035542198_200025704644 [0,1,0,0,0,0|1,0,1]=3 1005 B14R1.415 C[C@H](O)C(=O)CC(=O)c1ccccc1 1458a_217856618621_100000211460 [0,1,0,0,0,0|2,0,1]=4 1006 B14R1.415 [13CH3]C(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200025704644 [0,1,0,0,0,0|2,0,1]=4 1007 B14R1.417 C=C(C(=O)CC(C)C)c1ccccc1 1458a_100000065200_100000210624 [0,1,0,0,0,0|2,0,0]=3 1008 B14R1.417 C=C(C(=O)CC(C)O)c1ccccc1 1458a_100000065200_100011218427 [0,1,0,0,0,0|3,0,0]=4 1009 B14R1.417 C=C(C(=O)NC(C)C)c1ccccc1 1626a_100138425928_100000065200 [0,1,0,0,0,0|3,0,0]=4 1010 B14R1.417 C=C(C)CN(C)C(=O)c1ccccc1 11a_100000225649_100000185807 [0,1,0,0,0,0|1,0,2]=4 1011 B14R1.417 C=C(C)CN(C)C(=O)c1ccccc1 1626a_100000225649_100000185807 [0,1,0,0,0,0|1,0,2]=4 1012 B14R1.417 C=C(C)CN(C)C(=O)c1ccccc1 527a_100000225649_100000185807 [0,1,0,0,0,0|1,0,2]=4 1013 B14R1.417 CC(=O)CN(C)C(=O)c1ccccc1 1458a_100000194983_200000210301 [0,1,0,0,0,0|2,0,1]=4 1014 B14R1.417 CC(C)CC(=O)C(C)c1ccccc1 1458a_100000210554_100000230085 [0,1,0,0,0,0|2,0,1]=4 1015 B14R1.417 CC(C)CC(=O)C(F)c1ccccc1 1458a_100000698975_100000210624 [0,1,0,0,0,0|2,0,1]=4 1016 B14R1.417 CC(C)CC(=O)N(C)c1ccccc1 11a_100000210012_100000210554 [0,1,0,0,0,0|3,0,0]=4 1017 B14R1.417 CC(C)CC(=O)N(C)c1ccccc1 1626a_100000210012_100000210554 [0,1,0,0,0,0|3,0,0]=4 1018 B14R1.417 CC(C)CC(=O)N(C)c1ccccc1 22a_100000210012_100000210554 [0,1,0,0,0,0|3,0,0]=4 1019 B14R1.417 CC(C)CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210624 [0,1,0,0,0,0|2,0,1]=4 1020 B14R1.417 CC(C)CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210624 [0,1,0,0,0,0|1,0,2]=4 1021 B14R1.417 CC(C)CC(C)C(=O)c1ccccc1 1458a_100000185807_100000731052 [0,1,0,0,0,0|1,0,0]=2 1022 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 2230a_100000210012_100000731052 [0,1,0,0,0,0|3,0,0]=4 1023 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 2230a_100000712670_200000210301 [0,1,0,0,0,0|3,0,0]=4 1024 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 269982a_100000210012_100000731052 [0,1,0,0,0,0|3,0,0]=4 1025 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 269982a_100000712670_200000210301 [0,1,0,0,0,0|3,0,0]=4 1026 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 34a_100000210012_100000731052 [0,1,0,0,0,0|3,0,0]=4 1027 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 34a_100000712670_200000210301 [0,1,0,0,0,0|3,0,0]=4 1028 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 38a_100000712670_200000210301 [0,1,0,0,0,0|3,0,0]=4 1029 B14R1.417 CC(C)CC(C)N(C)c1ccccc1 7a_100000712670_200000210301 [0,1,0,0,0,0|3,0,0]=4 1030 B14R1.417 CC(C)CC(C)N([13CH3])c1ccccc1 2230a_100000712670_200025704644 [0,1,0,0,0,0|3,0,0]=4 1031 B14R1.417 CC(C)CC(C)N([13CH3])c1ccccc1 269982a_100000712670_200025704644 [0,1,0,0,0,0|3,0,0]=4 1032 B14R1.417 CC(C)CC(C)N([13CH3])c1ccccc1 34a_100000712670_200025704644 [0,1,0,0,0,0|3,0,0]=4 1033 B14R1.417 CC(C)CC(C)N([13CH3])c1ccccc1 38a_100000712670_200025704644 [0,1,0,0,0,0|3,0,0]=4 1034 B14R1.417 CC(C)CC(C)N([13CH3])c1ccccc1 7a_100000712670_200025704644 [0,1,0,0,0,0|3,0,0]=4 1035 B14R1.417 CC(C)CN(C)C(=O)c1ccccc1 11a_100000747067_100000185807 [0,1,0,0,0,0|1,0,0]=2 1036 B14R1.417 CC(C)CN(C)C(=O)c1ccccc1 1626a_100000747067_100000185807 [0,1,0,0,0,0|1,0,0]=2 1037 B14R1.417 CC(C)CN(C)C(=O)c1ccccc1 240690a_100000747067_100000185807 [0,1,0,0,0,0|1,0,0]=2 1038 B14R1.417 CC(C)CN(C)C(=O)c1ccccc1 527a_100000747067_100000185807 [0,1,0,0,0,0|1,0,0]=2 1039 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 2230a_100000195388_100000210760 [0,1,0,0,0,0|2,0,1]=4 1040 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 2230a_100000747067_100000230085 [0,1,0,0,0,0|2,0,1]=4 1041 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 2230a_103437231818_200000210301 [0,1,0,0,0,0|2,0,1]=4 1042 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 269982a_100000195388_100000210624 [0,1,0,0,0,0|2,0,1]=4 1043 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 269982a_100000747067_100000230085 [0,1,0,0,0,0|2,0,1]=4 1044 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 269982a_103437231818_200000210301 [0,1,0,0,0,0|2,0,1]=4 1045 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 270004a_100000195388_100000210432 [0,1,0,0,0,0|2,0,1]=4 1046 B14R1.417 CC(C)CN([13CH3])C(C)c1ccccc1 2230a_103437231818_200025704644 [0,1,0,0,0,0|2,0,1]=4 1047 B14R1.417 CC(C)CN([13CH3])C(C)c1ccccc1 269982a_103437231818_200025704644 [0,1,0,0,0,0|2,0,1]=4 1048 B14R1.417 CC(C)NC(C)C(=O)c1ccccc1 2230a_100138425928_100000239700 [0,1,0,0,0,0|2,0,0]=3 1049 B14R1.417 CC(C)SC(C)C(=O)c1ccccc1 62a_100000210206_100000239700 [0,1,0,0,0,0|2,0,0]=3 1050 B14R1.417 CC(C)SC(C)C(=O)c1ccccc1 62a_100000239700_100000210206 [0,1,0,0,0,0|2,0,0]=3 1051 B14R1.417 CC(O)CN(C)C(=O)c1ccccc1 240690a_100000227577_100000185807 [0,1,0,0,0,0|2,0,0]=3 1052 B14R1.417 CC(O)CN(C)C(=O)c1ccccc1 527a_100000227577_100000185807 [0,1,0,0,0,0|2,0,0]=3 1053 B14R1.417 CN(CC(=O)[13CH3])C(=O)c1ccccc1 1458a_100000194983_200025704644 [0,1,0,0,0,0|2,0,1]=4 1054 B14R1.540 C#CC(OCC(C)C)c1ccccc1 34a_100011219616_100000210624 [0,1,0,0,0,0|1,0,1]=3 1055 B14R1.540 C#CC(OCC(C)C)c1ccccc1 7a_100011219616_100000210760 [0,1,0,0,0,0|1,0,1]=3 1056 B14R1.540 C#CC(OCC(C)O)c1ccccc1 34a_100011219616_100011218427 [0,1,0,0,0,0|2,0,1]=4 1057 B14R1.540 C#CC(OCC(C)O)c1ccccc1 7a_100011219616_100011218427 [0,1,0,0,0,0|2,0,1]=4 1058 B14R1.540 C#CC(OC[C@@H](C)O)c1ccccc1 34a_100011219616_100009817552 [0,1,0,0,0,0|2,0,1]=4 1059 B14R1.540 C#CC(OC[C@@H](C)O)c1ccccc1 7a_100011219616_100009817552 [0,1,0,0,0,0|2,0,1]=4 1060 B14R1.540 C=CC(=NNC(C)C)c1ccccc1 4a_100000741168_200000750708 [0,1,0,0,0,0|3,0,0]=4 1061 B14R1.540 C=CC(NCC(C)C)c1ccccc1 2230a_100000210953_200000085779 [0,1,0,0,0,0|2,0,1]=4 1062 B14R1.540 C=CC(OCC(C)C)c1ccccc1 34a_100011215659_100000210624 [0,1,0,0,0,0|1,0,1]=3 1063 B14R1.540 C=CC(OCC(C)C)c1ccccc1 7a_100011215659_100000210760 [0,1,0,0,0,0|1,0,1]=3 1064 B14R1.540 C=CC(OCC(C)O)c1ccccc1 34a_100011215659_100011218427 [0,1,0,0,0,0|2,0,1]=4 1065 B14R1.540 C=CC(OCC(C)O)c1ccccc1 7a_100011215659_100011218427 [0,1,0,0,0,0|2,0,1]=4 1066 B14R1.540 C=CC(OC[C@@H](C)O)c1ccccc1 34a_100011215659_100009817552 [0,1,0,0,0,0|2,0,1]=4 1067 B14R1.540 C=CC(OC[C@@H](C)O)c1ccccc1 7a_100011215659_100009817552 [0,1,0,0,0,0|2,0,1]=4 1068 B14R1.540 C=CC(SCC(C)C)c1ccccc1 62a_100000210624_200000085779 [0,1,0,0,0,0|1,1,1]=4 1069 B14R1.540 C=CC(SCC(C)C)c1ccccc1 62a_200000085779_100000210760 [0,1,0,0,0,0|1,1,1]=4 1070 B14R1.540 CC(C)CN[C@H](CO)c1ccccc1 2230a_100000751927_100000210760 [0,1,0,0,0,0|1,0,2]=4 1071 B14R1.540 CC(C)CN[C@H](CO)c1ccccc1 270004a_100000751927_100000210432 [0,1,0,0,0,0|1,0,2]=4 1072 B14R1.540 CC(C)CN[C@H](CO)c1ccccc1 34a_100000751927_100000210624 [0,1,0,0,0,0|1,0,2]=4 1073 B14R1.540 CC(C)COC(C#N)c1ccccc1 7a_100011217353_100000210760 [0,1,0,0,0,0|1,0,1]=3 1074 B14R1.540 CC(C)COC(CBr)c1ccccc1 7a_100000185958_100000210760 [0,1,0,0,0,0|1,0,1]=3 1075 B14R1.540 CC(C)COC(CN)c1ccccc1 34a_100000210709_100000210624 [0,1,0,0,0,0|1,0,1]=3 1076 B14R1.540 CC(C)CO[C@H](CCl)c1ccccc1 34a_100011933945_100000210624 [0,1,0,0,0,0|1,0,1]=3 1077 B14R1.540 CC(C)CO[C@H](CCl)c1ccccc1 7a_100011933945_100000210760 [0,1,0,0,0,0|1,0,1]=3 1078 B14R1.540 CC(C)NN=C(CF)c1ccccc1 4a_100000741168_100000069468 [0,1,0,0,0,0|3,0,0]=4 1079 B14R1.540 CC(C)NN=C(CO)c1ccccc1 4a_100000741168_100000748912 [0,1,0,0,0,0|2,0,1]=4 1080 B14R1.540 CC(O)COC(C#N)c1ccccc1 7a_100011217353_100011218427 [0,1,0,0,0,0|2,0,1]=4 1081 B14R1.540 CC(O)COC(CBr)c1ccccc1 7a_100000185958_100011218427 [0,1,0,0,0,0|2,0,1]=4 1082 B14R1.540 CC(O)COC(CN)c1ccccc1 34a_100000210709_100011218427 [0,1,0,0,0,0|2,0,1]=4 1083 B14R1.540 CC(O)CO[C@H](CCl)c1ccccc1 34a_100011933945_100011218427 [0,1,0,0,0,0|2,0,1]=4 1084 B14R1.540 CC(O)CO[C@H](CCl)c1ccccc1 7a_100011933945_100011218427 [0,1,0,0,0,0|2,0,1]=4 1085 B14R1.540 CCC(=NNC(C)C)c1ccccc1 4a_100000741168_100000210124 [0,1,0,0,0,0|3,0,0]=4 1086 B14R1.540 CCC(NCC(C)C)c1ccccc1 2230a_100000737752_100000210760 [0,1,0,0,0,0|2,0,1]=4 1087 B14R1.540 CCC(NCC(C)C)c1ccccc1 269862a_100000210953_100000210124 [0,1,0,0,0,0|2,0,1]=4 1088 B14R1.540 CCC(NCC(C)C)c1ccccc1 270004a_100000737752_100000210432 [0,1,0,0,0,0|2,0,1]=4 1089 B14R1.540 CCC(OCC(C)C)c1ccccc1 34a_100000698172_100000210624 [0,1,0,0,0,0|1,0,1]=3 1090 B14R1.540 CCC(OCC(C)C)c1ccccc1 7a_100000698172_100000210760 [0,1,0,0,0,0|1,0,1]=3 1091 B14R1.540 CCC(OCC(C)O)c1ccccc1 34a_100000698172_100011218427 [0,1,0,0,0,0|2,0,1]=4 1092 B14R1.540 CCC(OCC(C)O)c1ccccc1 7a_100000698172_100011218427 [0,1,0,0,0,0|2,0,1]=4 1093 B14R1.540 CCC(OC[C@@H](C)O)c1ccccc1 34a_100000698172_100009817552 [0,1,0,0,0,0|2,0,1]=4 1094 B14R1.540 CCC(OC[C@@H](C)O)c1ccccc1 7a_100000698172_100009817552 [0,1,0,0,0,0|2,0,1]=4 1095 B14R1.540 CCN(CCC(C)C)c1ccccc1 2230a_100000210013_100000210312 [0,1,0,0,0,0|3,0,0]=4 1096 B14R1.540 CCN(CCC(C)C)c1ccccc1 269982a_100000210013_100000210312 [0,1,0,0,0,0|3,0,0]=4 1097 B14R1.540 CCN(CCC(C)C)c1ccccc1 34a_100000210013_100000210312 [0,1,0,0,0,0|3,0,0]=4 1098 B14R1.540 CNC(CCC(C)C)c1ccccc1 269862a_106832991636_200011267664 [0,1,0,0,0,0|2,0,1]=4 1099 B14R1.540 C[C@@H](O)COC(C#N)c1ccccc1 7a_100011217353_100009817552 [0,1,0,0,0,0|2,0,1]=4 1100 B14R1.540 C[C@@H](O)COC(CBr)c1ccccc1 7a_100000185958_100009817552 [0,1,0,0,0,0|2,0,1]=4 1101 B14R1.540 C[C@@H](O)COC(CN)c1ccccc1 34a_100000210709_100009817552 [0,1,0,0,0,0|2,0,1]=4 1102 B14R1.540 C[C@@H](O)CO[C@H](CCl)c1ccccc1 34a_100011933945_100009817552 [0,1,0,0,0,0|2,0,1]=4 1103 B14R1.540 C[C@@H](O)CO[C@H](CCl)c1ccccc1 7a_100011933945_100009817552 [0,1,0,0,0,0|2,0,1]=4 1104 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000730704 [0,1,0,0,0,0|1,0,2]=4 1105 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000730704 [0,1,0,0,0,0|1,0,2]=4 1106 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000730704 [0,1,0,0,0,0|1,0,2]=4 1107 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000730704 [0,1,0,0,0,0|1,0,2]=4 1108 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000730704 [0,1,0,0,0,0|1,0,2]=4 1109 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000730704 [0,1,0,0,0,0|1,0,2]=4 1110 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 11a_100000765925_100000185839 [0,1,0,0,0,0|1,0,2]=4 1111 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 1626a_100000765925_100000185839 [0,1,0,0,0,0|1,0,2]=4 1112 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 240690a_100000765925_100000185839 [0,1,0,0,0,0|1,0,2]=4 1113 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 527a_100000765925_100000185839 [0,1,0,0,0,0|1,0,2]=4 1114 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 11a_100000765925_100000188618 [0,1,0,0,0,0|1,0,2]=4 1115 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 1626a_100000765925_100000188618 [0,1,0,0,0,0|1,0,2]=4 1116 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 240690a_100000765925_100000188618 [0,1,0,0,0,0|1,0,2]=4 1117 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 527a_100000765925_100000188618 [0,1,0,0,0,0|1,0,2]=4 1118 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 11a_100000765925_100000210187 [0,1,0,0,0,0|1,0,2]=4 1119 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 1626a_100000765925_100000210187 [0,1,0,0,0,0|1,0,2]=4 1120 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 240690a_100000765925_100000210187 [0,1,0,0,0,0|1,0,2]=4 1121 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 527a_100000765925_100000210187 [0,1,0,0,0,0|1,0,2]=4 1122 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 11a_100000765925_100000187176 [0,1,0,0,0,0|1,0,2]=4 1123 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 1626a_100000765925_100000187176 [0,1,0,0,0,0|1,0,2]=4 1124 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 240690a_100000765925_100000187176 [0,1,0,0,0,0|1,0,2]=4 1125 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 527a_100000765925_100000187176 [0,1,0,0,0,0|1,0,2]=4 1126 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 11a_100000765925_100000187904 [0,1,0,0,0,0|1,0,2]=4 1127 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 1626a_100000765925_100000187904 [0,1,0,0,0,0|1,0,2]=4 1128 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 240690a_100000765925_100000187904 [0,1,0,0,0,0|1,0,2]=4 1129 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 527a_100000765925_100000187904 [0,1,0,0,0,0|1,0,2]=4 1130 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)O 240690a_100000765925_100000212099 [0,1,0,0,0,0|1,0,2]=4 1131 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)O 527a_100000765925_100000212099 [0,1,0,0,0,0|1,0,2]=4 1132 B14R1.678 CC(=CCC(=O)c1ccc(cc1)Br)C 1458a_100000185839_100000761012 [0,1,0,0,0,0|1,0,2]=4 1133 B14R1.678 CC(=CCC(=O)c1ccc(cc1)C)C 1458a_100000188618_100000761012 [0,1,0,0,0,0|1,0,2]=4 1134 B14R1.678 CC(=CCC(=O)c1ccc(cc1)Cl)C 1458a_100000210187_100000761012 [0,1,0,0,0,0|1,0,2]=4 1135 B14R1.678 CC(=CCC(=O)c1ccc(cc1)F)C 1458a_100000187176_100000761012 [0,1,0,0,0,0|1,0,2]=4 1136 B14R1.678 CC(=CCC(=O)c1ccc(cc1)I)C 1458a_100000187904_100000761012 [0,1,0,0,0,0|1,0,2]=4 1137 B14R1.678 CC(=CCC(=O)c1ccc(cc1)O)C 1458a_100000212099_100000761012 [0,1,0,0,0,0|1,0,2]=4 1138 B14R1.678 CC(=NNC(C)C)c1ccc(cc1)Br 4a_100000741168_100000185794 [0,1,0,0,0,0|3,0,0]=4 1139 B14R1.678 CC(=NNC(C)C)c1ccc(cc1)C 4a_100000741168_100000185793 [0,1,0,0,0,0|3,0,0]=4 1140 B14R1.678 CC(=NNC(C)C)c1ccc(cc1)Cl 4a_100000741168_100000185797 [0,1,0,0,0,0|3,0,0]=4 1141 B14R1.678 CC(=NNC(C)C)c1ccc(cc1)F 4a_100000741168_100000185800 [0,1,0,0,0,0|3,0,0]=4 1142 B14R1.678 CC(=NNC(C)C)c1ccc(cc1)I 4a_100000741168_100000185465 [0,1,0,0,0,0|3,0,0]=4 1143 B14R1.678 CC(=NNC(C)C)c1ccc(cc1)O 4a_100000741168_100000185113 [0,1,0,0,0,0|3,0,0]=4 1144 B14R1.678 CC(=O)CCC(=O)c1ccc(cc1)C 1458a_100000070787_100000701375 [0,1,0,0,0,0|2,0,1]=4 1145 B14R1.678 CC(=O)CCC(=O)c1ccc(cc1)F 1458a_100000070787_100000211231 [0,1,0,0,0,0|2,0,1]=4 1146 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)C 1458a_100000183637_200000210301 [0,1,0,0,0,0|2,0,1]=4 1147 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_200000210301 [0,1,0,0,0,0|2,0,1]=4 1148 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_200000210301 [0,1,0,0,0,0|2,0,1]=4 1149 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_200000210301 [0,1,0,0,0,0|2,0,1]=4 1150 B14R1.678 CC(=O)COC(=O)c1ccc(cc1)O 271570a_203496583355_200027936475 [0,1,0,0,0,0|1,0,1]=3 1151 B14R1.678 CC(Br)COC(C)c1ccc(cc1)Br 34a_100012180447_100000755118 [0,1,0,0,0,0|2,0,1]=4 1152 B14R1.678 CC(Br)COC(C)c1ccc(cc1)F 34a_100012180447_100000743420 [0,1,0,0,0,0|2,0,1]=4 1153 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210312 [0,1,0,0,0,0|1,0,0]=2 1154 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210312 [0,1,0,0,0,0|1,0,0]=2 1155 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210312 [0,1,0,0,0,0|1,0,0]=2 1156 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210312 [0,1,0,0,0,0|1,0,0]=2 1157 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210312 [0,1,0,0,0,0|1,0,0]=2 1158 B14R1.678 CC(C)CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210312 [0,1,0,0,0,0|3,0,0]=4 1159 B14R1.678 CC(C)CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000210312 [0,1,0,0,0,0|3,0,0]=4 1160 B14R1.678 CC(C)CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210312 [0,1,0,0,0,0|3,0,0]=4 1161 B14R1.678 CC(C)CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210312 [0,1,0,0,0,0|3,0,0]=4 1162 B14R1.678 CC(C)CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210312 [0,1,0,0,0,0|3,0,0]=4 1163 B14R1.678 CC(C)CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210312 [0,1,0,0,0,0|3,0,0]=4 1164 B14R1.678 CC(C)CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210312 [0,1,0,0,0,0|3,0,0]=4 1165 B14R1.678 CC(C)CCN(C)c1ccc(cc1)F 269982a_100000219829_100000210312 [0,1,0,0,0,0|3,0,0]=4 1166 B14R1.678 CC(C)CCN(C)c1ccc(cc1)F 34a_100000219829_100000210312 [0,1,0,0,0,0|3,0,0]=4 1167 B14R1.678 CC(C)CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210312 [0,1,0,0,0,0|3,0,0]=4 1168 B14R1.678 CC(C)CCN(C)c1ccc(cc1)I 269982a_100000743151_100000210312 [0,1,0,0,0,0|3,0,0]=4 1169 B14R1.678 CC(C)CCN(C)c1ccc(cc1)I 34a_100000743151_100000210312 [0,1,0,0,0,0|3,0,0]=4 1170 B14R1.678 CC(C)CCN(C)c1ccc(cc1)O 269982a_100000182112_100000210312 [0,1,0,0,0,0|3,0,0]=4 1171 B14R1.678 CC(C)CCN(C)c1ccc(cc1)O 34a_100000182112_100000210312 [0,1,0,0,0,0|3,0,0]=4 1172 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 11a_100000210953_100000185839 [0,1,0,0,0,0|1,0,0]=2 1173 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 1626a_100000210953_100000185839 [0,1,0,0,0,0|1,0,0]=2 1174 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 240690a_100000210953_100000185839 [0,1,0,0,0,0|1,0,0]=2 1175 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 527a_100000210953_100000185839 [0,1,0,0,0,0|1,0,0]=2 1176 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 11a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1177 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 1626a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1178 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 240690a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1179 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 527a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1180 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 11a_100000210953_100000187176 [0,1,0,0,0,0|1,0,0]=2 1181 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 1626a_100000210953_100000187176 [0,1,0,0,0,0|1,0,0]=2 1182 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 240690a_100000210953_100000187176 [0,1,0,0,0,0|1,0,0]=2 1183 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 527a_100000210953_100000187176 [0,1,0,0,0,0|1,0,0]=2 1184 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 11a_100000210953_100000187904 [0,1,0,0,0,0|1,0,0]=2 1185 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 1626a_100000210953_100000187904 [0,1,0,0,0,0|1,0,0]=2 1186 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 240690a_100000210953_100000187904 [0,1,0,0,0,0|1,0,0]=2 1187 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 527a_100000210953_100000187904 [0,1,0,0,0,0|1,0,0]=2 1188 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)O 240690a_100000210953_100000212099 [0,1,0,0,0,0|1,0,0]=2 1189 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)O 271570a_203496583355_200000155730 [0,1,0,0,0,0|1,0,0]=2 1190 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)O 527a_100000210953_100000212099 [0,1,0,0,0,0|1,0,0]=2 1191 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Br 2230a_100000210953_100000755118 [0,1,0,0,0,0|2,0,1]=4 1192 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Br 269862a_100000210953_100000185794 [0,1,0,0,0,0|2,0,1]=4 1193 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Br 34a_100000210953_100000755118 [0,1,0,0,0,0|2,0,1]=4 1194 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Cl 2230a_100000210953_100000684792 [0,1,0,0,0,0|2,0,1]=4 1195 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Cl 269862a_100000210953_100000185797 [0,1,0,0,0,0|2,0,1]=4 1196 B14R1.678 CC(C)CNC(C)c1ccc(cc1)F 2230a_100000210953_100000743420 [0,1,0,0,0,0|2,0,1]=4 1197 B14R1.678 CC(C)CNC(C)c1ccc(cc1)F 269862a_100000210953_100000185800 [0,1,0,0,0,0|2,0,1]=4 1198 B14R1.678 CC(C)CNC(C)c1ccc(cc1)F 34a_100000210953_100000743420 [0,1,0,0,0,0|2,0,1]=4 1199 B14R1.678 CC(C)CNC(C)c1ccc(cc1)I 269862a_100000210953_100000185465 [0,1,0,0,0,0|2,0,1]=4 1200 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210760 [0,1,0,0,0,0|2,0,1]=4 1201 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)F 270004a_100025705893_100000210432 [0,1,0,0,0,0|2,0,1]=4 1202 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210624 [0,1,0,0,0,0|2,0,1]=4 1203 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210760 [0,1,0,0,0,0|2,0,1]=4 1204 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)I 270004a_100000753911_100000210432 [0,1,0,0,0,0|2,0,1]=4 1205 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210760 [0,1,0,0,0,0|2,0,1]=4 1206 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)O 270004a_100161106496_100000210432 [0,1,0,0,0,0|2,0,1]=4 1207 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210760 [0,1,0,0,0,0|2,0,1]=4 1208 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Br 270004a_100000720352_100000210432 [0,1,0,0,0,0|2,0,1]=4 1209 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210760 [0,1,0,0,0,0|2,0,1]=4 1210 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Cl 270004a_100015205461_100000210432 [0,1,0,0,0,0|2,0,1]=4 1211 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210624 [0,1,0,0,0,0|2,0,1]=4 1212 B14R1.678 CC(C)COC(C)c1ccc(cc1)Br 34a_100000210257_100000755118 [0,1,0,0,0,0|1,0,1]=3 1213 B14R1.678 CC(C)COC(C)c1ccc(cc1)Br 34a_100000745893_100000210624 [0,1,0,0,0,0|1,0,1]=3 1214 B14R1.678 CC(C)COC(C)c1ccc(cc1)Br 7a_100000745893_100000210760 [0,1,0,0,0,0|1,0,1]=3 1215 B14R1.678 CC(C)COC(C)c1ccc(cc1)F 34a_100000181323_100000210624 [0,1,0,0,0,0|1,0,1]=3 1216 B14R1.678 CC(C)COC(C)c1ccc(cc1)F 34a_100000210257_100000743420 [0,1,0,0,0,0|1,0,1]=3 1217 B14R1.678 CC(C)COC(C)c1ccc(cc1)F 7a_100000181323_100000210760 [0,1,0,0,0,0|1,0,1]=3 1218 B14R1.678 CC(C)COC(C)c1ccc(cc1)N 34a_100011216399_100000210624 [0,1,0,0,0,0|1,0,1]=3 1219 B14R1.678 CC(C)COC(C)c1ccc(cn1)Br 34a_100012353650_100000210624 [0,1,0,0,0,0|2,0,1]=4 1220 B14R1.678 CC(C)COC(C)c1ccc(cn1)Br 7a_100012353650_100000210760 [0,1,0,0,0,0|2,0,1]=4 1221 B14R1.678 CC(C)COC(C)c1ccc(nc1)Br 34a_200010274204_100000210624 [0,1,0,0,0,0|2,0,1]=4 1222 B14R1.678 CC(C)COC(C)c1ccc(nc1)Br 7a_200010274204_100000210760 [0,1,0,0,0,0|2,0,1]=4 1223 B14R1.678 CC(C)COC(C)c1ccc(nc1)Cl 34a_200012017543_100000210624 [0,1,0,0,0,0|2,0,1]=4 1224 B14R1.678 CC(C)COC(C)c1ccc(nc1)Cl 7a_200012017543_100000210760 [0,1,0,0,0,0|2,0,1]=4 1225 B14R1.678 CC(C)CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210624 [0,1,0,0,0,0|1,0,1]=3 1226 B14R1.678 CC(C)CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210760 [0,1,0,0,0,0|1,0,1]=3 1227 B14R1.678 CC(C)CSC(C)c1ccc(cc1)Br 62a_100000210624_100000755118 [0,1,0,0,0,0|1,1,1]=4 1228 B14R1.678 CC(C)CSC(C)c1ccc(cc1)Br 62a_100000755118_100000210760 [0,1,0,0,0,0|1,1,1]=4 1229 B14R1.678 CC(C)CSC(C)c1ccc(cc1)Cl 62a_100000210624_100000684792 [0,1,0,0,0,0|1,1,1]=4 1230 B14R1.678 CC(C)CSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210760 [0,1,0,0,0,0|1,1,1]=4 1231 B14R1.678 CC(C)CSC(C)c1ccc(cc1)F 62a_100000210624_100000743420 [0,1,0,0,0,0|1,1,1]=4 1232 B14R1.678 CC(C)CSC(C)c1ccc(cc1)F 62a_100000743420_100000210760 [0,1,0,0,0,0|1,1,1]=4 1233 B14R1.678 CC(C)NCC(=O)c1ccc(cc1)Br 34a_100138425928_100000188085 [0,1,0,0,0,0|2,0,0]=3 1234 B14R1.678 CC(C)NCC(=O)c1ccc(cc1)I 34a_100138425928_100011216261 [0,1,0,0,0,0|2,0,0]=3 1235 B14R1.678 CC(C)NCC(=O)c1ccc(cc1)O 34a_100138425928_100009814261 [0,1,0,0,0,0|2,0,0]=3 1236 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)Br 22a_100000741168_100000185839 [0,1,0,0,0,0|2,0,0]=3 1237 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)Cl 22a_100000741168_100000210187 [0,1,0,0,0,0|2,0,0]=3 1238 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)F 22a_100000741168_100000187176 [0,1,0,0,0,0|2,0,0]=3 1239 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)I 22a_100000741168_100000187904 [0,1,0,0,0,0|2,0,0]=3 1240 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)O 22a_100000741168_100000212099 [0,1,0,0,0,0|2,0,0]=3 1241 B14R1.678 CC(C)OCC(=O)c1ccc(cc1)Br 34a_100000212225_100000188085 [0,1,0,0,0,0|2,0,0]=3 1242 B14R1.678 CC(C)OCC(=O)c1ccc(cc1)F 34a_100000246311_100000210206 [0,1,0,0,0,0|2,0,0]=3 1243 B14R1.678 CC(C)OCC(=O)c1ccc(cc1)I 34a_100000212225_100011216261 [0,1,0,0,0,0|2,0,0]=3 1244 B14R1.678 CC(C)OCC(=O)c1ccc(cc1)O 34a_100000212225_100009814261 [0,1,0,0,0,0|2,0,0]=3 1245 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210206 [0,1,0,0,0,0|2,0,0]=3 1246 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000210206_100000211071 [0,1,0,0,0,0|2,0,0]=3 1247 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210206 [0,1,0,0,0,0|2,0,0]=3 1248 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)F 62a_100000210206_100000211279 [0,1,0,0,0,0|2,0,0]=3 1249 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)F 62a_100000211279_100000210206 [0,1,0,0,0,0|2,0,0]=3 1250 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)I 62a_100000210206_100011216261 [0,1,0,0,0,0|2,0,0]=3 1251 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)I 62a_100011216261_100000210206 [0,1,0,0,0,0|2,0,0]=3 1252 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)O 62a_100000210206_100009814261 [0,1,0,0,0,0|2,0,0]=3 1253 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)O 62a_100009814261_100000210206 [0,1,0,0,0,0|2,0,0]=3 1254 B14R1.678 CC(C)SCC(=O)c1ccc(cn1)Cl 62a_100000210206_100016989621 [0,1,0,0,0,0|3,0,0]=4 1255 B14R1.678 CC(C)SCC(=O)c1ccc(cn1)Cl 62a_100016989621_100000210206 [0,1,0,0,0,0|3,0,0]=4 1256 B14R1.678 CC(C)SCC(=O)c1ccc(nc1)Cl 62a_100000210206_100009864725 [0,1,0,0,0,0|3,0,0]=4 1257 B14R1.678 CC(C)SCC(=O)c1ccc(nc1)Cl 62a_100009864725_100000210206 [0,1,0,0,0,0|3,0,0]=4 1258 B14R1.678 CC(F)COC(C)c1ccc(cc1)Br 34a_100015925927_100000755118 [0,1,0,0,0,0|2,0,1]=4 1259 B14R1.678 CC(F)COC(C)c1ccc(cc1)F 34a_100015925927_100000743420 [0,1,0,0,0,0|2,0,1]=4 1260 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100012276601 [0,1,0,0,0,0|2,0,0]=3 1261 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100012276601 [0,1,0,0,0,0|2,0,0]=3 1262 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100012276601 [0,1,0,0,0,0|2,0,0]=3 1263 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100012276601 [0,1,0,0,0,0|2,0,0]=3 1264 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100012276601 [0,1,0,0,0,0|2,0,0]=3 1265 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Br 11a_100000210904_100000185839 [0,1,0,0,0,0|2,0,0]=3 1266 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Br 240690a_100000210904_100000185839 [0,1,0,0,0,0|2,0,0]=3 1267 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Br 527a_100000210904_100000185839 [0,1,0,0,0,0|2,0,0]=3 1268 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Cl 11a_100000210904_100000210187 [0,1,0,0,0,0|2,0,0]=3 1269 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Cl 240690a_100000210904_100000210187 [0,1,0,0,0,0|2,0,0]=3 1270 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Cl 527a_100000210904_100000210187 [0,1,0,0,0,0|2,0,0]=3 1271 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)F 11a_100000210904_100000187176 [0,1,0,0,0,0|2,0,0]=3 1272 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)F 240690a_100000210904_100000187176 [0,1,0,0,0,0|2,0,0]=3 1273 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)F 527a_100000210904_100000187176 [0,1,0,0,0,0|2,0,0]=3 1274 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)I 11a_100000210904_100000187904 [0,1,0,0,0,0|2,0,0]=3 1275 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)I 240690a_100000210904_100000187904 [0,1,0,0,0,0|2,0,0]=3 1276 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)I 527a_100000210904_100000187904 [0,1,0,0,0,0|2,0,0]=3 1277 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)O 240690a_100000210904_100000212099 [0,1,0,0,0,0|2,0,0]=3 1278 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)O 527a_100000210904_100000212099 [0,1,0,0,0,0|2,0,0]=3 1279 B14R1.678 CC(O)COC(C)c1ccc(cc1)Br 34a_100000745893_100011218427 [0,1,0,0,0,0|2,0,1]=4 1280 B14R1.678 CC(O)COC(C)c1ccc(cc1)Br 7a_100000745893_100011218427 [0,1,0,0,0,0|2,0,1]=4 1281 B14R1.678 CC(O)COC(C)c1ccc(cc1)F 34a_100000181323_100011218427 [0,1,0,0,0,0|2,0,1]=4 1282 B14R1.678 CC(O)COC(C)c1ccc(cc1)F 7a_100000181323_100011218427 [0,1,0,0,0,0|2,0,1]=4 1283 B14R1.678 CC(O)COC(C)c1ccc(cc1)N 34a_100011216399_100011218427 [0,1,0,0,0,0|2,0,1]=4 1284 B14R1.678 CC(O)CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100011218427 [0,1,0,0,0,0|2,0,1]=4 1285 B14R1.678 CC(O)CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100011218427 [0,1,0,0,0,0|2,0,1]=4 1286 B14R1.678 CC(OC[C@@H](C)Cl)c1ccc(cc1)Br 34a_100016084084_100000755118 [0,1,0,0,0,0|2,0,1]=4 1287 B14R1.678 CC(OC[C@@H](C)Cl)c1ccc(cc1)F 34a_100016084084_100000743420 [0,1,0,0,0,0|2,0,1]=4 1288 B14R1.678 CC(OC[C@@H](C)N)c1ccc(cc1)Br 34a_100000737577_100000755118 [0,1,0,0,0,0|2,0,1]=4 1289 B14R1.678 CC(OC[C@@H](C)N)c1ccc(cc1)F 34a_100000737577_100000743420 [0,1,0,0,0,0|2,0,1]=4 1290 B14R1.678 CC(OC[C@@H](C)O)c1ccc(cc1)Br 34a_100000745893_100009817552 [0,1,0,0,0,0|2,0,1]=4 1291 B14R1.678 CC(OC[C@@H](C)O)c1ccc(cc1)Br 7a_100000745893_100009817552 [0,1,0,0,0,0|2,0,1]=4 1292 B14R1.678 CC(OC[C@@H](C)O)c1ccc(cc1)F 34a_100000181323_100009817552 [0,1,0,0,0,0|2,0,1]=4 1293 B14R1.678 CC(OC[C@@H](C)O)c1ccc(cc1)F 7a_100000181323_100009817552 [0,1,0,0,0,0|2,0,1]=4 1294 B14R1.678 CC(OC[C@@H](C)O)c1ccc(cc1)N 34a_100011216399_100009817552 [0,1,0,0,0,0|2,0,1]=4 1295 B14R1.678 CN(C)/C=C/C(=O)c1ccc(cc1)O 271570a_203496583355_100016267632 [0,1,0,0,0,0|2,0,1]=4 1296 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)Br 269982a_100102631434_100011215963 [0,1,0,0,0,0|2,0,0]=3 1297 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)Cl 269982a_100102631434_100011216492 [0,1,0,0,0,0|2,0,0]=3 1298 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)F 2230a_100102631434_100000211231 [0,1,0,0,0,0|2,0,0]=3 1299 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)F 269982a_100102631434_100000211231 [0,1,0,0,0,0|2,0,0]=3 1300 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)O 2230a_100102631434_100009879949 [0,1,0,0,0,0|2,0,0]=3 1301 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)O 269982a_100102631434_100009879949 [0,1,0,0,0,0|2,0,0]=3 1302 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)O 271570a_203496583355_200102510076 [0,1,0,0,0,0|2,0,0]=3 1303 B14R1.678 C[C@H](OC[C@@H](C)O)c1ccc(cc1)Cl 34a_100011852131_100009817552 [0,1,0,0,0,0|2,0,1]=4 1304 B14R1.678 C[C@H](OC[C@@H](C)O)c1ccc(cc1)Cl 7a_100011852131_100009817552 [0,1,0,0,0,0|2,0,1]=4 1305 B14R1.678 Cc1ccc(cc1)C(=O)CCC(C)C 1458a_100000188618_100000210312 [0,1,0,0,0,0|1,0,0]=2 1306 B14R1.678 Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100000188618_100012276601 [0,1,0,0,0,0|2,0,0]=3 1307 B14R1.678 Cc1ccc(cc1)C(=O)CCN(C)C 2230a_100102631434_100000701375 [0,1,0,0,0,0|2,0,0]=3 1308 B14R1.678 Cc1ccc(cc1)C(=O)CCN(C)C 269982a_100102631434_100000701375 [0,1,0,0,0,0|2,0,0]=3 1309 B14R1.678 Cc1ccc(cc1)C(=O)CNC(C)C 2230a_100138425928_100000211441 [0,1,0,0,0,0|2,0,0]=3 1310 B14R1.678 Cc1ccc(cc1)C(=O)CNC(C)C 34a_100138425928_100000211441 [0,1,0,0,0,0|2,0,0]=3 1311 B14R1.678 Cc1ccc(cc1)C(=O)COC(C)C 34a_100000212225_100000211441 [0,1,0,0,0,0|2,0,0]=3 1312 B14R1.678 Cc1ccc(cc1)C(=O)CSC(C)C 62a_100000210206_100000211441 [0,1,0,0,0,0|2,0,0]=3 1313 B14R1.678 Cc1ccc(cc1)C(=O)CSC(C)C 62a_100000211441_100000210206 [0,1,0,0,0,0|2,0,0]=3 1314 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)[13CH3] 1458a_100000183637_200025704644 [0,1,0,0,0,0|2,0,1]=4 1315 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000188618 [0,1,0,0,0,0|1,0,0]=2 1316 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000188618 [0,1,0,0,0,0|1,0,0]=2 1317 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000188618 [0,1,0,0,0,0|1,0,0]=2 1318 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000188618 [0,1,0,0,0,0|1,0,0]=2 1319 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000188618 [0,1,0,0,0,0|2,0,0]=3 1320 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000188618 [0,1,0,0,0,0|2,0,0]=3 1321 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000188618 [0,1,0,0,0,0|2,0,0]=3 1322 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000188618 [0,1,0,0,0,0|3,0,0]=4 1323 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000188618 [0,1,0,0,0,0|3,0,0]=4 1324 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000188618 [0,1,0,0,0,0|3,0,0]=4 1325 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000188618 [0,1,0,0,0,0|3,0,0]=4 1326 B14R1.678 Cc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100000188618 [0,1,0,0,0,0|2,0,0]=3 1327 B14R1.678 Cc1ccc(cc1)C(C)NCC(C)C 2230a_100000210953_100011261388 [0,1,0,0,0,0|2,0,1]=4 1328 B14R1.678 Cc1ccc(cc1)C(C)NCC(C)C 269862a_100000210953_100000185793 [0,1,0,0,0,0|2,0,1]=4 1329 B14R1.678 Cc1ccc(cc1)C(C)NCC(C)C 34a_100000210953_100011261388 [0,1,0,0,0,0|2,0,1]=4 1330 B14R1.678 Cc1ccc(cc1)C(C)OCC(C)Br 34a_100012180447_100011261388 [0,1,0,0,0,0|2,0,1]=4 1331 B14R1.678 Cc1ccc(cc1)C(C)OCC(C)C 34a_100000210257_100011261388 [0,1,0,0,0,0|1,0,1]=3 1332 B14R1.678 Cc1ccc(cc1)C(C)OCC(C)F 34a_100015925927_100011261388 [0,1,0,0,0,0|2,0,1]=4 1333 B14R1.678 Cc1ccc(cc1)C(C)OC[C@@H](C)Cl 34a_100016084084_100011261388 [0,1,0,0,0,0|2,0,1]=4 1334 B14R1.678 Cc1ccc(cc1)C(C)OC[C@@H](C)N 34a_100000737577_100011261388 [0,1,0,0,0,0|2,0,1]=4 1335 B14R1.678 Cc1ccc(cc1)C(C)SCC(C)C 62a_100000210624_100011261388 [0,1,0,0,0,0|1,1,1]=4 1336 B14R1.678 Cc1ccc(cc1)C(C)SCC(C)C 62a_100011261388_100000210760 [0,1,0,0,0,0|1,1,1]=4 1337 B14R1.678 Cc1ccc(cc1)N(C)CCC(C)C 2230a_100000219977_100000210312 [0,1,0,0,0,0|3,0,0]=4 1338 B14R1.678 Cc1ccc(cc1)N(C)CCC(C)C 269982a_100000219977_100000210312 [0,1,0,0,0,0|3,0,0]=4 1339 B14R1.678 Cc1ccc(cc1)N(C)CCC(C)C 34a_100000219977_100000210312 [0,1,0,0,0,0|3,0,0]=4 1340 B14R1.678 Cc1ccc(cc1)[C@@H](C)NCC(C)C 2230a_100016988085_100000210760 [0,1,0,0,0,0|2,0,1]=4 1341 B14R1.678 Cc1ccc(cc1)[C@@H](C)NCC(C)C 270004a_100016988085_100000210432 [0,1,0,0,0,0|2,0,1]=4 1342 B14R1.678 Cc1ccc(cc1)[C@@H](C)NCC(C)C 34a_100016988085_100000210624 [0,1,0,0,0,0|2,0,1]=4 1343 B14R1.678 Cc1ccc(cc1)[C@@H](C)OCC(C)C 34a_100000690690_100000210624 [0,1,0,0,0,0|1,0,1]=3 1344 B14R1.678 Cc1ccc(cc1)[C@@H](C)OCC(C)C 7a_100000690690_100000210760 [0,1,0,0,0,0|1,0,1]=3 1345 B14R1.678 Cc1ccc(cc1)[C@@H](C)OCC(C)O 34a_100000690690_100011218427 [0,1,0,0,0,0|2,0,1]=4 1346 B14R1.678 Cc1ccc(cc1)[C@@H](C)OCC(C)O 7a_100000690690_100011218427 [0,1,0,0,0,0|2,0,1]=4 1347 B14R1.678 Cc1ccc(cc1)[C@@H](C)OC[C@@H](C)O 34a_100000690690_100009817552 [0,1,0,0,0,0|2,0,1]=4 1348 B14R1.678 Cc1ccc(cc1)[C@@H](C)OC[C@@H](C)O 7a_100000690690_100009817552 [0,1,0,0,0,0|2,0,1]=4 1349 B14R1.678 Cc1ccc(cn1)C(=O)CSC(C)C 62a_100000210206_100012027583 [0,1,0,0,0,0|3,0,0]=4 1350 B14R1.678 Cc1ccc(cn1)C(=O)CSC(C)C 62a_100012027583_100000210206 [0,1,0,0,0,0|3,0,0]=4 1351 B14R1.678 Cc1ccc(cn1)C(C)OCC(C)C 34a_200011815720_100000210624 [0,1,0,0,0,0|2,0,1]=4 1352 B14R1.678 Cc1ccc(cn1)C(C)OCC(C)C 7a_200011815720_100000210760 [0,1,0,0,0,0|2,0,1]=4 1353 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 11a_100000765723_100000185839 [0,1,0,0,0,0|3,0,0]=4 1354 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 1626a_100000765723_100000185839 [0,1,0,0,0,0|3,0,0]=4 1355 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 240690a_100000765723_100000185839 [0,1,0,0,0,0|3,0,0]=4 1356 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 527a_100000765723_100000185839 [0,1,0,0,0,0|3,0,0]=4 1357 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 11a_100000765723_100000210187 [0,1,0,0,0,0|3,0,0]=4 1358 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 1626a_100000765723_100000210187 [0,1,0,0,0,0|3,0,0]=4 1359 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 240690a_100000765723_100000210187 [0,1,0,0,0,0|3,0,0]=4 1360 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 527a_100000765723_100000210187 [0,1,0,0,0,0|3,0,0]=4 1361 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 11a_100000765723_100000187176 [0,1,0,0,0,0|3,0,0]=4 1362 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 1626a_100000765723_100000187176 [0,1,0,0,0,0|3,0,0]=4 1363 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 240690a_100000765723_100000187176 [0,1,0,0,0,0|3,0,0]=4 1364 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 527a_100000765723_100000187176 [0,1,0,0,0,0|3,0,0]=4 1365 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 11a_100000765723_100000187904 [0,1,0,0,0,0|3,0,0]=4 1366 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 1626a_100000765723_100000187904 [0,1,0,0,0,0|3,0,0]=4 1367 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 240690a_100000765723_100000187904 [0,1,0,0,0,0|3,0,0]=4 1368 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 527a_100000765723_100000187904 [0,1,0,0,0,0|3,0,0]=4 1369 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)O 240690a_100000765723_100000212099 [0,1,0,0,0,0|3,0,0]=4 1370 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)O 527a_100000765723_100000212099 [0,1,0,0,0,0|3,0,0]=4 1371 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_200025704644 [0,1,0,0,0,0|2,0,1]=4 1372 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_200025704644 [0,1,0,0,0,0|2,0,1]=4 1373 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_200025704644 [0,1,0,0,0,0|2,0,1]=4 1374 B14R1.678 [2H]C(OCC(C)C)c1ccc(cc1)F 34a_217856618577_100000210624 [0,1,0,0,0,0|1,0,1]=3 1375 B14R1.678 [2H]C(OCC(C)C)c1ccc(cc1)F 7a_217856618577_100000210760 [0,1,0,0,0,0|1,0,1]=3 1376 B14R1.678 [2H]C(OCC(C)O)c1ccc(cc1)F 34a_217856618577_100011218427 [0,1,0,0,0,0|2,0,1]=4 1377 B14R1.678 [2H]C(OCC(C)O)c1ccc(cc1)F 7a_217856618577_100011218427 [0,1,0,0,0,0|2,0,1]=4 1378 B14R1.678 [2H]C(OC[C@@H](C)O)c1ccc(cc1)F 34a_217856618577_100009817552 [0,1,0,0,0,0|2,0,1]=4 1379 B14R1.678 [2H]C(OC[C@@H](C)O)c1ccc(cc1)F 7a_217856618577_100009817552 [0,1,0,0,0,0|2,0,1]=4 1380 B14R1.813 CC(C)CNC(C)(C)c1ccccc1 2230a_100000210953_100000034625 [0,1,0,0,0,0|2,0,1]=4 1381 B14R1.813 CC(C)CNC(C)(C)c1ccccc1 2230a_100011218174_100000210760 [0,1,0,0,0,0|2,0,1]=4 1382 B14R1.813 CC(C)CNC(C)(C)c1ccccc1 270004a_100011218174_100000210432 [0,1,0,0,0,0|2,0,1]=4 1383 B14R1.813 CC(C)CNS(=O)(=O)c1ccccc1 270084a_100000210953_100000210345 [0,1,0,0,0,0|2,0,0]=3 1384 B14R1.813 CC(C)CNS(=O)(=O)c1ccccc1 274078a_100000210953_100000210345 [0,1,0,0,0,0|2,0,0]=3 1385 B14R1.813 CC(C)CNS(=O)(=O)c1ccccc1 40a_100000210953_100000032697 [0,1,0,0,0,0|2,0,0]=3 1386 B14R1.813 CC(C)CNS(=O)(=O)c1ccccn1 270084a_100000210953_100016994956 [0,1,0,0,0,0|3,0,0]=4 1387 B14R1.813 CC(C)CNS(=O)(=O)c1ccccn1 274078a_100000210953_100016994956 [0,1,0,0,0,0|3,0,0]=4 1388 B14R1.813 CC(C)CNS(=O)(=O)c1ccccn1 40a_100000210953_100000070048 [0,1,0,0,0,0|3,0,0]=4 1389 B14R1.813 CC(C)CNS(=O)(=O)c1cccnc1 270084a_100000210953_100000736704 [0,1,0,0,0,0|3,0,0]=4 1390 B14R1.813 CC(C)CNS(=O)(=O)c1cccnc1 274078a_100000210953_100000736704 [0,1,0,0,0,0|3,0,0]=4 1391 B14R1.813 CC(C)COC(C)(C)c1ccccc1 7a_100000694644_100000210760 [0,1,0,0,0,0|1,0,1]=3 1392 B14R1.813 CC(C)COC(C)(C)c1ccccn1 7a_100000041474_100000210760 [0,1,0,0,0,0|2,0,1]=4 1393 B14R1.813 CC(C)CSC(C)(C)c1ccccc1 62a_100000034625_100000210760 [0,1,0,0,0,0|1,1,1]=4 1394 B14R1.813 CC(C)CSC(C)(C)c1ccccc1 62a_100000210624_100000034625 [0,1,0,0,0,0|1,1,1]=4 1395 B14R1.813 CC(C)CSC(F)(F)c1ccccc1 62a_100000210624_100000036403 [0,1,0,0,0,0|1,1,1]=4 1396 B14R1.813 CC(C)NCS(=O)(=O)c1ccccc1 34a_100138425928_200009813291 [0,1,0,0,0,0|3,0,0]=4 1397 B14R1.813 CC(C)NNS(=O)(=O)c1ccccc1 40a_100000741168_100000032697 [0,1,0,0,0,0|3,0,0]=4 1398 B14R1.813 CC(C)OCS(=O)(=O)c1ccccc1 34a_100000212225_200009813291 [0,1,0,0,0,0|3,0,0]=4 1399 B14R1.813 CC(C)SCS(=O)(=O)c1ccccc1 62a_100000210206_100000240042 [0,1,0,0,0,0|3,0,0]=4 1400 B14R1.813 CC(C)SCS(=O)(=O)c1ccccc1 62a_100000240042_100000210206 [0,1,0,0,0,0|3,0,0]=4 1401 B14R1.813 CC(O)CNS(=O)(=O)c1ccccc1 270084a_100000210904_100000210345 [0,1,0,0,0,0|3,0,0]=4 1402 B14R1.813 CC(O)CNS(=O)(=O)c1ccccc1 274078a_100000210904_100000210345 [0,1,0,0,0,0|3,0,0]=4 1403 B14R1.813 CC(O)CNS(=O)(=O)c1ccccc1 40a_100000210904_100000032697 [0,1,0,0,0,0|3,0,0]=4 1404 B14R1.813 CC(O)COC(C)(C)c1ccccc1 7a_100000694644_100011218427 [0,1,0,0,0,0|2,0,1]=4 1405 B14R1.813 CN(C)CCS(=O)(=O)c1ccccc1 2230a_100102631434_100000229977 [0,1,0,0,0,0|3,0,0]=4 1406 B14R1.813 CN(C)CCS(=O)(=O)c1ccccc1 2230a_103496528835_200000210301 [0,1,0,0,0,0|3,0,0]=4 1407 B14R1.813 CN(C)CCS(=O)(=O)c1ccccc1 269982a_100102631434_100000229977 [0,1,0,0,0,0|3,0,0]=4 1408 B14R1.813 CN(C)CCS(=O)(=O)c1ccccc1 269982a_103496528835_200000210301 [0,1,0,0,0,0|3,0,0]=4 1409 B14R1.813 CN(C)CCS(=O)(=O)c1ccccc1 34a_103496528835_200000210301 [0,1,0,0,0,0|3,0,0]=4 1410 B14R1.813 CN([13CH3])CCS(=O)(=O)c1ccccc1 2230a_103496528835_200025704644 [0,1,0,0,0,0|3,0,0]=4 1411 B14R1.813 CN([13CH3])CCS(=O)(=O)c1ccccc1 269982a_103496528835_200025704644 [0,1,0,0,0,0|3,0,0]=4 1412 B14R1.813 CN([13CH3])CCS(=O)(=O)c1ccccc1 34a_103496528835_200025704644 [0,1,0,0,0,0|3,0,0]=4 1413 B14R1.813 C[C@@H](O)COC(C)(C)c1ccccc1 7a_100000694644_100009817552 [0,1,0,0,0,0|2,0,1]=4 1414 B14R1.3098 CC(=NNC(C)(C)C)c1ccccc1 4a_100000725372_100000185851 [0,1,0,0,0,0|3,0,0]=4 1415 B14R1.3098 CC(C)(C)CCC(=O)c1ccccc1 1458a_100000185807_100000755188 [0,1,0,0,0,0|1,0,0]=2 1416 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 11a_100000743828_100000185807 [0,1,0,0,0,0|1,0,0]=2 1417 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 1626a_100000743828_100000185807 [0,1,0,0,0,0|1,0,0]=2 1418 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 240690a_100000743828_100000185807 [0,1,0,0,0,0|1,0,0]=2 1419 B14R1.3098 CC(C)(C)CNC(=O)c1ccccc1 527a_100000743828_100000185807 [0,1,0,0,0,0|1,0,0]=2 1420 B14R1.3098 CC(C)(C)NNC(=O)c1ccccc1 22a_100000725372_100000185807 [0,1,0,0,0,0|2,0,0]=3 1421 B14R1.3098 CC(C)(C)OCC(=O)c1ccccc1 7a_100015890283_100000211460 [0,1,0,0,0,0|2,0,0]=3 1422 B14R1.3098 CC(C)(C)OCC(=O)c1ccccn1 34a_100015890283_100000027445 [0,1,0,0,0,0|3,0,0]=4 1423 B14R1.3098 CC(C)(C)OCC(=O)c1ccccn1 7a_100015890283_100000027445 [0,1,0,0,0,0|3,0,0]=4 1424 B14R1.3098 CC(C)(C)OCC(=O)c1ccncc1 7a_100015890283_100015248511 [0,1,0,0,0,0|3,0,0]=4 1425 B14R1.3098 CC(C)(C)SCC(=O)c1ccccc1 62a_100000211460_100000211941 [0,1,0,0,0,0|2,0,0]=3 1426 B14R1.3098 CC(C)(C)SCC(=O)c1ccccc1 62a_100000211941_100000211460 [0,1,0,0,0,0|2,0,0]=3 1427 B14R1.3098 CC(C)(C)SCC(=O)c1ccccn1 62a_100000027445_100000211941 [0,1,0,0,0,0|3,0,0]=4 1428 B14R1.3098 CC(C)(C)SCC(=O)c1ccccn1 62a_100000211941_100000027445 [0,1,0,0,0,0|3,0,0]=4 1429 B14R1.3098 CC(C)(C)SCC(=O)c1cccnc1 62a_100000211941_100000757877 [0,1,0,0,0,0|3,0,0]=4 1430 B14R1.3098 CC(C)(C)SCC(=O)c1cccnc1 62a_100000757877_100000211941 [0,1,0,0,0,0|3,0,0]=4 1431 B14R1.3098 CC(C)(C)SCC(=O)c1ccncc1 62a_100000027454_100000211941 [0,1,0,0,0,0|3,0,0]=4 1432 B14R1.3098 CC(C)(C)SCC(=O)c1ccncc1 62a_100000211941_100000027454 [0,1,0,0,0,0|3,0,0]=4 1433 B14R1.3098 CC(C)(C)SCS(=O)c1ccccc1 62a_100000211941_100000031784 [0,1,0,0,0,0|3,0,0]=4 1434 B14R1.3098 CC(C)(F)CNC(=O)c1ccccc1 11a_100020643315_100000185807 [0,1,0,0,0,0|1,0,0]=2 1435 B14R1.3098 CC(C)(F)CNC(=O)c1ccccc1 1626a_100020643315_100000185807 [0,1,0,0,0,0|1,0,0]=2 1436 B14R1.3098 CC(C)(F)CNC(=O)c1ccccc1 240690a_100020643315_100000185807 [0,1,0,0,0,0|1,0,0]=2 1437 B14R1.3098 CC(C)(F)CNC(=O)c1ccccc1 527a_100020643315_100000185807 [0,1,0,0,0,0|1,0,0]=2 1438 B14R1.3098 CC(C)(O)CNC(=O)c1ccccc1 1626a_100000751335_100000185807 [0,1,0,0,0,0|1,0,0]=2 1439 B14R1.3098 CC(C)(O)CNC(=O)c1ccccc1 240690a_100000751335_100000185807 [0,1,0,0,0,0|1,0,0]=2 1440 B14R1.3098 CC(C)(O)CNC(=O)c1ccccc1 527a_100000751335_100000185807 [0,1,0,0,0,0|1,0,0]=2 1441 B14R1.3098 CC(F)(F)CNC(=O)c1ccccc1 11a_100000731000_100000185807 [0,1,0,0,0,0|2,0,0]=3 1442 B14R1.3098 CC(F)(F)CNC(=O)c1ccccc1 1626a_100000731000_100000185807 [0,1,0,0,0,0|2,0,0]=3 1443 B14R1.3098 CC(F)(F)CNC(=O)c1ccccc1 240690a_100000731000_100000185807 [0,1,0,0,0,0|2,0,0]=3 1444 B14R1.3098 CC(F)(F)CNC(=O)c1ccccc1 527a_100000731000_100000185807 [0,1,0,0,0,0|2,0,0]=3 1445 B14R1.3098 CC(NCC(C)(C)C)c1ccccc1 2230a_100000743828_100000230085 [0,1,0,0,0,0|2,0,1]=4 1446 B14R1.3098 CC(NCC(C)(C)C)c1ccccc1 269862a_100000743828_100000185851 [0,1,0,0,0,0|2,0,1]=4 1447 B14R1.3098 CC(NCC(C)(C)F)c1ccccc1 2230a_100020643315_100000230085 [0,1,0,0,0,0|2,0,1]=4 1448 B14R1.3098 CC(NCC(C)(C)F)c1ccccc1 269862a_100020643315_100000185851 [0,1,0,0,0,0|2,0,1]=4 1449 B14R1.3098 CC(NCC(C)(C)O)c1ccccc1 2230a_100000751335_100000230085 [0,1,0,0,0,0|2,0,1]=4 1450 B14R1.3098 CC(NCC(C)(C)O)c1ccccc1 269862a_100000751335_100000185851 [0,1,0,0,0,0|2,0,1]=4 1451 B14R1.3098 CC(OCC(C)(C)F)c1ccccc1 34a_100000716592_100000211855 [0,1,0,0,0,0|1,0,1]=3 1452 B14R1.3098 CC(OCC(C)(F)F)c1ccccc1 34a_100000068830_100000211855 [0,1,0,0,0,0|2,0,1]=4 1453 B14R1.3098 CC(SCC(C)(C)C)c1ccccc1 62a_100000230085_100011219605 [0,1,0,0,0,0|1,1,1]=4 1454 B14R1.3098 CC(SCC(C)(C)C)c1ccccc1 62a_100011219605_100000230085 [0,1,0,0,0,0|1,1,1]=4 1455 B14R1.3098 CC(SCC(C)(C)F)c1ccccc1 62a_100000230085_100011997219 [0,1,0,0,0,0|1,1,1]=4 1456 B14R1.3098 CC(SCC(C)(C)F)c1ccccc1 62a_100011997219_100000230085 [0,1,0,0,0,0|1,1,1]=4 1457 B14R1.3098 CC(SCC(C)(C)O)c1ccccc1 62a_100000230085_100000764493 [0,1,0,0,0,0|1,1,1]=4 1458 B14R1.3098 CC(SCC(C)(C)O)c1ccccc1 62a_100000764493_100000230085 [0,1,0,0,0,0|1,1,1]=4 1459 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 2230a_100000210012_100000755188 [0,1,0,0,0,0|3,0,0]=4 1460 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 269982a_100000210012_100000755188 [0,1,0,0,0,0|3,0,0]=4 1461 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 34a_100000210012_100000755188 [0,1,0,0,0,0|3,0,0]=4 1462 B14R1.3098 CN(CCC(C)(C)O)c1ccccc1 2230a_100000210012_100000702414 [0,1,0,0,0,0|3,0,0]=4 1463 B14R1.3098 CN(CCC(C)(C)O)c1ccccc1 34a_100000210012_100000702414 [0,1,0,0,0,0|3,0,0]=4 1464 B14R1.3098 CS(=O)(=O)CCC(=O)c1ccccc1 1458a_100000185807_100000731031 [0,1,0,0,0,0|3,0,0]=4 1465 B14R1.3098 C[C@@H](NCC(C)(C)C)c1ccccc1 270004a_100000751104_100011204126 [0,1,0,0,0,0|2,0,1]=4 1466 B14R1.3098 C[C@@H](OCC(C)(C)C)c1ccccc1 34a_100000761318_100011219605 [0,1,0,0,0,0|1,0,1]=3 1467 B14R1.3098 C[C@@H](OCC(C)(C)F)c1ccccc1 34a_100000761318_100011997219 [0,1,0,0,0,0|1,0,1]=3 1468 B14R1.3098 C[C@@H](OCC(C)(C)O)c1ccccc1 34a_100000761318_100000764493 [0,1,0,0,0,0|1,0,1]=3 1469 B14R1.3098 C[C@@H](OCC(C)(C)O)c1ccccc1 7a_100000761318_100000764493 [0,1,0,0,0,0|1,0,1]=3 1470 B14R1.3098 C[C@@H](OC[Si](C)(C)C)c1ccccc1 7a_100000761318_100000233785 [0,1,0,0,0,0|1,1,1]=4 1471 B14R1.3098 C[N+](C)(C)CCC(=O)c1ccccc1 1458a_100000185807_100000085578 [0,1,0,0,0,0|2,0,0]=3 1472 B14R1.3098 C[Si](C)(C)CCC(=O)c1ccccc1 1458a_100000185807_200000733723 [0,1,0,0,0,0|1,1,0]=3 1473 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 11a_102516607284_100000185807 [0,1,0,0,0,0|1,1,0]=3 1474 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 1626a_102516607284_100000185807 [0,1,0,0,0,0|1,1,0]=3 1475 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 240690a_102516607284_100000185807 [0,1,0,0,0,0|1,1,0]=3 1476 B14R1.3098 C[Si](C)(C)CNC(=O)c1ccccc1 527a_102516607284_100000185807 [0,1,0,0,0,0|1,1,0]=3 1477 B14R1.3098 O=C(CCC(F)(F)F)c1ccccc1 1458a_100000185807_100011219754 [0,1,0,0,0,0|3,0,0]=4 1478 B14R1.3098 O=C(NCC(F)(F)F)c1ccccc1 11a_100000717047_100000185807 [0,1,0,0,0,0|3,0,0]=4 1479 B14R1.3098 O=C(NCC(F)(F)F)c1ccccc1 1626a_100000717047_100000185807 [0,1,0,0,0,0|3,0,0]=4 1480 B14R1.3098 O=C(NCC(F)(F)F)c1ccccc1 240690a_100000717047_100000185807 [0,1,0,0,0,0|3,0,0]=4 1481 B14R1.3098 O=C(NCC(F)(F)F)c1ccccc1 527a_100000717047_100000185807 [0,1,0,0,0,0|3,0,0]=4 1482 B14R2.68 CC1CC=C(CC1)c2ccccc2 271570a_100010240233_100000210277 [0,0,0,1,0,0|2,0,0]=3 1483 B14R2.68 CC1CC=C(CC1)c2ccccn2 271570a_100010240233_100011216584 [0,0,0,1,0,0|3,0,0]=4 1484 B14R2.68 CC1CC=C(CC1)c2cccnc2 271570a_100010240233_100000752921 [0,0,0,1,0,0|3,0,0]=4 1485 B14R2.68 CC1CC=C(CC1)c2ccncc2 271570a_100010240233_100000035832 [0,0,0,1,0,0|3,0,0]=4 1486 B14R2.68 CN1CC=C(CC1)c2ccccc2 2230a_100000007107_200000210301 [0,0,0,1,0,0|3,0,0]=4 1487 B14R2.68 CN1CC=C(CC1)c2ccccc2 269982a_100000007107_200000210301 [0,0,0,1,0,0|3,0,0]=4 1488 B14R2.68 OC1CC=C(CC1)c2ccccc2 271570a_100010254553_100000210277 [0,0,0,1,0,0|3,0,0]=4 1489 B14R2.68 [13CH3]N1CC=C(CC1)c2ccccc2 2230a_100000007107_200025704644 [0,0,0,1,0,0|3,0,0]=4 1490 B14R2.68 [13CH3]N1CC=C(CC1)c2ccccc2 269982a_100000007107_200025704644 [0,0,0,1,0,0|3,0,0]=4 1491 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 240690a_100015190264_100000185807 [0,0,0,1,0,0|2,0,0]=3 1492 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 527a_100015190264_100000185807 [0,0,0,1,0,0|2,0,0]=3 1493 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 11a_100025746932_100000185807 [0,0,0,1,0,0|2,0,0]=3 1494 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 1626a_100025746932_100000185807 [0,0,0,1,0,0|2,0,0]=3 1495 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 240690a_100025746932_100000185807 [0,0,0,1,0,0|2,0,0]=3 1496 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 527a_100025746932_100000185807 [0,0,0,1,0,0|2,0,0]=3 1497 B14R2.422 CC1CN(C1)C(=O)c2ccccc2 11a_100000702820_100000185807 [0,0,0,1,0,0|1,0,0]=2 1498 B14R2.422 CC1CN(C1)C(=O)c2ccccc2 240690a_100000702820_100000185807 [0,0,0,1,0,0|1,0,0]=2 1499 B14R2.422 CC1CN(C1)C(=O)c2ccccc2 527a_100000702820_100000185807 [0,0,0,1,0,0|1,0,0]=2 1500 B14R2.422 CC1CN(C1)C(C)c2ccccc2 2230a_100000702820_100000230085 [0,0,0,1,0,0|2,0,1]=4 1501 B14R2.422 CC1CN(C1)C(C)c2ccccc2 269982a_100000702820_100000230085 [0,0,0,1,0,0|2,0,1]=4 1502 B14R2.422 CC1CN(C1)C(C)c2ccccc2 34a_100000702820_100000211855 [0,0,0,1,0,0|2,0,1]=4 1503 B14R2.422 O=C(c1ccccc1)N2CC(C2)F 11a_100000690557_100000185807 [0,0,0,1,0,0|2,0,0]=3 1504 B14R2.422 O=C(c1ccccc1)N2CC(C2)F 240690a_100000690557_100000185807 [0,0,0,1,0,0|2,0,0]=3 1505 B14R2.422 O=C(c1ccccc1)N2CC(C2)F 527a_100000690557_100000185807 [0,0,0,1,0,0|2,0,0]=3 1506 B14R2.422 O=C(c1ccccc1)N2CC(C2)O 11a_100000749847_100000185807 [0,0,0,1,0,0|2,0,0]=3 1507 B14R2.422 O=C(c1ccccc1)N2CC(C2)O 240690a_100000749847_100000185807 [0,0,0,1,0,0|2,0,0]=3 1508 B14R2.422 O=C(c1ccccc1)N2CC(C2)O 527a_100000749847_100000185807 [0,0,0,1,0,0|2,0,0]=3 1509 B14R2.792 CC(=NNC1CC1)c2ccccc2 4a_100000701032_100000185851 [0,0,0,1,0,0|3,0,0]=4 1510 B14R2.792 CC(NCC1CC1)c2ccccc2 2230a_100000735609_100000230085 [0,0,0,1,0,0|2,0,1]=4 1511 B14R2.792 CC(NCC1CC1)c2ccccc2 34a_100000735609_100000211855 [0,0,0,1,0,0|2,0,1]=4 1512 B14R2.792 CC(OCC1CC1)c2ccccc2 34a_100000211283_100000211855 [0,0,0,1,0,0|1,0,1]=3 1513 B14R2.792 CC(OC[C@@H]1CO1)c2ccccc2 34a_100000757423_100000211855 [0,0,0,1,0,0|2,0,1]=4 1514 B14R2.792 CC(SCC1CC1)c2ccccc2 62a_100000230085_100000742324 [0,0,0,1,0,0|1,1,1]=4 1515 B14R2.792 CC(SCC1CC1)c2ccccc2 62a_100000756562_100000230085 [0,0,0,1,0,0|1,1,1]=4 1516 B14R2.792 CN(CCC1CC1)c2ccccc2 2230a_100000210012_100000694398 [0,0,0,1,0,0|3,0,0]=4 1517 B14R2.792 CN(CCC1CC1)c2ccccc2 269982a_100000210012_100000694398 [0,0,0,1,0,0|3,0,0]=4 1518 B14R2.792 CN(CCC1CC1)c2ccccc2 34a_100000210012_100000694398 [0,0,0,1,0,0|3,0,0]=4 1519 B14R2.792 C[C@@H](NCC1CC1)c2ccccc2 2230a_100000751104_100000742324 [0,0,0,1,0,0|2,0,1]=4 1520 B14R2.792 C[C@@H](NCC1CC1)c2ccccc2 269862a_100000751104_100000741477 [0,0,0,1,0,0|2,0,1]=4 1521 B14R2.792 C[C@@H](OCC1CC1)c2ccccc2 34a_100000761318_100000742324 [0,0,0,1,0,0|1,0,1]=3 1522 B14R2.792 C[C@@H](OCC1CC1)c2ccccc2 7a_100000761318_100000742324 [0,0,0,1,0,0|1,0,1]=3 1523 B14R2.792 C[C@@H](OCC1CO1)c2ccccc2 34a_100000761318_102125554688 [0,0,0,1,0,0|2,0,1]=4 1524 B14R2.792 C[C@@H](OCC1CO1)c2ccccc2 7a_100000761318_102125554688 [0,0,0,1,0,0|2,0,1]=4 1525 B14R2.792 C[C@@H](OCC1CS1)c2ccccc2 7a_100000761318_100000031435 [0,0,0,1,0,0|2,0,1]=4 1526 B14R2.792 C[C@@H](OC[C@@H]1CO1)c2ccccc2 7a_100000761318_100000745022 [0,0,0,1,0,0|2,0,1]=4 1527 B14R2.792 O=C(CCC1CC1)c2ccccc2 1458a_100000185807_100000694398 [0,0,0,1,0,0|1,0,0]=2 1528 B14R2.792 O=C(CCC1CO1)c2ccccc2 1458a_100000185807_100000732470 [0,0,0,1,0,0|2,0,0]=3 1529 B14R2.792 O=C(CNC1CC1)c2ccccn2 34a_100000212008_100000027445 [0,0,0,1,0,0|3,0,0]=4 1530 B14R2.792 O=C(CSC1CC1)c2ccccc2 62a_100000211460_100000211595 [0,0,0,1,0,0|2,0,0]=3 1531 B14R2.792 O=C(CSC1CC1)c2ccccn2 62a_100000027445_100000211595 [0,0,0,1,0,0|3,0,0]=4 1532 B14R2.792 O=C(CSC1CC1)c2cccnc2 62a_100000757877_100000211595 [0,0,0,1,0,0|3,0,0]=4 1533 B14R2.792 O=C(CSC1CC1)c2ccncc2 62a_100000027454_100000211595 [0,0,0,1,0,0|3,0,0]=4 1534 B14R2.792 O=C(NCC1CC1)c2ccccc2 11a_100000735609_100000185807 [0,0,0,1,0,0|1,0,0]=2 1535 B14R2.792 O=C(NCC1CC1)c2ccccc2 1626a_100000735609_100000185807 [0,0,0,1,0,0|1,0,0]=2 1536 B14R2.792 O=C(NCC1CC1)c2ccccc2 240690a_100000735609_100000185807 [0,0,0,1,0,0|1,0,0]=2 1537 B14R2.792 O=C(NCC1CC1)c2ccccc2 527a_100000735609_100000185807 [0,0,0,1,0,0|1,0,0]=2 1538 B14R2.792 O=C(NNC1CC1)c2ccccc2 22a_100000701032_100000185807 [0,0,0,1,0,0|2,0,0]=3 1539 B14R2.25733 CC(=O)C1CC(=O)c2c1cccc2 1458a_100000070787_100010208147 [0,0,0,1,0,0|2,0,1]=4 1540 B14R2.25733 CN(C)C1CC(=O)c2c1cccc2 2230a_100102631434_100010208147 [0,0,0,1,0,0|2,0,0]=3 1541 B14R2.25733 CN(C)C1CC(=O)c2c1cccc2 269982a_100102631434_100010208147 [0,0,0,1,0,0|2,0,0]=3 1542 B14R2.25733 CN(C)C1OC(=O)c2c1cccc2 2230a_100102631434_100009813457 [0,0,0,1,0,0|1,0,0]=2 1543 B14R2.25733 CN(C)C1OC(=O)c2c1cccc2 269982a_100102631434_100009813457 [0,0,0,1,0,0|1,0,0]=2 1544 B14R2.31137 CC(C)CSC1Cc2c1cccc2 62a_100000210624_100009813401 [0,0,0,1,0,0|1,1,1]=4 1545 B14R2.31137 CC(C)CSC1Cc2c1cccc2 62a_100009813401_100000210760 [0,0,0,1,0,0|1,1,1]=4 1546 B14R2.31137 CC(C)NN=C1Cc2c1cccc2 4a_100000741168_100000051409 [0,0,0,1,0,0|3,0,0]=4 1547 B12R1.54 CC(C)COC(C)c1ccsc1 34a_100011350980_100000210624 [0,0,0,0,1,0|2,0,1]=4 1548 B12R1.54 CC(C)COC(C)c1ccsc1 7a_100011350980_100000210760 [0,0,0,0,1,0|2,0,1]=4 1549 B12R1.54 CC(C)CO[C@@H](C)c1ccco1 34a_100000755270_100000210624 [0,0,0,0,1,0|2,0,1]=4 1550 B12R1.54 CC(C)CO[C@@H](C)c1ccco1 7a_100000755270_100000210760 [0,0,0,0,1,0|2,0,1]=4 1551 B12R1.54 CC(C)CO[C@H](C)c1cccs1 7a_100000750433_100000210760 [0,0,0,0,1,0|2,0,1]=4 1552 B12R1.54 CC(C)NCC(=O)c1cccs1 2230a_100138425928_100000211436 [0,0,0,0,1,0|3,0,0]=4 1553 B12R1.54 CC(C)NCC(=O)c1ccsc1 2230a_100138425928_100011219462 [0,0,0,0,1,0|3,0,0]=4 1554 B12R1.54 CC(C)NCC(=O)c1ccsc1 34a_100138425928_100011219462 [0,0,0,0,1,0|3,0,0]=4 1555 B12R1.54 CC(C)OCC(=O)c1ccsc1 34a_100000212225_100011219462 [0,0,0,0,1,0|3,0,0]=4 1556 B12R1.54 CC(C)SCC(=O)c1ccc[nH]1 62a_100000210206_200011262396 [0,0,0,0,1,0|3,0,0]=4 1557 B12R1.54 CC(C)SCC(=O)c1ccc[nH]1 62a_200011262396_100000210206 [0,0,0,0,1,0|3,0,0]=4 1558 B12R1.54 CC(C)SCC(=O)c1ccco1 62a_100000210206_100000211439 [0,0,0,0,1,0|3,0,0]=4 1559 B12R1.54 CC(C)SCC(=O)c1ccco1 62a_100000211439_100000210206 [0,0,0,0,1,0|3,0,0]=4 1560 B12R1.54 CC(C)SCC(=O)c1cccs1 62a_100000210206_100000211436 [0,0,0,0,1,0|3,0,0]=4 1561 B12R1.54 CC(C)SCC(=O)c1cccs1 62a_100000211436_100000210206 [0,0,0,0,1,0|3,0,0]=4 1562 B12R1.54 CC(C)SCC(=O)c1ccsc1 62a_100000210206_100011219462 [0,0,0,0,1,0|3,0,0]=4 1563 B12R1.54 CC(C)SCC(=O)c1ccsc1 62a_100011219462_100000210206 [0,0,0,0,1,0|3,0,0]=4 1564 B12R1.54 CN(C)CCC(=O)c1cccs1 2230a_100102631434_100011290775 [0,0,0,0,1,0|3,0,0]=4 1565 B12R1.54 CN(C)CCC(=O)c1cccs1 269982a_100102631434_100011290775 [0,0,0,0,1,0|3,0,0]=4 1566 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [0,0,0,0,1,0|0,0,2]=3 1567 B12R1.107 C=C(F)CC(=O)c1ccccc1 1458a_100000185807_100009893438 [0,0,0,0,1,0|1,0,2]=4 1568 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [0,0,0,0,1,0|1,0,1]=3 1569 B12R1.107 CC(=O)CC(=O)c1ccccn1 1458a_100000070787_100000027445 [0,0,0,0,1,0|2,0,1]=4 1570 B12R1.107 CC(=O)CC(=O)c1cccnc1 1458a_100000070787_100015188593 [0,0,0,0,1,0|2,0,1]=4 1571 B12R1.107 CC(=O)CC(=O)c1ccncc1 1458a_100000070787_100000027454 [0,0,0,0,1,0|2,0,1]=4 1572 B12R1.107 CC(C)CC(=O)c1ccccc1 1458a_100000185807_100000210624 [0,0,0,0,1,0|0,0,0]=1 1573 B12R1.107 CC(C)CN(C)c1ccccc1 2230a_100000210012_100000210760 [0,0,0,0,1,0|2,0,0]=3 1574 B12R1.107 CC(C)CN(C)c1ccccc1 269982a_100000210012_100000210624 [0,0,0,0,1,0|2,0,0]=3 1575 B12R1.107 CC(C)CN(C)c1ccccc1 34a_100000210012_100000210624 [0,0,0,0,1,0|2,0,0]=3 1576 B12R1.107 CC(C)C[C@H](N)c1ccccc1 271570a_100015190218_100000210277 [0,0,0,0,1,0|1,0,1]=3 1577 B12R1.107 CC(C)C[C@H](N)c1ccccn1 271570a_100015190218_100011216584 [0,0,0,0,1,0|2,0,1]=4 1578 B12R1.107 CC(C)C[C@H](N)c1cccnc1 271570a_100015190218_100000752921 [0,0,0,0,1,0|2,0,1]=4 1579 B12R1.107 CC(C)C[C@H](N)c1ccncc1 271570a_100015190218_100000035832 [0,0,0,0,1,0|2,0,1]=4 1580 B12R1.107 CC(C)NC(=O)c1ccccc1 11a_100138425928_100000185807 [0,0,0,0,1,0|1,0,0]=2 1581 B12R1.107 CC(C)NC(=O)c1ccccc1 1626a_100138425928_100000185807 [0,0,0,0,1,0|1,0,0]=2 1582 B12R1.107 CC(C)NC(=O)c1ccccc1 240690a_100138425928_100000185807 [0,0,0,0,1,0|1,0,0]=2 1583 B12R1.107 CC(C)NC(=O)c1ccccc1 527a_100138425928_100000185807 [0,0,0,0,1,0|1,0,0]=2 1584 B12R1.107 CC(C)NC(C)c1ccccc1 2230a_100138425928_100000230085 [0,0,0,0,1,0|2,0,1]=4 1585 B12R1.107 CC(C)NC(C)c1ccccc1 34a_100138425928_100000211855 [0,0,0,0,1,0|2,0,1]=4 1586 B12R1.107 CC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000210206 [0,0,0,0,1,0|2,0,1]=4 1587 B12R1.107 CC(C)OC(C)c1ccccc1 34a_100000212225_100000211855 [0,0,0,0,1,0|1,0,1]=3 1588 B12R1.107 CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000210206 [0,0,0,0,1,0|1,0,1]=3 1589 B12R1.107 CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210206 [0,0,0,0,1,0|1,0,1]=3 1590 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000210206_100000230085 [0,0,0,0,1,0|1,1,1]=4 1591 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000230085_100000210206 [0,0,0,0,1,0|1,1,1]=4 1592 B12R1.107 CC(CN(C)C)c1ccccc1 2230a_100102631434_100000756946 [0,0,0,0,1,0|2,0,1]=4 1593 B12R1.107 CC(CN(C)C)c1ccccc1 269982a_100102631434_100000756946 [0,0,0,0,1,0|2,0,1]=4 1594 B12R1.107 CC(CN(C)C)c1ccccc1 270004a_100102631434_100000212034 [0,0,0,0,1,0|2,0,1]=4 1595 B12R1.107 CC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218427 [0,0,0,0,1,0|1,0,0]=2 1596 B12R1.107 CC(O)CN(C)c1ccccc1 2230a_100000210012_100011218427 [0,0,0,0,1,0|3,0,0]=4 1597 B12R1.107 CC(O)CN(C)c1ccccc1 269982a_100000210012_100011218427 [0,0,0,0,1,0|3,0,0]=4 1598 B12R1.107 CC(O)CN(C)c1ccccc1 34a_100000210012_100011218427 [0,0,0,0,1,0|3,0,0]=4 1599 B12R1.107 CN(C)CC(=O)c1ccccc1 269982a_100102631434_100000211460 [0,0,0,0,1,0|1,0,0]=2 1600 B12R1.107 CN(C)CC(=O)c1ccccn1 269982a_100102631434_100000027445 [0,0,0,0,1,0|2,0,0]=3 1601 B12R1.107 CN(C)CC(=O)c1cccnc1 269982a_100102631434_100000757877 [0,0,0,0,1,0|2,0,0]=3 1602 B12R1.107 CN(C)CC(=O)c1ccncc1 269982a_100102631434_100000027454 [0,0,0,0,1,0|2,0,0]=3 1603 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [0,0,0,0,1,0|1,0,2]=4 1604 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [0,0,0,0,1,0|1,0,2]=4 1605 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [0,0,0,0,1,0|1,0,2]=4 1606 B12R1.107 CN(C)CS(=O)c1ccccc1 269982a_100102631434_100000031784 [0,0,0,0,1,0|2,0,0]=3 1607 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [0,0,0,0,1,0|1,0,2]=4 1608 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [0,0,0,0,1,0|1,0,2]=4 1609 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [0,0,0,0,1,0|1,0,2]=4 1610 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 2230a_100000210012_100009817552 [0,0,0,0,1,0|3,0,0]=4 1611 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 269982a_100000210012_100009817552 [0,0,0,0,1,0|3,0,0]=4 1612 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 34a_100000210012_100009817552 [0,0,0,0,1,0|3,0,0]=4 1613 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [0,0,0,0,1,0|2,0,1]=4 1614 B12R1.107 O=C(CC(F)F)c1ccccc1 1458a_100000185807_100011934356 [0,0,0,0,1,0|2,0,0]=3 1615 B12R1.107 O=C(C[N+](=O)[O-])c1ccccc1 1458a_100000185807_100000761209 [0,0,0,0,1,0|3,0,0]=4 1616 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [0,0,0,0,1,0|2,0,1]=4 1617 B14R1.420 C=C(C)CNNC(=O)c1ccccc1 22a_100000729518_100000185807 [0,0,0,0,0,1|1,0,2]=4 1618 B14R1.420 C=C(C)COCC(=O)c1ccccn1 34a_100000210245_100000027445 [0,0,0,0,0,1|1,0,2]=4 1619 B14R1.420 C=C(C)CSCC(=O)c1ccccc1 62a_100000211460_100000211660 [0,0,0,0,0,1|0,1,2]=4 1620 B14R1.420 C=C(C)CSCC(=O)c1ccccc1 62a_100000748629_100000211460 [0,0,0,0,0,1|0,1,2]=4 1621 B14R1.420 CC(=CCCC(=O)c1ccccc1)C 1458a_100000185807_100011217483 [0,0,0,0,0,1|1,0,1]=3 1622 B14R1.420 CC(=CCNC(=O)c1ccccc1)C 11a_100000718196_100000185807 [0,0,0,0,0,1|1,0,1]=3 1623 B14R1.420 CC(=CCNC(=O)c1ccccc1)C 1626a_100000718196_100000185807 [0,0,0,0,0,1|1,0,1]=3 1624 B14R1.420 CC(=CCNC(=O)c1ccccc1)C 527a_100000718196_100000185807 [0,0,0,0,0,1|1,0,1]=3 1625 B14R1.420 CC(=CCOC(C)c1ccccc1)C 34a_100000753907_100000211855 [0,0,0,0,0,1|1,0,2]=4 1626 B14R1.420 CC(=CCO[C@H](C)c1ccccc1)C 34a_100000761318_100000761012 [0,0,0,0,0,1|1,0,2]=4 1627 B14R1.420 CC(=CCO[C@H](C)c1ccccc1)C 7a_100000761318_100000761012 [0,0,0,0,0,1|1,0,2]=4 1628 B14R1.420 CC(=NNCC(C)O)c1ccccc1 4a_200000730056_100000185851 [0,0,0,0,0,1|3,0,0]=4 1629 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000070787_100000211006 [0,0,0,0,0,1|2,0,1]=4 1630 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100011215641 [0,0,0,0,0,1|2,0,1]=4 1631 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000070787_200011215302 [0,0,0,0,0,1|2,0,1]=4 1632 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200000210301 [0,0,0,0,0,1|2,0,1]=4 1633 B14R1.420 CC(=O)CCOC(=O)c1ccccc1 1458a_100000070787_100000184176 [0,0,0,0,0,1|1,0,1]=3 1634 B14R1.420 CC(=O)COCC(=O)c1ccccn1 34a_100000211253_100000027445 [0,0,0,0,0,1|2,0,1]=4 1635 B14R1.420 CC(=O)NCCC(=O)c1ccccc1 1458a_100000185807_100000189650 [0,0,0,0,0,1|2,0,1]=4 1636 B14R1.420 CC(=O)OCCC(=O)c1ccccc1 1458a_100000185807_100009814007 [0,0,0,0,0,1|2,0,1]=4 1637 B14R1.420 CC(Br)CCOC(C)c1ccccc1 34a_100009893172_100000211855 [0,0,0,0,0,1|2,0,1]=4 1638 B14R1.420 CC(Br)COCC(=O)c1ccccn1 34a_100012180447_100000027445 [0,0,0,0,0,1|2,0,0]=3 1639 B14R1.420 CC(Br)COCC(C)c1ccccc1 34a_100012180447_100000756946 [0,0,0,0,0,1|2,0,1]=4 1640 B14R1.420 CC(Br)COCC(O)c1ccccc1 34a_100012180447_100000185958 [0,0,0,0,0,1|1,0,2]=4 1641 B14R1.420 CC(Br)COC[C@@H](O)c1ccccc1 34a_100012180447_100011933945 [0,0,0,0,0,1|1,0,2]=4 1642 B14R1.420 CC(C)C=NNC(=O)c1ccccc1 4a_100000184135_100000210432 [0,0,0,0,0,1|1,0,1]=3 1643 B14R1.420 CC(C)C=NNC(=O)c1ccccn1 4a_100000184044_100000210432 [0,0,0,0,0,1|2,0,1]=4 1644 B14R1.420 CC(C)C=NNC(=O)c1cccnc1 4a_100000189771_100000210432 [0,0,0,0,0,1|2,0,1]=4 1645 B14R1.420 CC(C)C=NNC(=O)c1ccncc1 4a_100000189768_100000210432 [0,0,0,0,0,1|2,0,1]=4 1646 B14R1.420 CC(C)CCCC(=O)c1ccccc1 1458a_100000185807_100011214892 [0,0,0,0,0,1|1,0,0]=2 1647 B14R1.420 CC(C)CCCN(C)c1ccccc1 2230a_100000210012_100011214892 [0,0,0,0,0,1|3,0,0]=4 1648 B14R1.420 CC(C)CCCN(C)c1ccccc1 269982a_100000210012_100011214892 [0,0,0,0,0,1|3,0,0]=4 1649 B14R1.420 CC(C)CCCN(C)c1ccccc1 34a_100000210012_100011214892 [0,0,0,0,0,1|3,0,0]=4 1650 B14R1.420 CC(C)CCNC(=O)c1ccccc1 11a_100000210545_100000185807 [0,0,0,0,0,1|1,0,0]=2 1651 B14R1.420 CC(C)CCNC(=O)c1ccccc1 1626a_100000210545_100000185807 [0,0,0,0,0,1|1,0,0]=2 1652 B14R1.420 CC(C)CCNC(=O)c1ccccc1 240690a_100000210545_100000185807 [0,0,0,0,0,1|1,0,0]=2 1653 B14R1.420 CC(C)CCNC(=O)c1ccccc1 527a_100000210545_100000185807 [0,0,0,0,0,1|1,0,0]=2 1654 B14R1.420 CC(C)CCNC(C)c1ccccc1 269862a_100000210545_100000185851 [0,0,0,0,0,1|2,0,1]=4 1655 B14R1.420 CC(C)CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210312 [0,0,0,0,0,1|2,0,1]=4 1656 B14R1.420 CC(C)CCN[C@H](C)c1ccccc1 269862a_100000751104_100000185833 [0,0,0,0,0,1|2,0,1]=4 1657 B14R1.420 CC(C)CCOC(C)c1ccccc1 34a_100000210254_100000211855 [0,0,0,0,0,1|1,0,1]=3 1658 B14R1.420 CC(C)CCOC(C)c1ccccc1 7a_100000210254_100000230085 [0,0,0,0,0,1|1,0,1]=3 1659 B14R1.420 CC(C)CCO[C@H](C)c1ccccc1 34a_100000761318_100000210312 [0,0,0,0,0,1|1,0,1]=3 1660 B14R1.420 CC(C)CCO[C@H](C)c1ccccc1 7a_100000761318_100000210626 [0,0,0,0,0,1|1,0,1]=3 1661 B14R1.420 CC(C)CCSC(C)c1ccccc1 62a_100000210312_100000230085 [0,0,0,0,0,1|1,1,1]=4 1662 B14R1.420 CC(C)CCSC(C)c1ccccc1 62a_100000230085_100000210312 [0,0,0,0,0,1|1,1,1]=4 1663 B14R1.420 CC(C)CNCC(=O)c1ccccn1 34a_100000210953_100000027445 [0,0,0,0,0,1|2,0,0]=3 1664 B14R1.420 CC(C)CNCC(C)c1ccccc1 2230a_100000210953_100000756946 [0,0,0,0,0,1|2,0,1]=4 1665 B14R1.420 CC(C)CNCC(C)c1ccccc1 2230a_100000701038_100000210760 [0,0,0,0,0,1|2,0,1]=4 1666 B14R1.420 CC(C)CNCC(C)c1ccccc1 270004a_100000210953_100000212034 [0,0,0,0,0,1|2,0,1]=4 1667 B14R1.420 CC(C)CNCC(C)c1ccccc1 270004a_100000701038_100000210432 [0,0,0,0,0,1|2,0,1]=4 1668 B14R1.420 CC(C)CNCC(C)c1ccccc1 34a_100000210953_100000756946 [0,0,0,0,0,1|2,0,1]=4 1669 B14R1.420 CC(C)CNCC(C)c1ccccc1 34a_100000701038_100000210624 [0,0,0,0,0,1|2,0,1]=4 1670 B14R1.420 CC(C)CNCC(O)c1ccccc1 2230a_100000210709_100000210760 [0,0,0,0,0,1|1,0,2]=4 1671 B14R1.420 CC(C)CNCC(O)c1ccccc1 2230a_100000210953_100000185958 [0,0,0,0,0,1|1,0,2]=4 1672 B14R1.420 CC(C)CNCC(O)c1ccccc1 270004a_100000210709_100000210432 [0,0,0,0,0,1|1,0,2]=4 1673 B14R1.420 CC(C)CNCC(O)c1ccccc1 34a_100000210953_100000185958 [0,0,0,0,0,1|1,0,2]=4 1674 B14R1.420 CC(C)CNC[C@@H](O)c1ccccc1 2230a_100000210953_100011933945 [0,0,0,0,0,1|1,0,2]=4 1675 B14R1.420 CC(C)CNC[C@@H](O)c1ccccc1 34a_100000210953_100011933945 [0,0,0,0,0,1|1,0,2]=4 1676 B14R1.420 CC(C)CNNC(=O)c1ccccc1 22a_100000696102_100000185807 [0,0,0,0,0,1|1,0,0]=2 1677 B14R1.420 CC(C)COCC(=O)c1ccccn1 34a_100000210257_100000027445 [0,0,0,0,0,1|1,0,0]=2 1678 B14R1.420 CC(C)COCC(C)c1ccccc1 34a_100000210257_100000756946 [0,0,0,0,0,1|1,0,1]=3 1679 B14R1.420 CC(C)COCC(C)c1ccccc1 34a_100011215166_100000210624 [0,0,0,0,0,1|1,0,1]=3 1680 B14R1.420 CC(C)COCC(C)c1ccccc1 7a_100011215166_100000210760 [0,0,0,0,0,1|1,0,1]=3 1681 B14R1.420 CC(C)COCC(O)c1ccccc1 34a_100000210257_100000185958 [0,0,0,0,0,1|0,0,2]=3 1682 B14R1.420 CC(C)COC[C@@H](N)c1ccccc1 34a_100000751927_100000210624 [0,0,0,0,0,1|1,0,1]=3 1683 B14R1.420 CC(C)COC[C@@H](N)c1ccncc1 34a_100138412524_100000210624 [0,0,0,0,0,1|2,0,1]=4 1684 B14R1.420 CC(C)COC[C@@H](O)c1ccccc1 34a_100000210257_100011933945 [0,0,0,0,0,1|0,0,2]=3 1685 B14R1.420 CC(C)CSCC(=O)c1ccccc1 62a_100000210624_100000211460 [0,0,0,0,0,1|0,1,0]=2 1686 B14R1.420 CC(C)CSCC(=O)c1ccccc1 62a_100000211460_100000210760 [0,0,0,0,0,1|0,1,0]=2 1687 B14R1.420 CC(C)CSCC(=O)c1ccccn1 62a_100000027445_100000210760 [0,0,0,0,0,1|1,1,0]=3 1688 B14R1.420 CC(C)CSCC(=O)c1ccccn1 62a_100000210624_100000027445 [0,0,0,0,0,1|1,1,0]=3 1689 B14R1.420 CC(C)CSCC(=O)c1cccnc1 62a_100000210624_100000757877 [0,0,0,0,0,1|1,1,0]=3 1690 B14R1.420 CC(C)CSCC(=O)c1cccnc1 62a_100000757877_100000210760 [0,0,0,0,0,1|1,1,0]=3 1691 B14R1.420 CC(C)CSCC(=O)c1ccncc1 62a_100000027454_100000210760 [0,0,0,0,0,1|1,1,0]=3 1692 B14R1.420 CC(C)CSCC(=O)c1ccncc1 62a_100000210624_100000027454 [0,0,0,0,0,1|1,1,0]=3 1693 B14R1.420 CC(C)CSCC(=O)c1ncccn1 62a_100000210624_100020636365 [0,0,0,0,0,1|2,1,0]=4 1694 B14R1.420 CC(C)CSCC(=O)c1ncccn1 62a_100020636365_100000210760 [0,0,0,0,0,1|2,1,0]=4 1695 B14R1.420 CC(C)CSCC(C)c1ccccc1 62a_100000210624_100000756946 [0,0,0,0,0,1|1,1,1]=4 1696 B14R1.420 CC(C)CSCC(C)c1ccccc1 62a_100000756946_100000210760 [0,0,0,0,0,1|1,1,1]=4 1697 B14R1.420 CC(C)CSCC(O)c1ccccc1 62a_100000185958_100000210760 [0,0,0,0,0,1|0,1,2]=4 1698 B14R1.420 CC(C)CSCC(O)c1ccccc1 62a_100000210624_100000185958 [0,0,0,0,0,1|0,1,2]=4 1699 B14R1.420 CC(C)CSCS(=O)c1ccccc1 62a_100000210624_100000031784 [0,0,0,0,0,1|1,1,0]=3 1700 B14R1.420 CC(C)CSC[C@@H](O)c1ccccc1 62a_100000210624_100011933945 [0,0,0,0,0,1|0,1,2]=4 1701 B14R1.420 CC(C)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000210760 [0,0,0,0,0,1|0,1,2]=4 1702 B14R1.420 CC(C)NCCC(=O)c1ccccc1 2230a_100138425928_100000750707 [0,0,0,0,0,1|1,0,0]=2 1703 B14R1.420 CC(C)NCCC(O)c1ccccc1 2230a_100000763605_100000210206 [0,0,0,0,0,1|1,0,2]=4 1704 B14R1.420 CC(C)NCCS(=O)c1ccccc1 2230a_100138425928_100000740319 [0,0,0,0,0,1|2,0,0]=3 1705 B14R1.420 CC(C)NCC[C@@H](O)c1ccccc1 2230a_100138425928_100000729684 [0,0,0,0,0,1|1,0,2]=4 1706 B14R1.420 CC(C)NCC[C@@H](O)c1ccccc1 34a_100138425928_100000729684 [0,0,0,0,0,1|1,0,2]=4 1707 B14R1.420 CC(C)OCCC(=O)c1ccccc1 1458a_100000185807_100000211751 [0,0,0,0,0,1|1,0,0]=2 1708 B14R1.420 CC(C)OCCN(C)c1ccccc1 2230a_100000210012_100000211751 [0,0,0,0,0,1|3,0,0]=4 1709 B14R1.420 CC(C)OCCN(C)c1ccccc1 269982a_100000210012_100000211751 [0,0,0,0,0,1|3,0,0]=4 1710 B14R1.420 CC(C)OCCN(C)c1ccccc1 34a_100000210012_100000211751 [0,0,0,0,0,1|3,0,0]=4 1711 B14R1.420 CC(C)OCC[C@@H](O)c1ccccc1 34a_100000212225_100000729684 [0,0,0,0,0,1|1,0,2]=4 1712 B14R1.420 CC(C)OCC[C@H](N)c1ccccc1 34a_100025705951_100000210206 [0,0,0,0,0,1|2,0,1]=4 1713 B14R1.420 CC(C)OCN[C@H](C)c1ccccc1 2230a_100000751104_100000709892 [0,0,0,0,0,1|2,0,1]=4 1714 B14R1.420 CC(C)OCO[C@H](C)c1ccccc1 34a_100000761318_100000709892 [0,0,0,0,0,1|1,0,1]=3 1715 B14R1.420 CC(C)OCSC(C)c1ccccc1 62a_100000230085_100000709892 [0,0,0,0,0,1|1,1,1]=4 1716 B14R1.420 CC(C)OCSC(C)c1ccccc1 62a_100000709892_100000230085 [0,0,0,0,0,1|1,1,1]=4 1717 B14R1.420 CC(C)SCCC(=O)c1ccccc1 1458a_100000185807_100000730970 [0,0,0,0,0,1|1,0,0]=2 1718 B14R1.420 CC(C)SCCC(=O)c1ccccc1 62a_100000210206_100000750707 [0,0,0,0,0,1|1,0,0]=2 1719 B14R1.420 CC(C)SCCC(=O)c1ccccc1 62a_100000750707_100000210206 [0,0,0,0,0,1|1,0,0]=2 1720 B14R1.420 CC(C)SCCN(C)c1ccccc1 2230a_100000210012_100000730970 [0,0,0,0,0,1|3,0,0]=4 1721 B14R1.420 CC(C)SCCN(C)c1ccccc1 269982a_100000210012_100000730970 [0,0,0,0,0,1|3,0,0]=4 1722 B14R1.420 CC(C)SCCN(C)c1ccccc1 34a_100000210012_100000730970 [0,0,0,0,0,1|3,0,0]=4 1723 B14R1.420 CC(C)SCCS(=O)c1ccccc1 62a_100000210206_100000740319 [0,0,0,0,0,1|2,0,0]=3 1724 B14R1.420 CC(C)SCC[C@@H](O)c1ccccc1 62a_100000210206_100000729684 [0,0,0,0,0,1|1,0,2]=4 1725 B14R1.420 CC(C)SCC[C@@H](O)c1ccccc1 62a_100000729684_100000210206 [0,0,0,0,0,1|1,0,2]=4 1726 B14R1.420 CC(C)SCOC(=O)c1ccccc1 62a_100000073877_100000210206 [0,0,0,0,0,1|0,0,0]=1 1727 B14R1.420 CC(C)SCOC(=O)c1ccccc1 62a_100000210206_100000073877 [0,0,0,0,0,1|0,0,0]=1 1728 B14R1.420 CC(COC[C@@H](C)Cl)c1ccccc1 34a_100016084084_100000756946 [0,0,0,0,0,1|2,0,1]=4 1729 B14R1.420 CC(COC[C@@H](C)N)c1ccccc1 34a_100000737577_100000756946 [0,0,0,0,0,1|2,0,1]=4 1730 B14R1.420 CC(COC[C@@H](C)O)c1ccccc1 34a_100011215166_100009817552 [0,0,0,0,0,1|2,0,1]=4 1731 B14R1.420 CC(COC[C@@H](C)O)c1ccccc1 7a_100011215166_100009817552 [0,0,0,0,0,1|2,0,1]=4 1732 B14R1.420 CC(F)COCC(=O)c1ccccn1 34a_100015925927_100000027445 [0,0,0,0,0,1|2,0,0]=3 1733 B14R1.420 CC(F)COCC(C)c1ccccc1 34a_100015925927_100000756946 [0,0,0,0,0,1|2,0,1]=4 1734 B14R1.420 CC(F)COCC(O)c1ccccc1 34a_100015925927_100000185958 [0,0,0,0,0,1|1,0,2]=4 1735 B14R1.420 CC(F)COC[C@@H](O)c1ccccc1 34a_100015925927_100011933945 [0,0,0,0,0,1|1,0,2]=4 1736 B14R1.420 CC(O)CCCC(=O)c1ccccc1 1458a_100000185807_200000718107 [0,0,0,0,0,1|2,0,0]=3 1737 B14R1.420 CC(O)CCNC(=O)c1ccccc1 240690a_200000755665_100000185807 [0,0,0,0,0,1|2,0,0]=3 1738 B14R1.420 CC(O)CCNC(=O)c1ccccc1 527a_200000755665_100000185807 [0,0,0,0,0,1|2,0,0]=3 1739 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 34a_100000761318_100012276601 [0,0,0,0,0,1|2,0,1]=4 1740 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 7a_100000761318_100012276601 [0,0,0,0,0,1|2,0,1]=4 1741 B14R1.420 CC(O)CNCC(=O)c1ccccn1 34a_100000210904_100000027445 [0,0,0,0,0,1|3,0,0]=4 1742 B14R1.420 CC(O)CNNC(=O)c1ccccc1 22a_200000730056_100000185807 [0,0,0,0,0,1|2,0,0]=3 1743 B14R1.420 CC(O)COCC(C)c1ccccc1 34a_100011215166_100011218427 [0,0,0,0,0,1|2,0,1]=4 1744 B14R1.420 CC(O)COCC(C)c1ccccc1 7a_100011215166_100011218427 [0,0,0,0,0,1|2,0,1]=4 1745 B14R1.420 CC(O)COC[C@@H](N)c1ccccc1 34a_100000751927_100011218427 [0,0,0,0,0,1|2,0,1]=4 1746 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100000211460_100011218427 [0,0,0,0,0,1|1,1,0]=3 1747 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100011218427_100000211460 [0,0,0,0,0,1|1,1,0]=3 1748 B14R1.420 CC(O)CSCC(=O)c1ccccn1 62a_100000027445_100011218427 [0,0,0,0,0,1|2,1,0]=4 1749 B14R1.420 CC(O)CSCC(=O)c1ccccn1 62a_100011218427_100000027445 [0,0,0,0,0,1|2,1,0]=4 1750 B14R1.420 CC(O)CSCC(=O)c1cccnc1 62a_100000757877_100011218427 [0,0,0,0,0,1|2,1,0]=4 1751 B14R1.420 CC(O)CSCC(=O)c1cccnc1 62a_100011218427_100000757877 [0,0,0,0,0,1|2,1,0]=4 1752 B14R1.420 CC(O)CSCC(=O)c1ccncc1 62a_100000027454_100011218427 [0,0,0,0,0,1|2,1,0]=4 1753 B14R1.420 CC(O)CSCC(=O)c1ccncc1 62a_100011218427_100000027454 [0,0,0,0,0,1|2,1,0]=4 1754 B14R1.420 CC(O)CSCS(=O)c1ccccc1 62a_100011218427_100000031784 [0,0,0,0,0,1|2,1,0]=4 1755 B14R1.420 CC(OCC[C@@H](C)N)c1ccccc1 34a_100000706166_100000211855 [0,0,0,0,0,1|2,0,1]=4 1756 B14R1.420 CN(C)CCCC(=O)c1ccccc1 1458a_100000185807_100000695564 [0,0,0,0,0,1|2,0,0]=3 1757 B14R1.420 CN(C)CCCC(=O)c1ccccc1 2230a_100102631434_100000211006 [0,0,0,0,0,1|2,0,0]=3 1758 B14R1.420 CN(C)CCCC(=O)c1ccccc1 269982a_100102631434_100000211006 [0,0,0,0,0,1|2,0,0]=3 1759 B14R1.420 CN(C)CCNC(=O)c1ccccc1 240690a_100000210585_100000185807 [0,0,0,0,0,1|2,0,0]=3 1760 B14R1.420 CN(C)CCNC(=O)c1ccccc1 269982a_100102631434_200011215302 [0,0,0,0,0,1|2,0,0]=3 1761 B14R1.420 CN(C)CCNC(=O)c1ccccc1 527a_100000210585_100000185807 [0,0,0,0,0,1|2,0,0]=3 1762 B14R1.420 CN(C)CCOC(=O)c1ccccc1 269982a_100102631434_100009812718 [0,0,0,0,0,1|1,0,0]=2 1763 B14R1.420 C[C@@H](Cl)COCC(=O)c1ccccn1 34a_100016084084_100000027445 [0,0,0,0,0,1|2,0,0]=3 1764 B14R1.420 C[C@@H](Cl)COCC(O)c1ccccc1 34a_100016084084_100000185958 [0,0,0,0,0,1|1,0,2]=4 1765 B14R1.420 C[C@@H](Cl)COC[C@@H](O)c1ccccc1 34a_100016084084_100011933945 [0,0,0,0,0,1|1,0,2]=4 1766 B14R1.420 C[C@@H](N)COCC(=O)c1ccccn1 34a_100000737577_100000027445 [0,0,0,0,0,1|2,0,0]=3 1767 B14R1.420 C[C@@H](N)COCC(O)c1ccccc1 34a_100000737577_100000185958 [0,0,0,0,0,1|1,0,2]=4 1768 B14R1.420 C[C@@H](N)COC[C@@H](O)c1ccccc1 34a_100000737577_100011933945 [0,0,0,0,0,1|1,0,2]=4 1769 B14R1.420 C[C@@H](O)COC[C@@H](N)c1ccccc1 34a_100000751927_100009817552 [0,0,0,0,0,1|2,0,1]=4 1770 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100000211460_100009817552 [0,0,0,0,0,1|1,1,0]=3 1771 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100009817552_100000211460 [0,0,0,0,0,1|1,1,0]=3 1772 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccn1 62a_100000027445_100009817552 [0,0,0,0,0,1|2,1,0]=4 1773 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccn1 62a_100009817552_100000027445 [0,0,0,0,0,1|2,1,0]=4 1774 B14R1.420 C[C@@H](O)CSCC(=O)c1cccnc1 62a_100000757877_100009817552 [0,0,0,0,0,1|2,1,0]=4 1775 B14R1.420 C[C@@H](O)CSCC(=O)c1cccnc1 62a_100009817552_100000757877 [0,0,0,0,0,1|2,1,0]=4 1776 B14R1.420 C[C@@H](O)CSCC(=O)c1ccncc1 62a_100000027454_100009817552 [0,0,0,0,0,1|2,1,0]=4 1777 B14R1.420 C[C@@H](O)CSCC(=O)c1ccncc1 62a_100009817552_100000027454 [0,0,0,0,0,1|2,1,0]=4 1778 B14R1.420 C[C@@H](O)CSCS(=O)c1ccccc1 62a_100009817552_100000031784 [0,0,0,0,0,1|2,1,0]=4 1779 B14R1.420 C[C@@H](OCCN(C)C)c1ccccc1 7a_100000761318_100000755713 [0,0,0,0,0,1|2,0,1]=4 1780 B14R1.420 O=C(COCC(F)F)c1ccccn1 34a_100000743014_100000027445 [0,0,0,0,0,1|3,0,0]=4 1781 B14R1.420 O=C(CSCC(F)F)c1ccccc1 62a_100000211460_100011934356 [0,0,0,0,0,1|2,1,0]=4 1782 B14R1.420 O=C(CSCC(F)F)c1ccccc1 62a_100011934356_100000211460 [0,0,0,0,0,1|2,1,0]=4 1783 B14R1.420 [13CH3]C(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200025704644 [0,0,0,0,0,1|2,0,1]=4 1784 B14R1.423 C/C(=C\c1ccccc1)/COC(C)C 34a_200025717232_100000210206 [0,0,0,0,0,1|3,0,0]=4 1785 B14R1.423 C/C(=C\c1ccccc1)/COC(C)C 7a_200025717232_100000210206 [0,0,0,0,0,1|3,0,0]=4 1786 B14R1.423 C=C(C)CCC(=O)Cc1ccccc1 1458a_200000688413_100015291786 [0,0,0,0,0,1|1,0,2]=4 1787 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 11a_100000106764_200000688413 [0,0,0,0,0,1|1,0,2]=4 1788 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 1626a_100000106764_200000688413 [0,0,0,0,0,1|1,0,2]=4 1789 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 22a_100000106764_200000688413 [0,0,0,0,0,1|1,0,2]=4 1790 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 527a_100000106764_200000688413 [0,0,0,0,0,1|1,0,2]=4 1791 B14R1.423 C=C(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100000765925 [0,0,0,0,0,1|1,0,2]=4 1792 B14R1.423 CC(=CCC(=O)Cc1ccccc1)C 1458a_100011220947_100015291786 [0,0,0,0,0,1|1,0,2]=4 1793 B14R1.423 CC(=CCC(=O)Nc1ccccc1)C 11a_100000106764_100011220947 [0,0,0,0,0,1|1,0,2]=4 1794 B14R1.423 CC(=CCC(=O)Nc1ccccc1)C 1626a_100000106764_100011220947 [0,0,0,0,0,1|1,0,2]=4 1795 B14R1.423 CC(=CCC(=O)Nc1ccccc1)C 22a_100000106764_100011220947 [0,0,0,0,0,1|1,0,2]=4 1796 B14R1.423 CC(=CCC(=O)Nc1ccccc1)C 527a_100000106764_100011220947 [0,0,0,0,0,1|1,0,2]=4 1797 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000070787_100000242058 [0,0,0,0,0,1|2,0,1]=4 1798 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200000210301 [0,0,0,0,0,1|2,0,1]=4 1799 B14R1.423 CC(=O)CCC(=O)Oc1ccccc1 1458a_100000070787_200000035796 [0,0,0,0,0,1|2,0,1]=4 1800 B14R1.423 CC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200000210301 [0,0,0,0,0,1|2,0,1]=4 1801 B14R1.423 CC(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_200000210301 [0,0,0,0,0,1|2,0,1]=4 1802 B14R1.423 CC(Br)COC(C)Cc1ccccc1 34a_100012180447_200011218536 [0,0,0,0,0,1|2,0,1]=4 1803 B14R1.423 CC(C)C=CC(=O)Cc1ccccc1 1458a_100016268746_100015291786 [0,0,0,0,0,1|1,0,1]=3 1804 B14R1.423 CC(C)C=CC(=O)Cc1ccccn1 1458a_100016268746_100000721315 [0,0,0,0,0,1|2,0,1]=4 1805 B14R1.423 CC(C)C=CC(=O)Cc1cccnc1 1458a_100016268746_100000733263 [0,0,0,0,0,1|2,0,1]=4 1806 B14R1.423 CC(C)C=CC(=O)Cc1ccncc1 1458a_100016268746_100000705612 [0,0,0,0,0,1|2,0,1]=4 1807 B14R1.423 CC(C)C=CC(=O)Nc1ccccc1 11a_100000106764_100016268746 [0,0,0,0,0,1|1,0,1]=3 1808 B14R1.423 CC(C)C=CC(=O)Nc1ccccc1 1626a_100000106764_100016268746 [0,0,0,0,0,1|1,0,1]=3 1809 B14R1.423 CC(C)C=CC(=O)Nc1ccccc1 22a_100000106764_100016268746 [0,0,0,0,0,1|1,0,1]=3 1810 B14R1.423 CC(C)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210312 [0,0,0,0,0,1|2,0,0]=3 1811 B14R1.423 CC(C)CCC(=O)Cc1ccccc1 1458a_100000181311_100015291786 [0,0,0,0,0,1|1,0,0]=2 1812 B14R1.423 CC(C)CCC(=O)Cc1ccccn1 1458a_100000181311_100000721315 [0,0,0,0,0,1|2,0,0]=3 1813 B14R1.423 CC(C)CCC(=O)Cc1ccccn1 1458a_100000233486_100000210312 [0,0,0,0,0,1|2,0,0]=3 1814 B14R1.423 CC(C)CCC(=O)Cc1cccnc1 1458a_100000181311_100000733263 [0,0,0,0,0,1|2,0,0]=3 1815 B14R1.423 CC(C)CCC(=O)Cc1cccnc1 1458a_100000737805_100000210312 [0,0,0,0,0,1|2,0,0]=3 1816 B14R1.423 CC(C)CCC(=O)Cc1cccnn1 1458a_100000181311_100016990269 [0,0,0,0,0,1|3,0,0]=4 1817 B14R1.423 CC(C)CCC(=O)Cc1ccncc1 1458a_100000181311_100000705612 [0,0,0,0,0,1|2,0,0]=3 1818 B14R1.423 CC(C)CCC(=O)Cc1cnccn1 1458a_100000181311_100016995436 [0,0,0,0,0,1|3,0,0]=4 1819 B14R1.423 CC(C)CCC(=O)Cc1cncnc1 1458a_100000181311_100015196519 [0,0,0,0,0,1|3,0,0]=4 1820 B14R1.423 CC(C)CCC(=O)Cc1cncnc1 1458a_100000721575_100000210312 [0,0,0,0,0,1|3,0,0]=4 1821 B14R1.423 CC(C)CCC(=O)Cc1ncccn1 1458a_100000181311_100000703007 [0,0,0,0,0,1|3,0,0]=4 1822 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000181311 [0,0,0,0,0,1|1,0,0]=2 1823 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100000181311 [0,0,0,0,0,1|1,0,0]=2 1824 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000181311 [0,0,0,0,0,1|1,0,0]=2 1825 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000181311 [0,0,0,0,0,1|1,0,0]=2 1826 B14R1.423 CC(C)CCC(C)Nc1ccccc1 34a_100000106764_100011261404 [0,0,0,0,0,1|2,0,1]=4 1827 B14R1.423 CC(C)CCC(C)Oc1ccccc1 34a_100000210340_100011261404 [0,0,0,0,0,1|2,0,1]=4 1828 B14R1.423 CC(C)CCC(C)Sc1ccccc1 62a_100000719477_100011261404 [0,0,0,0,0,1|2,0,1]=4 1829 B14R1.423 CC(C)CCC(C)Sc1ccccc1 62a_100011261404_100000041952 [0,0,0,0,0,1|2,0,1]=4 1830 B14R1.423 CC(C)CCN(C)Cc1ccccc1 2230a_100000186898_100000210312 [0,0,0,0,0,1|3,0,0]=4 1831 B14R1.423 CC(C)CCN(C)Cc1ccccc1 2230a_100000742789_100015291786 [0,0,0,0,0,1|3,0,0]=4 1832 B14R1.423 CC(C)CCN(C)Cc1ccccc1 269982a_100000186898_100000210312 [0,0,0,0,0,1|3,0,0]=4 1833 B14R1.423 CC(C)CCN(C)Cc1ccccc1 269982a_100000742789_100000211182 [0,0,0,0,0,1|3,0,0]=4 1834 B14R1.423 CC(C)CCN(C)Cc1ccccc1 270004a_100000742789_100015611070 [0,0,0,0,0,1|3,0,0]=4 1835 B14R1.423 CC(C)CNC(=O)C[n+]1ccccc1 11a_100000210953_200000086051 [0,0,0,0,0,1|2,0,0]=3 1836 B14R1.423 CC(C)CNC(=O)C[n+]1ccccc1 240690a_100000210953_200000086051 [0,0,0,0,0,1|2,0,0]=3 1837 B14R1.423 CC(C)CNC(=O)C[n+]1ccccc1 527a_100000210953_200000086051 [0,0,0,0,0,1|2,0,0]=3 1838 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 11a_100000210953_100000233486 [0,0,0,0,0,1|2,0,0]=3 1839 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 11a_100000210953_100000737805 [0,0,0,0,0,1|2,0,0]=3 1840 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 240690a_100000210953_100000737805 [0,0,0,0,0,1|2,0,0]=3 1841 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 527a_100000210953_100000737805 [0,0,0,0,0,1|2,0,0]=3 1842 B14R1.423 CC(C)CNC(=O)Cc1ccncc1 11a_100000210953_100011201483 [0,0,0,0,0,1|2,0,0]=3 1843 B14R1.423 CC(C)CNC(=O)Cc1ccncc1 240690a_100000210953_100011201483 [0,0,0,0,0,1|2,0,0]=3 1844 B14R1.423 CC(C)CNC(=O)Cc1cnccn1 11a_100000210953_100000726051 [0,0,0,0,0,1|3,0,0]=4 1845 B14R1.423 CC(C)CNC(=O)Cc1cnccn1 240690a_100000210953_100000726051 [0,0,0,0,0,1|3,0,0]=4 1846 B14R1.423 CC(C)CNC(=O)Cc1cnccn1 527a_100000210953_100000726051 [0,0,0,0,0,1|3,0,0]=4 1847 B14R1.423 CC(C)CNC(=O)Cc1cncnc1 11a_100000210953_100000721575 [0,0,0,0,0,1|3,0,0]=4 1848 B14R1.423 CC(C)CNC(=O)Cc1cncnc1 240690a_100000210953_100000721575 [0,0,0,0,0,1|3,0,0]=4 1849 B14R1.423 CC(C)CNC(=O)Cc1cncnc1 527a_100000210953_100000721575 [0,0,0,0,0,1|3,0,0]=4 1850 B14R1.423 CC(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100000210953 [0,0,0,0,0,1|1,0,0]=2 1851 B14R1.423 CC(C)CNC(C)Cc1ccccc1 34a_100000210953_200011218536 [0,0,0,0,0,1|2,0,1]=4 1852 B14R1.423 CC(C)COC(C)Cc1ccccc1 34a_100000210257_200011218536 [0,0,0,0,0,1|1,0,1]=3 1853 B14R1.423 CC(C)COC(C)Cc1ccccc1 34a_100000748627_100000210624 [0,0,0,0,0,1|1,0,1]=3 1854 B14R1.423 CC(C)COC(C)Cc1ccccc1 7a_100000748627_100000210760 [0,0,0,0,0,1|1,0,1]=3 1855 B14R1.423 CC(C)CSC(C)Cc1ccccc1 62a_100000210624_200011218536 [0,0,0,0,0,1|1,1,1]=4 1856 B14R1.423 CC(C)CSC(C)Cc1ccccc1 62a_200011218536_100000210760 [0,0,0,0,0,1|1,1,1]=4 1857 B14R1.423 CC(C)NCC(=O)Cc1ccccc1 2230a_100138425928_100000233483 [0,0,0,0,0,1|2,0,0]=3 1858 B14R1.423 CC(C)NCC(=O)Nc1ccccc1 2230a_100138425928_100000182850 [0,0,0,0,0,1|2,0,0]=3 1859 B14R1.423 CC(C)NCC(=O)Nc1ccccc1 34a_100138425928_100000182850 [0,0,0,0,0,1|2,0,0]=3 1860 B14R1.423 CC(C)NCC(=O)Nc1ccccn1 2230a_100138425928_100020662008 [0,0,0,0,0,1|3,0,0]=4 1861 B14R1.423 CC(C)NCC(=O)Nc1ccncc1 2230a_100138425928_100000754145 [0,0,0,0,0,1|3,0,0]=4 1862 B14R1.423 CC(C)NCC(=O)Oc1ccccc1 2230a_100138425928_100009813826 [0,0,0,0,0,1|2,0,0]=3 1863 B14R1.423 CC(C)NCC(=O)Oc1ccccc1 34a_100138425928_100009813826 [0,0,0,0,0,1|2,0,0]=3 1864 B14R1.423 CC(C)NNC(=O)C[n+]1ccccc1 22a_100000741168_200000086051 [0,0,0,0,0,1|3,0,0]=4 1865 B14R1.423 CC(C)NNC(=O)Cc1ccccn1 22a_100000741168_100000233486 [0,0,0,0,0,1|3,0,0]=4 1866 B14R1.423 CC(C)NNC(=O)Cc1cccnc1 22a_100000741168_100000737805 [0,0,0,0,0,1|3,0,0]=4 1867 B14R1.423 CC(C)NNC(=O)Cc1ccncc1 22a_100000741168_100011201483 [0,0,0,0,0,1|3,0,0]=4 1868 B14R1.423 CC(C)OCC(=O)Cc1ccccc1 1458a_100000745533_100015291786 [0,0,0,0,0,1|2,0,0]=3 1869 B14R1.423 CC(C)OCC(=O)Cc1ccccn1 1458a_100000745533_100000721315 [0,0,0,0,0,1|3,0,0]=4 1870 B14R1.423 CC(C)OCC(=O)Cc1cccnc1 1458a_100000745533_100000733263 [0,0,0,0,0,1|3,0,0]=4 1871 B14R1.423 CC(C)OCC(=O)Cc1ccncc1 1458a_100000745533_100000705612 [0,0,0,0,0,1|3,0,0]=4 1872 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 11a_100000106764_100000745533 [0,0,0,0,0,1|2,0,0]=3 1873 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 1626a_100000106764_100000745533 [0,0,0,0,0,1|2,0,0]=3 1874 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 22a_100000106764_100000745533 [0,0,0,0,0,1|2,0,0]=3 1875 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 34a_100000212225_100000182850 [0,0,0,0,0,1|2,0,0]=3 1876 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100000210206 [0,0,0,0,0,1|2,0,0]=3 1877 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 527a_100000106764_100000745533 [0,0,0,0,0,1|2,0,0]=3 1878 B14R1.423 CC(C)OCC(=O)Oc1ccccc1 34a_100000212225_100009813826 [0,0,0,0,0,1|2,0,0]=3 1879 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 1458a_100000241585_100015291786 [0,0,0,0,0,1|2,0,0]=3 1880 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 62a_100000210206_100000233483 [0,0,0,0,0,1|2,0,0]=3 1881 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000210206 [0,0,0,0,0,1|2,0,0]=3 1882 B14R1.423 CC(C)SCC(=O)Cc1ccccn1 1458a_100000241585_100000721315 [0,0,0,0,0,1|3,0,0]=4 1883 B14R1.423 CC(C)SCC(=O)Cc1cccnc1 1458a_100000241585_100000733263 [0,0,0,0,0,1|3,0,0]=4 1884 B14R1.423 CC(C)SCC(=O)Cc1ccncc1 1458a_100000241585_100000705612 [0,0,0,0,0,1|3,0,0]=4 1885 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 11a_100000106764_100000241585 [0,0,0,0,0,1|2,0,0]=3 1886 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 1626a_100000106764_100000241585 [0,0,0,0,0,1|2,0,0]=3 1887 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 22a_100000106764_100000241585 [0,0,0,0,0,1|2,0,0]=3 1888 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 527a_100000106764_100000241585 [0,0,0,0,0,1|2,0,0]=3 1889 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 62a_100000210206_100000182850 [0,0,0,0,0,1|2,0,0]=3 1890 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000210206 [0,0,0,0,0,1|2,0,0]=3 1891 B14R1.423 CC(C)SCC(=O)Nc1ccccn1 62a_100000210206_100020662008 [0,0,0,0,0,1|3,0,0]=4 1892 B14R1.423 CC(C)SCC(=O)Nc1ccccn1 62a_100020662008_100000210206 [0,0,0,0,0,1|3,0,0]=4 1893 B14R1.423 CC(C)SCC(=O)Nc1ccncc1 62a_100000210206_100000754145 [0,0,0,0,0,1|3,0,0]=4 1894 B14R1.423 CC(C)SCC(=O)Oc1ccccc1 62a_100000210206_100009813826 [0,0,0,0,0,1|2,0,0]=3 1895 B14R1.423 CC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000210206 [0,0,0,0,0,1|2,0,0]=3 1896 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)Cl 34a_100016084084_200011218536 [0,0,0,0,0,1|2,0,1]=4 1897 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)N 34a_100000737577_200011218536 [0,0,0,0,0,1|2,0,1]=4 1898 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)O 34a_100000748627_100009817552 [0,0,0,0,0,1|2,0,1]=4 1899 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)O 7a_100000748627_100009817552 [0,0,0,0,0,1|2,0,1]=4 1900 B14R1.423 CC(F)COC(C)Cc1ccccc1 34a_100015925927_200011218536 [0,0,0,0,0,1|2,0,1]=4 1901 B14R1.423 CC(O)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100012276601 [0,0,0,0,0,1|3,0,0]=4 1902 B14R1.423 CC(O)CCC(=O)Cc1ccccn1 1458a_100000233486_100012276601 [0,0,0,0,0,1|3,0,0]=4 1903 B14R1.423 CC(O)CCC(=O)Cc1cccnc1 1458a_100000737805_100012276601 [0,0,0,0,0,1|3,0,0]=4 1904 B14R1.423 CC(O)CCC(=O)Nc1ccccc1 1626a_100000106764_100000718519 [0,0,0,0,0,1|2,0,0]=3 1905 B14R1.423 CC(O)CNC(=O)C[n+]1ccccc1 11a_100000210904_200000086051 [0,0,0,0,0,1|3,0,0]=4 1906 B14R1.423 CC(O)CNC(=O)C[n+]1ccccc1 240690a_100000210904_200000086051 [0,0,0,0,0,1|3,0,0]=4 1907 B14R1.423 CC(O)CNC(=O)C[n+]1ccccc1 527a_100000210904_200000086051 [0,0,0,0,0,1|3,0,0]=4 1908 B14R1.423 CC(O)CNC(=O)Cc1ccccn1 11a_100000210904_100000233486 [0,0,0,0,0,1|3,0,0]=4 1909 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 11a_100000210904_100000737805 [0,0,0,0,0,1|3,0,0]=4 1910 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 240690a_100000210904_100000737805 [0,0,0,0,0,1|3,0,0]=4 1911 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 527a_100000210904_100000737805 [0,0,0,0,0,1|3,0,0]=4 1912 B14R1.423 CC(O)CNC(=O)Cc1ccncc1 11a_100000210904_100011201483 [0,0,0,0,0,1|3,0,0]=4 1913 B14R1.423 CC(O)CNC(=O)Cc1ccncc1 240690a_100000210904_100011201483 [0,0,0,0,0,1|3,0,0]=4 1914 B14R1.423 CC(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100000210904 [0,0,0,0,0,1|2,0,0]=3 1915 B14R1.423 CC(O)COC(C)Cc1ccccc1 34a_100000748627_100011218427 [0,0,0,0,0,1|2,0,1]=4 1916 B14R1.423 CC(O)COC(C)Cc1ccccc1 7a_100000748627_100011218427 [0,0,0,0,0,1|2,0,1]=4 1917 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000689311 [0,0,0,0,0,1|2,0,0]=3 1918 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 2230a_100102631434_100000242058 [0,0,0,0,0,1|2,0,0]=3 1919 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000689311 [0,0,0,0,0,1|2,0,0]=3 1920 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 269982a_100102631434_100000242058 [0,0,0,0,0,1|2,0,0]=3 1921 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000689311 [0,0,0,0,0,1|2,0,0]=3 1922 B14R1.423 CN(C)CCC(=O)Nc1cccnc1 2230a_100102631434_200015187043 [0,0,0,0,0,1|3,0,0]=4 1923 B14R1.423 CN(C)CCC(=O)Nc1cccnc1 269982a_100102631434_200015187043 [0,0,0,0,0,1|3,0,0]=4 1924 B14R1.423 CN(C)CCC(=O)Oc1ccccc1 2230a_100102631434_200000035796 [0,0,0,0,0,1|2,0,0]=3 1925 B14R1.423 CN(C)CCC(=O)Oc1ccccc1 269982a_100102631434_200000035796 [0,0,0,0,0,1|2,0,0]=3 1926 B14R1.423 C[S+](C)CCC(=O)Cc1ccccc1 1458a_100009452791_100015291786 [0,0,0,0,0,1|2,0,0]=3 1927 B14R1.423 C[S+](C)CCC(=O)Cc1ccccn1 1458a_100009452791_100000721315 [0,0,0,0,0,1|3,0,0]=4 1928 B14R1.423 C[S+](C)CCC(=O)Cc1cccnc1 1458a_100009452791_100000733263 [0,0,0,0,0,1|3,0,0]=4 1929 B14R1.423 C[S+](C)CCC(=O)Cc1ccncc1 1458a_100009452791_100000705612 [0,0,0,0,0,1|3,0,0]=4 1930 B14R1.423 C[S+](C)CCC(=O)Nc1ccccc1 11a_100000106764_100009452791 [0,0,0,0,0,1|2,0,0]=3 1931 B14R1.423 C[S+](C)CCC(=O)Nc1ccccc1 1626a_100000106764_100009452791 [0,0,0,0,0,1|2,0,0]=3 1932 B14R1.423 C[S+](C)CCC(=O)Nc1ccccc1 22a_100000106764_100009452791 [0,0,0,0,0,1|2,0,0]=3 1933 B14R1.423 O=C(NCC(F)F)Nc1ccccc1 2430a_100000106764_100000765723 [0,0,0,0,0,1|3,0,0]=4 1934 B14R1.423 [13CH3]C(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200025704644 [0,0,0,0,0,1|2,0,1]=4 1935 B14R1.423 [13CH3]C(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200025704644 [0,0,0,0,0,1|2,0,1]=4 1936 B14R1.423 [13CH3]C(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_200025704644 [0,0,0,0,0,1|2,0,1]=4 1937 B11R0.46 C/C=C/C=CC(=O)CCC(C)C 1458a_100000185730_100000210312 [1,0,1,0,0,0|1,0,1]=4 1938 B11R0.46 C/C=C/C=CC(=O)NCC(C)C 11a_100000210953_100000185730 [1,0,1,0,0,0|1,0,1]=4 1939 B11R0.46 C/C=C/C=CC(=O)NCC(C)C 1626a_100000210953_100000185730 [1,0,1,0,0,0|1,0,1]=4 1940 B11R0.46 C/C=C/C=CC(=O)NCC(C)C 240690a_100000210953_100000185730 [1,0,1,0,0,0|1,0,1]=4 1941 B11R1.16 C#CCC(=O)c1ccccc1 1458a_100000185807_100000184674 [2,0,0,0,0,0|0,0,2]=4 1942 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [2,0,0,0,0,0|0,0,2]=4 1943 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [2,0,0,0,0,0|0,0,0]=2 1944 B11R1.16 CCCN(C)c1ccccc1 2230a_100000210012_100000210303 [2,0,0,0,0,0|2,0,0]=4 1945 B11R1.16 CCCN(C)c1ccccc1 2230a_200011218496_200000210301 [2,0,0,0,0,0|2,0,0]=4 1946 B11R1.16 CCCN(C)c1ccccc1 269982a_100000210012_100000210303 [2,0,0,0,0,0|2,0,0]=4 1947 B11R1.16 CCCN(C)c1ccccc1 269982a_200011218496_200000210301 [2,0,0,0,0,0|2,0,0]=4 1948 B11R1.16 CCCN(C)c1ccccc1 34a_100000210012_100000210303 [2,0,0,0,0,0|2,0,0]=4 1949 B11R1.16 CCCN(C)c1ccccc1 34a_200011218496_200000210301 [2,0,0,0,0,0|2,0,0]=4 1950 B11R1.16 CCCN([13CH3])c1ccccc1 2230a_200011218496_200025704644 [2,0,0,0,0,0|2,0,0]=4 1951 B11R1.16 CCCN([13CH3])c1ccccc1 269982a_200011218496_200025704644 [2,0,0,0,0,0|2,0,0]=4 1952 B11R1.16 CCCN([13CH3])c1ccccc1 34a_200011218496_200025704644 [2,0,0,0,0,0|2,0,0]=4 1953 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [2,0,0,0,0,0|1,0,0]=3 1954 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [2,0,0,0,0,0|1,0,0]=3 1955 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [2,0,0,0,0,0|1,0,0]=3 1956 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [2,0,0,0,0,0|1,0,1]=4 1957 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [2,0,0,0,0,0|1,0,1]=4 1958 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [2,0,0,0,0,0|1,0,1]=4 1959 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [2,0,0,0,0,0|1,0,0]=3 1960 B11R1.16 CNCC(=O)c1ccccn1 34a_100102657272_100000027445 [2,0,0,0,0,0|2,0,0]=4 1961 B11R1.16 CNCC(=O)c1ccccn1 7a_106832991635_100000027445 [2,0,0,0,0,0|2,0,0]=4 1962 B11R1.16 CNCC(=O)c1ccncc1 7a_106832991635_100015248511 [2,0,0,0,0,0|2,0,0]=4 1963 B11R1.16 CNNC(=O)c1ccccc1 22a_100016993582_100000185807 [2,0,0,0,0,0|2,0,0]=4 1964 B11R1.16 COCC(=O)c1ccccn1 34a_100138415774_100000027445 [2,0,0,0,0,0|2,0,0]=4 1965 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [2,0,0,0,0,0|1,0,0]=3 1966 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [2,0,0,0,0,0|1,0,0]=3 1967 B11R1.16 CSCC(=O)c1ccccn1 62a_100000027445_200000210301 [2,0,0,0,0,0|2,0,0]=4 1968 B11R1.16 CSCC(=O)c1ccccn1 62a_200000210301_100000027445 [2,0,0,0,0,0|2,0,0]=4 1969 B11R1.16 CSCC(=O)c1cccnc1 62a_100000757877_200000210301 [2,0,0,0,0,0|2,0,0]=4 1970 B11R1.16 CSCC(=O)c1cccnc1 62a_200000210301_100000757877 [2,0,0,0,0,0|2,0,0]=4 1971 B11R1.16 CSCC(=O)c1ccncc1 62a_100000027454_200000210301 [2,0,0,0,0,0|2,0,0]=4 1972 B11R1.16 CSCC(=O)c1ccncc1 62a_200000210301_100000027454 [2,0,0,0,0,0|2,0,0]=4 1973 B11R1.16 CSCS(=O)c1ccccc1 62a_200000210301_100000031784 [2,0,0,0,0,0|2,0,0]=4 1974 B11R1.16 N#CCC(=O)c1ccccc1 1458a_100000185807_100011214920 [2,0,0,0,0,0|1,0,1]=4 1975 B11R1.16 O=C(CCF)c1ccccc1 1458a_100000185807_100011217306 [2,0,0,0,0,0|1,0,0]=3 1976 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [2,0,0,0,0,0|1,0,0]=3 1977 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [2,0,0,0,0,0|1,0,0]=3 1978 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [2,0,0,0,0,0|1,0,0]=3 1979 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_100000027445_200025704644 [2,0,0,0,0,0|2,0,0]=4 1980 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_200025704644_100000027445 [2,0,0,0,0,0|2,0,0]=4 1981 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_100000757877_200025704644 [2,0,0,0,0,0|2,0,0]=4 1982 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_200025704644_100000757877 [2,0,0,0,0,0|2,0,0]=4 1983 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_100000027454_200025704644 [2,0,0,0,0,0|2,0,0]=4 1984 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_200025704644_100000027454 [2,0,0,0,0,0|2,0,0]=4 1985 B11R1.16 [13CH3]SCS(=O)c1ccccc1 62a_200025704644_100000031784 [2,0,0,0,0,0|2,0,0]=4 1986 B11R1.28 BrCCOCc1ccccc1 34a_100000211926_100015291786 [2,0,0,0,0,0|1,0,1]=4 1987 B11R1.28 CCCC=Cc1ccccc1 271570a_100016258520_100000210277 [2,0,0,0,0,0|1,0,0]=3 1988 B11R1.28 CCCC=Cc1ccccn1 271570a_100016258520_100011216584 [2,0,0,0,0,0|2,0,0]=4 1989 B11R1.28 CCCC=Cc1cccnc1 271570a_100016258520_100000752921 [2,0,0,0,0,0|2,0,0]=4 1990 B11R1.28 CCCC=Cc1ccncc1 271570a_100016258520_100000035832 [2,0,0,0,0,0|2,0,0]=4 1991 B11R1.28 CCCCNc1ccccc1 34a_100000106764_100000210210 [2,0,0,0,0,0|2,0,0]=4 1992 B11R1.28 CCCCOc1ccccc1 34a_100000210340_100000210210 [2,0,0,0,0,0|2,0,0]=4 1993 B11R1.28 CCCCOc1ccccc1 7a_100000210340_100000210211 [2,0,0,0,0,0|2,0,0]=4 1994 B11R1.28 CCCCSc1ccccc1 62a_100000210211_100000041952 [2,0,0,0,0,0|2,0,0]=4 1995 B11R1.28 CCCCSc1ccccc1 62a_100000719477_100000210210 [2,0,0,0,0,0|2,0,0]=4 1996 B11R1.28 CCCNCc1ccccc1 207a_100020643023_100015611070 [2,0,0,0,0,0|1,0,1]=4 1997 B11R1.28 CCCNCc1ccccc1 2230a_100015324214_100000210303 [2,0,0,0,0,0|1,0,1]=4 1998 B11R1.28 CCCNCc1ccccc1 270004a_100020643023_100015611070 [2,0,0,0,0,0|1,0,1]=4 1999 B11R1.28 CCCNCc1ccccc1 34a_100015324214_100000210303 [2,0,0,0,0,0|1,0,1]=4 2000 B11R1.28 CCCOCc1ccccc1 34a_100000210258_100015291786 [2,0,0,0,0,0|0,0,1]=3 2001 B11R1.28 CCCOCc1ccccc1 34a_100000210790_100000210303 [2,0,0,0,0,0|0,0,1]=3 2002 B11R1.28 CCCOCc1ccccc1 7a_100000210790_100000210303 [2,0,0,0,0,0|0,0,1]=3 2003 B11R1.28 CCCOCc1ccccn1 34a_100000210258_100000721315 [2,0,0,0,0,0|1,0,1]=4 2004 B11R1.28 CCCOCc1cccnc1 34a_100000210258_100000733263 [2,0,0,0,0,0|1,0,1]=4 2005 B11R1.28 CCCSCc1ccccc1 62a_100000210303_100015291786 [2,0,0,0,0,0|0,1,1]=4 2006 B11R1.28 CCCSCc1ccccc1 62a_100000211182_100000210303 [2,0,0,0,0,0|0,1,1]=4 2007 B11R1.28 CCNN=Cc1ccccc1 4a_100000756455_100015611070 [2,0,0,0,0,0|2,0,0]=4 2008 B11R1.28 CCOC=Cc1ccccc1 271570a_100016256518_100000210277 [2,0,0,0,0,0|2,0,0]=4 2009 B11R1.28 CNC/C=C/c1ccccc1 2230a_100020603302_200000210301 [2,0,0,0,0,0|2,0,0]=4 2010 B11R1.28 CNC/C=C/c1ccccc1 2230a_106832991635_100016265936 [2,0,0,0,0,0|2,0,0]=4 2011 B11R1.28 CNC/C=C/c1ccccc1 34a_100020603302_200000210301 [2,0,0,0,0,0|2,0,0]=4 2012 B11R1.28 CNC/C=C/c1ccccc1 34a_100102657272_100016265936 [2,0,0,0,0,0|2,0,0]=4 2013 B11R1.28 CNC/C=C/c1ccccc1 7a_106832991635_100016265936 [2,0,0,0,0,0|2,0,0]=4 2014 B11R1.28 CNCC=Cc1ccccc1 270004a_106832991635_100000210105 [2,0,0,0,0,0|2,0,0]=4 2015 B11R1.28 CNCOCc1ccccc1 2230a_106832991635_100000763385 [2,0,0,0,0,0|1,0,1]=4 2016 B11R1.28 CNCOCc1ccccc1 34a_100102657272_100000763385 [2,0,0,0,0,0|1,0,1]=4 2017 B11R1.28 COC/C=C/c1ccccc1 34a_100000210256_200000210301 [2,0,0,0,0,0|2,0,0]=4 2018 B11R1.28 COC/C=C/c1ccccc1 34a_100138415774_100016265936 [2,0,0,0,0,0|2,0,0]=4 2019 B11R1.28 COCC=Cc1ccccc1 271570a_100016286323_100000210277 [2,0,0,0,0,0|2,0,0]=4 2020 B11R1.28 COCOCc1ccccc1 34a_100138415774_100000763385 [2,0,0,0,0,0|1,0,1]=4 2021 B11R1.28 CSC/C=C/c1ccccc1 62a_100016265936_200000210301 [2,0,0,0,0,0|2,0,0]=4 2022 B11R1.28 CSC/C=C/c1ccccc1 62a_200000210301_100016265936 [2,0,0,0,0,0|2,0,0]=4 2023 B11R1.28 CSCOCc1ccccc1 34a_100000210790_100011218213 [2,0,0,0,0,0|1,0,1]=4 2024 B11R1.28 CSCOCc1ccccc1 62a_100000763385_200000210301 [2,0,0,0,0,0|1,0,1]=4 2025 B11R1.28 CSCOCc1ccccc1 62a_200000210301_100000763385 [2,0,0,0,0,0|1,0,1]=4 2026 B11R1.28 FCCOCc1ccccc1 34a_100000210790_100011217306 [2,0,0,0,0,0|1,0,1]=4 2027 B11R1.28 FCCOCc1ccccc1 7a_100000210790_100011217306 [2,0,0,0,0,0|1,0,1]=4 2028 B11R1.28 NCCOCc1ccccc1 34a_100000210304_100015291786 [2,0,0,0,0,0|1,0,1]=4 2029 B11R1.28 OCCOCc1ccccc1 34a_100000210790_100000211926 [2,0,0,0,0,0|1,0,1]=4 2030 B11R1.28 OCCOCc1ccccc1 7a_100000210790_100000211926 [2,0,0,0,0,0|1,0,1]=4 2031 B11R1.28 [13CH3]NC/C=C/c1ccccc1 2230a_100020603302_200025704644 [2,0,0,0,0,0|2,0,0]=4 2032 B11R1.28 [13CH3]NC/C=C/c1ccccc1 34a_100020603302_200025704644 [2,0,0,0,0,0|2,0,0]=4 2033 B11R1.28 [13CH3]OC/C=C/c1ccccc1 34a_100000210256_200025704644 [2,0,0,0,0,0|2,0,0]=4 2034 B11R1.28 [13CH3]SC/C=C/c1ccccc1 62a_100016265936_200025704644 [2,0,0,0,0,0|2,0,0]=4 2035 B11R1.28 [13CH3]SC/C=C/c1ccccc1 62a_200025704644_100016265936 [2,0,0,0,0,0|2,0,0]=4 2036 B11R1.28 [13CH3]SCOCc1ccccc1 62a_100000763385_200025704644 [2,0,0,0,0,0|1,0,1]=4 2037 B11R1.28 [13CH3]SCOCc1ccccc1 62a_200025704644_100000763385 [2,0,0,0,0,0|1,0,1]=4 2038 B13R0.172 C=CC=CC(=O)CC(=O)NCC(C)C 1458a_100016291481_100000183291 [0,1,1,0,0,0|1,0,1]=4 2039 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747405 [1,1,0,0,0,0|1,0,1]=4 2040 B13R1.11 CCC(=O)CC(=O)c1ccccc1 1458a_100000210414_100000211460 [1,1,0,0,0,0|1,0,1]=4 2041 B13R1.11 CCC(C)CC(=O)c1ccccc1 1458a_100000185807_100000748023 [1,1,0,0,0,0|1,0,0]=3 2042 B13R1.11 CCC(C)NC(=O)c1ccccc1 11a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 2043 B13R1.11 CCC(C)NC(=O)c1ccccc1 1626a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 2044 B13R1.11 CCC(C)NC(=O)c1ccccc1 240690a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 2045 B13R1.11 CCC(C)NC(=O)c1ccccc1 527a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 2046 B13R1.11 CCC(C)OC(C)c1ccccc1 7a_100000210228_100000230085 [1,1,0,0,0,0|1,0,1]=4 2047 B13R1.11 CCC(C)O[C@H](C)c1ccccc1 34a_100000761318_100011215416 [1,1,0,0,0,0|1,0,1]=4 2048 B13R1.11 CCC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000758301 [1,1,0,0,0,0|1,0,1]=4 2049 B13R1.11 CCC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218378 [1,1,0,0,0,0|1,0,0]=3 2050 B13R1.11 CCN(C)CC(=O)c1ccccc1 269982a_100000225621_100000211460 [1,1,0,0,0,0|2,0,0]=4 2051 B13R1.11 CC[C@H](C)CC(=O)c1ccccc1 1458a_100000185807_100009816398 [1,1,0,0,0,0|1,0,0]=3 2052 B13R1.11 C[C@@H](CO)CC(=O)c1ccccc1 1458a_100000185807_100000059175 [1,1,0,0,0,0|2,0,0]=4 2053 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 11a_100102880703_100000185807 [1,1,0,0,0,0|2,0,0]=4 2054 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 1626a_100102880703_100000185807 [1,1,0,0,0,0|2,0,0]=4 2055 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 240690a_100102880703_100000185807 [1,1,0,0,0,0|2,0,0]=4 2056 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 527a_100102880703_100000185807 [1,1,0,0,0,0|2,0,0]=4 2057 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 240690a_100000737577_100000185807 [1,1,0,0,0,0|2,0,0]=4 2058 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 527a_100000737577_100000185807 [1,1,0,0,0,0|2,0,0]=4 2059 B13R1.17 CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210211 [1,1,0,0,0,0|1,0,0]=3 2060 B13R1.17 CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210211 [1,1,0,0,0,0|1,0,0]=3 2061 B13R1.17 CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210211 [1,1,0,0,0,0|1,0,0]=3 2062 B13R1.17 CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210211 [1,1,0,0,0,0|1,0,0]=3 2063 B13R1.17 CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210211 [1,1,0,0,0,0|1,0,0]=3 2064 B13R1.17 CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210211 [1,1,0,0,0,0|1,0,0]=3 2065 B13R1.17 CCCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011215321 [1,1,0,0,0,0|1,0,0]=3 2066 B13R1.17 CCCCS(=O)c1ccc(cc1)O 271570a_203496583355_100016336038 [1,1,0,0,0,0|2,0,0]=4 2067 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 11a_100020643023_100000185839 [1,1,0,0,0,0|1,0,0]=3 2068 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 1626a_100020643023_100000185839 [1,1,0,0,0,0|1,0,0]=3 2069 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 240690a_100020643023_100000185839 [1,1,0,0,0,0|1,0,0]=3 2070 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 527a_100020643023_100000185839 [1,1,0,0,0,0|1,0,0]=3 2071 B13R1.17 CCCNC(=O)c1ccc(cc1)C 11a_100020643023_100000188618 [1,1,0,0,0,0|1,0,0]=3 2072 B13R1.17 CCCNC(=O)c1ccc(cc1)C 1626a_100020643023_100000188618 [1,1,0,0,0,0|1,0,0]=3 2073 B13R1.17 CCCNC(=O)c1ccc(cc1)C 240690a_100020643023_100000188618 [1,1,0,0,0,0|1,0,0]=3 2074 B13R1.17 CCCNC(=O)c1ccc(cc1)C 527a_100020643023_100000188618 [1,1,0,0,0,0|1,0,0]=3 2075 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 11a_100020643023_100000210187 [1,1,0,0,0,0|1,0,0]=3 2076 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 1626a_100020643023_100000210187 [1,1,0,0,0,0|1,0,0]=3 2077 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 240690a_100020643023_100000210187 [1,1,0,0,0,0|1,0,0]=3 2078 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 527a_100020643023_100000210187 [1,1,0,0,0,0|1,0,0]=3 2079 B13R1.17 CCCNC(=O)c1ccc(cc1)F 11a_100020643023_100000187176 [1,1,0,0,0,0|1,0,0]=3 2080 B13R1.17 CCCNC(=O)c1ccc(cc1)F 1626a_100020643023_100000187176 [1,1,0,0,0,0|1,0,0]=3 2081 B13R1.17 CCCNC(=O)c1ccc(cc1)F 240690a_100020643023_100000187176 [1,1,0,0,0,0|1,0,0]=3 2082 B13R1.17 CCCNC(=O)c1ccc(cc1)F 527a_100020643023_100000187176 [1,1,0,0,0,0|1,0,0]=3 2083 B13R1.17 CCCNC(=O)c1ccc(cc1)I 11a_100020643023_100000187904 [1,1,0,0,0,0|1,0,0]=3 2084 B13R1.17 CCCNC(=O)c1ccc(cc1)I 1626a_100020643023_100000187904 [1,1,0,0,0,0|1,0,0]=3 2085 B13R1.17 CCCNC(=O)c1ccc(cc1)I 240690a_100020643023_100000187904 [1,1,0,0,0,0|1,0,0]=3 2086 B13R1.17 CCCNC(=O)c1ccc(cc1)I 527a_100020643023_100000187904 [1,1,0,0,0,0|1,0,0]=3 2087 B13R1.17 CCCNC(=O)c1ccc(cc1)O 240690a_100020643023_100000212099 [1,1,0,0,0,0|1,0,0]=3 2088 B13R1.17 CCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000152267 [1,1,0,0,0,0|1,0,0]=3 2089 B13R1.17 CCCNC(=O)c1ccc(cc1)O 527a_100020643023_100000212099 [1,1,0,0,0,0|1,0,0]=3 2090 B13R1.17 CCCNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781247 [1,1,0,0,0,0|2,0,0]=4 2091 B13R1.17 CCCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000161739 [1,1,0,0,0,0|2,0,0]=4 2092 B13R1.17 CCCOC(C)c1ccc(cc1)Br 34a_100000210258_100000755118 [1,1,0,0,0,0|1,0,1]=4 2093 B13R1.17 CCCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210303 [1,1,0,0,0,0|1,0,1]=4 2094 B13R1.17 CCCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210303 [1,1,0,0,0,0|1,0,1]=4 2095 B13R1.17 CCCOC(C)c1ccc(cc1)C 34a_100000210258_100011261388 [1,1,0,0,0,0|1,0,1]=4 2096 B13R1.17 CCCOC(C)c1ccc(cc1)F 34a_100000181323_100000210303 [1,1,0,0,0,0|1,0,1]=4 2097 B13R1.17 CCCOC(C)c1ccc(cc1)F 34a_100000210258_100000743420 [1,1,0,0,0,0|1,0,1]=4 2098 B13R1.17 CCCOC(C)c1ccc(cc1)F 7a_100000181323_100000210303 [1,1,0,0,0,0|1,0,1]=4 2099 B13R1.17 CCCOC(C)c1ccc(cc1)N 34a_100011216399_100000210303 [1,1,0,0,0,0|1,0,1]=4 2100 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210303 [1,1,0,0,0,0|1,0,1]=4 2101 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210303 [1,1,0,0,0,0|1,0,1]=4 2102 B13R1.17 CCCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210303 [1,1,0,0,0,0|1,0,1]=4 2103 B13R1.17 CCCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210303 [1,1,0,0,0,0|1,0,1]=4 2104 B13R1.17 CCNCC(=O)c1ccc(cc1)C 2230a_100015525214_100000211441 [1,1,0,0,0,0|2,0,0]=4 2105 B13R1.17 CCNNC(=O)c1ccc(cc1)Br 22a_100000756455_100000185839 [1,1,0,0,0,0|2,0,0]=4 2106 B13R1.17 CCNNC(=O)c1ccc(cc1)C 22a_100000756455_100000188618 [1,1,0,0,0,0|2,0,0]=4 2107 B13R1.17 CCNNC(=O)c1ccc(cc1)Cl 22a_100000756455_100000210187 [1,1,0,0,0,0|2,0,0]=4 2108 B13R1.17 CCNNC(=O)c1ccc(cc1)F 22a_100000756455_100000187176 [1,1,0,0,0,0|2,0,0]=4 2109 B13R1.17 CCNNC(=O)c1ccc(cc1)I 22a_100000756455_100000187904 [1,1,0,0,0,0|2,0,0]=4 2110 B13R1.17 CCNNC(=O)c1ccc(cc1)O 22a_100000756455_100000212099 [1,1,0,0,0,0|2,0,0]=4 2111 B13R1.17 CCOCC(=O)c1ccc(cc1)Br 34a_100121572206_100000188085 [1,1,0,0,0,0|2,0,0]=4 2112 B13R1.17 CCOCC(=O)c1ccc(cc1)C 34a_100121572206_100000211441 [1,1,0,0,0,0|2,0,0]=4 2113 B13R1.17 CCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210202 [1,1,0,0,0,0|2,0,0]=4 2114 B13R1.17 CCOCC(=O)c1ccc(cc1)I 34a_100121572206_100011216261 [1,1,0,0,0,0|2,0,0]=4 2115 B13R1.17 CCOCC(=O)c1ccc(cc1)O 34a_100121572206_100009814261 [1,1,0,0,0,0|2,0,0]=4 2116 B13R1.17 CCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210202 [1,1,0,0,0,0|2,0,0]=4 2117 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000210202_100000211441 [1,1,0,0,0,0|2,0,0]=4 2118 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210202 [1,1,0,0,0,0|2,0,0]=4 2119 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000210202_100000211071 [1,1,0,0,0,0|2,0,0]=4 2120 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210202 [1,1,0,0,0,0|2,0,0]=4 2121 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000210202_100000211279 [1,1,0,0,0,0|2,0,0]=4 2122 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210202 [1,1,0,0,0,0|2,0,0]=4 2123 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100000210202_100011216261 [1,1,0,0,0,0|2,0,0]=4 2124 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210202 [1,1,0,0,0,0|2,0,0]=4 2125 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100000210202_100009814261 [1,1,0,0,0,0|2,0,0]=4 2126 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210202 [1,1,0,0,0,0|2,0,0]=4 2127 B13R1.17 CNCCC(=O)c1ccc(cc1)Br 7a_106832991635_100011215963 [1,1,0,0,0,0|2,0,0]=4 2128 B13R1.17 CNCCC(=O)c1ccc(cc1)C 2230a_106832991635_100000701375 [1,1,0,0,0,0|2,0,0]=4 2129 B13R1.17 CNCCC(=O)c1ccc(cc1)C 7a_106832991635_100000701375 [1,1,0,0,0,0|2,0,0]=4 2130 B13R1.17 CNCCC(=O)c1ccc(cc1)Cl 7a_106832991635_100011216492 [1,1,0,0,0,0|2,0,0]=4 2131 B13R1.17 CNCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211231 [1,1,0,0,0,0|2,0,0]=4 2132 B13R1.17 CNCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211231 [1,1,0,0,0,0|2,0,0]=4 2133 B13R1.17 CNCCC(=O)c1ccc(cc1)O 2230a_106832991635_100009879949 [1,1,0,0,0,0|2,0,0]=4 2134 B13R1.17 CNCCC(=O)c1ccc(cc1)O 7a_106832991635_100009879949 [1,1,0,0,0,0|2,0,0]=4 2135 B13R1.17 COCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000233755 [1,1,0,0,0,0|2,0,0]=4 2136 B13R1.17 COCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000233755 [1,1,0,0,0,0|2,0,0]=4 2137 B13R1.17 COCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000233755 [1,1,0,0,0,0|2,0,0]=4 2138 B13R1.17 COCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000233755 [1,1,0,0,0,0|2,0,0]=4 2139 B13R1.17 COCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000233755 [1,1,0,0,0,0|2,0,0]=4 2140 B13R1.17 COCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000233755 [1,1,0,0,0,0|2,0,0]=4 2141 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000751147 [1,1,0,0,0,0|2,0,0]=4 2142 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_100011215963_200000210301 [1,1,0,0,0,0|2,0,0]=4 2143 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_200000210301_100011215963 [1,1,0,0,0,0|2,0,0]=4 2144 B13R1.17 CSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000751147 [1,1,0,0,0,0|2,0,0]=4 2145 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_100000701375_200000210301 [1,1,0,0,0,0|2,0,0]=4 2146 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_200000210301_100000701375 [1,1,0,0,0,0|2,0,0]=4 2147 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000751147 [1,1,0,0,0,0|2,0,0]=4 2148 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200000210301 [1,1,0,0,0,0|2,0,0]=4 2149 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_200000210301_100011216492 [1,1,0,0,0,0|2,0,0]=4 2150 B13R1.17 CSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000751147 [1,1,0,0,0,0|2,0,0]=4 2151 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_100000211231_200000210301 [1,1,0,0,0,0|2,0,0]=4 2152 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211231 [1,1,0,0,0,0|2,0,0]=4 2153 B13R1.17 CSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000751147 [1,1,0,0,0,0|2,0,0]=4 2154 B13R1.17 CSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000751147 [1,1,0,0,0,0|2,0,0]=4 2155 B13R1.17 CSCCC(=O)c1ccc(cc1)O 62a_200000210301_100009879949 [1,1,0,0,0,0|2,0,0]=4 2156 B13R1.17 Cc1ccc(cc1)C(=O)CCCF 1458a_100000188618_100011934791 [1,1,0,0,0,0|2,0,0]=4 2157 B13R1.17 Cc1ccc(cc1)C(=O)CCCO 1458a_100000188618_100011215043 [1,1,0,0,0,0|2,0,0]=4 2158 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_100000701375_200025704644 [1,1,0,0,0,0|2,0,0]=4 2159 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_200025704644_100000701375 [1,1,0,0,0,0|2,0,0]=4 2160 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000188618 [1,1,0,0,0,0|2,0,0]=4 2161 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000188618 [1,1,0,0,0,0|2,0,0]=4 2162 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000188618 [1,1,0,0,0,0|2,0,0]=4 2163 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000188618 [1,1,0,0,0,0|2,0,0]=4 2164 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000188618 [1,1,0,0,0,0|2,0,0]=4 2165 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000188618 [1,1,0,0,0,0|2,0,0]=4 2166 B13R1.17 O=C(CCCF)c1ccc(cc1)Br 1458a_100000185839_100011934791 [1,1,0,0,0,0|2,0,0]=4 2167 B13R1.17 O=C(CCCF)c1ccc(cc1)Cl 1458a_100000210187_100011934791 [1,1,0,0,0,0|2,0,0]=4 2168 B13R1.17 O=C(CCCF)c1ccc(cc1)F 1458a_100000187176_100011934791 [1,1,0,0,0,0|2,0,0]=4 2169 B13R1.17 O=C(CCCF)c1ccc(cc1)I 1458a_100000187904_100011934791 [1,1,0,0,0,0|2,0,0]=4 2170 B13R1.17 O=C(CCCF)c1ccc(cc1)O 1458a_100000212099_100011934791 [1,1,0,0,0,0|2,0,0]=4 2171 B13R1.17 O=C(CCCO)c1ccc(cc1)Br 1458a_100000185839_100011215043 [1,1,0,0,0,0|2,0,0]=4 2172 B13R1.17 O=C(CCCO)c1ccc(cc1)Cl 1458a_100000210187_100011215043 [1,1,0,0,0,0|2,0,0]=4 2173 B13R1.17 O=C(CCCO)c1ccc(cc1)F 1458a_100000187176_100011215043 [1,1,0,0,0,0|2,0,0]=4 2174 B13R1.17 O=C(CCCO)c1ccc(cc1)I 1458a_100000187904_100011215043 [1,1,0,0,0,0|2,0,0]=4 2175 B13R1.17 O=C(CCCO)c1ccc(cc1)O 1458a_100000212099_100011215043 [1,1,0,0,0,0|2,0,0]=4 2176 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 11a_100000724931_100000185839 [1,1,0,0,0,0|2,0,0]=4 2177 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 1626a_100000724931_100000185839 [1,1,0,0,0,0|2,0,0]=4 2178 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 240690a_100000724931_100000185839 [1,1,0,0,0,0|2,0,0]=4 2179 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 527a_100000724931_100000185839 [1,1,0,0,0,0|2,0,0]=4 2180 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 11a_100000724931_100000210187 [1,1,0,0,0,0|2,0,0]=4 2181 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 1626a_100000724931_100000210187 [1,1,0,0,0,0|2,0,0]=4 2182 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 240690a_100000724931_100000210187 [1,1,0,0,0,0|2,0,0]=4 2183 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 527a_100000724931_100000210187 [1,1,0,0,0,0|2,0,0]=4 2184 B13R1.17 O=C(NCCF)c1ccc(cc1)F 11a_100000724931_100000187176 [1,1,0,0,0,0|2,0,0]=4 2185 B13R1.17 O=C(NCCF)c1ccc(cc1)F 1626a_100000724931_100000187176 [1,1,0,0,0,0|2,0,0]=4 2186 B13R1.17 O=C(NCCF)c1ccc(cc1)F 240690a_100000724931_100000187176 [1,1,0,0,0,0|2,0,0]=4 2187 B13R1.17 O=C(NCCF)c1ccc(cc1)F 527a_100000724931_100000187176 [1,1,0,0,0,0|2,0,0]=4 2188 B13R1.17 O=C(NCCF)c1ccc(cc1)I 11a_100000724931_100000187904 [1,1,0,0,0,0|2,0,0]=4 2189 B13R1.17 O=C(NCCF)c1ccc(cc1)I 1626a_100000724931_100000187904 [1,1,0,0,0,0|2,0,0]=4 2190 B13R1.17 O=C(NCCF)c1ccc(cc1)I 240690a_100000724931_100000187904 [1,1,0,0,0,0|2,0,0]=4 2191 B13R1.17 O=C(NCCF)c1ccc(cc1)I 527a_100000724931_100000187904 [1,1,0,0,0,0|2,0,0]=4 2192 B13R1.17 O=C(NCCF)c1ccc(cc1)O 240690a_100000724931_100000212099 [1,1,0,0,0,0|2,0,0]=4 2193 B13R1.17 O=C(NCCF)c1ccc(cc1)O 527a_100000724931_100000212099 [1,1,0,0,0,0|2,0,0]=4 2194 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 240690a_100000210304_100000185839 [1,1,0,0,0,0|2,0,0]=4 2195 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 527a_100000210304_100000185839 [1,1,0,0,0,0|2,0,0]=4 2196 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 240690a_100000210304_100000210187 [1,1,0,0,0,0|2,0,0]=4 2197 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 527a_100000210304_100000210187 [1,1,0,0,0,0|2,0,0]=4 2198 B13R1.17 O=C(NCCO)c1ccc(cc1)F 240690a_100000210304_100000187176 [1,1,0,0,0,0|2,0,0]=4 2199 B13R1.17 O=C(NCCO)c1ccc(cc1)F 527a_100000210304_100000187176 [1,1,0,0,0,0|2,0,0]=4 2200 B13R1.17 O=C(NCCO)c1ccc(cc1)I 240690a_100000210304_100000187904 [1,1,0,0,0,0|2,0,0]=4 2201 B13R1.17 O=C(NCCO)c1ccc(cc1)I 527a_100000210304_100000187904 [1,1,0,0,0,0|2,0,0]=4 2202 B13R1.17 O=C(NCCO)c1ccc(cc1)O 240690a_100000210304_100000212099 [1,1,0,0,0,0|2,0,0]=4 2203 B13R1.17 O=C(NCCO)c1ccc(cc1)O 271570a_203496583355_200000158904 [1,1,0,0,0,0|2,0,0]=4 2204 B13R1.17 O=C(NCCO)c1ccc(cc1)O 527a_100000210304_100000212099 [1,1,0,0,0,0|2,0,0]=4 2205 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_100011215963_200025704644 [1,1,0,0,0,0|2,0,0]=4 2206 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_200025704644_100011215963 [1,1,0,0,0,0|2,0,0]=4 2207 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200025704644 [1,1,0,0,0,0|2,0,0]=4 2208 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_200025704644_100011216492 [1,1,0,0,0,0|2,0,0]=4 2209 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_100000211231_200025704644 [1,1,0,0,0,0|2,0,0]=4 2210 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211231 [1,1,0,0,0,0|2,0,0]=4 2211 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)O 62a_200025704644_100009879949 [1,1,0,0,0,0|2,0,0]=4 2212 B13R1.17 [2H]C(OCCC)c1ccc(cc1)F 34a_217856618577_100000210303 [1,1,0,0,0,0|1,0,1]=4 2213 B13R1.17 [2H]C(OCCC)c1ccc(cc1)F 7a_217856618577_100000210303 [1,1,0,0,0,0|1,0,1]=4 2214 B13R1.18 CCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210211 [1,1,0,0,0,0|1,0,0]=3 2215 B13R1.18 CCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210211 [1,1,0,0,0,0|1,0,0]=3 2216 B13R1.18 CCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210211 [1,1,0,0,0,0|1,0,0]=3 2217 B13R1.18 CCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210211 [1,1,0,0,0,0|1,0,0]=3 2218 B13R1.18 CCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210211 [1,1,0,0,0,0|1,0,0]=3 2219 B13R1.18 CCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210211 [1,1,0,0,0,0|1,0,0]=3 2220 B13R1.18 CCCCS(=O)c1cccc(c1)O 271570a_203496583355_200010264433 [1,1,0,0,0,0|2,0,0]=4 2221 B13R1.18 CCCNC(=O)c1cccc(c1)Br 11a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 2222 B13R1.18 CCCNC(=O)c1cccc(c1)Br 1626a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 2223 B13R1.18 CCCNC(=O)c1cccc(c1)Br 240690a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 2224 B13R1.18 CCCNC(=O)c1cccc(c1)Br 527a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 2225 B13R1.18 CCCNC(=O)c1cccc(c1)C 11a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 2226 B13R1.18 CCCNC(=O)c1cccc(c1)C 1626a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 2227 B13R1.18 CCCNC(=O)c1cccc(c1)C 240690a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 2228 B13R1.18 CCCNC(=O)c1cccc(c1)C 527a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 2229 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 11a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 2230 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 1626a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 2231 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 240690a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 2232 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 527a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 2233 B13R1.18 CCCNC(=O)c1cccc(c1)F 11a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 2234 B13R1.18 CCCNC(=O)c1cccc(c1)F 1626a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 2235 B13R1.18 CCCNC(=O)c1cccc(c1)F 240690a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 2236 B13R1.18 CCCNC(=O)c1cccc(c1)F 527a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 2237 B13R1.18 CCCNC(=O)c1cccc(c1)I 11a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 2238 B13R1.18 CCCNC(=O)c1cccc(c1)I 1626a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 2239 B13R1.18 CCCNC(=O)c1cccc(c1)I 240690a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 2240 B13R1.18 CCCNC(=O)c1cccc(c1)I 527a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 2241 B13R1.18 CCCNC(=O)c1cccc(c1)O 240690a_100020643023_100000183914 [1,1,0,0,0,0|1,0,0]=3 2242 B13R1.18 CCCNC(=O)c1cccc(c1)O 271570a_203496583355_200000152271 [1,1,0,0,0,0|1,0,0]=3 2243 B13R1.18 CCCNC(=O)c1cccc(c1)O 527a_100020643023_100000183914 [1,1,0,0,0,0|1,0,0]=3 2244 B13R1.18 CCCNC(=O)c1cncc(c1)O 271570a_203496583355_200000152275 [1,1,0,0,0,0|2,0,0]=4 2245 B13R1.18 CCCOC(C)c1cccc(c1)Br 34a_100000246457_100000210303 [1,1,0,0,0,0|1,0,1]=4 2246 B13R1.18 CCCOC(C)c1cccc(c1)Br 7a_100000246457_100000210303 [1,1,0,0,0,0|1,0,1]=4 2247 B13R1.18 CCCOC(C)c1cccc(c1)C 34a_100000757818_100000210303 [1,1,0,0,0,0|1,0,1]=4 2248 B13R1.18 CCCOC(C)c1cccc(c1)C 7a_100000757818_100000210303 [1,1,0,0,0,0|1,0,1]=4 2249 B13R1.18 CCCOC(C)c1cccc(c1)F 34a_100000744526_100000210303 [1,1,0,0,0,0|1,0,1]=4 2250 B13R1.18 CCCOC(C)c1cccc(c1)F 7a_100000744526_100000210303 [1,1,0,0,0,0|1,0,1]=4 2251 B13R1.18 CCCOC(C)c1cccc(c1)I 34a_100013085317_100000210303 [1,1,0,0,0,0|1,0,1]=4 2252 B13R1.18 CCCOC(C)c1cccc(c1)I 7a_100013085317_100000210303 [1,1,0,0,0,0|1,0,1]=4 2253 B13R1.18 CCCOC(C)c1cccc(c1)N 34a_100011217120_100000210303 [1,1,0,0,0,0|1,0,1]=4 2254 B13R1.18 CCCOC(C)c1cccc(c1)N 7a_100011217120_100000210303 [1,1,0,0,0,0|1,0,1]=4 2255 B13R1.18 CCCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210303 [1,1,0,0,0,0|1,0,1]=4 2256 B13R1.18 CCCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210303 [1,1,0,0,0,0|1,0,1]=4 2257 B13R1.18 CCNCC(=O)c1cccc(c1)Br 2230a_100015525214_100000212080 [1,1,0,0,0,0|2,0,0]=4 2258 B13R1.18 CCNCC(=O)c1cccc(c1)C 2230a_100015525214_100000739480 [1,1,0,0,0,0|2,0,0]=4 2259 B13R1.18 CCNCC(=O)c1cccc(c1)Cl 2230a_100015525214_100000211444 [1,1,0,0,0,0|2,0,0]=4 2260 B13R1.18 CCNCC(=O)c1cccc(c1)F 2230a_100015525214_100000215616 [1,1,0,0,0,0|2,0,0]=4 2261 B13R1.18 CCNNC(=O)c1cccc(c1)Br 22a_100000756455_100000210664 [1,1,0,0,0,0|2,0,0]=4 2262 B13R1.18 CCNNC(=O)c1cccc(c1)C 22a_100000756455_100000189346 [1,1,0,0,0,0|2,0,0]=4 2263 B13R1.18 CCNNC(=O)c1cccc(c1)Cl 22a_100000756455_100000210390 [1,1,0,0,0,0|2,0,0]=4 2264 B13R1.18 CCNNC(=O)c1cccc(c1)F 22a_100000756455_100000210950 [1,1,0,0,0,0|2,0,0]=4 2265 B13R1.18 CCNNC(=O)c1cccc(c1)I 22a_100000756455_100000184098 [1,1,0,0,0,0|2,0,0]=4 2266 B13R1.18 CCNNC(=O)c1cccc(c1)O 22a_100000756455_100000183914 [1,1,0,0,0,0|2,0,0]=4 2267 B13R1.18 CCOCC(=O)c1cccc(c1)Br 34a_100121572206_100000212080 [1,1,0,0,0,0|2,0,0]=4 2268 B13R1.18 CCOCC(=O)c1cccc(c1)C 34a_100121572206_100000739480 [1,1,0,0,0,0|2,0,0]=4 2269 B13R1.18 CCOCC(=O)c1cccc(c1)Cl 34a_100121572206_100000211444 [1,1,0,0,0,0|2,0,0]=4 2270 B13R1.18 CCOCC(=O)c1cccc(c1)Cl 7a_200011592804_100000210202 [1,1,0,0,0,0|2,0,0]=4 2271 B13R1.18 CCOCC(=O)c1cccc(c1)F 34a_100011592800_100000210202 [1,1,0,0,0,0|2,0,0]=4 2272 B13R1.18 CCOCC(=O)c1cccc(c1)F 34a_100121572206_100000215616 [1,1,0,0,0,0|2,0,0]=4 2273 B13R1.18 CCOCC(=O)c1cccc(c1)F 7a_100011592800_100000210202 [1,1,0,0,0,0|2,0,0]=4 2274 B13R1.18 CCOCC(=O)c1cccc(c1)O 34a_100121572206_100009813753 [1,1,0,0,0,0|2,0,0]=4 2275 B13R1.18 CCSCC(=O)c1cccc(c1)Br 62a_100000210202_100000212080 [1,1,0,0,0,0|2,0,0]=4 2276 B13R1.18 CCSCC(=O)c1cccc(c1)Br 62a_100000212080_100000210202 [1,1,0,0,0,0|2,0,0]=4 2277 B13R1.18 CCSCC(=O)c1cccc(c1)C 62a_100000210202_100000739480 [1,1,0,0,0,0|2,0,0]=4 2278 B13R1.18 CCSCC(=O)c1cccc(c1)C 62a_100000739480_100000210202 [1,1,0,0,0,0|2,0,0]=4 2279 B13R1.18 CCSCC(=O)c1cccc(c1)Cl 62a_100000210202_100000211444 [1,1,0,0,0,0|2,0,0]=4 2280 B13R1.18 CCSCC(=O)c1cccc(c1)Cl 62a_100000211444_100000210202 [1,1,0,0,0,0|2,0,0]=4 2281 B13R1.18 CCSCC(=O)c1cccc(c1)F 62a_100000210202_100000215616 [1,1,0,0,0,0|2,0,0]=4 2282 B13R1.18 CCSCC(=O)c1cccc(c1)F 62a_100000215616_100000210202 [1,1,0,0,0,0|2,0,0]=4 2283 B13R1.18 CCSCC(=O)c1cccc(c1)O 62a_100000210202_100009813753 [1,1,0,0,0,0|2,0,0]=4 2284 B13R1.18 CCSCC(=O)c1cccc(c1)O 62a_100009813753_100000210202 [1,1,0,0,0,0|2,0,0]=4 2285 B13R1.18 COCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000233755 [1,1,0,0,0,0|2,0,0]=4 2286 B13R1.18 COCCC(=O)c1cccc(c1)C 1458a_100000189346_100000233755 [1,1,0,0,0,0|2,0,0]=4 2287 B13R1.18 COCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000233755 [1,1,0,0,0,0|2,0,0]=4 2288 B13R1.18 COCCC(=O)c1cccc(c1)F 1458a_100000210950_100000233755 [1,1,0,0,0,0|2,0,0]=4 2289 B13R1.18 COCCC(=O)c1cccc(c1)I 1458a_100000184098_100000233755 [1,1,0,0,0,0|2,0,0]=4 2290 B13R1.18 COCCC(=O)c1cccc(c1)O 1458a_100000183914_100000233755 [1,1,0,0,0,0|2,0,0]=4 2291 B13R1.18 CSCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000751147 [1,1,0,0,0,0|2,0,0]=4 2292 B13R1.18 CSCCC(=O)c1cccc(c1)C 1458a_100000189346_100000751147 [1,1,0,0,0,0|2,0,0]=4 2293 B13R1.18 CSCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000751147 [1,1,0,0,0,0|2,0,0]=4 2294 B13R1.18 CSCCC(=O)c1cccc(c1)F 1458a_100000210950_100000751147 [1,1,0,0,0,0|2,0,0]=4 2295 B13R1.18 CSCCC(=O)c1cccc(c1)I 1458a_100000184098_100000751147 [1,1,0,0,0,0|2,0,0]=4 2296 B13R1.18 CSCCC(=O)c1cccc(c1)O 1458a_100000183914_100000751147 [1,1,0,0,0,0|2,0,0]=4 2297 B13R1.18 Cc1cccc(c1)C(=O)CCCF 1458a_100000189346_100011934791 [1,1,0,0,0,0|2,0,0]=4 2298 B13R1.18 Cc1cccc(c1)C(=O)CCCO 1458a_100000189346_100011215043 [1,1,0,0,0,0|2,0,0]=4 2299 B13R1.18 Cc1cccc(c1)C(=O)NCCF 11a_100000724931_100000189346 [1,1,0,0,0,0|2,0,0]=4 2300 B13R1.18 Cc1cccc(c1)C(=O)NCCF 1626a_100000724931_100000189346 [1,1,0,0,0,0|2,0,0]=4 2301 B13R1.18 Cc1cccc(c1)C(=O)NCCF 240690a_100000724931_100000189346 [1,1,0,0,0,0|2,0,0]=4 2302 B13R1.18 Cc1cccc(c1)C(=O)NCCF 527a_100000724931_100000189346 [1,1,0,0,0,0|2,0,0]=4 2303 B13R1.18 Cc1cccc(c1)C(=O)NCCO 240690a_100000210304_100000189346 [1,1,0,0,0,0|2,0,0]=4 2304 B13R1.18 Cc1cccc(c1)C(=O)NCCO 527a_100000210304_100000189346 [1,1,0,0,0,0|2,0,0]=4 2305 B13R1.18 O=C(CCCF)c1cccc(c1)Br 1458a_100000210664_100011934791 [1,1,0,0,0,0|2,0,0]=4 2306 B13R1.18 O=C(CCCF)c1cccc(c1)Cl 1458a_100000210390_100011934791 [1,1,0,0,0,0|2,0,0]=4 2307 B13R1.18 O=C(CCCF)c1cccc(c1)F 1458a_100000210950_100011934791 [1,1,0,0,0,0|2,0,0]=4 2308 B13R1.18 O=C(CCCF)c1cccc(c1)I 1458a_100000184098_100011934791 [1,1,0,0,0,0|2,0,0]=4 2309 B13R1.18 O=C(CCCF)c1cccc(c1)O 1458a_100000183914_100011934791 [1,1,0,0,0,0|2,0,0]=4 2310 B13R1.18 O=C(CCCO)c1cccc(c1)Br 1458a_100000210664_100011215043 [1,1,0,0,0,0|2,0,0]=4 2311 B13R1.18 O=C(CCCO)c1cccc(c1)Cl 1458a_100000210390_100011215043 [1,1,0,0,0,0|2,0,0]=4 2312 B13R1.18 O=C(CCCO)c1cccc(c1)F 1458a_100000210950_100011215043 [1,1,0,0,0,0|2,0,0]=4 2313 B13R1.18 O=C(CCCO)c1cccc(c1)I 1458a_100000184098_100011215043 [1,1,0,0,0,0|2,0,0]=4 2314 B13R1.18 O=C(CCCO)c1cccc(c1)O 1458a_100000183914_100011215043 [1,1,0,0,0,0|2,0,0]=4 2315 B13R1.18 O=C(NCCF)c1cccc(c1)Br 11a_100000724931_100000210664 [1,1,0,0,0,0|2,0,0]=4 2316 B13R1.18 O=C(NCCF)c1cccc(c1)Br 1626a_100000724931_100000210664 [1,1,0,0,0,0|2,0,0]=4 2317 B13R1.18 O=C(NCCF)c1cccc(c1)Br 240690a_100000724931_100000210664 [1,1,0,0,0,0|2,0,0]=4 2318 B13R1.18 O=C(NCCF)c1cccc(c1)Br 527a_100000724931_100000210664 [1,1,0,0,0,0|2,0,0]=4 2319 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 11a_100000724931_100000210390 [1,1,0,0,0,0|2,0,0]=4 2320 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 1626a_100000724931_100000210390 [1,1,0,0,0,0|2,0,0]=4 2321 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 240690a_100000724931_100000210390 [1,1,0,0,0,0|2,0,0]=4 2322 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 527a_100000724931_100000210390 [1,1,0,0,0,0|2,0,0]=4 2323 B13R1.18 O=C(NCCF)c1cccc(c1)F 11a_100000724931_100000210950 [1,1,0,0,0,0|2,0,0]=4 2324 B13R1.18 O=C(NCCF)c1cccc(c1)F 1626a_100000724931_100000210950 [1,1,0,0,0,0|2,0,0]=4 2325 B13R1.18 O=C(NCCF)c1cccc(c1)F 240690a_100000724931_100000210950 [1,1,0,0,0,0|2,0,0]=4 2326 B13R1.18 O=C(NCCF)c1cccc(c1)F 527a_100000724931_100000210950 [1,1,0,0,0,0|2,0,0]=4 2327 B13R1.18 O=C(NCCF)c1cccc(c1)I 11a_100000724931_100000184098 [1,1,0,0,0,0|2,0,0]=4 2328 B13R1.18 O=C(NCCF)c1cccc(c1)I 1626a_100000724931_100000184098 [1,1,0,0,0,0|2,0,0]=4 2329 B13R1.18 O=C(NCCF)c1cccc(c1)I 240690a_100000724931_100000184098 [1,1,0,0,0,0|2,0,0]=4 2330 B13R1.18 O=C(NCCF)c1cccc(c1)I 527a_100000724931_100000184098 [1,1,0,0,0,0|2,0,0]=4 2331 B13R1.18 O=C(NCCF)c1cccc(c1)O 240690a_100000724931_100000183914 [1,1,0,0,0,0|2,0,0]=4 2332 B13R1.18 O=C(NCCF)c1cccc(c1)O 527a_100000724931_100000183914 [1,1,0,0,0,0|2,0,0]=4 2333 B13R1.18 O=C(NCCO)c1cccc(c1)Br 240690a_100000210304_100000210664 [1,1,0,0,0,0|2,0,0]=4 2334 B13R1.18 O=C(NCCO)c1cccc(c1)Br 527a_100000210304_100000210664 [1,1,0,0,0,0|2,0,0]=4 2335 B13R1.18 O=C(NCCO)c1cccc(c1)Cl 240690a_100000210304_100000210390 [1,1,0,0,0,0|2,0,0]=4 2336 B13R1.18 O=C(NCCO)c1cccc(c1)Cl 527a_100000210304_100000210390 [1,1,0,0,0,0|2,0,0]=4 2337 B13R1.18 O=C(NCCO)c1cccc(c1)F 240690a_100000210304_100000210950 [1,1,0,0,0,0|2,0,0]=4 2338 B13R1.18 O=C(NCCO)c1cccc(c1)F 527a_100000210304_100000210950 [1,1,0,0,0,0|2,0,0]=4 2339 B13R1.18 O=C(NCCO)c1cccc(c1)I 240690a_100000210304_100000184098 [1,1,0,0,0,0|2,0,0]=4 2340 B13R1.18 O=C(NCCO)c1cccc(c1)I 527a_100000210304_100000184098 [1,1,0,0,0,0|2,0,0]=4 2341 B13R1.18 O=C(NCCO)c1cccc(c1)O 240690a_100000210304_100000183914 [1,1,0,0,0,0|2,0,0]=4 2342 B13R1.18 O=C(NCCO)c1cccc(c1)O 271570a_203496583355_200000158903 [1,1,0,0,0,0|2,0,0]=4 2343 B13R1.18 O=C(NCCO)c1cccc(c1)O 527a_100000210304_100000183914 [1,1,0,0,0,0|2,0,0]=4 2344 B13R1.24 C#CCCCC(=O)c1ccccc1 1458a_100000185807_100000731252 [1,1,0,0,0,0|1,0,1]=4 2345 B13R1.24 C#CCCNC(=O)c1ccccc1 11a_100000755551_100000185807 [1,1,0,0,0,0|1,0,1]=4 2346 B13R1.24 C#CCCNC(=O)c1ccccc1 1626a_100000755551_100000185807 [1,1,0,0,0,0|1,0,1]=4 2347 B13R1.24 C#CCCNC(=O)c1ccccc1 240690a_100000755551_100000185807 [1,1,0,0,0,0|1,0,1]=4 2348 B13R1.24 C#CCCNC(=O)c1ccccc1 527a_100000755551_100000185807 [1,1,0,0,0,0|1,0,1]=4 2349 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [1,1,0,0,0,0|1,0,1]=4 2350 B13R1.24 C=CCCNC(=O)c1ccccc1 11a_100015191253_100000185807 [1,1,0,0,0,0|1,0,1]=4 2351 B13R1.24 C=CCCNC(=O)c1ccccc1 1626a_100015191253_100000185807 [1,1,0,0,0,0|1,0,1]=4 2352 B13R1.24 C=CCCNC(=O)c1ccccc1 240690a_100015191253_100000185807 [1,1,0,0,0,0|1,0,1]=4 2353 B13R1.24 C=CCCNC(=O)c1ccccc1 527a_100015191253_100000185807 [1,1,0,0,0,0|1,0,1]=4 2354 B13R1.24 CC#CCNC(=O)c1ccccc1 11a_100000685387_100000185807 [1,1,0,0,0,0|1,0,1]=4 2355 B13R1.24 CC#CCNC(=O)c1ccccc1 1626a_100000685387_100000185807 [1,1,0,0,0,0|1,0,1]=4 2356 B13R1.24 CC#CCNC(=O)c1ccccc1 527a_100000685387_100000185807 [1,1,0,0,0,0|1,0,1]=4 2357 B13R1.24 CC(OCCCBr)c1ccccc1 34a_100011217188_100000211855 [1,1,0,0,0,0|1,0,1]=4 2358 B13R1.24 CC(OCCCCl)c1ccccc1 34a_100000230001_100000211855 [1,1,0,0,0,0|1,0,1]=4 2359 B13R1.24 CC(OCCCF)c1ccccc1 34a_100000759539_100000211855 [1,1,0,0,0,0|1,0,1]=4 2360 B13R1.24 CC(OCCCN)c1ccccc1 34a_100000182051_100000211855 [1,1,0,0,0,0|1,0,1]=4 2361 B13R1.24 CC/C=C\CC(=O)c1ccccc1 1458a_100000185807_100103147603 [1,1,0,0,0,0|1,0,1]=4 2362 B13R1.24 CCC#CCC(=O)c1ccccc1 1458a_100000185807_100009813939 [1,1,0,0,0,0|1,0,1]=4 2363 B13R1.24 CCC=NNC(=O)c1ccccc1 4a_100000184135_100000210100 [1,1,0,0,0,0|1,0,1]=4 2364 B13R1.24 CCCCCC(=O)c1ccccc1 1458a_100000185807_100000210326 [1,1,0,0,0,0|1,0,0]=3 2365 B13R1.24 CCCCNC(=O)c1ccccc1 11a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 2366 B13R1.24 CCCCNC(=O)c1ccccc1 1626a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 2367 B13R1.24 CCCCNC(=O)c1ccccc1 240690a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 2368 B13R1.24 CCCCNC(=O)c1ccccc1 527a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 2369 B13R1.24 CCCCOC(C)c1ccccc1 34a_100000210227_100000211855 [1,1,0,0,0,0|1,0,1]=4 2370 B13R1.24 CCCCOC(C)c1ccccc1 7a_100000210227_100000230085 [1,1,0,0,0,0|1,0,1]=4 2371 B13R1.24 CCCCO[C@H](C)c1ccccc1 34a_100000761318_100000210210 [1,1,0,0,0,0|1,0,1]=4 2372 B13R1.24 CCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210211 [1,1,0,0,0,0|1,0,1]=4 2373 B13R1.24 CCCNN=C(C)c1ccccc1 4a_100000740057_100000185851 [1,1,0,0,0,0|2,0,0]=4 2374 B13R1.24 CCCNNC(=O)c1ccccc1 22a_100000740057_100000185807 [1,1,0,0,0,0|1,0,0]=3 2375 B13R1.24 CCCOCC(=O)c1ccccn1 34a_100000210258_100000027445 [1,1,0,0,0,0|1,0,0]=3 2376 B13R1.24 CCCOCC(C)c1ccccc1 34a_100000210258_100000756946 [1,1,0,0,0,0|1,0,1]=4 2377 B13R1.24 CCCOCC(C)c1ccccc1 34a_100011215166_100000210303 [1,1,0,0,0,0|1,0,1]=4 2378 B13R1.24 CCCOCC(C)c1ccccc1 7a_100011215166_100000210303 [1,1,0,0,0,0|1,0,1]=4 2379 B13R1.24 CCCOCC(O)c1ccccc1 34a_100000210258_100000185958 [1,1,0,0,0,0|0,0,2]=4 2380 B13R1.24 CCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210303 [1,1,0,0,0,0|1,0,1]=4 2381 B13R1.24 CCCOC[C@@H](O)c1ccccc1 34a_100000210258_100011933945 [1,1,0,0,0,0|0,0,2]=4 2382 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000210303_100000211460 [1,1,0,0,0,0|0,1,0]=3 2383 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000211460_100000210303 [1,1,0,0,0,0|0,1,0]=3 2384 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000027445_100000210303 [1,1,0,0,0,0|1,1,0]=4 2385 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000210303_100000027445 [1,1,0,0,0,0|1,1,0]=4 2386 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000210303_100000757877 [1,1,0,0,0,0|1,1,0]=4 2387 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000757877_100000210303 [1,1,0,0,0,0|1,1,0]=4 2388 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000027454_100000210303 [1,1,0,0,0,0|1,1,0]=4 2389 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000210303_100000027454 [1,1,0,0,0,0|1,1,0]=4 2390 B13R1.24 CCCSCS(=O)c1ccccc1 62a_100000210303_100000031784 [1,1,0,0,0,0|1,1,0]=4 2391 B13R1.24 CCNCCC(=O)c1ccccc1 2230a_100015525214_100000750707 [1,1,0,0,0,0|1,0,0]=3 2392 B13R1.24 CCNCCS(=O)c1ccccc1 2230a_100015525214_100000740319 [1,1,0,0,0,0|2,0,0]=4 2393 B13R1.24 CCOCCC(=O)c1ccccc1 1458a_100000185807_100011215890 [1,1,0,0,0,0|1,0,0]=3 2394 B13R1.24 CCSCCC(=O)c1ccccc1 1458a_100000185807_100000757381 [1,1,0,0,0,0|1,0,0]=3 2395 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000210202_100000750707 [1,1,0,0,0,0|1,0,0]=3 2396 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000750707_100000210202 [1,1,0,0,0,0|1,0,0]=3 2397 B13R1.24 CCSCCS(=O)c1ccccc1 62a_100000210202_100000740319 [1,1,0,0,0,0|2,0,0]=4 2398 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000073877_100000210202 [1,1,0,0,0,0|0,0,0]=2 2399 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000210202_100000073877 [1,1,0,0,0,0|0,0,0]=2 2400 B13R1.24 CNCCCC(=O)c1ccccc1 2230a_106832991635_100000211006 [1,1,0,0,0,0|1,0,0]=3 2401 B13R1.24 CNCCCC(=O)c1ccccc1 7a_106832991635_100000211006 [1,1,0,0,0,0|1,0,0]=3 2402 B13R1.24 CNCCNC(=O)c1ccccc1 2230a_100000736134_200000210301 [1,1,0,0,0,0|1,0,0]=3 2403 B13R1.24 CNCCNC(=O)c1ccccc1 7a_106832991635_200011215302 [1,1,0,0,0,0|1,0,0]=3 2404 B13R1.24 CNCCNC(=O)c1ccncc1 2230a_200011198449_200000210301 [1,1,0,0,0,0|2,0,0]=4 2405 B13R1.24 CNCCOC(=O)c1ccccc1 34a_100102657272_100009812718 [1,1,0,0,0,0|0,0,0]=2 2406 B13R1.24 CNCCOC(=O)c1ccccc1 7a_106832991635_100000184176 [1,1,0,0,0,0|0,0,0]=2 2407 B13R1.24 COCCCC(=O)c1ccccc1 1458a_100000185807_100000740836 [1,1,0,0,0,0|1,0,0]=3 2408 B13R1.24 COCCNC(=O)c1ccccc1 1626a_100000209980_100000185807 [1,1,0,0,0,0|1,0,0]=3 2409 B13R1.24 COCCNC(=O)c1ccccc1 240690a_100000209980_100000185807 [1,1,0,0,0,0|1,0,0]=3 2410 B13R1.24 COCCNC(=O)c1ccccc1 34a_200000158897_200000210301 [1,1,0,0,0,0|1,0,0]=3 2411 B13R1.24 COCCNC(=O)c1ccccc1 527a_100000209980_100000185807 [1,1,0,0,0,0|1,0,0]=3 2412 B13R1.24 COCCNC(=O)c1ccccc1 7a_200000158897_200000210301 [1,1,0,0,0,0|1,0,0]=3 2413 B13R1.24 COCCOC(=O)c1ccccc1 34a_100138415774_100009812718 [1,1,0,0,0,0|0,0,0]=2 2414 B13R1.24 COCCOC(=O)c1ccccc1 7a_100000025465_200000210301 [1,1,0,0,0,0|0,0,0]=2 2415 B13R1.24 COCCOC(C)c1ccccc1 34a_100000210237_100000211855 [1,1,0,0,0,0|1,0,1]=4 2416 B13R1.24 COCCO[C@H](C)c1ccccc1 34a_100000761318_100011201679 [1,1,0,0,0,0|1,0,1]=4 2417 B13R1.24 COCCO[C@H](C)c1ccccc1 7a_100000761318_100000233755 [1,1,0,0,0,0|1,0,1]=4 2418 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000211460_100000766300 [1,1,0,0,0,0|1,1,0]=4 2419 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000766300_100000211460 [1,1,0,0,0,0|1,1,0]=4 2420 B13R1.24 CSCCCC(=O)c1ccccc1 62a_100000211006_200000210301 [1,1,0,0,0,0|1,0,0]=3 2421 B13R1.24 CSCCCC(=O)c1ccccc1 62a_200000210301_100000211006 [1,1,0,0,0,0|1,0,0]=3 2422 B13R1.24 CSCCNC(=O)c1ccccc1 11a_100020590264_100000185807 [1,1,0,0,0,0|1,0,0]=3 2423 B13R1.24 CSCCNC(=O)c1ccccc1 1626a_100020590264_100000185807 [1,1,0,0,0,0|1,0,0]=3 2424 B13R1.24 CSCCNC(=O)c1ccccc1 240690a_100020590264_100000185807 [1,1,0,0,0,0|1,0,0]=3 2425 B13R1.24 CSCCNC(=O)c1ccccc1 527a_100020590264_100000185807 [1,1,0,0,0,0|1,0,0]=3 2426 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200000210301_200011215302 [1,1,0,0,0,0|1,0,0]=3 2427 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200011215302_200000210301 [1,1,0,0,0,0|1,0,0]=3 2428 B13R1.24 CSCCOC(=O)c1ccccc1 62a_100009812718_200000210301 [1,1,0,0,0,0|0,0,0]=2 2429 B13R1.24 CSCCOC(=O)c1ccccc1 62a_200000210301_100009812718 [1,1,0,0,0,0|0,0,0]=2 2430 B13R1.24 CSCCOC(C)c1ccccc1 34a_100000230434_100000211855 [1,1,0,0,0,0|1,0,1]=4 2431 B13R1.24 CSCCOC(C)c1ccccc1 7a_100000230434_100000230085 [1,1,0,0,0,0|1,0,1]=4 2432 B13R1.24 CSCCO[C@H](C)c1ccccc1 34a_100000761318_100000212216 [1,1,0,0,0,0|1,0,1]=4 2433 B13R1.24 CSCCO[C@H](C)c1ccccc1 7a_100000761318_100000212216 [1,1,0,0,0,0|1,0,1]=4 2434 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100000211460_100011218213 [1,1,0,0,0,0|1,1,0]=4 2435 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100011218213_100000211460 [1,1,0,0,0,0|1,1,0]=4 2436 B13R1.24 C[C@@H](OCCCF)c1ccccc1 34a_100000761318_100011934791 [1,1,0,0,0,0|1,0,1]=4 2437 B13R1.24 C[C@@H](OCCCF)c1ccccc1 7a_100000761318_100011934791 [1,1,0,0,0,0|1,0,1]=4 2438 B13R1.24 C[C@@H](OCCCO)c1ccccc1 34a_100000761318_100000230001 [1,1,0,0,0,0|1,0,1]=4 2439 B13R1.24 C[C@@H](OCCCO)c1ccccc1 7a_100000761318_100011215043 [1,1,0,0,0,0|1,0,1]=4 2440 B13R1.24 N#CCCCC(=O)c1ccccc1 1458a_100000185807_100000211468 [1,1,0,0,0,0|1,0,1]=4 2441 B13R1.24 N#CCCNC(=O)c1ccccc1 11a_100000720768_100000185807 [1,1,0,0,0,0|1,0,1]=4 2442 B13R1.24 N#CCCNC(=O)c1ccccc1 1626a_100000720768_100000185807 [1,1,0,0,0,0|1,0,1]=4 2443 B13R1.24 N#CCCNC(=O)c1ccccc1 240690a_100000720768_100000185807 [1,1,0,0,0,0|1,0,1]=4 2444 B13R1.24 N#CCCNC(=O)c1ccccc1 527a_100000720768_100000185807 [1,1,0,0,0,0|1,0,1]=4 2445 B13R1.24 NCCOCC(=O)c1ccccn1 34a_100000210304_100000027445 [1,1,0,0,0,0|2,0,0]=4 2446 B13R1.24 O=C(CCCCF)c1ccccc1 1458a_100000185807_100000729493 [1,1,0,0,0,0|1,0,0]=3 2447 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [1,1,0,0,0,0|1,0,0]=3 2448 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100000750707_100015361967 [1,1,0,0,0,0|2,0,0]=4 2449 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100015361967_100000750707 [1,1,0,0,0,0|2,0,0]=4 2450 B13R1.24 O=C(COCCBr)c1ccccn1 34a_100000211926_100000027445 [1,1,0,0,0,0|2,0,0]=4 2451 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100000211460_100011217306 [1,1,0,0,0,0|1,1,0]=4 2452 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100011217306_100000211460 [1,1,0,0,0,0|1,1,0]=4 2453 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211460_100000211926 [1,1,0,0,0,0|1,1,0]=4 2454 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211926_100000211460 [1,1,0,0,0,0|1,1,0]=4 2455 B13R1.24 O=C(NCCCF)c1ccccc1 11a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 2456 B13R1.24 O=C(NCCCF)c1ccccc1 1626a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 2457 B13R1.24 O=C(NCCCF)c1ccccc1 240690a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 2458 B13R1.24 O=C(NCCCF)c1ccccc1 527a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 2459 B13R1.24 O=C(NCCCO)c1ccccc1 240690a_100000182051_100000185807 [1,1,0,0,0,0|1,0,0]=3 2460 B13R1.24 O=C(NCCCO)c1ccccc1 527a_100000182051_100000185807 [1,1,0,0,0,0|1,0,0]=3 2461 B13R1.24 O=C(NNCCO)c1ccccc1 22a_100000210001_100000185807 [1,1,0,0,0,0|2,0,0]=4 2462 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100000073877_100015361967 [1,1,0,0,0,0|1,0,0]=3 2463 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100015361967_100000073877 [1,1,0,0,0,0|1,0,0]=3 2464 B13R1.24 [13CH3]NCCNC(=O)c1ccccc1 2230a_100000736134_200025704644 [1,1,0,0,0,0|1,0,0]=3 2465 B13R1.24 [13CH3]NCCNC(=O)c1ccncc1 2230a_200011198449_200025704644 [1,1,0,0,0,0|2,0,0]=4 2466 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 34a_200000158897_200025704644 [1,1,0,0,0,0|1,0,0]=3 2467 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 7a_200000158897_200025704644 [1,1,0,0,0,0|1,0,0]=3 2468 B13R1.24 [13CH3]OCCOC(=O)c1ccccc1 7a_100000025465_200025704644 [1,1,0,0,0,0|0,0,0]=2 2469 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_100000211006_200025704644 [1,1,0,0,0,0|1,0,0]=3 2470 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_200025704644_100000211006 [1,1,0,0,0,0|1,0,0]=3 2471 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200011215302_200025704644 [1,1,0,0,0,0|1,0,0]=3 2472 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200025704644_200011215302 [1,1,0,0,0,0|1,0,0]=3 2473 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_100009812718_200025704644 [1,1,0,0,0,0|0,0,0]=2 2474 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_200025704644_100009812718 [1,1,0,0,0,0|0,0,0]=2 2475 B13R1.26 C#CC(OCCC)c1ccccc1 34a_100011219616_100000210303 [1,1,0,0,0,0|1,0,1]=4 2476 B13R1.26 C#CC(OCCC)c1ccccc1 7a_100011219616_100000210303 [1,1,0,0,0,0|1,0,1]=4 2477 B13R1.26 C=CC(OCCC)c1ccccc1 34a_100011215659_100000210303 [1,1,0,0,0,0|1,0,1]=4 2478 B13R1.26 C=CC(OCCC)c1ccccc1 7a_100011215659_100000210303 [1,1,0,0,0,0|1,0,1]=4 2479 B13R1.26 CCCOC(C#N)c1ccccc1 7a_100011217353_100000210303 [1,1,0,0,0,0|1,0,1]=4 2480 B13R1.26 CCCOC(CBr)c1ccccc1 7a_100000185958_100000210303 [1,1,0,0,0,0|1,0,1]=4 2481 B13R1.26 CCCOC(CC)c1ccccc1 34a_100000698172_100000210303 [1,1,0,0,0,0|1,0,1]=4 2482 B13R1.26 CCCOC(CC)c1ccccc1 7a_100000698172_100000210303 [1,1,0,0,0,0|1,0,1]=4 2483 B13R1.26 CCCOC(CN)c1ccccc1 34a_100000210709_100000210303 [1,1,0,0,0,0|1,0,1]=4 2484 B13R1.26 CCCO[C@H](CCl)c1ccccc1 34a_100011933945_100000210303 [1,1,0,0,0,0|1,0,1]=4 2485 B13R1.26 CCCO[C@H](CCl)c1ccccc1 7a_100011933945_100000210303 [1,1,0,0,0,0|1,0,1]=4 2486 B13R1.47 C=C(C(=O)CCC)c1ccccc1 1458a_100000065200_100000210303 [1,1,0,0,0,0|2,0,0]=4 2487 B13R1.47 CC(CCO)C(=O)c1ccccc1 1458a_100000185807_100009893172 [1,1,0,0,0,0|2,0,0]=4 2488 B13R1.47 CCCC(C)C(=O)c1ccccc1 1458a_100000185807_100000766640 [1,1,0,0,0,0|1,0,0]=3 2489 B13R1.47 CCCN(C)C(=O)c1ccccc1 11a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 2490 B13R1.47 CCCN(C)C(=O)c1ccccc1 1626a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 2491 B13R1.47 CCCN(C)C(=O)c1ccccc1 240690a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 2492 B13R1.47 CCCN(C)C(=O)c1ccccc1 527a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 2493 B13R1.47 CCNC(C)C(=O)c1ccccc1 2230a_100015525214_100000239700 [1,1,0,0,0,0|2,0,0]=4 2494 B13R1.47 CCSC(C)C(=O)c1ccccc1 62a_100000210202_100000239700 [1,1,0,0,0,0|2,0,0]=4 2495 B13R1.47 CCSC(C)C(=O)c1ccccc1 62a_100000239700_100000210202 [1,1,0,0,0,0|2,0,0]=4 2496 B13R1.47 CN(CCO)C(=O)c1ccccc1 240690a_100000210263_100000185807 [1,1,0,0,0,0|2,0,0]=4 2497 B13R1.47 CN(CCO)C(=O)c1ccccc1 527a_100000210263_100000185807 [1,1,0,0,0,0|2,0,0]=4 2498 B13R1.47 COCC(C)C(=O)c1ccccc1 1458a_100000185807_100000765312 [1,1,0,0,0,0|2,0,0]=4 2499 B13R1.122 CCCNS(=O)(=O)c1ccccc1 270084a_100020643023_100000210345 [1,1,0,0,0,0|2,0,0]=4 2500 B13R1.122 CCCNS(=O)(=O)c1ccccc1 274078a_100020643023_100000210345 [1,1,0,0,0,0|2,0,0]=4 2501 B13R1.122 CCCNS(=O)(=O)c1ccccc1 40a_100020643023_100000032697 [1,1,0,0,0,0|2,0,0]=4 2502 B13R1.122 CCCOC(C)(C)c1ccccc1 7a_100000694644_100000210303 [1,1,0,0,0,0|1,0,1]=4 2503 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [1,1,0,0,0,0|1,0,0]=3 2504 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [1,1,0,0,0,0|1,0,0]=3 2505 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [1,1,0,0,0,0|1,0,0]=3 2506 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [1,1,0,0,0,0|1,0,0]=3 2507 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [1,1,0,0,0,0|1,0,0]=3 2508 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [1,1,0,0,0,0|1,0,0]=3 2509 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [1,1,0,0,0,0|1,0,0]=3 2510 B13R1.674 CCCNC(=O)c1ccccc1Br 11a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 2511 B13R1.674 CCCNC(=O)c1ccccc1Br 1626a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 2512 B13R1.674 CCCNC(=O)c1ccccc1Br 240690a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 2513 B13R1.674 CCCNC(=O)c1ccccc1Br 527a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 2514 B13R1.674 CCCNC(=O)c1ccccc1C 11a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 2515 B13R1.674 CCCNC(=O)c1ccccc1C 1626a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 2516 B13R1.674 CCCNC(=O)c1ccccc1C 240690a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 2517 B13R1.674 CCCNC(=O)c1ccccc1C 527a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 2518 B13R1.674 CCCNC(=O)c1ccccc1Cl 11a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 2519 B13R1.674 CCCNC(=O)c1ccccc1Cl 1626a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 2520 B13R1.674 CCCNC(=O)c1ccccc1Cl 240690a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 2521 B13R1.674 CCCNC(=O)c1ccccc1Cl 527a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 2522 B13R1.674 CCCNC(=O)c1ccccc1F 11a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 2523 B13R1.674 CCCNC(=O)c1ccccc1F 1626a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 2524 B13R1.674 CCCNC(=O)c1ccccc1F 240690a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 2525 B13R1.674 CCCNC(=O)c1ccccc1F 527a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 2526 B13R1.674 CCCNC(=O)c1ccccc1I 11a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 2527 B13R1.674 CCCNC(=O)c1ccccc1I 1626a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 2528 B13R1.674 CCCNC(=O)c1ccccc1I 240690a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 2529 B13R1.674 CCCNC(=O)c1ccccc1I 527a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 2530 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [1,1,0,0,0,0|1,0,0]=3 2531 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [1,1,0,0,0,0|1,0,0]=3 2532 B13R1.674 CCCNC(=O)c1ccccc1[O-] 1626a_100020643023_100009911694 [1,1,0,0,0,0|1,0,0]=3 2533 B13R1.674 CCCNC(=O)c1ccccc1[O-] 240690a_100020643023_100009911694 [1,1,0,0,0,0|1,0,0]=3 2534 B13R1.674 CCCNC(=O)c1ccccc1[O-] 527a_100020643023_100009911694 [1,1,0,0,0,0|1,0,0]=3 2535 B13R1.674 CCCNC(=O)c1cccnc1O 271570a_203496583355_100000161721 [1,1,0,0,0,0|2,0,0]=4 2536 B13R1.674 CCCOC(C)c1ccccc1Br 34a_100000702211_100000210303 [1,1,0,0,0,0|1,0,1]=4 2537 B13R1.674 CCCOC(C)c1ccccc1Br 7a_100000702211_100000210303 [1,1,0,0,0,0|1,0,1]=4 2538 B13R1.674 CCCOC(C)c1ccccc1C 34a_100000742021_100000210303 [1,1,0,0,0,0|1,0,1]=4 2539 B13R1.674 CCCOC(C)c1ccccc1C 7a_100000742021_100000210303 [1,1,0,0,0,0|1,0,1]=4 2540 B13R1.674 CCCOC(C)c1ccccc1Cl 34a_100000740796_100000210303 [1,1,0,0,0,0|1,0,1]=4 2541 B13R1.674 CCCOC(C)c1ccccc1Cl 7a_100000740796_100000210303 [1,1,0,0,0,0|1,0,1]=4 2542 B13R1.674 CCCOC(C)c1ccccc1F 34a_100000210258_200000741388 [1,1,0,0,0,0|1,0,1]=4 2543 B13R1.674 CCCOC(C)c1ccccc1F 34a_100000697922_100000210303 [1,1,0,0,0,0|1,0,1]=4 2544 B13R1.674 CCCOC(C)c1ccccc1F 7a_100000697922_100000210303 [1,1,0,0,0,0|1,0,1]=4 2545 B13R1.674 CCCOC(C)c1ccccc1N 7a_100011405641_100000210303 [1,1,0,0,0,0|1,0,1]=4 2546 B13R1.674 CCNCC(=O)c1ccccc1C 2230a_100015525214_100000741374 [1,1,0,0,0,0|2,0,0]=4 2547 B13R1.674 CCNNC(=O)c1ccccc1Br 22a_100000756455_100000188424 [1,1,0,0,0,0|2,0,0]=4 2548 B13R1.674 CCNNC(=O)c1ccccc1C 22a_100000756455_100000212026 [1,1,0,0,0,0|2,0,0]=4 2549 B13R1.674 CCNNC(=O)c1ccccc1Cl 22a_100000756455_100000185844 [1,1,0,0,0,0|2,0,0]=4 2550 B13R1.674 CCNNC(=O)c1ccccc1F 22a_100000756455_100000188656 [1,1,0,0,0,0|2,0,0]=4 2551 B13R1.674 CCNNC(=O)c1ccccc1I 22a_100000756455_100000187884 [1,1,0,0,0,0|2,0,0]=4 2552 B13R1.674 CCNNC(=O)c1ccccc1O 22a_100000756455_100015234032 [1,1,0,0,0,0|2,0,0]=4 2553 B13R1.674 CCNNC(=O)c1ccccc1[O-] 22a_100000756455_100009911694 [1,1,0,0,0,0|2,0,0]=4 2554 B13R1.674 CCOCC(=O)c1ccccc1Br 34a_100121572206_100000199116 [1,1,0,0,0,0|2,0,0]=4 2555 B13R1.674 CCOCC(=O)c1ccccc1C 34a_100121572206_100000741374 [1,1,0,0,0,0|2,0,0]=4 2556 B13R1.674 CCOCC(=O)c1ccccc1Cl 34a_100121572206_100000211432 [1,1,0,0,0,0|2,0,0]=4 2557 B13R1.674 CCOCC(=O)c1ccccc1F 34a_100121572206_100000204681 [1,1,0,0,0,0|2,0,0]=4 2558 B13R1.674 CCSCC(=O)c1ccccc1Br 62a_100000199116_100000210202 [1,1,0,0,0,0|2,0,0]=4 2559 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000210202_100000741374 [1,1,0,0,0,0|2,0,0]=4 2560 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000741374_100000210202 [1,1,0,0,0,0|2,0,0]=4 2561 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000210202_100000211432 [1,1,0,0,0,0|2,0,0]=4 2562 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210202 [1,1,0,0,0,0|2,0,0]=4 2563 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000204681_100000210202 [1,1,0,0,0,0|2,0,0]=4 2564 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000210202_100000204681 [1,1,0,0,0,0|2,0,0]=4 2565 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000188908_100000210202 [1,1,0,0,0,0|2,0,0]=4 2566 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000210202_100000188908 [1,1,0,0,0,0|2,0,0]=4 2567 B13R1.674 CNCCC(=O)c1ccccc1F 2230a_106832991635_100000086012 [1,1,0,0,0,0|2,0,0]=4 2568 B13R1.674 CNCCC(=O)c1ccccc1F 7a_106832991635_100000086012 [1,1,0,0,0,0|2,0,0]=4 2569 B13R1.674 CNCCC(=O)c1ccccc1O 7a_106832991635_100009873196 [1,1,0,0,0,0|2,0,0]=4 2570 B13R1.674 COCCC(=O)c1ccccc1Br 1458a_100000188424_100000233755 [1,1,0,0,0,0|2,0,0]=4 2571 B13R1.674 COCCC(=O)c1ccccc1C 1458a_100000212026_100000233755 [1,1,0,0,0,0|2,0,0]=4 2572 B13R1.674 COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000233755 [1,1,0,0,0,0|2,0,0]=4 2573 B13R1.674 COCCC(=O)c1ccccc1F 1458a_100000188656_100000233755 [1,1,0,0,0,0|2,0,0]=4 2574 B13R1.674 COCCC(=O)c1ccccc1I 1458a_100000187884_100000233755 [1,1,0,0,0,0|2,0,0]=4 2575 B13R1.674 COCCC(=O)c1ccccc1O 1458a_100015234032_100000233755 [1,1,0,0,0,0|2,0,0]=4 2576 B13R1.674 COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000233755 [1,1,0,0,0,0|2,0,0]=4 2577 B13R1.674 CSCCC(=O)c1ccccc1Br 1458a_100000188424_100000751147 [1,1,0,0,0,0|2,0,0]=4 2578 B13R1.674 CSCCC(=O)c1ccccc1C 1458a_100000212026_100000751147 [1,1,0,0,0,0|2,0,0]=4 2579 B13R1.674 CSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000751147 [1,1,0,0,0,0|2,0,0]=4 2580 B13R1.674 CSCCC(=O)c1ccccc1F 1458a_100000188656_100000751147 [1,1,0,0,0,0|2,0,0]=4 2581 B13R1.674 CSCCC(=O)c1ccccc1F 62a_100000086012_200000210301 [1,1,0,0,0,0|2,0,0]=4 2582 B13R1.674 CSCCC(=O)c1ccccc1F 62a_200000210301_100000086012 [1,1,0,0,0,0|2,0,0]=4 2583 B13R1.674 CSCCC(=O)c1ccccc1I 1458a_100000187884_100000751147 [1,1,0,0,0,0|2,0,0]=4 2584 B13R1.674 CSCCC(=O)c1ccccc1O 1458a_100015234032_100000751147 [1,1,0,0,0,0|2,0,0]=4 2585 B13R1.674 CSCCC(=O)c1ccccc1O 62a_200000210301_100009873196 [1,1,0,0,0,0|2,0,0]=4 2586 B13R1.674 CSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000751147 [1,1,0,0,0,0|2,0,0]=4 2587 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [1,1,0,0,0,0|2,0,0]=4 2588 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [1,1,0,0,0,0|2,0,0]=4 2589 B13R1.674 Cc1ccccc1C(=O)NCCF 11a_100000724931_100000212026 [1,1,0,0,0,0|2,0,0]=4 2590 B13R1.674 Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000212026 [1,1,0,0,0,0|2,0,0]=4 2591 B13R1.674 Cc1ccccc1C(=O)NCCF 240690a_100000724931_100000212026 [1,1,0,0,0,0|2,0,0]=4 2592 B13R1.674 Cc1ccccc1C(=O)NCCF 527a_100000724931_100000212026 [1,1,0,0,0,0|2,0,0]=4 2593 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [1,1,0,0,0,0|2,0,0]=4 2594 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [1,1,0,0,0,0|2,0,0]=4 2595 B13R1.674 O=C(CCCF)c1ccccc1Br 1458a_100000188424_100011934791 [1,1,0,0,0,0|2,0,0]=4 2596 B13R1.674 O=C(CCCF)c1ccccc1Cl 1458a_100000185844_100011934791 [1,1,0,0,0,0|2,0,0]=4 2597 B13R1.674 O=C(CCCF)c1ccccc1F 1458a_100000188656_100011934791 [1,1,0,0,0,0|2,0,0]=4 2598 B13R1.674 O=C(CCCF)c1ccccc1I 1458a_100000187884_100011934791 [1,1,0,0,0,0|2,0,0]=4 2599 B13R1.674 O=C(CCCF)c1ccccc1O 1458a_100015234032_100011934791 [1,1,0,0,0,0|2,0,0]=4 2600 B13R1.674 O=C(CCCF)c1ccccc1[O-] 1458a_100009911694_100011934791 [1,1,0,0,0,0|2,0,0]=4 2601 B13R1.674 O=C(CCCO)c1ccccc1Br 1458a_100000188424_100011215043 [1,1,0,0,0,0|2,0,0]=4 2602 B13R1.674 O=C(CCCO)c1ccccc1Cl 1458a_100000185844_100011215043 [1,1,0,0,0,0|2,0,0]=4 2603 B13R1.674 O=C(CCCO)c1ccccc1F 1458a_100000188656_100011215043 [1,1,0,0,0,0|2,0,0]=4 2604 B13R1.674 O=C(CCCO)c1ccccc1I 1458a_100000187884_100011215043 [1,1,0,0,0,0|2,0,0]=4 2605 B13R1.674 O=C(CCCO)c1ccccc1O 1458a_100015234032_100011215043 [1,1,0,0,0,0|2,0,0]=4 2606 B13R1.674 O=C(CCCO)c1ccccc1[O-] 1458a_100009911694_100011215043 [1,1,0,0,0,0|2,0,0]=4 2607 B13R1.674 O=C(NCCF)c1ccccc1Br 11a_100000724931_100000188424 [1,1,0,0,0,0|2,0,0]=4 2608 B13R1.674 O=C(NCCF)c1ccccc1Br 1626a_100000724931_100000188424 [1,1,0,0,0,0|2,0,0]=4 2609 B13R1.674 O=C(NCCF)c1ccccc1Br 240690a_100000724931_100000188424 [1,1,0,0,0,0|2,0,0]=4 2610 B13R1.674 O=C(NCCF)c1ccccc1Br 527a_100000724931_100000188424 [1,1,0,0,0,0|2,0,0]=4 2611 B13R1.674 O=C(NCCF)c1ccccc1Cl 11a_100000724931_100000185844 [1,1,0,0,0,0|2,0,0]=4 2612 B13R1.674 O=C(NCCF)c1ccccc1Cl 1626a_100000724931_100000185844 [1,1,0,0,0,0|2,0,0]=4 2613 B13R1.674 O=C(NCCF)c1ccccc1Cl 240690a_100000724931_100000185844 [1,1,0,0,0,0|2,0,0]=4 2614 B13R1.674 O=C(NCCF)c1ccccc1Cl 527a_100000724931_100000185844 [1,1,0,0,0,0|2,0,0]=4 2615 B13R1.674 O=C(NCCF)c1ccccc1F 11a_100000724931_100000188656 [1,1,0,0,0,0|2,0,0]=4 2616 B13R1.674 O=C(NCCF)c1ccccc1F 1626a_100000724931_100000188656 [1,1,0,0,0,0|2,0,0]=4 2617 B13R1.674 O=C(NCCF)c1ccccc1F 240690a_100000724931_100000188656 [1,1,0,0,0,0|2,0,0]=4 2618 B13R1.674 O=C(NCCF)c1ccccc1F 527a_100000724931_100000188656 [1,1,0,0,0,0|2,0,0]=4 2619 B13R1.674 O=C(NCCF)c1ccccc1I 11a_100000724931_100000187884 [1,1,0,0,0,0|2,0,0]=4 2620 B13R1.674 O=C(NCCF)c1ccccc1I 1626a_100000724931_100000187884 [1,1,0,0,0,0|2,0,0]=4 2621 B13R1.674 O=C(NCCF)c1ccccc1I 240690a_100000724931_100000187884 [1,1,0,0,0,0|2,0,0]=4 2622 B13R1.674 O=C(NCCF)c1ccccc1I 527a_100000724931_100000187884 [1,1,0,0,0,0|2,0,0]=4 2623 B13R1.674 O=C(NCCF)c1ccccc1O 240690a_100000724931_100015234032 [1,1,0,0,0,0|2,0,0]=4 2624 B13R1.674 O=C(NCCF)c1ccccc1[O-] 1626a_100000724931_100009911694 [1,1,0,0,0,0|2,0,0]=4 2625 B13R1.674 O=C(NCCF)c1ccccc1[O-] 240690a_100000724931_100009911694 [1,1,0,0,0,0|2,0,0]=4 2626 B13R1.674 O=C(NCCF)c1ccccc1[O-] 527a_100000724931_100009911694 [1,1,0,0,0,0|2,0,0]=4 2627 B13R1.674 O=C(NCCO)c1ccccc1Br 240690a_100000210304_100000188424 [1,1,0,0,0,0|2,0,0]=4 2628 B13R1.674 O=C(NCCO)c1ccccc1Br 527a_100000210304_100000188424 [1,1,0,0,0,0|2,0,0]=4 2629 B13R1.674 O=C(NCCO)c1ccccc1Cl 240690a_100000210304_100000185844 [1,1,0,0,0,0|2,0,0]=4 2630 B13R1.674 O=C(NCCO)c1ccccc1Cl 527a_100000210304_100000185844 [1,1,0,0,0,0|2,0,0]=4 2631 B13R1.674 O=C(NCCO)c1ccccc1F 240690a_100000210304_100000188656 [1,1,0,0,0,0|2,0,0]=4 2632 B13R1.674 O=C(NCCO)c1ccccc1F 527a_100000210304_100000188656 [1,1,0,0,0,0|2,0,0]=4 2633 B13R1.674 O=C(NCCO)c1ccccc1I 240690a_100000210304_100000187884 [1,1,0,0,0,0|2,0,0]=4 2634 B13R1.674 O=C(NCCO)c1ccccc1I 527a_100000210304_100000187884 [1,1,0,0,0,0|2,0,0]=4 2635 B13R1.674 O=C(NCCO)c1ccccc1O 240690a_100000210304_100015234032 [1,1,0,0,0,0|2,0,0]=4 2636 B13R1.674 O=C(NCCO)c1ccccc1O 271570a_203496583355_200000158863 [1,1,0,0,0,0|2,0,0]=4 2637 B13R1.674 O=C(NCCO)c1ccccc1[O-] 240690a_100000210304_100009911694 [1,1,0,0,0,0|2,0,0]=4 2638 B13R1.674 O=C(NCCO)c1ccccc1[O-] 527a_100000210304_100009911694 [1,1,0,0,0,0|2,0,0]=4 2639 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_100000086012_200025704644 [1,1,0,0,0,0|2,0,0]=4 2640 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_200025704644_100000086012 [1,1,0,0,0,0|2,0,0]=4 2641 B13R1.674 [13CH3]SCCC(=O)c1ccccc1O 62a_200025704644_100009873196 [1,1,0,0,0,0|2,0,0]=4 2642 B13R1.149 CC(Br)COCc1cccc(c1)Br 34a_100012180447_100000698116 [1,1,0,0,0,0|1,0,1]=4 2643 B13R1.149 CC(Br)COCc1cccc(c1)Cl 34a_100012180447_100000187163 [1,1,0,0,0,0|1,0,1]=4 2644 B13R1.149 CC(Br)COCc1cccc(c1)F 34a_100012180447_100000187166 [1,1,0,0,0,0|1,0,1]=4 2645 B13R1.149 CC(Br)COCc1cccc(c1)I 34a_100012180447_100011218688 [1,1,0,0,0,0|1,0,1]=4 2646 B13R1.149 CC(Br)COCc1cccc(c1)O 34a_100012180447_100011660834 [1,1,0,0,0,0|1,0,1]=4 2647 B13R1.149 CC(C)CC=Cc1cc(ccn1)Cl 271570a_100016259101_100010167805 [1,1,0,0,0,0|2,0,0]=4 2648 B13R1.149 CC(C)CC=Cc1cc(ccn1)F 271570a_100016259101_100009817058 [1,1,0,0,0,0|2,0,0]=4 2649 B13R1.149 CC(C)CC=Cc1cc(ccn1)N 271570a_100016259101_100009814236 [1,1,0,0,0,0|2,0,0]=4 2650 B13R1.149 CC(C)CC=Cc1cc(ccn1)O 271570a_100016259101_100000762945 [1,1,0,0,0,0|2,0,0]=4 2651 B13R1.149 CC(C)CC=Cc1cc[nH]c(=O)c1 271570a_100016259101_100009816521 [1,1,0,0,0,0|2,0,0]=4 2652 B13R1.149 CC(C)CC=Cc1ccc[n+](c1)C 271570a_100016259101_100009996589 [1,1,0,0,0,0|2,0,0]=4 2653 B13R1.149 CC(C)CC=Cc1ccc[n+](c1)[O-] 271570a_100016259101_100009815978 [1,1,0,0,0,0|2,0,0]=4 2654 B13R1.149 CC(C)CC=Cc1cccc(=O)[nH]1 271570a_100016259101_100000761760 [1,1,0,0,0,0|2,0,0]=4 2655 B13R1.149 CC(C)CC=Cc1cccc(c1)Br 271570a_100016259101_100000691529 [1,1,0,0,0,0|1,0,0]=3 2656 B13R1.149 CC(C)CC=Cc1cccc(c1)Cl 271570a_100016259101_100000699651 [1,1,0,0,0,0|1,0,0]=3 2657 B13R1.149 CC(C)CC=Cc1cccc(c1)F 271570a_100016259101_100000685547 [1,1,0,0,0,0|1,0,0]=3 2658 B13R1.149 CC(C)CC=Cc1cccc(c1)N 271570a_100016259101_100000210019 [1,1,0,0,0,0|1,0,0]=3 2659 B13R1.149 CC(C)CC=Cc1cccc(c1)O 271570a_100016259101_100000211634 [1,1,0,0,0,0|1,0,0]=3 2660 B13R1.149 CC(C)CC=Cc1cccc(c1)[S] 271570a_100016259101_114929384022 [1,1,0,0,0,0|1,0,0]=3 2661 B13R1.149 CC(C)CC=Cc1cccc(n1)Br 271570a_100016259101_100000684672 [1,1,0,0,0,0|2,0,0]=4 2662 B13R1.149 CC(C)CC=Cc1cccc(n1)F 271570a_100016259101_100009815982 [1,1,0,0,0,0|2,0,0]=4 2663 B13R1.149 CC(C)CC=Cc1cccc(n1)N 271570a_100016259101_100000740741 [1,1,0,0,0,0|2,0,0]=4 2664 B13R1.149 CC(C)CC=Cc1ccnc(c1)Br 271570a_100016259101_100009814637 [1,1,0,0,0,0|2,0,0]=4 2665 B13R1.149 CC(C)CC=Cc1ccnc(c1)Cl 271570a_100016259101_100000035001 [1,1,0,0,0,0|2,0,0]=4 2666 B13R1.149 CC(C)CC=Cc1ccnc(c1)F 271570a_100016259101_100009816116 [1,1,0,0,0,0|2,0,0]=4 2667 B13R1.149 CC(C)CC=Cc1ccnc(c1)N 271570a_100016259101_100000744379 [1,1,0,0,0,0|2,0,0]=4 2668 B13R1.149 CC(C)CC=Cc1cncc(c1)Br 271570a_100016259101_100000728054 [1,1,0,0,0,0|2,0,0]=4 2669 B13R1.149 CC(C)CC=Cc1cncc(c1)Cl 271570a_100016259101_100000049639 [1,1,0,0,0,0|2,0,0]=4 2670 B13R1.149 CC(C)CC=Cc1cncc(c1)F 271570a_100016259101_100000744099 [1,1,0,0,0,0|2,0,0]=4 2671 B13R1.149 CC(C)CC=Cc1cncc(c1)N 271570a_100016259101_100000687067 [1,1,0,0,0,0|2,0,0]=4 2672 B13R1.149 CC(C)CC=Cc1cncc(c1)O 271570a_100016259101_100000754920 [1,1,0,0,0,0|2,0,0]=4 2673 B13R1.149 CC(C)CCNc1cccc(c1)Br 34a_100000210019_100000210312 [1,1,0,0,0,0|2,0,0]=4 2674 B13R1.149 CC(C)CCNc1cccc(c1)Cl 34a_100000185859_100000210312 [1,1,0,0,0,0|2,0,0]=4 2675 B13R1.149 CC(C)CCNc1cccc(c1)F 34a_100000210047_100000210312 [1,1,0,0,0,0|2,0,0]=4 2676 B13R1.149 CC(C)CCNc1cccc(c1)I 34a_100000211102_100000210312 [1,1,0,0,0,0|2,0,0]=4 2677 B13R1.149 CC(C)CCNc1cccc(c1)O 34a_100000210217_100000210312 [1,1,0,0,0,0|2,0,0]=4 2678 B13R1.149 CC(C)CCOc1cccc(c1)Br 34a_100000210342_100000210312 [1,1,0,0,0,0|2,0,0]=4 2679 B13R1.149 CC(C)CCOc1cccc(c1)Br 7a_100000210342_100000210626 [1,1,0,0,0,0|2,0,0]=4 2680 B13R1.149 CC(C)CCOc1cccc(c1)Cl 34a_100000210295_100000210312 [1,1,0,0,0,0|2,0,0]=4 2681 B13R1.149 CC(C)CCOc1cccc(c1)Cl 7a_100000210295_100000210626 [1,1,0,0,0,0|2,0,0]=4 2682 B13R1.149 CC(C)CCOc1cccc(c1)F 34a_100000210426_100000210312 [1,1,0,0,0,0|2,0,0]=4 2683 B13R1.149 CC(C)CCOc1cccc(c1)F 7a_100000210426_100000210626 [1,1,0,0,0,0|2,0,0]=4 2684 B13R1.149 CC(C)CCOc1cccc(c1)I 34a_100000211634_100000210312 [1,1,0,0,0,0|2,0,0]=4 2685 B13R1.149 CC(C)CCOc1cccc(c1)I 7a_100000211634_100000210626 [1,1,0,0,0,0|2,0,0]=4 2686 B13R1.149 CC(C)CCOc1cccc(c1)N 34a_100000210217_100000210312 [1,1,0,0,0,0|2,0,0]=4 2687 B13R1.149 CC(C)CCSc1cccc(c1)Br 62a_100000210312_100000691529 [1,1,0,0,0,0|2,0,0]=4 2688 B13R1.149 CC(C)CCSc1cccc(c1)Br 62a_100000691529_100000210312 [1,1,0,0,0,0|2,0,0]=4 2689 B13R1.149 CC(C)CCSc1cccc(c1)Cl 62a_100000210312_100000699651 [1,1,0,0,0,0|2,0,0]=4 2690 B13R1.149 CC(C)CCSc1cccc(c1)Cl 62a_100000699651_100000210312 [1,1,0,0,0,0|2,0,0]=4 2691 B13R1.149 CC(C)CCSc1cccc(c1)F 62a_100000210312_100000685547 [1,1,0,0,0,0|2,0,0]=4 2692 B13R1.149 CC(C)CCSc1cccc(c1)F 62a_100000685547_100000210312 [1,1,0,0,0,0|2,0,0]=4 2693 B13R1.149 CC(C)CCSc1cccc(c1)N 62a_100000210019_100000210312 [1,1,0,0,0,0|2,0,0]=4 2694 B13R1.149 CC(C)CCSc1cccc(c1)N 62a_100000210312_100000210019 [1,1,0,0,0,0|2,0,0]=4 2695 B13R1.149 CC(C)CCSc1cccc(c1)O 62a_100000210312_100000211634 [1,1,0,0,0,0|2,0,0]=4 2696 B13R1.149 CC(C)CCSc1cccc(c1)[S] 62a_100000210312_114929384022 [1,1,0,0,0,0|2,0,0]=4 2697 B13R1.149 CC(C)CCSc1cccc(c1)[S] 62a_114929384022_100000210312 [1,1,0,0,0,0|2,0,0]=4 2698 B13R1.149 CC(C)CNCc1cccc(c1)Br 207a_100000210953_100000210085 [1,1,0,0,0,0|1,0,1]=4 2699 B13R1.149 CC(C)CNCc1cccc(c1)Br 2230a_100000174977_100000210760 [1,1,0,0,0,0|1,0,1]=4 2700 B13R1.149 CC(C)CNCc1cccc(c1)Br 2230a_100000210953_100000698116 [1,1,0,0,0,0|1,0,1]=4 2701 B13R1.149 CC(C)CNCc1cccc(c1)Br 26a_100000210953_100000210342 [1,1,0,0,0,0|1,0,1]=4 2702 B13R1.149 CC(C)CNCc1cccc(c1)Br 270004a_100000174977_100000210432 [1,1,0,0,0,0|1,0,1]=4 2703 B13R1.149 CC(C)CNCc1cccc(c1)Br 270004a_100000210953_100000210085 [1,1,0,0,0,0|1,0,1]=4 2704 B13R1.149 CC(C)CNCc1cccc(c1)Br 34a_100000174977_100000210624 [1,1,0,0,0,0|1,0,1]=4 2705 B13R1.149 CC(C)CNCc1cccc(c1)Br 34a_100000210953_100000698116 [1,1,0,0,0,0|1,0,1]=4 2706 B13R1.149 CC(C)CNCc1cccc(c1)Cl 207a_100000210953_100000210801 [1,1,0,0,0,0|1,0,1]=4 2707 B13R1.149 CC(C)CNCc1cccc(c1)Cl 2230a_100000174878_100000210760 [1,1,0,0,0,0|1,0,1]=4 2708 B13R1.149 CC(C)CNCc1cccc(c1)Cl 2230a_100000210953_100000181238 [1,1,0,0,0,0|1,0,1]=4 2709 B13R1.149 CC(C)CNCc1cccc(c1)Cl 270004a_100000174878_100000210432 [1,1,0,0,0,0|1,0,1]=4 2710 B13R1.149 CC(C)CNCc1cccc(c1)Cl 270004a_100000210953_100000210801 [1,1,0,0,0,0|1,0,1]=4 2711 B13R1.149 CC(C)CNCc1cccc(c1)Cl 34a_100000174878_100000210624 [1,1,0,0,0,0|1,0,1]=4 2712 B13R1.149 CC(C)CNCc1cccc(c1)Cl 34a_100000210953_100000187163 [1,1,0,0,0,0|1,0,1]=4 2713 B13R1.149 CC(C)CNCc1cccc(c1)F 207a_100000210953_100000210812 [1,1,0,0,0,0|1,0,1]=4 2714 B13R1.149 CC(C)CNCc1cccc(c1)F 2230a_100000174948_100000210760 [1,1,0,0,0,0|1,0,1]=4 2715 B13R1.149 CC(C)CNCc1cccc(c1)F 2230a_100000210953_100000230114 [1,1,0,0,0,0|1,0,1]=4 2716 B13R1.149 CC(C)CNCc1cccc(c1)F 270004a_100000174948_100000210432 [1,1,0,0,0,0|1,0,1]=4 2717 B13R1.149 CC(C)CNCc1cccc(c1)F 270004a_100000210953_100000210812 [1,1,0,0,0,0|1,0,1]=4 2718 B13R1.149 CC(C)CNCc1cccc(c1)F 34a_100000174948_100000210624 [1,1,0,0,0,0|1,0,1]=4 2719 B13R1.149 CC(C)CNCc1cccc(c1)F 34a_100000210953_100000187166 [1,1,0,0,0,0|1,0,1]=4 2720 B13R1.149 CC(C)CNCc1cccc(c1)I 207a_100000210953_100000014684 [1,1,0,0,0,0|1,0,1]=4 2721 B13R1.149 CC(C)CNCc1cccc(c1)I 2230a_100000106179_100000210760 [1,1,0,0,0,0|1,0,1]=4 2722 B13R1.149 CC(C)CNCc1cccc(c1)I 2230a_100000210953_100011218688 [1,1,0,0,0,0|1,0,1]=4 2723 B13R1.149 CC(C)CNCc1cccc(c1)I 270004a_100000106179_100000210432 [1,1,0,0,0,0|1,0,1]=4 2724 B13R1.149 CC(C)CNCc1cccc(c1)I 270004a_100000210953_100000014684 [1,1,0,0,0,0|1,0,1]=4 2725 B13R1.149 CC(C)CNCc1cccc(c1)I 34a_100000106179_100000210624 [1,1,0,0,0,0|1,0,1]=4 2726 B13R1.149 CC(C)CNCc1cccc(c1)I 34a_100000210953_100011218688 [1,1,0,0,0,0|1,0,1]=4 2727 B13R1.149 CC(C)CNCc1cccc(c1)O 207a_100000210953_100000188321 [1,1,0,0,0,0|1,0,1]=4 2728 B13R1.149 CC(C)CNCc1cccc(c1)O 2230a_100000210953_100011660834 [1,1,0,0,0,0|1,0,1]=4 2729 B13R1.149 CC(C)CNCc1cccc(c1)O 2230a_100000743036_100000210760 [1,1,0,0,0,0|1,0,1]=4 2730 B13R1.149 CC(C)CNCc1cccc(c1)O 270004a_100000210953_100000188321 [1,1,0,0,0,0|1,0,1]=4 2731 B13R1.149 CC(C)CNCc1cccc(c1)O 270004a_100000743036_100000210432 [1,1,0,0,0,0|1,0,1]=4 2732 B13R1.149 CC(C)CNCc1cccc(c1)O 271570a_203496583355_100015187148 [1,1,0,0,0,0|1,0,1]=4 2733 B13R1.149 CC(C)CNCc1cccc(c1)O 34a_100000210953_100011660834 [1,1,0,0,0,0|1,0,1]=4 2734 B13R1.149 CC(C)CNCc1cccc(c1)O 34a_100000743036_100000210624 [1,1,0,0,0,0|1,0,1]=4 2735 B13R1.149 CC(C)COCc1cc(ccn1)Br 34a_100000210257_100010173614 [1,1,0,0,0,0|1,0,1]=4 2736 B13R1.149 CC(C)COCc1cc(ccn1)Cl 34a_100000210257_100016988179 [1,1,0,0,0,0|1,0,1]=4 2737 B13R1.149 CC(C)COCc1cc(ccn1)Cl 34a_100000748867_100000210624 [1,1,0,0,0,0|1,0,1]=4 2738 B13R1.149 CC(C)COCc1cc(ccn1)N 34a_100000692640_100000210624 [1,1,0,0,0,0|1,0,1]=4 2739 B13R1.149 CC(C)COCc1ccc[n+](c1)[O-] 34a_100000037817_100000210624 [1,1,0,0,0,0|1,0,1]=4 2740 B13R1.149 CC(C)COCc1ccc[n+](c1)[O-] 7a_100000037817_100000210760 [1,1,0,0,0,0|1,0,1]=4 2741 B13R1.149 CC(C)COCc1cccc(c1)Br 34a_100000210257_100000698116 [1,1,0,0,0,0|0,0,1]=3 2742 B13R1.149 CC(C)COCc1cccc(c1)Br 34a_100000687537_100000210624 [1,1,0,0,0,0|0,0,1]=3 2743 B13R1.149 CC(C)COCc1cccc(c1)Br 7a_100000687537_100000210760 [1,1,0,0,0,0|0,0,1]=3 2744 B13R1.149 CC(C)COCc1cccc(c1)Cl 34a_100000210257_100000187163 [1,1,0,0,0,0|0,0,1]=3 2745 B13R1.149 CC(C)COCc1cccc(c1)Cl 34a_100000241301_100000210624 [1,1,0,0,0,0|0,0,1]=3 2746 B13R1.149 CC(C)COCc1cccc(c1)Cl 7a_100000241301_100000210760 [1,1,0,0,0,0|0,0,1]=3 2747 B13R1.149 CC(C)COCc1cccc(c1)F 34a_100000210257_100000187166 [1,1,0,0,0,0|0,0,1]=3 2748 B13R1.149 CC(C)COCc1cccc(c1)F 34a_100000210976_100000210624 [1,1,0,0,0,0|0,0,1]=3 2749 B13R1.149 CC(C)COCc1cccc(c1)F 7a_100000210976_100000210760 [1,1,0,0,0,0|0,0,1]=3 2750 B13R1.149 CC(C)COCc1cccc(c1)I 34a_100000210257_100011218688 [1,1,0,0,0,0|0,0,1]=3 2751 B13R1.149 CC(C)COCc1cccc(c1)I 34a_100011215336_100000210624 [1,1,0,0,0,0|0,0,1]=3 2752 B13R1.149 CC(C)COCc1cccc(c1)I 7a_100011215336_100000210760 [1,1,0,0,0,0|0,0,1]=3 2753 B13R1.149 CC(C)COCc1cccc(c1)N 34a_100000211919_100000210624 [1,1,0,0,0,0|0,0,1]=3 2754 B13R1.149 CC(C)COCc1cccc(c1)O 34a_100000210257_100011660834 [1,1,0,0,0,0|0,0,1]=3 2755 B13R1.149 CC(C)COCc1cccc(n1)Br 34a_100000210257_100009889011 [1,1,0,0,0,0|1,0,1]=4 2756 B13R1.149 CC(C)COCc1cccc(n1)Br 34a_100000694195_100000210624 [1,1,0,0,0,0|1,0,1]=4 2757 B13R1.149 CC(C)COCc1cccc(n1)Cl 34a_100000210257_100000086093 [1,1,0,0,0,0|1,0,1]=4 2758 B13R1.149 CC(C)COCc1cccc(n1)Cl 34a_100011998359_100000210624 [1,1,0,0,0,0|1,0,1]=4 2759 B13R1.149 CC(C)COCc1cccc(n1)F 34a_100000086748_100000210624 [1,1,0,0,0,0|1,0,1]=4 2760 B13R1.149 CC(C)COCc1cccc(n1)F 34a_100000210257_100009819644 [1,1,0,0,0,0|1,0,1]=4 2761 B13R1.149 CC(C)COCc1ccnc(c1)Br 34a_100000210257_100010243470 [1,1,0,0,0,0|1,0,1]=4 2762 B13R1.149 CC(C)COCc1ccnc(c1)Br 34a_100009814636_100000210624 [1,1,0,0,0,0|1,0,1]=4 2763 B13R1.149 CC(C)COCc1ccnc(c1)Br 7a_100009814636_100000210760 [1,1,0,0,0,0|1,0,1]=4 2764 B13R1.149 CC(C)COCc1ccnc(c1)Cl 34a_100000210257_100000764220 [1,1,0,0,0,0|1,0,1]=4 2765 B13R1.149 CC(C)COCc1ccnc(c1)Cl 34a_100000748751_100000210624 [1,1,0,0,0,0|1,0,1]=4 2766 B13R1.149 CC(C)COCc1ccnc(c1)F 34a_100000082451_100000210624 [1,1,0,0,0,0|1,0,1]=4 2767 B13R1.149 CC(C)COCc1cncc(c1)Br 34a_100000210257_100000738771 [1,1,0,0,0,0|1,0,1]=4 2768 B13R1.149 CC(C)COCc1cncc(c1)Br 34a_100011259137_100000210624 [1,1,0,0,0,0|1,0,1]=4 2769 B13R1.149 CC(C)COCc1cncc(c1)Br 7a_100011259137_100000210760 [1,1,0,0,0,0|1,0,1]=4 2770 B13R1.149 CC(C)COCc1cncc(c1)Cl 34a_100000092867_100000210624 [1,1,0,0,0,0|1,0,1]=4 2771 B13R1.149 CC(C)COCc1cncc(c1)Cl 34a_100000210257_100016992070 [1,1,0,0,0,0|1,0,1]=4 2772 B13R1.149 CC(C)COCc1cncc(c1)Cl 7a_100000092867_100000210760 [1,1,0,0,0,0|1,0,1]=4 2773 B13R1.149 CC(C)COCc1cncc(c1)F 34a_100000210257_100000725299 [1,1,0,0,0,0|1,0,1]=4 2774 B13R1.149 CC(C)COCc1cncc(c1)F 34a_100011962875_100000210624 [1,1,0,0,0,0|1,0,1]=4 2775 B13R1.149 CC(C)COCc1cncc(c1)F 7a_100011962875_100000210760 [1,1,0,0,0,0|1,0,1]=4 2776 B13R1.149 CC(C)COCc1cncc(c1)N 34a_100000085308_100000210624 [1,1,0,0,0,0|1,0,1]=4 2777 B13R1.149 CC(C)CSCc1cccc(c1)Br 62a_100000210624_100000211773 [1,1,0,0,0,0|0,1,1]=4 2778 B13R1.149 CC(C)CSCc1cccc(c1)Br 62a_100000211773_100000210760 [1,1,0,0,0,0|0,1,1]=4 2779 B13R1.149 CC(C)CSCc1cccc(c1)Cl 62a_100000187163_100000210760 [1,1,0,0,0,0|0,1,1]=4 2780 B13R1.149 CC(C)CSCc1cccc(c1)Cl 62a_100000210624_100000187163 [1,1,0,0,0,0|0,1,1]=4 2781 B13R1.149 CC(C)CSCc1cccc(c1)F 62a_100000210624_100000230114 [1,1,0,0,0,0|0,1,1]=4 2782 B13R1.149 CC(C)CSCc1cccc(c1)F 62a_100000230114_100000210760 [1,1,0,0,0,0|0,1,1]=4 2783 B13R1.149 CC(C)CSCc1cccc(c1)I 62a_100000210624_100011218688 [1,1,0,0,0,0|0,1,1]=4 2784 B13R1.149 CC(C)CSCc1cccc(c1)I 62a_100011218688_100000210760 [1,1,0,0,0,0|0,1,1]=4 2785 B13R1.149 CC(C)CSCc1cccc(c1)O 62a_100000210624_100011660834 [1,1,0,0,0,0|0,1,1]=4 2786 B13R1.149 CC(C)CSCc1cccc(c1)O 62a_100011660834_100000210760 [1,1,0,0,0,0|0,1,1]=4 2787 B13R1.149 CC(C)NN=Cc1cccc(c1)Br 4a_100000741168_100000210085 [1,1,0,0,0,0|2,0,0]=4 2788 B13R1.149 CC(C)NN=Cc1cccc(c1)Cl 4a_100000741168_100000210801 [1,1,0,0,0,0|2,0,0]=4 2789 B13R1.149 CC(C)NN=Cc1cccc(c1)F 4a_100000741168_100000210812 [1,1,0,0,0,0|2,0,0]=4 2790 B13R1.149 CC(C)NN=Cc1cccc(c1)I 4a_100000741168_100000014684 [1,1,0,0,0,0|2,0,0]=4 2791 B13R1.149 CC(C)NN=Cc1cccc(c1)O 4a_100000741168_100000188321 [1,1,0,0,0,0|2,0,0]=4 2792 B13R1.149 CC(F)COCc1cccc(c1)Br 34a_100015925927_100000698116 [1,1,0,0,0,0|1,0,1]=4 2793 B13R1.149 CC(F)COCc1cccc(c1)Cl 34a_100015925927_100000187163 [1,1,0,0,0,0|1,0,1]=4 2794 B13R1.149 CC(F)COCc1cccc(c1)F 34a_100015925927_100000187166 [1,1,0,0,0,0|1,0,1]=4 2795 B13R1.149 CC(F)COCc1cccc(c1)I 34a_100015925927_100011218688 [1,1,0,0,0,0|1,0,1]=4 2796 B13R1.149 CC(F)COCc1cccc(c1)O 34a_100015925927_100011660834 [1,1,0,0,0,0|1,0,1]=4 2797 B13R1.149 CC(O)COCc1cccc(c1)Br 34a_100000687537_100011218427 [1,1,0,0,0,0|1,0,1]=4 2798 B13R1.149 CC(O)COCc1cccc(c1)Br 7a_100000687537_100011218427 [1,1,0,0,0,0|1,0,1]=4 2799 B13R1.149 CC(O)COCc1cccc(c1)Cl 34a_100000241301_100011218427 [1,1,0,0,0,0|1,0,1]=4 2800 B13R1.149 CC(O)COCc1cccc(c1)Cl 7a_100000241301_100011218427 [1,1,0,0,0,0|1,0,1]=4 2801 B13R1.149 CC(O)COCc1cccc(c1)F 34a_100000210976_100011218427 [1,1,0,0,0,0|1,0,1]=4 2802 B13R1.149 CC(O)COCc1cccc(c1)F 7a_100000210976_100011218427 [1,1,0,0,0,0|1,0,1]=4 2803 B13R1.149 CC(O)COCc1cccc(c1)I 34a_100011215336_100011218427 [1,1,0,0,0,0|1,0,1]=4 2804 B13R1.149 CC(O)COCc1cccc(c1)I 7a_100011215336_100011218427 [1,1,0,0,0,0|1,0,1]=4 2805 B13R1.149 CC(O)COCc1cccc(c1)N 34a_100000211919_100011218427 [1,1,0,0,0,0|1,0,1]=4 2806 B13R1.149 CN(C)CC=Cc1cccc(c1)Cl 270004a_100102631434_100016268971 [1,1,0,0,0,0|2,0,0]=4 2807 B13R1.149 C[C@@H](Cl)COCc1cccc(c1)Br 34a_100016084084_100000698116 [1,1,0,0,0,0|1,0,1]=4 2808 B13R1.149 C[C@@H](Cl)COCc1cccc(c1)Cl 34a_100016084084_100000187163 [1,1,0,0,0,0|1,0,1]=4 2809 B13R1.149 C[C@@H](Cl)COCc1cccc(c1)F 34a_100016084084_100000187166 [1,1,0,0,0,0|1,0,1]=4 2810 B13R1.149 C[C@@H](Cl)COCc1cccc(c1)I 34a_100016084084_100011218688 [1,1,0,0,0,0|1,0,1]=4 2811 B13R1.149 C[C@@H](Cl)COCc1cccc(c1)O 34a_100016084084_100011660834 [1,1,0,0,0,0|1,0,1]=4 2812 B13R1.149 C[C@@H](N)COCc1cccc(c1)Br 34a_100000737577_100000698116 [1,1,0,0,0,0|1,0,1]=4 2813 B13R1.149 C[C@@H](N)COCc1cccc(c1)Cl 34a_100000737577_100000187163 [1,1,0,0,0,0|1,0,1]=4 2814 B13R1.149 C[C@@H](N)COCc1cccc(c1)F 34a_100000737577_100000187166 [1,1,0,0,0,0|1,0,1]=4 2815 B13R1.149 C[C@@H](N)COCc1cccc(c1)I 34a_100000737577_100011218688 [1,1,0,0,0,0|1,0,1]=4 2816 B13R1.149 C[C@@H](N)COCc1cccc(c1)O 34a_100000737577_100011660834 [1,1,0,0,0,0|1,0,1]=4 2817 B13R1.149 C[C@@H](O)COCc1cccc(c1)Br 34a_100000687537_100009817552 [1,1,0,0,0,0|1,0,1]=4 2818 B13R1.149 C[C@@H](O)COCc1cccc(c1)Br 7a_100000687537_100009817552 [1,1,0,0,0,0|1,0,1]=4 2819 B13R1.149 C[C@@H](O)COCc1cccc(c1)Cl 34a_100000241301_100009817552 [1,1,0,0,0,0|1,0,1]=4 2820 B13R1.149 C[C@@H](O)COCc1cccc(c1)Cl 7a_100000241301_100009817552 [1,1,0,0,0,0|1,0,1]=4 2821 B13R1.149 C[C@@H](O)COCc1cccc(c1)F 34a_100000210976_100009817552 [1,1,0,0,0,0|1,0,1]=4 2822 B13R1.149 C[C@@H](O)COCc1cccc(c1)F 7a_100000210976_100009817552 [1,1,0,0,0,0|1,0,1]=4 2823 B13R1.149 C[C@@H](O)COCc1cccc(c1)I 34a_100011215336_100009817552 [1,1,0,0,0,0|1,0,1]=4 2824 B13R1.149 C[C@@H](O)COCc1cccc(c1)I 7a_100011215336_100009817552 [1,1,0,0,0,0|1,0,1]=4 2825 B13R1.149 C[C@@H](O)COCc1cccc(c1)N 34a_100000211919_100009817552 [1,1,0,0,0,0|1,0,1]=4 2826 B13R1.149 Cc1cc(ccn1)C=CCC(C)C 271570a_100016259101_100000758586 [1,1,0,0,0,0|2,0,0]=4 2827 B13R1.149 Cc1cc(ccn1)COCC(C)C 34a_100000210257_200020672517 [1,1,0,0,0,0|1,0,1]=4 2828 B13R1.149 Cc1cc(ccn1)COCC(C)C 34a_100011998630_100000210624 [1,1,0,0,0,0|1,0,1]=4 2829 B13R1.149 Cc1cccc(c1)C=CCC(C)C 271570a_100016259101_100011215228 [1,1,0,0,0,0|1,0,0]=3 2830 B13R1.149 Cc1cccc(c1)C=CCN(C)C 270004a_100102631434_100102525846 [1,1,0,0,0,0|2,0,0]=4 2831 B13R1.149 Cc1cccc(c1)C=NNC(C)C 4a_100000741168_100000211157 [1,1,0,0,0,0|2,0,0]=4 2832 B13R1.149 Cc1cccc(c1)CNCC(C)C 207a_100000210953_100000211157 [1,1,0,0,0,0|1,0,1]=4 2833 B13R1.149 Cc1cccc(c1)CNCC(C)C 2230a_100000185548_100000210760 [1,1,0,0,0,0|1,0,1]=4 2834 B13R1.149 Cc1cccc(c1)CNCC(C)C 2230a_100000210953_100000211840 [1,1,0,0,0,0|1,0,1]=4 2835 B13R1.149 Cc1cccc(c1)CNCC(C)C 270004a_100000185548_100000210432 [1,1,0,0,0,0|1,0,1]=4 2836 B13R1.149 Cc1cccc(c1)CNCC(C)C 270004a_100000210953_100000211157 [1,1,0,0,0,0|1,0,1]=4 2837 B13R1.149 Cc1cccc(c1)CNCC(C)C 34a_100000185548_100000210624 [1,1,0,0,0,0|1,0,1]=4 2838 B13R1.149 Cc1cccc(c1)CNCC(C)C 34a_100000210953_100000211840 [1,1,0,0,0,0|1,0,1]=4 2839 B13R1.149 Cc1cccc(c1)COCC(C)Br 34a_100012180447_100000211840 [1,1,0,0,0,0|1,0,1]=4 2840 B13R1.149 Cc1cccc(c1)COCC(C)C 34a_100000210257_100000211840 [1,1,0,0,0,0|0,0,1]=3 2841 B13R1.149 Cc1cccc(c1)COCC(C)C 34a_100011217746_100000210624 [1,1,0,0,0,0|0,0,1]=3 2842 B13R1.149 Cc1cccc(c1)COCC(C)C 7a_100011217746_100000210760 [1,1,0,0,0,0|0,0,1]=3 2843 B13R1.149 Cc1cccc(c1)COCC(C)F 34a_100015925927_100000211840 [1,1,0,0,0,0|1,0,1]=4 2844 B13R1.149 Cc1cccc(c1)COCC(C)O 34a_100011217746_100011218427 [1,1,0,0,0,0|1,0,1]=4 2845 B13R1.149 Cc1cccc(c1)COCC(C)O 7a_100011217746_100011218427 [1,1,0,0,0,0|1,0,1]=4 2846 B13R1.149 Cc1cccc(c1)COC[C@@H](C)Cl 34a_100016084084_100000211840 [1,1,0,0,0,0|1,0,1]=4 2847 B13R1.149 Cc1cccc(c1)COC[C@@H](C)N 34a_100000737577_100000211840 [1,1,0,0,0,0|1,0,1]=4 2848 B13R1.149 Cc1cccc(c1)COC[C@@H](C)O 34a_100011217746_100009817552 [1,1,0,0,0,0|1,0,1]=4 2849 B13R1.149 Cc1cccc(c1)COC[C@@H](C)O 7a_100011217746_100009817552 [1,1,0,0,0,0|1,0,1]=4 2850 B13R1.149 Cc1cccc(c1)CSCC(C)C 62a_100000210624_100000211840 [1,1,0,0,0,0|0,1,1]=4 2851 B13R1.149 Cc1cccc(c1)CSCC(C)C 62a_100000211840_100000210760 [1,1,0,0,0,0|0,1,1]=4 2852 B13R1.149 Cc1cccc(c1)NCCC(C)C 2230a_100000188690_100000210312 [1,1,0,0,0,0|2,0,0]=4 2853 B13R1.149 Cc1cccc(c1)NCCC(C)C 34a_100000188690_100000210312 [1,1,0,0,0,0|2,0,0]=4 2854 B13R1.149 Cc1cccc(c1)OCCC(C)C 34a_100000210337_100000210312 [1,1,0,0,0,0|2,0,0]=4 2855 B13R1.149 Cc1cccc(c1)OCCC(C)C 7a_100000210337_100000210626 [1,1,0,0,0,0|2,0,0]=4 2856 B13R1.149 Cc1cccc(c1)SCCC(C)C 62a_100000210312_100011215228 [1,1,0,0,0,0|2,0,0]=4 2857 B13R1.149 Cc1cccc(c1)SCCC(C)C 62a_100011215228_100000210312 [1,1,0,0,0,0|2,0,0]=4 2858 B13R1.149 Cc1cccc(n1)C=CCC(C)C 271570a_100016259101_100000742759 [1,1,0,0,0,0|2,0,0]=4 2859 B13R1.149 Cc1cccc(n1)COCC(C)C 34a_100000210257_100000757606 [1,1,0,0,0,0|1,0,1]=4 2860 B13R1.149 Cc1cccc(n1)COCC(C)C 34a_100000690600_100000210624 [1,1,0,0,0,0|1,0,1]=4 2861 B13R1.149 Cc1ccnc(c1)C=CCC(C)C 271570a_100016259101_100000750283 [1,1,0,0,0,0|2,0,0]=4 2862 B13R1.149 Cc1ccnc(c1)COCC(C)C 34a_100000210257_100000718516 [1,1,0,0,0,0|1,0,1]=4 2863 B13R1.149 Cc1ccnc(c1)COCC(C)C 34a_100011998357_100000210624 [1,1,0,0,0,0|1,0,1]=4 2864 B13R1.149 Cc1cncc(c1)C=CCC(C)C 271570a_100016259101_100000760492 [1,1,0,0,0,0|2,0,0]=4 2865 B13R1.149 Cc1cncc(c1)COCC(C)C 34a_100000210257_100000716715 [1,1,0,0,0,0|1,0,1]=4 2866 B13R1.149 Cc1cncc(c1)COCC(C)C 34a_100011998709_100000210624 [1,1,0,0,0,0|1,0,1]=4 2867 B13R1.149 Cc1cncc(c1)COCC(C)C 7a_100011998709_100000210760 [1,1,0,0,0,0|1,0,1]=4 2868 B13R1.158 CC(Br)COCc1ccccc1Br 34a_100012180447_100000184730 [1,1,0,0,0,0|1,0,1]=4 2869 B13R1.158 CC(Br)COCc1ccccc1Cl 34a_100012180447_100000187162 [1,1,0,0,0,0|1,0,1]=4 2870 B13R1.158 CC(Br)COCc1ccccc1F 34a_100012180447_100000211605 [1,1,0,0,0,0|1,0,1]=4 2871 B13R1.158 CC(Br)COCc1ccccc1I 34a_100012180447_100011215278 [1,1,0,0,0,0|1,0,1]=4 2872 B13R1.158 CC(C)CC=Cc1c[nH]ccc1=O 271570a_100016259101_100009998708 [1,1,0,0,0,0|2,0,0]=4 2873 B13R1.158 CC(C)CC=Cc1c[nH]ccc1=S 271570a_100016259101_200012280681 [1,1,0,0,0,0|2,0,0]=4 2874 B13R1.158 CC(C)CC=Cc1ccc[nH]c1=O 271570a_100016259101_100000050042 [1,1,0,0,0,0|2,0,0]=4 2875 B13R1.158 CC(C)CC=Cc1cccc[n+]1C 271570a_100016259101_100000212160 [1,1,0,0,0,0|2,0,0]=4 2876 B13R1.158 CC(C)CC=Cc1cccc[n+]1[O-] 271570a_100016259101_200000042595 [1,1,0,0,0,0|2,0,0]=4 2877 B13R1.158 CC(C)CC=Cc1ccccc1Br 271570a_100016259101_100000695589 [1,1,0,0,0,0|1,0,0]=3 2878 B13R1.158 CC(C)CC=Cc1ccccc1Cl 271570a_100016259101_100000764095 [1,1,0,0,0,0|1,0,0]=3 2879 B13R1.158 CC(C)CC=Cc1ccccc1F 271570a_100016259101_100011215700 [1,1,0,0,0,0|1,0,0]=3 2880 B13R1.158 CC(C)CC=Cc1ccccc1N 271570a_100016259101_100000210017 [1,1,0,0,0,0|1,0,0]=3 2881 B13R1.158 CC(C)CC=Cc1ccccc1O 271570a_100016259101_100000739446 [1,1,0,0,0,0|1,0,0]=3 2882 B13R1.158 CC(C)CC=Cc1cccnc1Br 271570a_100016259101_100010202626 [1,1,0,0,0,0|2,0,0]=4 2883 B13R1.158 CC(C)CC=Cc1cccnc1Cl 271570a_100016259101_100000036424 [1,1,0,0,0,0|2,0,0]=4 2884 B13R1.158 CC(C)CC=Cc1cccnc1F 271570a_100016259101_100009816115 [1,1,0,0,0,0|2,0,0]=4 2885 B13R1.158 CC(C)CC=Cc1cccnc1N 271570a_100016259101_100000045569 [1,1,0,0,0,0|2,0,0]=4 2886 B13R1.158 CC(C)CC=Cc1ccncc1Br 271570a_100016259101_100000726257 [1,1,0,0,0,0|2,0,0]=4 2887 B13R1.158 CC(C)CC=Cc1ccncc1Cl 271570a_100016259101_100000708259 [1,1,0,0,0,0|2,0,0]=4 2888 B13R1.158 CC(C)CC=Cc1ccncc1F 271570a_100016259101_100000047030 [1,1,0,0,0,0|2,0,0]=4 2889 B13R1.158 CC(C)CC=Cc1ccncc1N 271570a_100016259101_100009815883 [1,1,0,0,0,0|2,0,0]=4 2890 B13R1.158 CC(C)CC=Cc1ccncc1O 271570a_100016259101_100009817591 [1,1,0,0,0,0|2,0,0]=4 2891 B13R1.158 CC(C)CC=Cc1cnccc1Br 271570a_100016259101_100010138639 [1,1,0,0,0,0|2,0,0]=4 2892 B13R1.158 CC(C)CC=Cc1cnccc1Cl 271570a_100016259101_100009995489 [1,1,0,0,0,0|2,0,0]=4 2893 B13R1.158 CC(C)CC=Cc1cnccc1F 271570a_100016259101_100009820683 [1,1,0,0,0,0|2,0,0]=4 2894 B13R1.158 CC(C)CC=Cc1cnccc1N 271570a_100016259101_100000047001 [1,1,0,0,0,0|2,0,0]=4 2895 B13R1.158 CC(C)CC=Cc1ncccc1Br 271570a_100016259101_100000696092 [1,1,0,0,0,0|2,0,0]=4 2896 B13R1.158 CC(C)CC=Cc1ncccc1Cl 271570a_100016259101_100011356963 [1,1,0,0,0,0|2,0,0]=4 2897 B13R1.158 CC(C)CC=Cc1ncccc1F 271570a_100016259101_100000685392 [1,1,0,0,0,0|2,0,0]=4 2898 B13R1.158 CC(C)CC=Cc1ncccc1N 271570a_100016259101_100000688686 [1,1,0,0,0,0|2,0,0]=4 2899 B13R1.158 CC(C)CC=Cc1ncccc1O 271570a_100016259101_100000034122 [1,1,0,0,0,0|2,0,0]=4 2900 B13R1.158 CC(C)CCNc1ccccc1Br 34a_100000210017_100000210312 [1,1,0,0,0,0|2,0,0]=4 2901 B13R1.158 CC(C)CCNc1ccccc1Cl 34a_100000185783_100000210312 [1,1,0,0,0,0|2,0,0]=4 2902 B13R1.158 CC(C)CCNc1ccccc1F 34a_100000210422_100000210312 [1,1,0,0,0,0|2,0,0]=4 2903 B13R1.158 CC(C)CCNc1ccccc1I 34a_100000210053_100000210312 [1,1,0,0,0,0|2,0,0]=4 2904 B13R1.158 CC(C)CCNc1ccccc1O 34a_100000185747_100000210312 [1,1,0,0,0,0|2,0,0]=4 2905 B13R1.158 CC(C)CCOc1ccccc1Br 34a_100000181306_100000210312 [1,1,0,0,0,0|2,0,0]=4 2906 B13R1.158 CC(C)CCOc1ccccc1Br 7a_100000181306_100000210626 [1,1,0,0,0,0|2,0,0]=4 2907 B13R1.158 CC(C)CCOc1ccccc1Cl 34a_100000210172_100000210312 [1,1,0,0,0,0|2,0,0]=4 2908 B13R1.158 CC(C)CCOc1ccccc1Cl 7a_100000210172_100000210626 [1,1,0,0,0,0|2,0,0]=4 2909 B13R1.158 CC(C)CCOc1ccccc1F 34a_100000210171_100000210312 [1,1,0,0,0,0|2,0,0]=4 2910 B13R1.158 CC(C)CCOc1ccccc1F 7a_100000210171_100000210626 [1,1,0,0,0,0|2,0,0]=4 2911 B13R1.158 CC(C)CCOc1ccccc1I 34a_100000739446_100000210312 [1,1,0,0,0,0|2,0,0]=4 2912 B13R1.158 CC(C)CCOc1ccccc1I 7a_100000739446_100000210626 [1,1,0,0,0,0|2,0,0]=4 2913 B13R1.158 CC(C)CCOc1ccccc1N 34a_100000185747_100000210312 [1,1,0,0,0,0|2,0,0]=4 2914 B13R1.158 CC(C)CCOc1ccccc1N 7a_100000185747_100000210626 [1,1,0,0,0,0|2,0,0]=4 2915 B13R1.158 CC(C)CCSc1ccccc1Br 62a_100000210312_100000695589 [1,1,0,0,0,0|2,0,0]=4 2916 B13R1.158 CC(C)CCSc1ccccc1Br 62a_100000695589_100000210312 [1,1,0,0,0,0|2,0,0]=4 2917 B13R1.158 CC(C)CCSc1ccccc1Cl 62a_100000210312_100000764095 [1,1,0,0,0,0|2,0,0]=4 2918 B13R1.158 CC(C)CCSc1ccccc1Cl 62a_100000764095_100000210312 [1,1,0,0,0,0|2,0,0]=4 2919 B13R1.158 CC(C)CCSc1ccccc1F 62a_100000210312_100011215700 [1,1,0,0,0,0|2,0,0]=4 2920 B13R1.158 CC(C)CCSc1ccccc1F 62a_100011215700_100000210312 [1,1,0,0,0,0|2,0,0]=4 2921 B13R1.158 CC(C)CCSc1ccccc1N 62a_100000210017_100000210312 [1,1,0,0,0,0|2,0,0]=4 2922 B13R1.158 CC(C)CCSc1ccccc1N 62a_100000210312_100000210017 [1,1,0,0,0,0|2,0,0]=4 2923 B13R1.158 CC(C)CCSc1ccccc1O 62a_100000210312_100000739446 [1,1,0,0,0,0|2,0,0]=4 2924 B13R1.158 CC(C)CCSc1ccccc1O 62a_100000739446_100000210312 [1,1,0,0,0,0|2,0,0]=4 2925 B13R1.158 CC(C)CNCc1ccccc1Br 207a_100000210953_100000211189 [1,1,0,0,0,0|1,0,1]=4 2926 B13R1.158 CC(C)CNCc1ccccc1Br 2230a_100000210953_100000184730 [1,1,0,0,0,0|1,0,1]=4 2927 B13R1.158 CC(C)CNCc1ccccc1Br 2230a_100000689332_100000210760 [1,1,0,0,0,0|1,0,1]=4 2928 B13R1.158 CC(C)CNCc1ccccc1Br 26a_100000210953_100000181306 [1,1,0,0,0,0|1,0,1]=4 2929 B13R1.158 CC(C)CNCc1ccccc1Br 270004a_100000210953_100000211189 [1,1,0,0,0,0|1,0,1]=4 2930 B13R1.158 CC(C)CNCc1ccccc1Br 270004a_100000689332_100000210432 [1,1,0,0,0,0|1,0,1]=4 2931 B13R1.158 CC(C)CNCc1ccccc1Br 34a_100000210953_100000184730 [1,1,0,0,0,0|1,0,1]=4 2932 B13R1.158 CC(C)CNCc1ccccc1Br 34a_100000689332_100000210624 [1,1,0,0,0,0|1,0,1]=4 2933 B13R1.158 CC(C)CNCc1ccccc1Cl 207a_100000210953_100000210073 [1,1,0,0,0,0|1,0,1]=4 2934 B13R1.158 CC(C)CNCc1ccccc1Cl 2230a_100000174879_100000210760 [1,1,0,0,0,0|1,0,1]=4 2935 B13R1.158 CC(C)CNCc1ccccc1Cl 2230a_100000210953_100000187162 [1,1,0,0,0,0|1,0,1]=4 2936 B13R1.158 CC(C)CNCc1ccccc1Cl 26a_100000210953_100000210172 [1,1,0,0,0,0|1,0,1]=4 2937 B13R1.158 CC(C)CNCc1ccccc1Cl 270004a_100000174879_100000210432 [1,1,0,0,0,0|1,0,1]=4 2938 B13R1.158 CC(C)CNCc1ccccc1Cl 270004a_100000210953_100000210073 [1,1,0,0,0,0|1,0,1]=4 2939 B13R1.158 CC(C)CNCc1ccccc1Cl 34a_100000174879_100000210624 [1,1,0,0,0,0|1,0,1]=4 2940 B13R1.158 CC(C)CNCc1ccccc1Cl 34a_100000210953_100000187162 [1,1,0,0,0,0|1,0,1]=4 2941 B13R1.158 CC(C)CNCc1ccccc1F 207a_100000210953_100000210811 [1,1,0,0,0,0|1,0,1]=4 2942 B13R1.158 CC(C)CNCc1ccccc1F 2230a_100000210953_100000211605 [1,1,0,0,0,0|1,0,1]=4 2943 B13R1.158 CC(C)CNCc1ccccc1F 270004a_100000174869_100000210432 [1,1,0,0,0,0|1,0,1]=4 2944 B13R1.158 CC(C)CNCc1ccccc1F 270004a_100000210953_100000210811 [1,1,0,0,0,0|1,0,1]=4 2945 B13R1.158 CC(C)CNCc1ccccc1F 34a_100000174869_100000210624 [1,1,0,0,0,0|1,0,1]=4 2946 B13R1.158 CC(C)CNCc1ccccc1F 34a_100000210953_100000211605 [1,1,0,0,0,0|1,0,1]=4 2947 B13R1.158 CC(C)CNCc1ccccc1I 207a_100000210953_100000010305 [1,1,0,0,0,0|1,0,1]=4 2948 B13R1.158 CC(C)CNCc1ccccc1I 2230a_100000210953_100011215278 [1,1,0,0,0,0|1,0,1]=4 2949 B13R1.158 CC(C)CNCc1ccccc1I 270004a_100000210953_100000010305 [1,1,0,0,0,0|1,0,1]=4 2950 B13R1.158 CC(C)CNCc1ccccc1I 270004a_100015347259_100000210432 [1,1,0,0,0,0|1,0,1]=4 2951 B13R1.158 CC(C)CNCc1ccccc1I 34a_100000210953_100011215278 [1,1,0,0,0,0|1,0,1]=4 2952 B13R1.158 CC(C)CNCc1ccccc1O 270004a_100000185550_100000210432 [1,1,0,0,0,0|1,0,1]=4 2953 B13R1.158 CC(C)CNCc1ccccc1O 34a_100000185550_100000210624 [1,1,0,0,0,0|1,0,1]=4 2954 B13R1.158 CC(C)COCc1ccccc1Br 34a_100000210257_100000184730 [1,1,0,0,0,0|0,0,1]=3 2955 B13R1.158 CC(C)COCc1ccccc1Br 34a_100000756307_100000210624 [1,1,0,0,0,0|0,0,1]=3 2956 B13R1.158 CC(C)COCc1ccccc1Br 7a_100000756307_100000210760 [1,1,0,0,0,0|0,0,1]=3 2957 B13R1.158 CC(C)COCc1ccccc1Cl 34a_100000210257_100000187162 [1,1,0,0,0,0|0,0,1]=3 2958 B13R1.158 CC(C)COCc1ccccc1Cl 34a_100000210847_100000210624 [1,1,0,0,0,0|0,0,1]=3 2959 B13R1.158 CC(C)COCc1ccccc1Cl 7a_100000210847_100000210760 [1,1,0,0,0,0|0,0,1]=3 2960 B13R1.158 CC(C)COCc1ccccc1F 34a_100000210257_100000211605 [1,1,0,0,0,0|0,0,1]=3 2961 B13R1.158 CC(C)COCc1ccccc1F 34a_100000211962_100000210624 [1,1,0,0,0,0|0,0,1]=3 2962 B13R1.158 CC(C)COCc1ccccc1F 7a_100000211962_100000210760 [1,1,0,0,0,0|0,0,1]=3 2963 B13R1.158 CC(C)COCc1ccccc1I 34a_100000187465_100000210624 [1,1,0,0,0,0|0,0,1]=3 2964 B13R1.158 CC(C)COCc1ccccc1I 34a_100000210257_100011215278 [1,1,0,0,0,0|0,0,1]=3 2965 B13R1.158 CC(C)COCc1ccccc1I 7a_100000187465_100000210760 [1,1,0,0,0,0|0,0,1]=3 2966 B13R1.158 CC(C)COCc1ccccc1N 34a_100000212039_100000210624 [1,1,0,0,0,0|0,0,1]=3 2967 B13R1.158 CC(C)COCc1cccnc1Br 34a_100000210257_100010140945 [1,1,0,0,0,0|1,0,1]=4 2968 B13R1.158 CC(C)COCc1cccnc1Br 34a_100000719692_100000210624 [1,1,0,0,0,0|1,0,1]=4 2969 B13R1.158 CC(C)COCc1cccnc1Br 7a_100000719692_100000210760 [1,1,0,0,0,0|1,0,1]=4 2970 B13R1.158 CC(C)COCc1cccnc1Cl 34a_100000210257_100000045678 [1,1,0,0,0,0|1,0,1]=4 2971 B13R1.158 CC(C)COCc1cccnc1Cl 34a_100000748726_100000210624 [1,1,0,0,0,0|1,0,1]=4 2972 B13R1.158 CC(C)COCc1cccnc1Cl 7a_100000748726_100000210760 [1,1,0,0,0,0|1,0,1]=4 2973 B13R1.158 CC(C)COCc1cccnc1F 34a_100000079888_100000210624 [1,1,0,0,0,0|1,0,1]=4 2974 B13R1.158 CC(C)COCc1cccnc1F 34a_100000210257_100000099810 [1,1,0,0,0,0|1,0,1]=4 2975 B13R1.158 CC(C)COCc1cccnc1F 7a_100000079888_100000210760 [1,1,0,0,0,0|1,0,1]=4 2976 B13R1.158 CC(C)COCc1ccncc1F 34a_100012172863_100000210624 [1,1,0,0,0,0|1,0,1]=4 2977 B13R1.158 CC(C)COCc1cnccc1Cl 34a_100000117392_100000210624 [1,1,0,0,0,0|1,0,1]=4 2978 B13R1.158 CC(C)COCc1ncccc1Br 34a_100000210257_100025702911 [1,1,0,0,0,0|1,0,1]=4 2979 B13R1.158 CC(C)COCc1ncccc1Br 34a_100011996772_100000210624 [1,1,0,0,0,0|1,0,1]=4 2980 B13R1.158 CC(C)COCc1ncccc1Cl 34a_100012002383_100000210624 [1,1,0,0,0,0|1,0,1]=4 2981 B13R1.158 CC(C)COCc1ncccc1F 34a_100000210257_100000104219 [1,1,0,0,0,0|1,0,1]=4 2982 B13R1.158 CC(C)COCc1ncccc1F 34a_100011934865_100000210624 [1,1,0,0,0,0|1,0,1]=4 2983 B13R1.158 CC(C)COCc1ncccc1N 34a_114873767017_100000210624 [1,1,0,0,0,0|1,0,1]=4 2984 B13R1.158 CC(C)COCc1ncccc1O 34a_100000210257_200020655725 [1,1,0,0,0,0|1,0,1]=4 2985 B13R1.158 CC(C)CSCc1ccccc1Br 62a_100000184730_100000210760 [1,1,0,0,0,0|0,1,1]=4 2986 B13R1.158 CC(C)CSCc1ccccc1Br 62a_100000210624_100000184730 [1,1,0,0,0,0|0,1,1]=4 2987 B13R1.158 CC(C)CSCc1ccccc1Cl 62a_100000187162_100000210760 [1,1,0,0,0,0|0,1,1]=4 2988 B13R1.158 CC(C)CSCc1ccccc1Cl 62a_100000210624_100000187162 [1,1,0,0,0,0|0,1,1]=4 2989 B13R1.158 CC(C)CSCc1ccccc1F 62a_100000210624_100000211605 [1,1,0,0,0,0|0,1,1]=4 2990 B13R1.158 CC(C)CSCc1ccccc1F 62a_100000211605_100000210760 [1,1,0,0,0,0|0,1,1]=4 2991 B13R1.158 CC(C)CSCc1ccccc1I 62a_100000210624_100011216222 [1,1,0,0,0,0|0,1,1]=4 2992 B13R1.158 CC(C)CSCc1ccccc1I 62a_100011216222_100000210760 [1,1,0,0,0,0|0,1,1]=4 2993 B13R1.158 CC(C)NN=Cc1ccccc1Br 4a_100000741168_100000211189 [1,1,0,0,0,0|2,0,0]=4 2994 B13R1.158 CC(C)NN=Cc1ccccc1Cl 4a_100000741168_100000210073 [1,1,0,0,0,0|2,0,0]=4 2995 B13R1.158 CC(C)NN=Cc1ccccc1F 4a_100000741168_100000210811 [1,1,0,0,0,0|2,0,0]=4 2996 B13R1.158 CC(C)NN=Cc1ccccc1I 4a_100000741168_100000010305 [1,1,0,0,0,0|2,0,0]=4 2997 B13R1.158 CC(C)NN=Cc1ccccc1O 4a_100000741168_100000185834 [1,1,0,0,0,0|2,0,0]=4 2998 B13R1.158 CC(F)COCc1ccccc1Br 34a_100015925927_100000184730 [1,1,0,0,0,0|1,0,1]=4 2999 B13R1.158 CC(F)COCc1ccccc1Cl 34a_100015925927_100000187162 [1,1,0,0,0,0|1,0,1]=4 3000 B13R1.158 CC(F)COCc1ccccc1F 34a_100015925927_100000211605 [1,1,0,0,0,0|1,0,1]=4 3001 B13R1.158 CC(F)COCc1ccccc1I 34a_100015925927_100011215278 [1,1,0,0,0,0|1,0,1]=4 3002 B13R1.158 CC(O)COCc1ccccc1Br 34a_100000756307_100011218427 [1,1,0,0,0,0|1,0,1]=4 3003 B13R1.158 CC(O)COCc1ccccc1Br 7a_100000756307_100011218427 [1,1,0,0,0,0|1,0,1]=4 3004 B13R1.158 CC(O)COCc1ccccc1Cl 34a_100000210847_100011218427 [1,1,0,0,0,0|1,0,1]=4 3005 B13R1.158 CC(O)COCc1ccccc1Cl 7a_100000210847_100011218427 [1,1,0,0,0,0|1,0,1]=4 3006 B13R1.158 CC(O)COCc1ccccc1F 34a_100000211962_100011218427 [1,1,0,0,0,0|1,0,1]=4 3007 B13R1.158 CC(O)COCc1ccccc1F 7a_100000211962_100011218427 [1,1,0,0,0,0|1,0,1]=4 3008 B13R1.158 CC(O)COCc1ccccc1I 34a_100000187465_100011218427 [1,1,0,0,0,0|1,0,1]=4 3009 B13R1.158 CC(O)COCc1ccccc1I 7a_100000187465_100011218427 [1,1,0,0,0,0|1,0,1]=4 3010 B13R1.158 CC(O)COCc1ccccc1N 34a_100000212039_100011218427 [1,1,0,0,0,0|1,0,1]=4 3011 B13R1.158 CN(C)CC=Cc1ccccc1Br 270004a_100102631434_200016268969 [1,1,0,0,0,0|2,0,0]=4 3012 B13R1.158 CN(C)CC=Cc1ccccc1Cl 270004a_100102631434_200102525841 [1,1,0,0,0,0|2,0,0]=4 3013 B13R1.158 CN(C)CC=Cc1ccccc1F 270004a_100102631434_200102525844 [1,1,0,0,0,0|2,0,0]=4 3014 B13R1.158 C[C@@H](Cl)COCc1ccccc1Br 34a_100016084084_100000184730 [1,1,0,0,0,0|1,0,1]=4 3015 B13R1.158 C[C@@H](Cl)COCc1ccccc1Cl 34a_100016084084_100000187162 [1,1,0,0,0,0|1,0,1]=4 3016 B13R1.158 C[C@@H](Cl)COCc1ccccc1F 34a_100016084084_100000211605 [1,1,0,0,0,0|1,0,1]=4 3017 B13R1.158 C[C@@H](Cl)COCc1ccccc1I 34a_100016084084_100011215278 [1,1,0,0,0,0|1,0,1]=4 3018 B13R1.158 C[C@@H](N)COCc1ccccc1Br 34a_100000737577_100000184730 [1,1,0,0,0,0|1,0,1]=4 3019 B13R1.158 C[C@@H](N)COCc1ccccc1Cl 34a_100000737577_100000187162 [1,1,0,0,0,0|1,0,1]=4 3020 B13R1.158 C[C@@H](N)COCc1ccccc1F 34a_100000737577_100000211605 [1,1,0,0,0,0|1,0,1]=4 3021 B13R1.158 C[C@@H](N)COCc1ccccc1I 34a_100000737577_100011215278 [1,1,0,0,0,0|1,0,1]=4 3022 B13R1.158 C[C@@H](O)COCc1ccccc1Br 34a_100000756307_100009817552 [1,1,0,0,0,0|1,0,1]=4 3023 B13R1.158 C[C@@H](O)COCc1ccccc1Br 7a_100000756307_100009817552 [1,1,0,0,0,0|1,0,1]=4 3024 B13R1.158 C[C@@H](O)COCc1ccccc1Cl 34a_100000210847_100009817552 [1,1,0,0,0,0|1,0,1]=4 3025 B13R1.158 C[C@@H](O)COCc1ccccc1Cl 7a_100000210847_100009817552 [1,1,0,0,0,0|1,0,1]=4 3026 B13R1.158 C[C@@H](O)COCc1ccccc1F 34a_100000211962_100009817552 [1,1,0,0,0,0|1,0,1]=4 3027 B13R1.158 C[C@@H](O)COCc1ccccc1F 7a_100000211962_100009817552 [1,1,0,0,0,0|1,0,1]=4 3028 B13R1.158 C[C@@H](O)COCc1ccccc1I 34a_100000187465_100009817552 [1,1,0,0,0,0|1,0,1]=4 3029 B13R1.158 C[C@@H](O)COCc1ccccc1I 7a_100000187465_100009817552 [1,1,0,0,0,0|1,0,1]=4 3030 B13R1.158 C[C@@H](O)COCc1ccccc1N 34a_100000212039_100009817552 [1,1,0,0,0,0|1,0,1]=4 3031 B13R1.158 Cc1ccccc1C=CCC(C)C 271570a_100016259101_100000210755 [1,1,0,0,0,0|1,0,0]=3 3032 B13R1.158 Cc1ccccc1C=NNC(C)C 4a_100000741168_100000211143 [1,1,0,0,0,0|2,0,0]=4 3033 B13R1.158 Cc1ccccc1CNCC(C)C 207a_100000210953_100000211143 [1,1,0,0,0,0|1,0,1]=4 3034 B13R1.158 Cc1ccccc1CNCC(C)C 2230a_100000210953_100000211839 [1,1,0,0,0,0|1,0,1]=4 3035 B13R1.158 Cc1ccccc1CNCC(C)C 270004a_100000174972_100000210432 [1,1,0,0,0,0|1,0,1]=4 3036 B13R1.158 Cc1ccccc1CNCC(C)C 270004a_100000210953_100000211143 [1,1,0,0,0,0|1,0,1]=4 3037 B13R1.158 Cc1ccccc1CNCC(C)C 34a_100000174972_100000210624 [1,1,0,0,0,0|1,0,1]=4 3038 B13R1.158 Cc1ccccc1CNCC(C)C 34a_100000210953_100000211839 [1,1,0,0,0,0|1,0,1]=4 3039 B13R1.158 Cc1ccccc1COCC(C)Br 34a_100012180447_100000211839 [1,1,0,0,0,0|1,0,1]=4 3040 B13R1.158 Cc1ccccc1COCC(C)C 34a_100000210257_100000211839 [1,1,0,0,0,0|0,0,1]=3 3041 B13R1.158 Cc1ccccc1COCC(C)C 34a_100000698903_100000210624 [1,1,0,0,0,0|0,0,1]=3 3042 B13R1.158 Cc1ccccc1COCC(C)C 7a_100000698903_100000210760 [1,1,0,0,0,0|0,0,1]=3 3043 B13R1.158 Cc1ccccc1COCC(C)F 34a_100015925927_100000211839 [1,1,0,0,0,0|1,0,1]=4 3044 B13R1.158 Cc1ccccc1COCC(C)O 34a_100000698903_100011218427 [1,1,0,0,0,0|1,0,1]=4 3045 B13R1.158 Cc1ccccc1COCC(C)O 7a_100000698903_100011218427 [1,1,0,0,0,0|1,0,1]=4 3046 B13R1.158 Cc1ccccc1COC[C@@H](C)Cl 34a_100016084084_100000211839 [1,1,0,0,0,0|1,0,1]=4 3047 B13R1.158 Cc1ccccc1COC[C@@H](C)N 34a_100000737577_100000211839 [1,1,0,0,0,0|1,0,1]=4 3048 B13R1.158 Cc1ccccc1COC[C@@H](C)O 34a_100000698903_100009817552 [1,1,0,0,0,0|1,0,1]=4 3049 B13R1.158 Cc1ccccc1COC[C@@H](C)O 7a_100000698903_100009817552 [1,1,0,0,0,0|1,0,1]=4 3050 B13R1.158 Cc1ccccc1CSCC(C)C 62a_100000210624_100000211839 [1,1,0,0,0,0|0,1,1]=4 3051 B13R1.158 Cc1ccccc1CSCC(C)C 62a_100000211839_100000210760 [1,1,0,0,0,0|0,1,1]=4 3052 B13R1.158 Cc1ccccc1NCCC(C)C 34a_100015192222_100000210312 [1,1,0,0,0,0|2,0,0]=4 3053 B13R1.158 Cc1ccccc1OCCC(C)C 34a_100000210338_100000210312 [1,1,0,0,0,0|2,0,0]=4 3054 B13R1.158 Cc1ccccc1OCCC(C)C 7a_100000210338_100000210626 [1,1,0,0,0,0|2,0,0]=4 3055 B13R1.158 Cc1ccccc1SCCC(C)C 62a_100000210312_100000210755 [1,1,0,0,0,0|2,0,0]=4 3056 B13R1.158 Cc1ccccc1SCCC(C)C 62a_100000210755_100000210312 [1,1,0,0,0,0|2,0,0]=4 3057 B13R1.158 Cc1cccnc1C=CCC(C)C 271570a_100016259101_100000751373 [1,1,0,0,0,0|2,0,0]=4 3058 B13R1.158 Cc1cccnc1COCC(C)C 34a_100000210257_100000696600 [1,1,0,0,0,0|1,0,1]=4 3059 B13R1.158 Cc1cccnc1COCC(C)C 34a_100000698912_100000210624 [1,1,0,0,0,0|1,0,1]=4 3060 B13R1.158 Cc1ccncc1C=CCC(C)C 271570a_100016259101_100000761580 [1,1,0,0,0,0|2,0,0]=4 3061 B13R1.158 Cc1ccncc1COCC(C)C 34a_100000210257_100000690890 [1,1,0,0,0,0|1,0,1]=4 3062 B13R1.158 Cc1ccncc1COCC(C)C 34a_100011996381_100000210624 [1,1,0,0,0,0|1,0,1]=4 3063 B13R1.158 Cc1cnccc1C=CCC(C)C 271570a_100016259101_100015191297 [1,1,0,0,0,0|2,0,0]=4 3064 B13R1.158 Cc1cnccc1COCC(C)C 34a_100000210257_100020672809 [1,1,0,0,0,0|1,0,1]=4 3065 B13R1.158 Cc1cnccc1COCC(C)C 34a_100011997032_100000210624 [1,1,0,0,0,0|1,0,1]=4 3066 B13R1.158 Cc1ncccc1C=CCC(C)C 271570a_100016259101_100000751574 [1,1,0,0,0,0|2,0,0]=4 3067 B13R1.158 Cc1ncccc1COCC(C)C 34a_100000210257_100000732876 [1,1,0,0,0,0|1,0,1]=4 3068 B13R1.158 Cc1ncccc1COCC(C)C 34a_100000729262_100000210624 [1,1,0,0,0,0|1,0,1]=4 3069 B13R1.158 Cc1ncccc1COCC(C)C 7a_100000729262_100000210760 [1,1,0,0,0,0|1,0,1]=4 3070 B13R1.348 CC(C)CC(=O)Cc1ccccc1 1458a_100000210554_100015291786 [1,1,0,0,0,0|1,0,1]=4 3071 B13R1.348 CC(C)CC(=O)Nc1ccccc1 11a_100000106764_100000210554 [1,1,0,0,0,0|2,0,0]=4 3072 B13R1.348 CC(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000210554 [1,1,0,0,0,0|2,0,0]=4 3073 B13R1.348 CC(C)CC(=O)Nc1ccccc1 22a_100000106764_100000210554 [1,1,0,0,0,0|2,0,0]=4 3074 B13R1.348 CC(C)CC(=O)Nc1ccccc1 527a_100000106764_100000210554 [1,1,0,0,0,0|2,0,0]=4 3075 B13R1.348 CC(C)CC(C)Nc1ccccc1 34a_100000106764_100000731052 [1,1,0,0,0,0|2,0,0]=4 3076 B13R1.348 CC(C)CC(C)Oc1ccccc1 34a_100000210340_100000731052 [1,1,0,0,0,0|2,0,0]=4 3077 B13R1.348 CC(C)CC(C)Oc1ccccc1 7a_100000210340_100000731052 [1,1,0,0,0,0|2,0,0]=4 3078 B13R1.348 CC(C)CC(C)Sc1ccccc1 62a_100000719477_100000731052 [1,1,0,0,0,0|2,0,0]=4 3079 B13R1.348 CC(C)CC(C)Sc1ccccc1 62a_100000731052_100000041952 [1,1,0,0,0,0|2,0,0]=4 3080 B13R1.348 CC(C)CN(C)Cc1ccccc1 2230a_100000186898_100000210760 [1,1,0,0,0,0|1,0,1]=4 3081 B13R1.348 CC(C)CN(C)Cc1ccccc1 2230a_100000189081_200000210301 [1,1,0,0,0,0|1,0,1]=4 3082 B13R1.348 CC(C)CN(C)Cc1ccccc1 2230a_100000747067_100015291786 [1,1,0,0,0,0|1,0,1]=4 3083 B13R1.348 CC(C)CN(C)Cc1ccccc1 269982a_100000186898_100000210624 [1,1,0,0,0,0|1,0,1]=4 3084 B13R1.348 CC(C)CN(C)Cc1ccccc1 269982a_100000189081_200000210301 [1,1,0,0,0,0|1,0,1]=4 3085 B13R1.348 CC(C)CN(C)Cc1ccccc1 269982a_100000747067_100000211182 [1,1,0,0,0,0|1,0,1]=4 3086 B13R1.348 CC(C)CN(C)Cc1ccccc1 270004a_100000186898_100000210432 [1,1,0,0,0,0|1,0,1]=4 3087 B13R1.348 CC(C)CN(C)Cc1ccccc1 270004a_100000747067_100015611070 [1,1,0,0,0,0|1,0,1]=4 3088 B13R1.348 CC(C)CN(C)Cc1ccccc1 34a_100000189081_200000210301 [1,1,0,0,0,0|1,0,1]=4 3089 B13R1.348 CC(C)CN([13CH3])Cc1ccccc1 2230a_100000189081_200025704644 [1,1,0,0,0,0|1,0,1]=4 3090 B13R1.348 CC(C)CN([13CH3])Cc1ccccc1 269982a_100000189081_200025704644 [1,1,0,0,0,0|1,0,1]=4 3091 B13R1.348 CC(C)CN([13CH3])Cc1ccccc1 34a_100000189081_200025704644 [1,1,0,0,0,0|1,0,1]=4 3092 B13R1.351 CC(C)C(=O)C=Cc1ccccc1 1458a_100000210462_100000210206 [1,1,0,0,0,0|1,0,1]=4 3093 B13R1.351 CC(C)C(C)NCc1ccccc1 207a_100000211541_100015611070 [1,1,0,0,0,0|1,0,1]=4 3094 B13R1.351 CC(C)C(C)NCc1ccccc1 2230a_100000211541_100015291786 [1,1,0,0,0,0|1,0,1]=4 3095 B13R1.351 CC(C)C(C)NCc1ccccc1 270004a_100000211541_100015611070 [1,1,0,0,0,0|1,0,1]=4 3096 B13R1.351 CC(C)C(C)OCc1ccccc1 7a_100000748068_100000211182 [1,1,0,0,0,0|0,0,1]=3 3097 B13R1.351 CC(C)C(C)OCc1ccccn1 7a_100000748068_100000721315 [1,1,0,0,0,0|1,0,1]=4 3098 B13R1.351 CC(C)C(C)OCc1cccnc1 7a_100000748068_100000741622 [1,1,0,0,0,0|1,0,1]=4 3099 B13R1.351 CC(C)C(C)OCc1ccncc1 7a_100000748068_100015193705 [1,1,0,0,0,0|1,0,1]=4 3100 B13R1.513 CC(Br)COCc1ccc(cc1)Br 34a_100012180447_100000189115 [1,1,0,0,0,0|1,0,1]=4 3101 B13R1.513 CC(Br)COCc1ccc(cc1)Cl 34a_100012180447_100000694040 [1,1,0,0,0,0|1,0,1]=4 3102 B13R1.513 CC(Br)COCc1ccc(cc1)F 34a_100012180447_100000198546 [1,1,0,0,0,0|1,0,1]=4 3103 B13R1.513 CC(Br)COCc1ccc(cc1)I 34a_100012180447_100000189116 [1,1,0,0,0,0|1,0,1]=4 3104 B13R1.513 CC(C)CC=Cc1cc[n+](cc1)[O-] 271570a_100016259101_100000039755 [1,1,0,0,0,0|2,0,0]=4 3105 B13R1.513 CC(C)CC=Cc1ccc(=O)[nH]c1 271570a_100016259101_100000212171 [1,1,0,0,0,0|2,0,0]=4 3106 B13R1.513 CC(C)CC=Cc1ccc(cc1)Br 271570a_100016259101_100000752885 [1,1,0,0,0,0|1,0,0]=3 3107 B13R1.513 CC(C)CC=Cc1ccc(cc1)Cl 271570a_100016259101_100000755918 [1,1,0,0,0,0|1,0,0]=3 3108 B13R1.513 CC(C)CC=Cc1ccc(cc1)F 271570a_100016259101_100000211213 [1,1,0,0,0,0|1,0,0]=3 3109 B13R1.513 CC(C)CC=Cc1ccc(cc1)N 271570a_100016259101_100000185761 [1,1,0,0,0,0|1,0,0]=3 3110 B13R1.513 CC(C)CC=Cc1ccc(cc1)O 271570a_100016259101_100000185759 [1,1,0,0,0,0|1,0,0]=3 3111 B13R1.513 CC(C)CC=Cc1ccc(cn1)Br 271570a_100016259101_100000686858 [1,1,0,0,0,0|2,0,0]=4 3112 B13R1.513 CC(C)CC=Cc1ccc(cn1)Cl 271570a_100016259101_100011356976 [1,1,0,0,0,0|2,0,0]=4 3113 B13R1.513 CC(C)CC=Cc1ccc(cn1)F 271570a_100016259101_100000744514 [1,1,0,0,0,0|2,0,0]=4 3114 B13R1.513 CC(C)CC=Cc1ccc(cn1)N 271570a_100016259101_100000744251 [1,1,0,0,0,0|2,0,0]=4 3115 B13R1.513 CC(C)CC=Cc1ccc(cn1)O 271570a_100016259101_100000685995 [1,1,0,0,0,0|2,0,0]=4 3116 B13R1.513 CC(C)CC=Cc1ccc(nc1)Br 271570a_100016259101_100009814638 [1,1,0,0,0,0|2,0,0]=4 3117 B13R1.513 CC(C)CC=Cc1ccc(nc1)Cl 271570a_100016259101_100000034144 [1,1,0,0,0,0|2,0,0]=4 3118 B13R1.513 CC(C)CC=Cc1ccc(nc1)F 271570a_100016259101_100000748661 [1,1,0,0,0,0|2,0,0]=4 3119 B13R1.513 CC(C)CC=Cc1ccc(nc1)N 271570a_100016259101_100000187370 [1,1,0,0,0,0|2,0,0]=4 3120 B13R1.513 CC(C)CCNc1ccc(cc1)Br 2230a_100000210018_100000210312 [1,1,0,0,0,0|2,0,0]=4 3121 B13R1.513 CC(C)CCNc1ccc(cc1)Br 34a_100000210018_100000210312 [1,1,0,0,0,0|2,0,0]=4 3122 B13R1.513 CC(C)CCNc1ccc(cc1)Cl 2230a_100000210052_100000210312 [1,1,0,0,0,0|2,0,0]=4 3123 B13R1.513 CC(C)CCNc1ccc(cc1)Cl 34a_100000210052_100000210312 [1,1,0,0,0,0|2,0,0]=4 3124 B13R1.513 CC(C)CCNc1ccc(cc1)F 34a_100000185862_100000210312 [1,1,0,0,0,0|2,0,0]=4 3125 B13R1.513 CC(C)CCNc1ccc(cc1)I 34a_100000185761_100000210312 [1,1,0,0,0,0|2,0,0]=4 3126 B13R1.513 CC(C)CCNc1ccc(cc1)O 34a_100000185829_100000210312 [1,1,0,0,0,0|2,0,0]=4 3127 B13R1.513 CC(C)CCOc1ccc(cc1)Br 34a_100000185759_100000210312 [1,1,0,0,0,0|2,0,0]=4 3128 B13R1.513 CC(C)CCOc1ccc(cc1)Br 7a_100000185759_100000210626 [1,1,0,0,0,0|2,0,0]=4 3129 B13R1.513 CC(C)CCOc1ccc(cc1)Cl 34a_100000210216_100000210312 [1,1,0,0,0,0|2,0,0]=4 3130 B13R1.513 CC(C)CCOc1ccc(cc1)Cl 7a_100000210216_100000210626 [1,1,0,0,0,0|2,0,0]=4 3131 B13R1.513 CC(C)CCOc1ccc(cc1)F 34a_100000210339_100000210312 [1,1,0,0,0,0|2,0,0]=4 3132 B13R1.513 CC(C)CCOc1ccc(cc1)I 34a_100000212066_100000210312 [1,1,0,0,0,0|2,0,0]=4 3133 B13R1.513 CC(C)CCOc1ccc(cc1)I 7a_100000212066_100000210626 [1,1,0,0,0,0|2,0,0]=4 3134 B13R1.513 CC(C)CCOc1ccc(cc1)N 34a_100000185829_100000210312 [1,1,0,0,0,0|2,0,0]=4 3135 B13R1.513 CC(C)CCSc1ccc(cc1)Br 62a_100000210312_100000752885 [1,1,0,0,0,0|2,0,0]=4 3136 B13R1.513 CC(C)CCSc1ccc(cc1)Br 62a_100000752885_100000210312 [1,1,0,0,0,0|2,0,0]=4 3137 B13R1.513 CC(C)CCSc1ccc(cc1)Cl 62a_100000210312_100000755918 [1,1,0,0,0,0|2,0,0]=4 3138 B13R1.513 CC(C)CCSc1ccc(cc1)Cl 62a_100000755918_100000210312 [1,1,0,0,0,0|2,0,0]=4 3139 B13R1.513 CC(C)CCSc1ccc(cc1)F 62a_100000210312_100000211213 [1,1,0,0,0,0|2,0,0]=4 3140 B13R1.513 CC(C)CCSc1ccc(cc1)F 62a_100000211213_100000210312 [1,1,0,0,0,0|2,0,0]=4 3141 B13R1.513 CC(C)CCSc1ccc(cc1)N 62a_100000185761_100000210312 [1,1,0,0,0,0|2,0,0]=4 3142 B13R1.513 CC(C)CCSc1ccc(cc1)N 62a_100000210312_100000185761 [1,1,0,0,0,0|2,0,0]=4 3143 B13R1.513 CC(C)CCSc1ccc(cc1)O 271570a_203496583355_200009813137 [1,1,0,0,0,0|2,0,0]=4 3144 B13R1.513 CC(C)CCSc1ccc(cc1)O 62a_100000210312_100000185759 [1,1,0,0,0,0|2,0,0]=4 3145 B13R1.513 CC(C)CNCc1ccc(cc1)Br 207a_100000210953_100000186029 [1,1,0,0,0,0|1,0,1]=4 3146 B13R1.513 CC(C)CNCc1ccc(cc1)Br 2230a_100000174875_100000210760 [1,1,0,0,0,0|1,0,1]=4 3147 B13R1.513 CC(C)CNCc1ccc(cc1)Br 2230a_100000210953_100011217064 [1,1,0,0,0,0|1,0,1]=4 3148 B13R1.513 CC(C)CNCc1ccc(cc1)Br 26a_100000210953_100000185759 [1,1,0,0,0,0|1,0,1]=4 3149 B13R1.513 CC(C)CNCc1ccc(cc1)Br 270004a_100000174875_100000210432 [1,1,0,0,0,0|1,0,1]=4 3150 B13R1.513 CC(C)CNCc1ccc(cc1)Br 270004a_100000210953_100000186029 [1,1,0,0,0,0|1,0,1]=4 3151 B13R1.513 CC(C)CNCc1ccc(cc1)Br 34a_100000174875_100000210624 [1,1,0,0,0,0|1,0,1]=4 3152 B13R1.513 CC(C)CNCc1ccc(cc1)Br 34a_100000210953_100000189115 [1,1,0,0,0,0|1,0,1]=4 3153 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 207a_100000210953_100000189385 [1,1,0,0,0,0|1,0,1]=4 3154 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 2230a_100000174871_100000210760 [1,1,0,0,0,0|1,0,1]=4 3155 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 2230a_100000210953_100000694040 [1,1,0,0,0,0|1,0,1]=4 3156 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 270004a_100000174871_100000210432 [1,1,0,0,0,0|1,0,1]=4 3157 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 270004a_100000210953_100000189385 [1,1,0,0,0,0|1,0,1]=4 3158 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 34a_100000174871_100000210624 [1,1,0,0,0,0|1,0,1]=4 3159 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 34a_100000210953_100000694040 [1,1,0,0,0,0|1,0,1]=4 3160 B13R1.513 CC(C)CNCc1ccc(cc1)F 207a_100000210953_100000210084 [1,1,0,0,0,0|1,0,1]=4 3161 B13R1.513 CC(C)CNCc1ccc(cc1)F 2230a_100000174882_100000210760 [1,1,0,0,0,0|1,0,1]=4 3162 B13R1.513 CC(C)CNCc1ccc(cc1)F 2230a_100000210953_100000198546 [1,1,0,0,0,0|1,0,1]=4 3163 B13R1.513 CC(C)CNCc1ccc(cc1)F 270004a_100000174882_100000210432 [1,1,0,0,0,0|1,0,1]=4 3164 B13R1.513 CC(C)CNCc1ccc(cc1)F 270004a_100000210953_100000210084 [1,1,0,0,0,0|1,0,1]=4 3165 B13R1.513 CC(C)CNCc1ccc(cc1)F 34a_100000174882_100000210624 [1,1,0,0,0,0|1,0,1]=4 3166 B13R1.513 CC(C)CNCc1ccc(cc1)F 34a_100000210953_100000198546 [1,1,0,0,0,0|1,0,1]=4 3167 B13R1.513 CC(C)CNCc1ccc(cc1)I 207a_100000210953_100000188517 [1,1,0,0,0,0|1,0,1]=4 3168 B13R1.513 CC(C)CNCc1ccc(cc1)I 2230a_100000210953_100000189116 [1,1,0,0,0,0|1,0,1]=4 3169 B13R1.513 CC(C)CNCc1ccc(cc1)I 2230a_100016989417_100000210760 [1,1,0,0,0,0|1,0,1]=4 3170 B13R1.513 CC(C)CNCc1ccc(cc1)I 270004a_100016989417_100000210432 [1,1,0,0,0,0|1,0,1]=4 3171 B13R1.513 CC(C)CNCc1ccc(cc1)I 34a_100000210953_100000189116 [1,1,0,0,0,0|1,0,1]=4 3172 B13R1.513 CC(C)CNCc1ccc(cc1)I 34a_100016989417_100000210624 [1,1,0,0,0,0|1,0,1]=4 3173 B13R1.513 CC(C)CNCc1ccc(cc1)O 271570a_203496583355_100015183326 [1,1,0,0,0,0|1,0,1]=4 3174 B13R1.513 CC(C)CNCc1ccc(cc1)O 34a_100000185549_100000210624 [1,1,0,0,0,0|1,0,1]=4 3175 B13R1.513 CC(C)COCc1cc[n+](cc1)C 34a_100009831711_100000210624 [1,1,0,0,0,0|1,0,1]=4 3176 B13R1.513 CC(C)COCc1cc[n+](cc1)[O-] 34a_100000031831_100000210624 [1,1,0,0,0,0|1,0,1]=4 3177 B13R1.513 CC(C)COCc1cc[n+](cc1)[O-] 7a_100000031831_100000210760 [1,1,0,0,0,0|1,0,1]=4 3178 B13R1.513 CC(C)COCc1ccc(=O)[nH]c1 34a_100011999846_100000210624 [1,1,0,0,0,0|1,0,1]=4 3179 B13R1.513 CC(C)COCc1ccc(cc1)Br 34a_100000210257_100000189115 [1,1,0,0,0,0|0,0,1]=3 3180 B13R1.513 CC(C)COCc1ccc(cc1)Br 34a_100000695286_100000210624 [1,1,0,0,0,0|0,0,1]=3 3181 B13R1.513 CC(C)COCc1ccc(cc1)Cl 34a_100000210257_100000694040 [1,1,0,0,0,0|0,0,1]=3 3182 B13R1.513 CC(C)COCc1ccc(cc1)Cl 34a_100000211118_100000210624 [1,1,0,0,0,0|0,0,1]=3 3183 B13R1.513 CC(C)COCc1ccc(cc1)Cl 7a_100000211118_100000210760 [1,1,0,0,0,0|0,0,1]=3 3184 B13R1.513 CC(C)COCc1ccc(cc1)F 34a_100000210257_100000198546 [1,1,0,0,0,0|0,0,1]=3 3185 B13R1.513 CC(C)COCc1ccc(cc1)F 34a_100000210977_100000210624 [1,1,0,0,0,0|0,0,1]=3 3186 B13R1.513 CC(C)COCc1ccc(cc1)F 7a_100000210977_100000210760 [1,1,0,0,0,0|0,0,1]=3 3187 B13R1.513 CC(C)COCc1ccc(cc1)I 34a_100000210257_100000189116 [1,1,0,0,0,0|0,0,1]=3 3188 B13R1.513 CC(C)COCc1ccc(cc1)I 34a_100000690907_100000210624 [1,1,0,0,0,0|0,0,1]=3 3189 B13R1.513 CC(C)COCc1ccc(cc1)I 7a_100000690907_100000210760 [1,1,0,0,0,0|0,0,1]=3 3190 B13R1.513 CC(C)COCc1ccc(cc1)N 34a_100011215238_100000210624 [1,1,0,0,0,0|0,0,1]=3 3191 B13R1.513 CC(C)COCc1ccc(cn1)Br 34a_100000210257_100000702658 [1,1,0,0,0,0|1,0,1]=4 3192 B13R1.513 CC(C)COCc1ccc(cn1)Br 34a_100000754261_100000210624 [1,1,0,0,0,0|1,0,1]=4 3193 B13R1.513 CC(C)COCc1ccc(cn1)Cl 34a_100000210257_100012066911 [1,1,0,0,0,0|1,0,1]=4 3194 B13R1.513 CC(C)COCc1ccc(cn1)Cl 34a_100000703999_100000210624 [1,1,0,0,0,0|1,0,1]=4 3195 B13R1.513 CC(C)COCc1ccc(cn1)F 34a_100000210257_100000703193 [1,1,0,0,0,0|1,0,1]=4 3196 B13R1.513 CC(C)COCc1ccc(cn1)F 34a_100011999454_100000210624 [1,1,0,0,0,0|1,0,1]=4 3197 B13R1.513 CC(C)COCc1ccc(cn1)N 34a_100011998161_100000210624 [1,1,0,0,0,0|1,0,1]=4 3198 B13R1.513 CC(C)COCc1ccc(nc1)Br 34a_100000210257_100009831999 [1,1,0,0,0,0|1,0,1]=4 3199 B13R1.513 CC(C)COCc1ccc(nc1)Br 34a_100009816760_100000210624 [1,1,0,0,0,0|1,0,1]=4 3200 B13R1.513 CC(C)COCc1ccc(nc1)Br 7a_100009816760_100000210760 [1,1,0,0,0,0|1,0,1]=4 3201 B13R1.513 CC(C)COCc1ccc(nc1)Cl 34a_100000210257_100000735431 [1,1,0,0,0,0|1,0,1]=4 3202 B13R1.513 CC(C)COCc1ccc(nc1)Cl 34a_100000755211_100000210624 [1,1,0,0,0,0|1,0,1]=4 3203 B13R1.513 CC(C)COCc1ccc(nc1)Cl 7a_100000755211_100000210760 [1,1,0,0,0,0|1,0,1]=4 3204 B13R1.513 CC(C)COCc1ccc(nc1)F 34a_100000079959_100000210624 [1,1,0,0,0,0|1,0,1]=4 3205 B13R1.513 CC(C)COCc1ccc(nc1)F 34a_100000210257_100000099788 [1,1,0,0,0,0|1,0,1]=4 3206 B13R1.513 CC(C)COCc1ccc(nc1)N 34a_100000704267_100000210624 [1,1,0,0,0,0|1,0,1]=4 3207 B13R1.513 CC(C)CSCc1ccc(cc1)Br 62a_100000189115_100000210760 [1,1,0,0,0,0|0,1,1]=4 3208 B13R1.513 CC(C)CSCc1ccc(cc1)Br 62a_100000210624_100000189115 [1,1,0,0,0,0|0,1,1]=4 3209 B13R1.513 CC(C)CSCc1ccc(cc1)Cl 62a_100000187161_100000210760 [1,1,0,0,0,0|0,1,1]=4 3210 B13R1.513 CC(C)CSCc1ccc(cc1)Cl 62a_100000210624_100000187161 [1,1,0,0,0,0|0,1,1]=4 3211 B13R1.513 CC(C)CSCc1ccc(cc1)F 62a_100000198546_100000210760 [1,1,0,0,0,0|0,1,1]=4 3212 B13R1.513 CC(C)CSCc1ccc(cc1)F 62a_100000210624_100000187164 [1,1,0,0,0,0|0,1,1]=4 3213 B13R1.513 CC(C)CSCc1ccc(cc1)I 62a_100000189116_100000210760 [1,1,0,0,0,0|0,1,1]=4 3214 B13R1.513 CC(C)CSCc1ccc(cc1)I 62a_100000210624_100000189116 [1,1,0,0,0,0|0,1,1]=4 3215 B13R1.513 CC(C)NN=Cc1ccc(cc1)Br 4a_100000741168_100000186029 [1,1,0,0,0,0|2,0,0]=4 3216 B13R1.513 CC(C)NN=Cc1ccc(cc1)Cl 4a_100000741168_100000189385 [1,1,0,0,0,0|2,0,0]=4 3217 B13R1.513 CC(C)NN=Cc1ccc(cc1)F 4a_100000741168_100000210084 [1,1,0,0,0,0|2,0,0]=4 3218 B13R1.513 CC(C)NN=Cc1ccc(cc1)I 4a_100000741168_100000188517 [1,1,0,0,0,0|2,0,0]=4 3219 B13R1.513 CC(C)NN=Cc1ccc(cc1)O 4a_100000741168_100000185832 [1,1,0,0,0,0|2,0,0]=4 3220 B13R1.513 CC(F)COCc1ccc(cc1)Br 34a_100015925927_100000189115 [1,1,0,0,0,0|1,0,1]=4 3221 B13R1.513 CC(F)COCc1ccc(cc1)Cl 34a_100015925927_100000694040 [1,1,0,0,0,0|1,0,1]=4 3222 B13R1.513 CC(F)COCc1ccc(cc1)F 34a_100015925927_100000198546 [1,1,0,0,0,0|1,0,1]=4 3223 B13R1.513 CC(F)COCc1ccc(cc1)I 34a_100015925927_100000189116 [1,1,0,0,0,0|1,0,1]=4 3224 B13R1.513 CC(O)COCc1ccc(cc1)Br 34a_100000695286_100011218427 [1,1,0,0,0,0|1,0,1]=4 3225 B13R1.513 CC(O)COCc1ccc(cc1)Cl 34a_100000211118_100011218427 [1,1,0,0,0,0|1,0,1]=4 3226 B13R1.513 CC(O)COCc1ccc(cc1)Cl 7a_100000211118_100011218427 [1,1,0,0,0,0|1,0,1]=4 3227 B13R1.513 CC(O)COCc1ccc(cc1)F 34a_100000210977_100011218427 [1,1,0,0,0,0|1,0,1]=4 3228 B13R1.513 CC(O)COCc1ccc(cc1)F 7a_100000210977_100011218427 [1,1,0,0,0,0|1,0,1]=4 3229 B13R1.513 CC(O)COCc1ccc(cc1)I 34a_100000690907_100011218427 [1,1,0,0,0,0|1,0,1]=4 3230 B13R1.513 CC(O)COCc1ccc(cc1)I 7a_100000690907_100011218427 [1,1,0,0,0,0|1,0,1]=4 3231 B13R1.513 CC(O)COCc1ccc(cc1)N 34a_100011215238_100011218427 [1,1,0,0,0,0|1,0,1]=4 3232 B13R1.513 CN(C)CC=Cc1ccc(cc1)Br 270004a_100102631434_100016291818 [1,1,0,0,0,0|2,0,0]=4 3233 B13R1.513 CN(C)CC=Cc1ccc(cc1)Cl 270004a_100102631434_100102525842 [1,1,0,0,0,0|2,0,0]=4 3234 B13R1.513 CN(C)CC=Cc1ccc(cc1)F 270004a_100102631434_100016272083 [1,1,0,0,0,0|2,0,0]=4 3235 B13R1.513 C[C@@H](Cl)COCc1ccc(cc1)Br 34a_100016084084_100000189115 [1,1,0,0,0,0|1,0,1]=4 3236 B13R1.513 C[C@@H](Cl)COCc1ccc(cc1)Cl 34a_100016084084_100000694040 [1,1,0,0,0,0|1,0,1]=4 3237 B13R1.513 C[C@@H](Cl)COCc1ccc(cc1)F 34a_100016084084_100000198546 [1,1,0,0,0,0|1,0,1]=4 3238 B13R1.513 C[C@@H](Cl)COCc1ccc(cc1)I 34a_100016084084_100000189116 [1,1,0,0,0,0|1,0,1]=4 3239 B13R1.513 C[C@@H](N)COCc1ccc(cc1)Br 34a_100000737577_100000189115 [1,1,0,0,0,0|1,0,1]=4 3240 B13R1.513 C[C@@H](N)COCc1ccc(cc1)Cl 34a_100000737577_100000694040 [1,1,0,0,0,0|1,0,1]=4 3241 B13R1.513 C[C@@H](N)COCc1ccc(cc1)F 34a_100000737577_100000198546 [1,1,0,0,0,0|1,0,1]=4 3242 B13R1.513 C[C@@H](N)COCc1ccc(cc1)I 34a_100000737577_100000189116 [1,1,0,0,0,0|1,0,1]=4 3243 B13R1.513 C[C@@H](O)COCc1ccc(cc1)Br 34a_100000695286_100009817552 [1,1,0,0,0,0|1,0,1]=4 3244 B13R1.513 C[C@@H](O)COCc1ccc(cc1)Cl 34a_100000211118_100009817552 [1,1,0,0,0,0|1,0,1]=4 3245 B13R1.513 C[C@@H](O)COCc1ccc(cc1)Cl 7a_100000211118_100009817552 [1,1,0,0,0,0|1,0,1]=4 3246 B13R1.513 C[C@@H](O)COCc1ccc(cc1)F 34a_100000210977_100009817552 [1,1,0,0,0,0|1,0,1]=4 3247 B13R1.513 C[C@@H](O)COCc1ccc(cc1)F 7a_100000210977_100009817552 [1,1,0,0,0,0|1,0,1]=4 3248 B13R1.513 C[C@@H](O)COCc1ccc(cc1)I 34a_100000690907_100009817552 [1,1,0,0,0,0|1,0,1]=4 3249 B13R1.513 C[C@@H](O)COCc1ccc(cc1)I 7a_100000690907_100009817552 [1,1,0,0,0,0|1,0,1]=4 3250 B13R1.513 C[C@@H](O)COCc1ccc(cc1)N 34a_100011215238_100009817552 [1,1,0,0,0,0|1,0,1]=4 3251 B13R1.513 Cc1ccc(cc1)C=CCC(C)C 271570a_100016259101_100000186775 [1,1,0,0,0,0|1,0,0]=3 3252 B13R1.513 Cc1ccc(cc1)C=CCN(C)C 270004a_100102631434_100016257026 [1,1,0,0,0,0|2,0,0]=4 3253 B13R1.513 Cc1ccc(cc1)C=NNC(C)C 4a_100000741168_100000211033 [1,1,0,0,0,0|2,0,0]=4 3254 B13R1.513 Cc1ccc(cc1)CNCC(C)C 207a_100000210953_100000211033 [1,1,0,0,0,0|1,0,1]=4 3255 B13R1.513 Cc1ccc(cc1)CNCC(C)C 2230a_100000174908_100000210760 [1,1,0,0,0,0|1,0,1]=4 3256 B13R1.513 Cc1ccc(cc1)CNCC(C)C 2230a_100000210953_100000210814 [1,1,0,0,0,0|1,0,1]=4 3257 B13R1.513 Cc1ccc(cc1)CNCC(C)C 26a_100000210953_200020625495 [1,1,0,0,0,0|1,0,1]=4 3258 B13R1.513 Cc1ccc(cc1)CNCC(C)C 270004a_100000174908_100000210432 [1,1,0,0,0,0|1,0,1]=4 3259 B13R1.513 Cc1ccc(cc1)CNCC(C)C 270004a_100000210953_100000211033 [1,1,0,0,0,0|1,0,1]=4 3260 B13R1.513 Cc1ccc(cc1)CNCC(C)C 34a_100000174908_100000210624 [1,1,0,0,0,0|1,0,1]=4 3261 B13R1.513 Cc1ccc(cc1)CNCC(C)C 34a_100000210953_100000210814 [1,1,0,0,0,0|1,0,1]=4 3262 B13R1.513 Cc1ccc(cc1)COCC(C)Br 34a_100012180447_100000210814 [1,1,0,0,0,0|1,0,1]=4 3263 B13R1.513 Cc1ccc(cc1)COCC(C)C 34a_100000210257_100000210814 [1,1,0,0,0,0|0,0,1]=3 3264 B13R1.513 Cc1ccc(cc1)COCC(C)C 34a_100011215236_100000210624 [1,1,0,0,0,0|0,0,1]=3 3265 B13R1.513 Cc1ccc(cc1)COCC(C)C 7a_100011215236_100000210760 [1,1,0,0,0,0|0,0,1]=3 3266 B13R1.513 Cc1ccc(cc1)COCC(C)F 34a_100015925927_100000210814 [1,1,0,0,0,0|1,0,1]=4 3267 B13R1.513 Cc1ccc(cc1)COCC(C)O 34a_100011215236_100011218427 [1,1,0,0,0,0|1,0,1]=4 3268 B13R1.513 Cc1ccc(cc1)COCC(C)O 7a_100011215236_100011218427 [1,1,0,0,0,0|1,0,1]=4 3269 B13R1.513 Cc1ccc(cc1)COC[C@@H](C)Cl 34a_100016084084_100000210814 [1,1,0,0,0,0|1,0,1]=4 3270 B13R1.513 Cc1ccc(cc1)COC[C@@H](C)N 34a_100000737577_100000210814 [1,1,0,0,0,0|1,0,1]=4 3271 B13R1.513 Cc1ccc(cc1)COC[C@@H](C)O 34a_100011215236_100009817552 [1,1,0,0,0,0|1,0,1]=4 3272 B13R1.513 Cc1ccc(cc1)COC[C@@H](C)O 7a_100011215236_100009817552 [1,1,0,0,0,0|1,0,1]=4 3273 B13R1.513 Cc1ccc(cc1)CSCC(C)C 62a_100000210624_100000210814 [1,1,0,0,0,0|0,1,1]=4 3274 B13R1.513 Cc1ccc(cc1)CSCC(C)C 62a_100000210814_100000210760 [1,1,0,0,0,0|0,1,1]=4 3275 B13R1.513 Cc1ccc(cc1)NCCC(C)C 34a_100000124888_100000210312 [1,1,0,0,0,0|2,0,0]=4 3276 B13R1.513 Cc1ccc(cc1)OCCC(C)C 34a_100000210336_100000210312 [1,1,0,0,0,0|2,0,0]=4 3277 B13R1.513 Cc1ccc(cc1)OCCC(C)C 7a_100000210336_100000210626 [1,1,0,0,0,0|2,0,0]=4 3278 B13R1.513 Cc1ccc(cc1)SCCC(C)C 62a_100000186775_100000210312 [1,1,0,0,0,0|2,0,0]=4 3279 B13R1.513 Cc1ccc(cc1)SCCC(C)C 62a_100000210312_100000186775 [1,1,0,0,0,0|2,0,0]=4 3280 B13R1.513 Cc1ccc(cn1)C=CCC(C)C 271570a_100016259101_100000751577 [1,1,0,0,0,0|2,0,0]=4 3281 B13R1.513 Cc1ccc(cn1)COCC(C)C 34a_100000210257_100016987292 [1,1,0,0,0,0|1,0,1]=4 3282 B13R1.513 Cc1ccc(cn1)COCC(C)C 34a_100011248133_100000210624 [1,1,0,0,0,0|1,0,1]=4 3283 B13R1.513 Cc1ccc(nc1)C=CCC(C)C 271570a_100016259101_100000754016 [1,1,0,0,0,0|2,0,0]=4 3284 B13R1.513 Cc1ccc(nc1)COCC(C)C 34a_100000210257_100000691093 [1,1,0,0,0,0|1,0,1]=4 3285 B13R1.513 Cc1ccc(nc1)COCC(C)C 34a_100012001401_100000210624 [1,1,0,0,0,0|1,0,1]=4 3286 B13R1.718 C=CC(C)COCc1ccccc1 34a_100011215527_100015291786 [1,1,0,0,0,0|0,0,2]=4 3287 B13R1.718 C=CC(C)COCc1ccccc1 7a_100011215527_100000211182 [1,1,0,0,0,0|0,0,2]=4 3288 B13R1.718 CC(CCCc1ccccc1)S[13CH3] 62a_200010759516_200025704644 [1,1,0,0,0,0|1,0,1]=4 3289 B13R1.718 CC(CCCc1ccccc1)S[13CH3] 62a_200025704644_200010759516 [1,1,0,0,0,0|1,0,1]=4 3290 B13R1.718 CC(CN)COCc1ccccc1 34a_100000744482_100015291786 [1,1,0,0,0,0|0,0,1]=3 3291 B13R1.718 CC(CN)COCc1ccccn1 34a_100000744482_100000721315 [1,1,0,0,0,0|1,0,1]=4 3292 B13R1.718 CC(CN)COCc1cccnc1 34a_100000744482_100000733263 [1,1,0,0,0,0|1,0,1]=4 3293 B13R1.718 CC(CO)CNCc1ccccc1 207a_100000744482_100015611070 [1,1,0,0,0,0|1,0,1]=4 3294 B13R1.718 CC(CO)CNCc1ccccc1 34a_100000744482_100015291786 [1,1,0,0,0,0|1,0,1]=4 3295 B13R1.718 CC(COCc1ccccc1)O[13CH3] 34a_100000764311_200025704644 [1,1,0,0,0,0|0,0,1]=3 3296 B13R1.718 CC(COCc1ccccc1)O[13CH3] 7a_100000764311_200025704644 [1,1,0,0,0,0|0,0,1]=3 3297 B13R1.718 CCC(C)CNCc1ccccc1 207a_100020588543_100015611070 [1,1,0,0,0,0|1,0,1]=4 3298 B13R1.718 CCC(C)CNCc1ccccc1 2230a_100015324214_100000748023 [1,1,0,0,0,0|1,0,1]=4 3299 B13R1.718 CCC(C)CNCc1ccccc1 2230a_100020588543_100015291786 [1,1,0,0,0,0|1,0,1]=4 3300 B13R1.718 CCC(C)CNCc1ccccc1 270004a_100015324214_100000243153 [1,1,0,0,0,0|1,0,1]=4 3301 B13R1.718 CCC(C)CNCc1ccccc1 270004a_100020588543_100015611070 [1,1,0,0,0,0|1,0,1]=4 3302 B13R1.718 CCC(C)CNCc1ccccc1 34a_100015324214_100000748023 [1,1,0,0,0,0|1,0,1]=4 3303 B13R1.718 CCC(C)COCc1ccccc1 34a_100000210790_100000748023 [1,1,0,0,0,0|0,0,1]=3 3304 B13R1.718 CCC(C)COCc1ccccc1 7a_100000210790_100000748023 [1,1,0,0,0,0|0,0,1]=3 3305 B13R1.718 CCC(C)CSCc1ccccc1 62a_100000211182_100000748023 [1,1,0,0,0,0|0,1,1]=4 3306 B13R1.718 CCC(C)CSCc1ccccc1 62a_100000748023_100015291786 [1,1,0,0,0,0|0,1,1]=4 3307 B13R1.718 CCC(C)NN=Cc1ccccc1 4a_100000718999_100015611070 [1,1,0,0,0,0|2,0,0]=4 3308 B13R1.718 CCC(O)COCc1ccccc1 34a_100000210790_100011218378 [1,1,0,0,0,0|1,0,1]=4 3309 B13R1.718 CCC(O)COCc1ccccc1 7a_100000210790_100011218378 [1,1,0,0,0,0|1,0,1]=4 3310 B13R1.718 CCN(C)C/C=C/c1ccccc1 2230a_100000225621_100016265936 [1,1,0,0,0,0|2,0,0]=4 3311 B13R1.718 CCN(C)C/C=C/c1ccccc1 2230a_100020603567_200000210301 [1,1,0,0,0,0|2,0,0]=4 3312 B13R1.718 CCN(C)C/C=C/c1ccccc1 269982a_100000225621_100016265936 [1,1,0,0,0,0|2,0,0]=4 3313 B13R1.718 CCN(C)C/C=C/c1ccccc1 269982a_100020603567_200000210301 [1,1,0,0,0,0|2,0,0]=4 3314 B13R1.718 CCN(C)COCc1ccccc1 2230a_100000225621_100000763385 [1,1,0,0,0,0|1,0,1]=4 3315 B13R1.718 CCN([13CH3])C/C=C/c1ccccc1 2230a_100020603567_200025704644 [1,1,0,0,0,0|2,0,0]=4 3316 B13R1.718 CCN([13CH3])C/C=C/c1ccccc1 269982a_100020603567_200025704644 [1,1,0,0,0,0|2,0,0]=4 3317 B13R1.718 CC[C@H](C)CNCc1ccccc1 2230a_100015324214_100009816398 [1,1,0,0,0,0|1,0,1]=4 3318 B13R1.718 CC[C@H](C)CNCc1ccccc1 34a_100015324214_100009816398 [1,1,0,0,0,0|1,0,1]=4 3319 B13R1.718 CC[C@H](C)COCc1ccccc1 34a_100000210790_100009816398 [1,1,0,0,0,0|0,0,1]=3 3320 B13R1.718 CC[C@H](C)COCc1ccccc1 7a_100000210790_100009816398 [1,1,0,0,0,0|0,0,1]=3 3321 B13R1.718 CC[C@H](C)COCc1ccccc1 7a_100009816381_100000211182 [1,1,0,0,0,0|0,0,1]=3 3322 B13R1.718 CC[C@H](C)COCc1ccccn1 7a_100009816381_100000721315 [1,1,0,0,0,0|1,0,1]=4 3323 B13R1.718 CC[C@H](C)COCc1cccnc1 7a_100009816381_100000741622 [1,1,0,0,0,0|1,0,1]=4 3324 B13R1.718 CC[C@H](C)COCc1ccncc1 7a_100009816381_100015193705 [1,1,0,0,0,0|1,0,1]=4 3325 B13R1.718 CC[C@H](C)CSCc1ccccc1 62a_100000211182_100009816398 [1,1,0,0,0,0|0,1,1]=4 3326 B13R1.718 CC[C@H](C)CSCc1ccccc1 62a_100009816398_100015291786 [1,1,0,0,0,0|0,1,1]=4 3327 B13R1.718 CNC(C)CCCc1ccccc1 2230a_106832991635_200010759516 [1,1,0,0,0,0|1,0,1]=4 3328 B13R1.718 CNC(C)CCCc1ccccc1 34a_100102657272_200010759516 [1,1,0,0,0,0|1,0,1]=4 3329 B13R1.718 CNC(C)CCCc1ccccc1 7a_106832991635_200010759516 [1,1,0,0,0,0|1,0,1]=4 3330 B13R1.718 CNC(C)COCc1ccccc1 270004a_106832991635_100011215004 [1,1,0,0,0,0|0,0,1]=3 3331 B13R1.718 CNC(C)CSCc1ccccc1 270004a_106832991635_100000172147 [1,1,0,0,0,0|0,1,1]=4 3332 B13R1.718 COC(C)CCCc1ccccc1 34a_100138415774_200010759516 [1,1,0,0,0,0|1,0,1]=4 3333 B13R1.718 COC(C)COCc1ccccc1 34a_100000690652_100015291786 [1,1,0,0,0,0|0,0,1]=3 3334 B13R1.718 COC(C)COCc1ccccc1 34a_100000764311_200000210301 [1,1,0,0,0,0|0,0,1]=3 3335 B13R1.718 COC(C)COCc1ccccc1 7a_100000764311_200000210301 [1,1,0,0,0,0|0,0,1]=3 3336 B13R1.718 COC(C)COCc1ccccn1 34a_100000690652_100000721315 [1,1,0,0,0,0|1,0,1]=4 3337 B13R1.718 COC(C)COCc1cccnc1 34a_100000690652_100000733263 [1,1,0,0,0,0|1,0,1]=4 3338 B13R1.718 CO[C@H](C)CNCc1ccccc1 207a_100020591295_100015611070 [1,1,0,0,0,0|1,0,1]=4 3339 B13R1.718 CO[C@H](C)CNCc1ccccc1 2230a_100020591295_100015291786 [1,1,0,0,0,0|1,0,1]=4 3340 B13R1.718 CO[C@H](C)CNCc1ccccc1 270004a_100020591295_100015611070 [1,1,0,0,0,0|1,0,1]=4 3341 B13R1.718 CSC(C)CCCc1ccccc1 62a_200000210301_200010759516 [1,1,0,0,0,0|1,0,1]=4 3342 B13R1.718 CSC(C)CCCc1ccccc1 62a_200010759516_200000210301 [1,1,0,0,0,0|1,0,1]=4 3343 B13R1.718 C[C@@H](CO)CNCc1ccccc1 2230a_100015324214_100000059175 [1,1,0,0,0,0|1,0,1]=4 3344 B13R1.718 C[C@@H](CO)CNCc1ccccc1 34a_100015324214_100000059175 [1,1,0,0,0,0|1,0,1]=4 3345 B13R1.718 C[C@@H](CO)COCc1ccccc1 34a_100000210790_100000059175 [1,1,0,0,0,0|0,0,1]=3 3346 B13R1.718 C[C@@H](CO)COCc1ccccc1 7a_100000210790_100000059175 [1,1,0,0,0,0|0,0,1]=3 3347 B13R1.718 C[C@@H](CO)CSCc1ccccc1 62a_100000059175_100015291786 [1,1,0,0,0,0|0,1,1]=4 3348 B13R1.718 C[C@@H](CO)CSCc1ccccc1 62a_100000211182_100000059175 [1,1,0,0,0,0|0,1,1]=4 3349 B13R1.718 ClCC(Cl)COCc1ccccc1 34a_100000033668_100015291786 [1,1,0,0,0,0|1,0,1]=4 3350 B13R1.718 NC[C@@H](F)COCc1ccccc1 34a_100015665980_100015291786 [1,1,0,0,0,0|1,0,1]=4 3351 B13R1.718 OCC(O)COCc1ccccc1 34a_100000210790_100011219619 [1,1,0,0,0,0|1,0,1]=4 3352 B13R1.718 OCC(O)COCc1ccccc1 7a_100000210790_100011219619 [1,1,0,0,0,0|1,0,1]=4 3353 B13R1.718 OC[C@H](O)COCc1ccccc1 34a_100000210790_100009815848 [1,1,0,0,0,0|1,0,1]=4 3354 B13R1.718 OC[C@H](O)COCc1ccccc1 7a_100000210790_100009815848 [1,1,0,0,0,0|1,0,1]=4 3355 B13R1.718 O[C@@H](CF)COCc1ccccc1 34a_100000210790_100015614560 [1,1,0,0,0,0|1,0,1]=4 3356 B13R1.718 O[C@@H](CF)COCc1ccccc1 7a_100000210790_100015614560 [1,1,0,0,0,0|1,0,1]=4 3357 B13R1.3523 CC(C)(C)CCNc1ccccc1 34a_100000106764_100000755188 [1,1,0,0,0,0|2,0,0]=4 3358 B13R1.3523 CC(C)(C)CCOc1ccccc1 34a_100000210340_100000755188 [1,1,0,0,0,0|2,0,0]=4 3359 B13R1.3523 CC(C)(C)CCOc1ccccc1 7a_100000210340_100000755188 [1,1,0,0,0,0|2,0,0]=4 3360 B13R1.3523 CC(C)(C)CCSc1ccccc1 62a_100000719477_100000755188 [1,1,0,0,0,0|2,0,0]=4 3361 B13R1.3523 CC(C)(C)CCSc1ccccc1 62a_100000755188_100000041952 [1,1,0,0,0,0|2,0,0]=4 3362 B13R1.3523 CC(C)(C)CNCc1ccccc1 207a_100000743828_100015611070 [1,1,0,0,0,0|1,0,1]=4 3363 B13R1.3523 CC(C)(C)CNCc1ccccc1 2230a_100000743828_100015291786 [1,1,0,0,0,0|1,0,1]=4 3364 B13R1.3523 CC(C)(C)CNCc1ccccc1 270004a_100000743828_100015611070 [1,1,0,0,0,0|1,0,1]=4 3365 B13R1.3523 CC(C)(C)CNCc1ccccc1 270004a_100015324214_100011204126 [1,1,0,0,0,0|1,0,1]=4 3366 B13R1.3523 CC(C)(C)CNCc1ccccc1 34a_100015324214_100011219605 [1,1,0,0,0,0|1,0,1]=4 3367 B13R1.3523 CC(C)(C)COCc1ccccc1 34a_100000210790_100011219605 [1,1,0,0,0,0|0,0,1]=3 3368 B13R1.3523 CC(C)(C)CSCc1ccccc1 62a_100000211182_100011219605 [1,1,0,0,0,0|0,1,1]=4 3369 B13R1.3523 CC(C)(C)CSCc1ccccc1 62a_100011219605_100015291786 [1,1,0,0,0,0|0,1,1]=4 3370 B13R1.3523 CC(C)(C)NN=Cc1ccccc1 4a_100000725372_100015611070 [1,1,0,0,0,0|2,0,0]=4 3371 B13R1.3523 CC(C)(F)CNCc1ccccc1 207a_100020643315_100015611070 [1,1,0,0,0,0|1,0,1]=4 3372 B13R1.3523 CC(C)(F)CNCc1ccccc1 2230a_100020643315_100015291786 [1,1,0,0,0,0|1,0,1]=4 3373 B13R1.3523 CC(C)(F)CNCc1ccccc1 270004a_100020643315_100015611070 [1,1,0,0,0,0|1,0,1]=4 3374 B13R1.3523 CC(C)(F)CNCc1ccccc1 34a_100015324214_100011997219 [1,1,0,0,0,0|1,0,1]=4 3375 B13R1.3523 CC(C)(F)COCc1ccccc1 34a_100000210790_100011997219 [1,1,0,0,0,0|0,0,1]=3 3376 B13R1.3523 CC(C)(F)COCc1ccccc1 34a_100000716592_100015291786 [1,1,0,0,0,0|0,0,1]=3 3377 B13R1.3523 CC(C)(F)COCc1ccccn1 34a_100000716592_100000721315 [1,1,0,0,0,0|1,0,1]=4 3378 B13R1.3523 CC(C)(F)COCc1cccnc1 34a_100000716592_100000733263 [1,1,0,0,0,0|1,0,1]=4 3379 B13R1.3523 CC(C)(F)CSCc1ccccc1 62a_100000211182_100011997219 [1,1,0,0,0,0|0,1,1]=4 3380 B13R1.3523 CC(C)(F)CSCc1ccccc1 62a_100011997219_100015291786 [1,1,0,0,0,0|0,1,1]=4 3381 B13R1.3523 CC(C)(O)CCNc1ccccc1 34a_100000106764_100000702414 [1,1,0,0,0,0|2,0,0]=4 3382 B13R1.3523 CC(C)(O)CCOc1ccccc1 34a_100000210340_100000702414 [1,1,0,0,0,0|2,0,0]=4 3383 B13R1.3523 CC(C)(O)CCOc1ccccc1 7a_100000210340_100000702414 [1,1,0,0,0,0|2,0,0]=4 3384 B13R1.3523 CC(C)(O)CCSc1ccccc1 62a_100000702414_100000041952 [1,1,0,0,0,0|2,0,0]=4 3385 B13R1.3523 CC(C)(O)CCSc1ccccc1 62a_100000719477_100000702414 [1,1,0,0,0,0|2,0,0]=4 3386 B13R1.3523 CC(C)(O)CNCc1ccccc1 207a_100000751335_100015611070 [1,1,0,0,0,0|1,0,1]=4 3387 B13R1.3523 CC(C)(O)CNCc1ccccc1 2230a_100000751335_100015291786 [1,1,0,0,0,0|1,0,1]=4 3388 B13R1.3523 CC(C)(O)CNCc1ccccc1 270004a_100000751335_100015611070 [1,1,0,0,0,0|1,0,1]=4 3389 B13R1.3523 CC(C)(O)CNCc1ccccc1 34a_100015324214_100000764493 [1,1,0,0,0,0|1,0,1]=4 3390 B13R1.3523 CC(C)(O)COCc1ccccc1 34a_100000210790_100000764493 [1,1,0,0,0,0|0,0,1]=3 3391 B13R1.3523 CC(C)(O)COCc1ccccc1 7a_100000210790_100000764493 [1,1,0,0,0,0|0,0,1]=3 3392 B13R1.3523 CC(C)(O)CSCc1ccccc1 62a_100000211182_100000764493 [1,1,0,0,0,0|0,1,1]=4 3393 B13R1.3523 CC(C)(O)CSCc1ccccc1 62a_100000764493_100015291786 [1,1,0,0,0,0|0,1,1]=4 3394 B13R1.3523 CC(F)(F)COCc1ccccc1 34a_100000068830_100015291786 [1,1,0,0,0,0|1,0,1]=4 3395 B13R1.3523 C[Si](C)(C)COCc1ccccc1 7a_100000210790_100000233785 [1,1,0,0,0,0|0,1,1]=4 3396 B13R1.129 CC(C)CNC(=O)c1ccc(o1)O 271570a_203496583355_100000160793 [0,1,0,0,1,0|2,0,0]=4 3397 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748629 [0,1,0,0,1,0|0,0,2]=4 3398 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000748629 [0,1,0,0,1,0|0,0,2]=4 3399 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748629 [0,1,0,0,1,0|0,0,2]=4 3400 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000748629 [0,1,0,0,1,0|0,0,2]=4 3401 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000748629 [0,1,0,0,1,0|0,0,2]=4 3402 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000748629 [0,1,0,0,1,0|0,0,2]=4 3403 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Br 1458a_100000070787_100000188085 [0,1,0,0,1,0|1,0,1]=4 3404 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)C 1458a_100000070787_100000211441 [0,1,0,0,1,0|1,0,1]=4 3405 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000070787_100000211071 [0,1,0,0,1,0|1,0,1]=4 3406 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)F 1458a_100000070787_100000211279 [0,1,0,0,1,0|1,0,1]=4 3407 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)I 1458a_100000070787_100011216261 [0,1,0,0,1,0|1,0,1]=4 3408 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 1458a_100000070787_100009814261 [0,1,0,0,1,0|1,0,1]=4 3409 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 271570a_203496583355_100000184285 [0,1,0,0,1,0|1,0,1]=4 3410 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210624 [0,1,0,0,1,0|0,0,0]=2 3411 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210624 [0,1,0,0,1,0|0,0,0]=2 3412 B13R1.132 CC(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000210624 [0,1,0,0,1,0|0,0,0]=2 3413 B13R1.132 CC(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000210624 [0,1,0,0,1,0|0,0,0]=2 3414 B13R1.132 CC(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000210624 [0,1,0,0,1,0|0,0,0]=2 3415 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 2230a_100000219623_100000210760 [0,1,0,0,1,0|2,0,0]=4 3416 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 2230a_200011231703_200000210301 [0,1,0,0,1,0|2,0,0]=4 3417 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 269982a_100000219623_100000210624 [0,1,0,0,1,0|2,0,0]=4 3418 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 269982a_200011231703_200000210301 [0,1,0,0,1,0|2,0,0]=4 3419 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 34a_100000219623_100000210624 [0,1,0,0,1,0|2,0,0]=4 3420 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br 34a_200011231703_200000210301 [0,1,0,0,1,0|2,0,0]=4 3421 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210760 [0,1,0,0,1,0|2,0,0]=4 3422 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210624 [0,1,0,0,1,0|2,0,0]=4 3423 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 34a_100020629279_100000210624 [0,1,0,0,1,0|2,0,0]=4 3424 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 2230a_100000219829_100000210760 [0,1,0,0,1,0|2,0,0]=4 3425 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 2230a_100000713154_200000210301 [0,1,0,0,1,0|2,0,0]=4 3426 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 269982a_100000219829_100000210624 [0,1,0,0,1,0|2,0,0]=4 3427 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 269982a_100000713154_200000210301 [0,1,0,0,1,0|2,0,0]=4 3428 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 34a_100000219829_100000210624 [0,1,0,0,1,0|2,0,0]=4 3429 B13R1.132 CC(C)CN(C)c1ccc(cc1)F 34a_100000713154_200000210301 [0,1,0,0,1,0|2,0,0]=4 3430 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 2230a_100000743151_100000210760 [0,1,0,0,1,0|2,0,0]=4 3431 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 269982a_100000743151_100000210624 [0,1,0,0,1,0|2,0,0]=4 3432 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 34a_100000743151_100000210624 [0,1,0,0,1,0|2,0,0]=4 3433 B13R1.132 CC(C)CN(C)c1ccc(cc1)O 269982a_100000182112_100000210624 [0,1,0,0,1,0|2,0,0]=4 3434 B13R1.132 CC(C)CN(C)c1ccc(cc1)O 34a_100000182112_100000210624 [0,1,0,0,1,0|2,0,0]=4 3435 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)Br 2230a_200011231703_200025704644 [0,1,0,0,1,0|2,0,0]=4 3436 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)Br 269982a_200011231703_200025704644 [0,1,0,0,1,0|2,0,0]=4 3437 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)Br 34a_200011231703_200025704644 [0,1,0,0,1,0|2,0,0]=4 3438 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)F 2230a_100000713154_200025704644 [0,1,0,0,1,0|2,0,0]=4 3439 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)F 269982a_100000713154_200025704644 [0,1,0,0,1,0|2,0,0]=4 3440 B13R1.132 CC(C)CN([13CH3])c1ccc(cc1)F 34a_100000713154_200025704644 [0,1,0,0,1,0|2,0,0]=4 3441 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)Br 271570a_100015190218_100000752885 [0,1,0,0,1,0|1,0,1]=4 3442 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)Cl 271570a_100015190218_100000755918 [0,1,0,0,1,0|1,0,1]=4 3443 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)F 271570a_100015190218_100000211213 [0,1,0,0,1,0|1,0,1]=4 3444 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)N 271570a_100015190218_100000185761 [0,1,0,0,1,0|1,0,1]=4 3445 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)O 271570a_100015190218_100000185759 [0,1,0,0,1,0|1,0,1]=4 3446 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 11a_100138425928_100000185839 [0,1,0,0,1,0|1,0,0]=3 3447 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 1626a_100138425928_100000185839 [0,1,0,0,1,0|1,0,0]=3 3448 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 240690a_100138425928_100000185839 [0,1,0,0,1,0|1,0,0]=3 3449 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 527a_100138425928_100000185839 [0,1,0,0,1,0|1,0,0]=3 3450 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 11a_100138425928_100000210187 [0,1,0,0,1,0|1,0,0]=3 3451 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 1626a_100138425928_100000210187 [0,1,0,0,1,0|1,0,0]=3 3452 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 240690a_100138425928_100000210187 [0,1,0,0,1,0|1,0,0]=3 3453 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 527a_100138425928_100000210187 [0,1,0,0,1,0|1,0,0]=3 3454 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 11a_100138425928_100000187176 [0,1,0,0,1,0|1,0,0]=3 3455 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 1626a_100138425928_100000187176 [0,1,0,0,1,0|1,0,0]=3 3456 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 240690a_100138425928_100000187176 [0,1,0,0,1,0|1,0,0]=3 3457 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 527a_100138425928_100000187176 [0,1,0,0,1,0|1,0,0]=3 3458 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 11a_100138425928_100000187904 [0,1,0,0,1,0|1,0,0]=3 3459 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 1626a_100138425928_100000187904 [0,1,0,0,1,0|1,0,0]=3 3460 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 240690a_100138425928_100000187904 [0,1,0,0,1,0|1,0,0]=3 3461 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 527a_100138425928_100000187904 [0,1,0,0,1,0|1,0,0]=3 3462 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 240690a_100138425928_100000212099 [0,1,0,0,1,0|1,0,0]=3 3463 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 271570a_203496583355_200000152628 [0,1,0,0,1,0|1,0,0]=3 3464 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 527a_100138425928_100000212099 [0,1,0,0,1,0|1,0,0]=3 3465 B13R1.132 CC(C)NC(=O)c1ccc(nc1)O 271570a_203496583355_100000157566 [0,1,0,0,1,0|2,0,0]=4 3466 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 34a_100000212225_100000755118 [0,1,0,0,1,0|1,0,1]=4 3467 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 34a_100000745893_100000210206 [0,1,0,0,1,0|1,0,1]=4 3468 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 7a_100000745893_100000210206 [0,1,0,0,1,0|1,0,1]=4 3469 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 34a_100000181323_100000210206 [0,1,0,0,1,0|1,0,1]=4 3470 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 34a_100000212225_100000743420 [0,1,0,0,1,0|1,0,1]=4 3471 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 7a_100000181323_100000210206 [0,1,0,0,1,0|1,0,1]=4 3472 B13R1.132 CC(C)OC(C)c1ccc(cc1)N 34a_100011216399_100000210206 [0,1,0,0,1,0|1,0,1]=4 3473 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210206 [0,1,0,0,1,0|1,0,1]=4 3474 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210206 [0,1,0,0,1,0|1,0,1]=4 3475 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100011218427 [0,1,0,0,1,0|1,0,0]=3 3476 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011218427 [0,1,0,0,1,0|1,0,0]=3 3477 B13R1.132 CC(O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100011218427 [0,1,0,0,1,0|1,0,0]=3 3478 B13R1.132 CC(O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100011218427 [0,1,0,0,1,0|1,0,0]=3 3479 B13R1.132 CC(O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011218427 [0,1,0,0,1,0|1,0,0]=3 3480 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Br 269982a_100102631434_100000188085 [0,1,0,0,1,0|1,0,0]=3 3481 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Cl 269982a_100102631434_100000211071 [0,1,0,0,1,0|1,0,0]=3 3482 B13R1.132 CN(C)CC(=O)c1ccc(cc1)F 269982a_100102631434_100000211279 [0,1,0,0,1,0|1,0,0]=3 3483 B13R1.132 CN(C)CC(=O)c1ccc(cc1)I 269982a_100102631434_100011216261 [0,1,0,0,1,0|1,0,0]=3 3484 B13R1.132 CN(C)CC(=O)c1ccc(cc1)O 269982a_100102631434_100009814261 [0,1,0,0,1,0|1,0,0]=3 3485 B13R1.132 CN(C)CC(=O)c1ccc(cn1)Cl 269982a_100102631434_100016989621 [0,1,0,0,1,0|2,0,0]=4 3486 B13R1.132 CN(C)CC(=O)c1ccc(nc1)Cl 269982a_100102631434_100009864725 [0,1,0,0,1,0|2,0,0]=4 3487 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)C 1458a_100000188618_100000210624 [0,1,0,0,1,0|0,0,0]=2 3488 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)O 1458a_100000188618_100011218427 [0,1,0,0,1,0|1,0,0]=3 3489 B13R1.132 Cc1ccc(cc1)C(=O)CC(F)F 1458a_100000188618_100011934356 [0,1,0,0,1,0|2,0,0]=4 3490 B13R1.132 Cc1ccc(cc1)C(=O)CN(C)C 2230a_100102631434_100000211441 [0,1,0,0,1,0|1,0,0]=3 3491 B13R1.132 Cc1ccc(cc1)C(=O)CN(C)C 269982a_100102631434_100000211441 [0,1,0,0,1,0|1,0,0]=3 3492 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 11a_100138425928_100000188618 [0,1,0,0,1,0|1,0,0]=3 3493 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 1626a_100138425928_100000188618 [0,1,0,0,1,0|1,0,0]=3 3494 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 240690a_100138425928_100000188618 [0,1,0,0,1,0|1,0,0]=3 3495 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 527a_100138425928_100000188618 [0,1,0,0,1,0|1,0,0]=3 3496 B13R1.132 Cc1ccc(cc1)C(C)OC(C)C 34a_100000212225_100011261388 [0,1,0,0,1,0|1,0,1]=4 3497 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 2230a_100000219977_100000210760 [0,1,0,0,1,0|2,0,0]=4 3498 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 2230a_100015205861_200000210301 [0,1,0,0,1,0|2,0,0]=4 3499 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 269982a_100000219977_100000210624 [0,1,0,0,1,0|2,0,0]=4 3500 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 269982a_100015205861_200000210301 [0,1,0,0,1,0|2,0,0]=4 3501 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 34a_100000219977_100000210624 [0,1,0,0,1,0|2,0,0]=4 3502 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 34a_100015205861_200000210301 [0,1,0,0,1,0|2,0,0]=4 3503 B13R1.132 Cc1ccc(cc1)N([13CH3])CC(C)C 2230a_100015205861_200025704644 [0,1,0,0,1,0|2,0,0]=4 3504 B13R1.132 Cc1ccc(cc1)N([13CH3])CC(C)C 269982a_100015205861_200025704644 [0,1,0,0,1,0|2,0,0]=4 3505 B13R1.132 Cc1ccc(cc1)N([13CH3])CC(C)C 34a_100015205861_200025704644 [0,1,0,0,1,0|2,0,0]=4 3506 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 34a_100000690690_100000210206 [0,1,0,0,1,0|1,0,1]=4 3507 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 7a_100000690690_100000210206 [0,1,0,0,1,0|1,0,1]=4 3508 B13R1.132 Cc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000186775 [0,1,0,0,1,0|1,0,1]=4 3509 B13R1.132 Cc1ccc(cn1)C(=O)CN(C)C 269982a_100102631434_100012027583 [0,1,0,0,1,0|2,0,0]=4 3510 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Br 1458a_100000185839_100011934356 [0,1,0,0,1,0|2,0,0]=4 3511 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Cl 1458a_100000210187_100011934356 [0,1,0,0,1,0|2,0,0]=4 3512 B13R1.132 O=C(CC(F)F)c1ccc(cc1)F 1458a_100000187176_100011934356 [0,1,0,0,1,0|2,0,0]=4 3513 B13R1.132 O=C(CC(F)F)c1ccc(cc1)I 1458a_100000187904_100011934356 [0,1,0,0,1,0|2,0,0]=4 3514 B13R1.132 O=C(CC(F)F)c1ccc(cc1)O 1458a_100000212099_100011934356 [0,1,0,0,1,0|2,0,0]=4 3515 B13R1.132 [2H]C(OC(C)C)c1ccc(cc1)F 34a_217856618577_100000210206 [0,1,0,0,1,0|1,0,1]=4 3516 B13R1.132 [2H]C(OC(C)C)c1ccc(cc1)F 7a_217856618577_100000210206 [0,1,0,0,1,0|1,0,1]=4 3517 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000748629 [0,1,0,0,1,0|0,0,2]=4 3518 B13R1.147 C=C(C)CC(=O)c1cccc(c1)C 1458a_100000189346_100000748629 [0,1,0,0,1,0|0,0,2]=4 3519 B13R1.147 C=C(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000748629 [0,1,0,0,1,0|0,0,2]=4 3520 B13R1.147 C=C(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000748629 [0,1,0,0,1,0|0,0,2]=4 3521 B13R1.147 C=C(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000748629 [0,1,0,0,1,0|0,0,2]=4 3522 B13R1.147 C=C(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000748629 [0,1,0,0,1,0|0,0,2]=4 3523 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Br 1458a_100000070787_100000212080 [0,1,0,0,1,0|1,0,1]=4 3524 B13R1.147 CC(=O)CC(=O)c1cccc(c1)C 1458a_100000070787_100000739480 [0,1,0,0,1,0|1,0,1]=4 3525 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000070787_100000211444 [0,1,0,0,1,0|1,0,1]=4 3526 B13R1.147 CC(=O)CC(=O)c1cccc(c1)F 1458a_100000070787_100000215616 [0,1,0,0,1,0|1,0,1]=4 3527 B13R1.147 CC(=O)CC(=O)c1cccc(c1)O 1458a_100000070787_100009813753 [0,1,0,0,1,0|1,0,1]=4 3528 B13R1.147 CC(C)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000210624 [0,1,0,0,1,0|0,0,0]=2 3529 B13R1.147 CC(C)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210624 [0,1,0,0,1,0|0,0,0]=2 3530 B13R1.147 CC(C)CC(=O)c1cccc(c1)F 1458a_100000210950_100000210624 [0,1,0,0,1,0|0,0,0]=2 3531 B13R1.147 CC(C)CC(=O)c1cccc(c1)I 1458a_100000184098_100000210624 [0,1,0,0,1,0|0,0,0]=2 3532 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000210624 [0,1,0,0,1,0|0,0,0]=2 3533 B13R1.147 CC(C)CC(=O)c1cccc(c1)O 271570a_203496583355_100000723889 [0,1,0,0,1,0|0,0,0]=2 3534 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 2230a_100000219648_100000210760 [0,1,0,0,1,0|2,0,0]=4 3535 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 269982a_100000219648_100000210624 [0,1,0,0,1,0|2,0,0]=4 3536 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 34a_100000219648_100000210624 [0,1,0,0,1,0|2,0,0]=4 3537 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 2230a_100000220044_100000210760 [0,1,0,0,1,0|2,0,0]=4 3538 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 2230a_100015204621_200000210301 [0,1,0,0,1,0|2,0,0]=4 3539 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 269982a_100000220044_100000210624 [0,1,0,0,1,0|2,0,0]=4 3540 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 269982a_100015204621_200000210301 [0,1,0,0,1,0|2,0,0]=4 3541 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 34a_100000220044_100000210624 [0,1,0,0,1,0|2,0,0]=4 3542 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 34a_100015204621_200000210301 [0,1,0,0,1,0|2,0,0]=4 3543 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 7a_100015204621_200000210301 [0,1,0,0,1,0|2,0,0]=4 3544 B13R1.147 CC(C)CN(C)c1cccc(c1)F 2230a_100020633736_100000210760 [0,1,0,0,1,0|2,0,0]=4 3545 B13R1.147 CC(C)CN(C)c1cccc(c1)F 269982a_100020633736_100000210624 [0,1,0,0,1,0|2,0,0]=4 3546 B13R1.147 CC(C)CN(C)c1cccc(c1)F 34a_100020633736_100000210624 [0,1,0,0,1,0|2,0,0]=4 3547 B13R1.147 CC(C)CN(C)c1cccc(c1)I 2230a_100000221217_100000210760 [0,1,0,0,1,0|2,0,0]=4 3548 B13R1.147 CC(C)CN(C)c1cccc(c1)I 269982a_100000221217_100000210624 [0,1,0,0,1,0|2,0,0]=4 3549 B13R1.147 CC(C)CN(C)c1cccc(c1)I 34a_100000221217_100000210624 [0,1,0,0,1,0|2,0,0]=4 3550 B13R1.147 CC(C)CN(C)c1cccc(c1)O 2230a_100000756613_100000210760 [0,1,0,0,1,0|2,0,0]=4 3551 B13R1.147 CC(C)CN(C)c1cccc(c1)O 269982a_100000756613_100000210624 [0,1,0,0,1,0|2,0,0]=4 3552 B13R1.147 CC(C)CN(C)c1cccc(c1)O 34a_100000756613_100000210624 [0,1,0,0,1,0|2,0,0]=4 3553 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 2230a_100015204621_200025704644 [0,1,0,0,1,0|2,0,0]=4 3554 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 269982a_100015204621_200025704644 [0,1,0,0,1,0|2,0,0]=4 3555 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 34a_100015204621_200025704644 [0,1,0,0,1,0|2,0,0]=4 3556 B13R1.147 CC(C)CN([13CH3])c1cccc(c1)Cl 7a_100015204621_200025704644 [0,1,0,0,1,0|2,0,0]=4 3557 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Br 271570a_100015190218_100000691529 [0,1,0,0,1,0|1,0,1]=4 3558 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)Cl 271570a_100015190218_100000699651 [0,1,0,0,1,0|1,0,1]=4 3559 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)F 271570a_100015190218_100000685547 [0,1,0,0,1,0|1,0,1]=4 3560 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)N 271570a_100015190218_100000210019 [0,1,0,0,1,0|1,0,1]=4 3561 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)O 271570a_100015190218_100000211634 [0,1,0,0,1,0|1,0,1]=4 3562 B13R1.147 CC(C)C[C@H](N)c1cccc(c1)[S] 271570a_100015190218_114929384022 [0,1,0,0,1,0|1,0,1]=4 3563 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 11a_100138425928_100000210664 [0,1,0,0,1,0|1,0,0]=3 3564 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 1626a_100138425928_100000210664 [0,1,0,0,1,0|1,0,0]=3 3565 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 240690a_100138425928_100000210664 [0,1,0,0,1,0|1,0,0]=3 3566 B13R1.147 CC(C)NC(=O)c1cccc(c1)Br 527a_100138425928_100000210664 [0,1,0,0,1,0|1,0,0]=3 3567 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 11a_100138425928_100000210390 [0,1,0,0,1,0|1,0,0]=3 3568 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 1626a_100138425928_100000210390 [0,1,0,0,1,0|1,0,0]=3 3569 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 240690a_100138425928_100000210390 [0,1,0,0,1,0|1,0,0]=3 3570 B13R1.147 CC(C)NC(=O)c1cccc(c1)Cl 527a_100138425928_100000210390 [0,1,0,0,1,0|1,0,0]=3 3571 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 11a_100138425928_100000210950 [0,1,0,0,1,0|1,0,0]=3 3572 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 1626a_100138425928_100000210950 [0,1,0,0,1,0|1,0,0]=3 3573 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 240690a_100138425928_100000210950 [0,1,0,0,1,0|1,0,0]=3 3574 B13R1.147 CC(C)NC(=O)c1cccc(c1)F 527a_100138425928_100000210950 [0,1,0,0,1,0|1,0,0]=3 3575 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 11a_100138425928_100000184098 [0,1,0,0,1,0|1,0,0]=3 3576 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 1626a_100138425928_100000184098 [0,1,0,0,1,0|1,0,0]=3 3577 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 240690a_100138425928_100000184098 [0,1,0,0,1,0|1,0,0]=3 3578 B13R1.147 CC(C)NC(=O)c1cccc(c1)I 527a_100138425928_100000184098 [0,1,0,0,1,0|1,0,0]=3 3579 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 240690a_100138425928_100000183914 [0,1,0,0,1,0|1,0,0]=3 3580 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 271570a_203496583355_200000152632 [0,1,0,0,1,0|1,0,0]=3 3581 B13R1.147 CC(C)NC(=O)c1cccc(c1)O 527a_100138425928_100000183914 [0,1,0,0,1,0|1,0,0]=3 3582 B13R1.147 CC(C)NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229805 [0,1,0,0,1,0|2,0,0]=4 3583 B13R1.147 CC(C)NC(=O)c1cncc(c1)O 271570a_203496583355_200000152636 [0,1,0,0,1,0|2,0,0]=4 3584 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 34a_100000246457_100000210206 [0,1,0,0,1,0|1,0,1]=4 3585 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 7a_100000246457_100000210206 [0,1,0,0,1,0|1,0,1]=4 3586 B13R1.147 CC(C)OC(C)c1cccc(c1)F 34a_100000744526_100000210206 [0,1,0,0,1,0|1,0,1]=4 3587 B13R1.147 CC(C)OC(C)c1cccc(c1)F 7a_100000744526_100000210206 [0,1,0,0,1,0|1,0,1]=4 3588 B13R1.147 CC(C)OC(C)c1cccc(c1)I 34a_100013085317_100000210206 [0,1,0,0,1,0|1,0,1]=4 3589 B13R1.147 CC(C)OC(C)c1cccc(c1)I 7a_100013085317_100000210206 [0,1,0,0,1,0|1,0,1]=4 3590 B13R1.147 CC(C)OC(C)c1cccc(c1)N 34a_100011217120_100000210206 [0,1,0,0,1,0|1,0,1]=4 3591 B13R1.147 CC(C)OC(C)c1cccc(c1)N 7a_100011217120_100000210206 [0,1,0,0,1,0|1,0,1]=4 3592 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210206 [0,1,0,0,1,0|1,0,1]=4 3593 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210206 [0,1,0,0,1,0|1,0,1]=4 3594 B13R1.147 CC(O)CC(=O)c1cccc(c1)Br 1458a_100000210664_100011218427 [0,1,0,0,1,0|1,0,0]=3 3595 B13R1.147 CC(O)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100011218427 [0,1,0,0,1,0|1,0,0]=3 3596 B13R1.147 CC(O)CC(=O)c1cccc(c1)F 1458a_100000210950_100011218427 [0,1,0,0,1,0|1,0,0]=3 3597 B13R1.147 CC(O)CC(=O)c1cccc(c1)I 1458a_100000184098_100011218427 [0,1,0,0,1,0|1,0,0]=3 3598 B13R1.147 CC(O)CC(=O)c1cccc(c1)O 1458a_100000183914_100011218427 [0,1,0,0,1,0|1,0,0]=3 3599 B13R1.147 CN(C)CC(=O)c1cccc(c1)Br 2230a_100102631434_100000212080 [0,1,0,0,1,0|1,0,0]=3 3600 B13R1.147 CN(C)CC(=O)c1cccc(c1)Br 269982a_100102631434_100000212080 [0,1,0,0,1,0|1,0,0]=3 3601 B13R1.147 CN(C)CC(=O)c1cccc(c1)Cl 2230a_100102631434_100000211444 [0,1,0,0,1,0|1,0,0]=3 3602 B13R1.147 CN(C)CC(=O)c1cccc(c1)Cl 269982a_100102631434_100000211444 [0,1,0,0,1,0|1,0,0]=3 3603 B13R1.147 CN(C)CC(=O)c1cccc(c1)F 2230a_100102631434_100000215616 [0,1,0,0,1,0|1,0,0]=3 3604 B13R1.147 CN(C)CC(=O)c1cccc(c1)F 269982a_100102631434_100000215616 [0,1,0,0,1,0|1,0,0]=3 3605 B13R1.147 CN(C)CC(=O)c1cccc(c1)O 269982a_100102631434_100009813753 [0,1,0,0,1,0|1,0,0]=3 3606 B13R1.147 CN(C)CC(=O)c1ccnc(c1)Cl 269982a_100102631434_100009817076 [0,1,0,0,1,0|2,0,0]=4 3607 B13R1.147 Cc1cccc(c1)C(=O)CC(C)C 1458a_100000189346_100000210624 [0,1,0,0,1,0|0,0,0]=2 3608 B13R1.147 Cc1cccc(c1)C(=O)CC(C)O 1458a_100000189346_100011218427 [0,1,0,0,1,0|1,0,0]=3 3609 B13R1.147 Cc1cccc(c1)C(=O)CC(F)F 1458a_100000189346_100011934356 [0,1,0,0,1,0|2,0,0]=4 3610 B13R1.147 Cc1cccc(c1)C(=O)CN(C)C 2230a_100102631434_100000739480 [0,1,0,0,1,0|1,0,0]=3 3611 B13R1.147 Cc1cccc(c1)C(=O)CN(C)C 269982a_100102631434_100000739480 [0,1,0,0,1,0|1,0,0]=3 3612 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 11a_100138425928_100000189346 [0,1,0,0,1,0|1,0,0]=3 3613 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 1626a_100138425928_100000189346 [0,1,0,0,1,0|1,0,0]=3 3614 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 240690a_100138425928_100000189346 [0,1,0,0,1,0|1,0,0]=3 3615 B13R1.147 Cc1cccc(c1)C(=O)NC(C)C 527a_100138425928_100000189346 [0,1,0,0,1,0|1,0,0]=3 3616 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 34a_100000757818_100000210206 [0,1,0,0,1,0|1,0,1]=4 3617 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 7a_100000757818_100000210206 [0,1,0,0,1,0|1,0,1]=4 3618 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 2230a_100000219674_100000210760 [0,1,0,0,1,0|2,0,0]=4 3619 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 269982a_100000219674_100000210624 [0,1,0,0,1,0|2,0,0]=4 3620 B13R1.147 Cc1cccc(c1)N(C)CC(C)C 34a_100000219674_100000210624 [0,1,0,0,1,0|2,0,0]=4 3621 B13R1.147 Cc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100011215228 [0,1,0,0,1,0|1,0,1]=4 3622 B13R1.147 O=C(CC(F)F)c1cccc(c1)Br 1458a_100000210664_100011934356 [0,1,0,0,1,0|2,0,0]=4 3623 B13R1.147 O=C(CC(F)F)c1cccc(c1)Cl 1458a_100000210390_100011934356 [0,1,0,0,1,0|2,0,0]=4 3624 B13R1.147 O=C(CC(F)F)c1cccc(c1)F 1458a_100000210950_100011934356 [0,1,0,0,1,0|2,0,0]=4 3625 B13R1.147 O=C(CC(F)F)c1cccc(c1)I 1458a_100000184098_100011934356 [0,1,0,0,1,0|2,0,0]=4 3626 B13R1.147 O=C(CC(F)F)c1cccc(c1)O 1458a_100000183914_100011934356 [0,1,0,0,1,0|2,0,0]=4 3627 B13R1.152 C=C(C(=O)C(C)C)c1ccccc1 1458a_100000065200_100000210206 [0,1,0,0,1,0|1,0,1]=4 3628 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 1458a_100000070787_100000239700 [0,1,0,0,1,0|1,0,1]=4 3629 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000179758 [0,1,0,0,1,0|1,0,1]=4 3630 B13R1.152 CC(C(=O)c1ccccc1)N(C)C 2230a_100102631434_100000239700 [0,1,0,0,1,0|1,0,0]=3 3631 B13R1.152 CC(C(=O)c1ccccc1)N(C)C 269982a_100102631434_100000239700 [0,1,0,0,1,0|1,0,0]=3 3632 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 11a_200000211004_100000185807 [0,1,0,0,1,0|1,0,0]=3 3633 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 1626a_200000211004_100000185807 [0,1,0,0,1,0|1,0,0]=3 3634 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 240690a_200000211004_100000185807 [0,1,0,0,1,0|1,0,0]=3 3635 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 527a_200000211004_100000185807 [0,1,0,0,1,0|1,0,0]=3 3636 B13R1.201 C=C(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748629 [0,1,0,0,1,0|0,0,2]=4 3637 B13R1.201 C=C(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748629 [0,1,0,0,1,0|0,0,2]=4 3638 B13R1.201 C=C(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748629 [0,1,0,0,1,0|0,0,2]=4 3639 B13R1.201 C=C(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748629 [0,1,0,0,1,0|0,0,2]=4 3640 B13R1.201 C=C(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748629 [0,1,0,0,1,0|0,0,2]=4 3641 B13R1.201 C=C(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748629 [0,1,0,0,1,0|0,0,2]=4 3642 B13R1.201 C=C(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748629 [0,1,0,0,1,0|0,0,2]=4 3643 B13R1.201 CC(=O)CC(=O)c1ccccc1Br 1458a_100000070787_100000199116 [0,1,0,0,1,0|1,0,1]=4 3644 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [0,1,0,0,1,0|1,0,1]=4 3645 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl 1458a_100000070787_100000211432 [0,1,0,0,1,0|1,0,1]=4 3646 B13R1.201 CC(=O)CC(=O)c1ccccc1F 1458a_100000070787_100000204681 [0,1,0,0,1,0|1,0,1]=4 3647 B13R1.201 CC(=O)CC(=O)c1ccccc1O 1458a_100000070787_100000188908 [0,1,0,0,1,0|1,0,1]=4 3648 B13R1.201 CC(=O)CC(=O)c1ccccc1O 271570a_203496583355_200011243946 [0,1,0,0,1,0|1,0,1]=4 3649 B13R1.201 CC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000210624 [0,1,0,0,1,0|0,0,0]=2 3650 B13R1.201 CC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000210624 [0,1,0,0,1,0|0,0,0]=2 3651 B13R1.201 CC(C)CC(=O)c1ccccc1F 1458a_100000188656_100000210624 [0,1,0,0,1,0|0,0,0]=2 3652 B13R1.201 CC(C)CC(=O)c1ccccc1I 1458a_100000187884_100000210624 [0,1,0,0,1,0|0,0,0]=2 3653 B13R1.201 CC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000210624 [0,1,0,0,1,0|0,0,0]=2 3654 B13R1.201 CC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000210624 [0,1,0,0,1,0|0,0,0]=2 3655 B13R1.201 CC(C)CN(C)c1ccccc1Br 2230a_100020606079_100000210760 [0,1,0,0,1,0|2,0,0]=4 3656 B13R1.201 CC(C)CN(C)c1ccccc1Br 269982a_100020606079_100000210624 [0,1,0,0,1,0|2,0,0]=4 3657 B13R1.201 CC(C)CN(C)c1ccccc1Br 34a_100020606079_100000210624 [0,1,0,0,1,0|2,0,0]=4 3658 B13R1.201 CC(C)CN(C)c1ccccc1Cl 2230a_100000219374_100000210760 [0,1,0,0,1,0|2,0,0]=4 3659 B13R1.201 CC(C)CN(C)c1ccccc1Cl 2230a_100011231759_200000210301 [0,1,0,0,1,0|2,0,0]=4 3660 B13R1.201 CC(C)CN(C)c1ccccc1Cl 269982a_100000219374_100000210624 [0,1,0,0,1,0|2,0,0]=4 3661 B13R1.201 CC(C)CN(C)c1ccccc1Cl 269982a_100011231759_200000210301 [0,1,0,0,1,0|2,0,0]=4 3662 B13R1.201 CC(C)CN(C)c1ccccc1Cl 34a_100000219374_100000210624 [0,1,0,0,1,0|2,0,0]=4 3663 B13R1.201 CC(C)CN(C)c1ccccc1Cl 34a_100011231759_200000210301 [0,1,0,0,1,0|2,0,0]=4 3664 B13R1.201 CC(C)CN(C)c1ccccc1F 2230a_100000220357_100000210760 [0,1,0,0,1,0|2,0,0]=4 3665 B13R1.201 CC(C)CN(C)c1ccccc1F 269982a_100000220357_100000210624 [0,1,0,0,1,0|2,0,0]=4 3666 B13R1.201 CC(C)CN(C)c1ccccc1F 34a_100000220357_100000210624 [0,1,0,0,1,0|2,0,0]=4 3667 B13R1.201 CC(C)CN(C)c1ccccc1F 38a_100000220357_100000210624 [0,1,0,0,1,0|2,0,0]=4 3668 B13R1.201 CC(C)CN(C)c1ccccc1O 269982a_100000033821_100000210624 [0,1,0,0,1,0|2,0,0]=4 3669 B13R1.201 CC(C)CN([13CH3])c1ccccc1Cl 2230a_100011231759_200025704644 [0,1,0,0,1,0|2,0,0]=4 3670 B13R1.201 CC(C)CN([13CH3])c1ccccc1Cl 269982a_100011231759_200025704644 [0,1,0,0,1,0|2,0,0]=4 3671 B13R1.201 CC(C)CN([13CH3])c1ccccc1Cl 34a_100011231759_200025704644 [0,1,0,0,1,0|2,0,0]=4 3672 B13R1.201 CC(C)C[C@H](N)c1ccccc1Br 271570a_100015190218_100000695589 [0,1,0,0,1,0|1,0,1]=4 3673 B13R1.201 CC(C)C[C@H](N)c1ccccc1Cl 271570a_100015190218_100000764095 [0,1,0,0,1,0|1,0,1]=4 3674 B13R1.201 CC(C)C[C@H](N)c1ccccc1F 271570a_100015190218_100011215700 [0,1,0,0,1,0|1,0,1]=4 3675 B13R1.201 CC(C)C[C@H](N)c1ccccc1N 271570a_100015190218_100000210017 [0,1,0,0,1,0|1,0,1]=4 3676 B13R1.201 CC(C)C[C@H](N)c1ccccc1O 271570a_100015190218_100000739446 [0,1,0,0,1,0|1,0,1]=4 3677 B13R1.201 CC(C)NC(=O)c1ccccc1Br 11a_100138425928_100000188424 [0,1,0,0,1,0|1,0,0]=3 3678 B13R1.201 CC(C)NC(=O)c1ccccc1Br 1626a_100138425928_100000188424 [0,1,0,0,1,0|1,0,0]=3 3679 B13R1.201 CC(C)NC(=O)c1ccccc1Br 240690a_100138425928_100000188424 [0,1,0,0,1,0|1,0,0]=3 3680 B13R1.201 CC(C)NC(=O)c1ccccc1Br 527a_100138425928_100000188424 [0,1,0,0,1,0|1,0,0]=3 3681 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 11a_100138425928_100000185844 [0,1,0,0,1,0|1,0,0]=3 3682 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 1626a_100138425928_100000185844 [0,1,0,0,1,0|1,0,0]=3 3683 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 240690a_100138425928_100000185844 [0,1,0,0,1,0|1,0,0]=3 3684 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 527a_100138425928_100000185844 [0,1,0,0,1,0|1,0,0]=3 3685 B13R1.201 CC(C)NC(=O)c1ccccc1F 11a_100138425928_100000188656 [0,1,0,0,1,0|1,0,0]=3 3686 B13R1.201 CC(C)NC(=O)c1ccccc1F 1626a_100138425928_100000188656 [0,1,0,0,1,0|1,0,0]=3 3687 B13R1.201 CC(C)NC(=O)c1ccccc1F 240690a_100138425928_100000188656 [0,1,0,0,1,0|1,0,0]=3 3688 B13R1.201 CC(C)NC(=O)c1ccccc1F 527a_100138425928_100000188656 [0,1,0,0,1,0|1,0,0]=3 3689 B13R1.201 CC(C)NC(=O)c1ccccc1I 11a_100138425928_100000187884 [0,1,0,0,1,0|1,0,0]=3 3690 B13R1.201 CC(C)NC(=O)c1ccccc1I 1626a_100138425928_100000187884 [0,1,0,0,1,0|1,0,0]=3 3691 B13R1.201 CC(C)NC(=O)c1ccccc1I 240690a_100138425928_100000187884 [0,1,0,0,1,0|1,0,0]=3 3692 B13R1.201 CC(C)NC(=O)c1ccccc1I 527a_100138425928_100000187884 [0,1,0,0,1,0|1,0,0]=3 3693 B13R1.201 CC(C)NC(=O)c1ccccc1O 240690a_100138425928_100015234032 [0,1,0,0,1,0|1,0,0]=3 3694 B13R1.201 CC(C)NC(=O)c1ccccc1O 271570a_203496583355_200000152627 [0,1,0,0,1,0|1,0,0]=3 3695 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 1626a_100138425928_100009911694 [0,1,0,0,1,0|1,0,0]=3 3696 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 240690a_100138425928_100009911694 [0,1,0,0,1,0|1,0,0]=3 3697 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 527a_100138425928_100009911694 [0,1,0,0,1,0|1,0,0]=3 3698 B13R1.201 CC(C)OC(=O)c1ccccc1O 271570a_203496583355_100000169877 [0,1,0,0,1,0|0,0,0]=2 3699 B13R1.201 CC(C)OC(C)c1ccccc1Br 34a_100000702211_100000210206 [0,1,0,0,1,0|1,0,1]=4 3700 B13R1.201 CC(C)OC(C)c1ccccc1Br 7a_100000702211_100000210206 [0,1,0,0,1,0|1,0,1]=4 3701 B13R1.201 CC(C)OC(C)c1ccccc1Cl 34a_100000740796_100000210206 [0,1,0,0,1,0|1,0,1]=4 3702 B13R1.201 CC(C)OC(C)c1ccccc1Cl 7a_100000740796_100000210206 [0,1,0,0,1,0|1,0,1]=4 3703 B13R1.201 CC(C)OC(C)c1ccccc1F 34a_100000212225_200000741388 [0,1,0,0,1,0|1,0,1]=4 3704 B13R1.201 CC(C)OC(C)c1ccccc1F 34a_100000697922_100000210206 [0,1,0,0,1,0|1,0,1]=4 3705 B13R1.201 CC(C)OC(C)c1ccccc1F 7a_100000697922_100000210206 [0,1,0,0,1,0|1,0,1]=4 3706 B13R1.201 CC(C)OC(C)c1ccccc1N 7a_100011405641_100000210206 [0,1,0,0,1,0|1,0,1]=4 3707 B13R1.201 CC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218427 [0,1,0,0,1,0|1,0,0]=3 3708 B13R1.201 CC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218427 [0,1,0,0,1,0|1,0,0]=3 3709 B13R1.201 CC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218427 [0,1,0,0,1,0|1,0,0]=3 3710 B13R1.201 CC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218427 [0,1,0,0,1,0|1,0,0]=3 3711 B13R1.201 CC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218427 [0,1,0,0,1,0|1,0,0]=3 3712 B13R1.201 CC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218427 [0,1,0,0,1,0|1,0,0]=3 3713 B13R1.201 CN(C)CC(=O)c1ccccc1Br 269982a_100102631434_100000199116 [0,1,0,0,1,0|1,0,0]=3 3714 B13R1.201 CN(C)CC(=O)c1ccccc1Cl 269982a_100102631434_100000211432 [0,1,0,0,1,0|1,0,0]=3 3715 B13R1.201 CN(C)CC(=O)c1ccccc1F 269982a_100102631434_100000204681 [0,1,0,0,1,0|1,0,0]=3 3716 B13R1.201 CN(C)CC(=O)c1ccccc1O 269982a_100102631434_100000188908 [0,1,0,0,1,0|1,0,0]=3 3717 B13R1.201 Cc1ccccc1C(=O)CC(C)C 1458a_100000212026_100000210624 [0,1,0,0,1,0|0,0,0]=2 3718 B13R1.201 Cc1ccccc1C(=O)CC(C)O 1458a_100000212026_100011218427 [0,1,0,0,1,0|1,0,0]=3 3719 B13R1.201 Cc1ccccc1C(=O)CC(F)F 1458a_100000212026_100011934356 [0,1,0,0,1,0|2,0,0]=4 3720 B13R1.201 Cc1ccccc1C(=O)CN(C)C 2230a_100102631434_100000741374 [0,1,0,0,1,0|1,0,0]=3 3721 B13R1.201 Cc1ccccc1C(=O)CN(C)C 269982a_100102631434_100000741374 [0,1,0,0,1,0|1,0,0]=3 3722 B13R1.201 Cc1ccccc1C(=O)NC(C)C 11a_100138425928_100000212026 [0,1,0,0,1,0|1,0,0]=3 3723 B13R1.201 Cc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000212026 [0,1,0,0,1,0|1,0,0]=3 3724 B13R1.201 Cc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000212026 [0,1,0,0,1,0|1,0,0]=3 3725 B13R1.201 Cc1ccccc1C(=O)NC(C)C 527a_100138425928_100000212026 [0,1,0,0,1,0|1,0,0]=3 3726 B13R1.201 Cc1ccccc1C(C)OC(C)C 34a_100000742021_100000210206 [0,1,0,0,1,0|1,0,1]=4 3727 B13R1.201 Cc1ccccc1C(C)OC(C)C 7a_100000742021_100000210206 [0,1,0,0,1,0|1,0,1]=4 3728 B13R1.201 Cc1ccccc1N(C)CC(C)C 2230a_100000219699_100000210760 [0,1,0,0,1,0|2,0,0]=4 3729 B13R1.201 Cc1ccccc1N(C)CC(C)C 269982a_100000219699_100000210624 [0,1,0,0,1,0|2,0,0]=4 3730 B13R1.201 Cc1ccccc1N(C)CC(C)C 34a_100000219699_100000210624 [0,1,0,0,1,0|2,0,0]=4 3731 B13R1.201 Cc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100000210755 [0,1,0,0,1,0|1,0,1]=4 3732 B13R1.201 O=C(CC(F)F)c1ccccc1Br 1458a_100000188424_100011934356 [0,1,0,0,1,0|2,0,0]=4 3733 B13R1.201 O=C(CC(F)F)c1ccccc1Cl 1458a_100000185844_100011934356 [0,1,0,0,1,0|2,0,0]=4 3734 B13R1.201 O=C(CC(F)F)c1ccccc1F 1458a_100000188656_100011934356 [0,1,0,0,1,0|2,0,0]=4 3735 B13R1.201 O=C(CC(F)F)c1ccccc1I 1458a_100000187884_100011934356 [0,1,0,0,1,0|2,0,0]=4 3736 B13R1.201 O=C(CC(F)F)c1ccccc1O 1458a_100015234032_100011934356 [0,1,0,0,1,0|2,0,0]=4 3737 B13R1.201 O=C(CC(F)F)c1ccccc1[O-] 1458a_100009911694_100011934356 [0,1,0,0,1,0|2,0,0]=4 3738 B13R1.347 CC(C)NS(=O)(=O)c1ccccc1 270084a_100138425928_100000210345 [0,1,0,0,1,0|2,0,0]=4 3739 B13R1.347 CC(C)NS(=O)(=O)c1ccccc1 274078a_100138425928_100000210345 [0,1,0,0,1,0|2,0,0]=4 3740 B13R1.347 CC(C)OC(C)(C)c1ccccc1 7a_100000694644_100000210206 [0,1,0,0,1,0|1,0,1]=4 3741 B13R1.347 CN(C)CS(=O)(=O)c1ccccc1 269982a_100102631434_100000240042 [0,1,0,0,1,0|2,0,0]=4 3742 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 11a_100000715429_100000185807 [0,1,0,0,1,0|1,0,0]=3 3743 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 1626a_100000715429_100000185807 [0,1,0,0,1,0|1,0,0]=3 3744 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 240690a_100000715429_100000185807 [0,1,0,0,1,0|1,0,0]=3 3745 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 527a_100000715429_100000185807 [0,1,0,0,1,0|1,0,0]=3 3746 B13R1.352 CC(OC(C)(C)C)c1ccccc1 34a_100015890283_100000211855 [0,1,0,0,1,0|1,0,1]=4 3747 B13R1.352 CC(OC(C)(C)C)c1ccccc1 7a_100015890283_100000230085 [0,1,0,0,1,0|1,0,1]=4 3748 B13R1.352 CN(CC(C)(C)C)c1ccccc1 34a_100000210012_100011219605 [0,1,0,0,1,0|2,0,0]=4 3749 B13R1.352 CN(CC(C)(C)F)c1ccccc1 34a_100000210012_100011997219 [0,1,0,0,1,0|2,0,0]=4 3750 B13R1.352 CN(CC(C)(C)O)c1ccccc1 34a_100000210012_100000764493 [0,1,0,0,1,0|2,0,0]=4 3751 B13R1.352 C[C@@H](OC(C)(C)C)c1ccccc1 34a_100000761318_100000210625 [0,1,0,0,1,0|1,0,1]=4 3752 B13R1.352 C[Si](C)(C)CC(=O)c1ccccc1 1458a_100000185807_100000233785 [0,1,0,0,1,0|0,1,0]=3 3753 B13R1.713 C#CC(OC(C)C)c1ccccc1 34a_100011219616_100000210206 [0,1,0,0,1,0|1,0,1]=4 3754 B13R1.713 C#CC(OC(C)C)c1ccccc1 7a_100011219616_100000210206 [0,1,0,0,1,0|1,0,1]=4 3755 B13R1.713 C=CC(OC(C)C)c1ccccc1 34a_100011215659_100000210206 [0,1,0,0,1,0|1,0,1]=4 3756 B13R1.713 C=CC(OC(C)C)c1ccccc1 7a_100011215659_100000210206 [0,1,0,0,1,0|1,0,1]=4 3757 B13R1.713 CC(C)C[C@H](N[13CH3])c1ccccc1 2230a_100016987908_200025704644 [0,1,0,0,1,0|1,0,1]=4 3758 B13R1.713 CC(C)OC(C#N)c1ccccc1 7a_100011217353_100000210206 [0,1,0,0,1,0|1,0,1]=4 3759 B13R1.713 CC(C)OC(CBr)c1ccccc1 7a_100000185958_100000210206 [0,1,0,0,1,0|1,0,1]=4 3760 B13R1.713 CC(C)OC(CN)c1ccccc1 34a_100000210709_100000210206 [0,1,0,0,1,0|1,0,1]=4 3761 B13R1.713 CC(C)O[C@H](CCl)c1ccccc1 34a_100011933945_100000210206 [0,1,0,0,1,0|1,0,1]=4 3762 B13R1.713 CC(C)O[C@H](CCl)c1ccccc1 7a_100011933945_100000210206 [0,1,0,0,1,0|1,0,1]=4 3763 B13R1.713 CCC(OC(C)C)c1ccccc1 34a_100000698172_100000210206 [0,1,0,0,1,0|1,0,1]=4 3764 B13R1.713 CCC(OC(C)C)c1ccccc1 7a_100000698172_100000210206 [0,1,0,0,1,0|1,0,1]=4 3765 B13R1.713 CCN(CC(C)C)c1ccccc1 2230a_100000210013_100000210760 [0,1,0,0,1,0|2,0,0]=4 3766 B13R1.713 CCN(CC(C)C)c1ccccc1 269982a_100000210013_100000210624 [0,1,0,0,1,0|2,0,0]=4 3767 B13R1.713 CCN(CC(C)C)c1ccccc1 34a_100000210013_100000210624 [0,1,0,0,1,0|2,0,0]=4 3768 B13R1.713 CNC(CC(C)C)c1ccccc1 269862a_106832991636_100000211545 [0,1,0,0,1,0|1,0,1]=4 3769 B13R1.713 CN[C@@H](CC(C)C)c1ccccc1 2230a_100016987908_200000210301 [0,1,0,0,1,0|1,0,1]=4 3770 B15R1.490 CC(Br)COCS(=O)(=O)c1ccccc1 34a_100012180447_200009813291 [0,1,0,0,0,1|2,0,0]=4 3771 B15R1.490 CC(C)CCNS(=O)(=O)c1ccccc1 270084a_100000210545_100000210345 [0,1,0,0,0,1|2,0,0]=4 3772 B15R1.490 CC(C)CCNS(=O)(=O)c1ccccc1 274078a_100000210545_100000210345 [0,1,0,0,0,1|2,0,0]=4 3773 B15R1.490 CC(C)CCNS(=O)(=O)c1ccccc1 40a_100000210545_100000032697 [0,1,0,0,0,1|2,0,0]=4 3774 B15R1.490 CC(C)CCOC(C)(C)c1ccccc1 7a_100000694644_100000210626 [0,1,0,0,0,1|1,0,1]=4 3775 B15R1.490 CC(C)CCOC(F)(F)c1ccccc1 7a_100000210254_100000036403 [0,1,0,0,0,1|1,0,1]=4 3776 B15R1.490 CC(C)CNCS(=O)(=O)c1ccccc1 34a_100000210953_200009813291 [0,1,0,0,0,1|2,0,0]=4 3777 B15R1.490 CC(C)CNNS(=O)(=O)c1ccccc1 40a_100000696102_100000032697 [0,1,0,0,0,1|2,0,0]=4 3778 B15R1.490 CC(C)COCC(C)(C)c1ccccc1 7a_100000747608_100000210760 [0,1,0,0,0,1|1,0,1]=4 3779 B15R1.490 CC(C)COCC(F)(F)c1ccccc1 34a_100000210257_100009875531 [0,1,0,0,0,1|1,0,1]=4 3780 B15R1.490 CC(C)COCS(=O)(=O)c1ccccc1 34a_100000210257_200009813291 [0,1,0,0,0,1|1,0,0]=3 3781 B15R1.490 CC(C)CSCS(=O)(=O)c1ccccc1 62a_100000210624_100000240042 [0,1,0,0,0,1|1,1,0]=4 3782 B15R1.490 CC(C)CSCS(=O)(=O)c1ccccc1 62a_100000240042_100000210760 [0,1,0,0,0,1|1,1,0]=4 3783 B15R1.490 CC(C)NCCS(=O)(=O)c1ccccc1 2230a_100000168333_100000210206 [0,1,0,0,0,1|2,0,0]=4 3784 B15R1.490 CC(C)NCCS(=O)(=O)c1ccccc1 2230a_100138425928_100000229977 [0,1,0,0,0,1|2,0,0]=4 3785 B15R1.490 CC(C)OCCS(=O)(=O)c1ccccc1 34a_200011215558_100000210206 [0,1,0,0,0,1|2,0,0]=4 3786 B15R1.490 CC(C)OCCS(=O)(=O)c1ccccc1 7a_200011215558_100000210206 [0,1,0,0,0,1|2,0,0]=4 3787 B15R1.490 CC(C)SCCS(=O)(=O)c1ccccc1 62a_100000210206_100000229977 [0,1,0,0,0,1|2,0,0]=4 3788 B15R1.490 CC(C)SCCS(=O)(=O)c1ccccc1 62a_100000229977_100000210206 [0,1,0,0,0,1|2,0,0]=4 3789 B15R1.490 CC(F)COCS(=O)(=O)c1ccccc1 34a_100015925927_200009813291 [0,1,0,0,0,1|2,0,0]=4 3790 B15R1.490 CN(C)CCOS(=O)(=O)c1ccccc1 269982a_100102631434_200000070464 [0,1,0,0,0,1|2,0,0]=4 3791 B15R1.490 C[C@@H](Cl)COCS(=O)(=O)c1ccccc1 34a_100016084084_200009813291 [0,1,0,0,0,1|2,0,0]=4 3792 B15R1.490 C[C@@H](N)COCS(=O)(=O)c1ccccc1 34a_100000737577_200009813291 [0,1,0,0,0,1|2,0,0]=4 3793 B15R1.500 C=C(C)C(=O)COC(=O)c1ccccc1 1458a_100000185857_100000073877 [0,1,0,0,0,1|0,0,2]=4 3794 B15R1.500 CC(=NNC(=O)c1ccccc1)C(C)C 4a_100000184135_100000211110 [0,1,0,0,0,1|1,0,1]=4 3795 B15R1.500 CC(C)C(=O)CCC(=O)c1ccccc1 1458a_100000210198_100000750707 [0,1,0,0,0,1|1,0,0]=3 3796 B15R1.500 CC(C)C(=O)CNC(=O)c1ccccc1 1458a_100000182045_100000210206 [0,1,0,0,0,1|1,0,0]=3 3797 B15R1.500 CC(C)C(=O)CNC(=O)c1cccnc1 1458a_100000688122_100000210206 [0,1,0,0,0,1|2,0,0]=4 3798 B15R1.500 CC(C)C(=O)COC(=O)c1ccccc1 1458a_100000210198_100000073877 [0,1,0,0,0,1|0,0,0]=2 3799 B15R1.500 CC(C)C(=O)CO[C@H](C)c1ccccc1 34a_100000761318_100000753385 [0,1,0,0,0,1|1,0,1]=4 3800 B15R1.500 CC(C)C(=O)CO[C@H](C)c1ccccc1 7a_100000761318_100000753385 [0,1,0,0,0,1|1,0,1]=4 3801 B15R1.500 CC(C)C(=O)CSC(=S)c1ccccc1 1458a_100000043459_100000210206 [0,1,0,0,0,1|0,2,0]=4 3802 B15R1.500 CC(C)C(=O)NNC(=O)c1ccccc1 22a_100000184118_100000185807 [0,1,0,0,0,1|1,0,1]=4 3803 B15R1.500 CC(C)C(=O)NNC(=O)c1ccccc1 22a_100000184135_100000210198 [0,1,0,0,0,1|1,0,1]=4 3804 B15R1.500 CC(C)C(=O)OCC(=O)c1ccccc1 1458a_100000185807_100000139345 [0,1,0,0,0,1|0,0,1]=3 3805 B15R1.500 CC(C)C(C)OCC(=O)c1ccccc1 7a_100000748068_100000211460 [0,1,0,0,0,1|0,0,0]=2 3806 B15R1.500 CC(C)C(C)OCC(=O)c1ccccn1 7a_100000748068_100000027445 [0,1,0,0,0,1|1,0,0]=3 3807 B15R1.500 CC(C)C(C)OCC(=O)c1ccncc1 7a_100000748068_100015248511 [0,1,0,0,0,1|1,0,0]=3 3808 B15R1.500 CC(C)C(C)OCC(O)c1ccccc1 7a_100000748068_100000185958 [0,1,0,0,0,1|0,0,2]=4 3809 B15R1.500 CC(C)C(C)OC[C@@H](O)c1ccccc1 7a_100000748068_100011933945 [0,1,0,0,0,1|0,0,2]=4 3810 B15R1.500 CC(C)C(O)CNC(=O)c1ccccc1 11a_100000759067_100000185807 [0,1,0,0,0,1|1,0,0]=3 3811 B15R1.500 CC(C)C(O)CNC(=O)c1ccccc1 240690a_100000759067_100000185807 [0,1,0,0,0,1|1,0,0]=3 3812 B15R1.500 CC(C)C(O)CNC(=O)c1ccccc1 527a_100000759067_100000185807 [0,1,0,0,0,1|1,0,0]=3 3813 B15R1.500 CC(C)N(C)CCC(=O)c1ccccc1 269982a_200000211004_100000750707 [0,1,0,0,0,1|1,0,0]=3 3814 B15R1.500 CC(C)N(C)CCS(=O)c1ccccc1 269982a_200000211004_100000740319 [0,1,0,0,0,1|2,0,0]=4 3815 B15R1.500 CC(C)N(C)COC(=O)c1ccccc1 269982a_200000211004_100000073877 [0,1,0,0,0,1|0,0,0]=2 3816 B15R1.500 CC(COC(=O)c1ccccc1)N(C)C 270004a_100102631434_100000000904 [0,1,0,0,0,1|1,0,0]=3 3817 B15R1.500 CC(COC(C)C(C)C)c1ccccc1 7a_100000748068_100000756946 [0,1,0,0,0,1|1,0,1]=4 3818 B15R1.500 CC(F)C(=O)CCC(=O)c1ccccc1 1458a_100000062450_100000750707 [0,1,0,0,0,1|2,0,0]=4 3819 B15R1.500 CC(F)C(=O)COC(=O)c1ccccc1 1458a_100000062450_100000073877 [0,1,0,0,0,1|1,0,0]=3 3820 B15R1.500 CC(OC[C@H](N)C(C)C)c1ccccc1 34a_100011830312_100000211855 [0,1,0,0,0,1|1,0,1]=4 3821 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 11a_100015183351_100000185807 [0,1,0,0,0,1|2,0,0]=4 3822 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 11a_100102631434_100000182045 [0,1,0,0,0,1|2,0,0]=4 3823 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 1626a_100102631434_100000182045 [0,1,0,0,0,1|2,0,0]=4 3824 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 240690a_100015183351_100000185807 [0,1,0,0,0,1|2,0,0]=4 3825 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 240690a_100102631434_100000182045 [0,1,0,0,0,1|2,0,0]=4 3826 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 527a_100015183351_100000185807 [0,1,0,0,0,1|2,0,0]=4 3827 B15R1.500 CN(C)C(=O)CNC(=O)c1ccccc1 527a_100102631434_100000182045 [0,1,0,0,0,1|2,0,0]=4 3828 B15R1.500 C[C@@H](O)C(=O)CCC(=O)c1ccccc1 1458a_100000717761_100000750707 [0,1,0,0,0,1|2,0,0]=4 3829 B15R1.500 C[C@@H](O)C(=O)COC(=O)c1ccccc1 1458a_100000717761_100000073877 [0,1,0,0,0,1|1,0,0]=3 3830 B15R1.500 C[C@H](O)C(=O)CCC(=O)c1ccccc1 1458a_217856618621_100000750707 [0,1,0,0,0,1|2,0,0]=4 3831 B15R1.500 C[C@H](O)C(=O)COC(=O)c1ccccc1 1458a_217856618621_100000073877 [0,1,0,0,0,1|1,0,0]=3 3832 B15R1.500 O=C(OCC(=O)C(O)O)c1ccccc1 1458a_100000233687_100000073877 [0,1,0,0,0,1|2,0,0]=4 3833 B15R1.882 C=C(C)COCC(=O)c1ccc(cc1)Br 34a_100000210245_100000188085 [0,1,0,0,0,1|0,0,2]=4 3834 B15R1.882 C=C(C)COCC(=O)c1ccc(cc1)C 34a_100000210245_100000211441 [0,1,0,0,0,1|0,0,2]=4 3835 B15R1.882 C=C(C)COCC(=O)c1ccc(cc1)F 34a_100000246311_100000748629 [0,1,0,0,0,1|0,0,2]=4 3836 B15R1.882 C=C(C)COCC(=O)c1ccc(cc1)I 34a_100000210245_100011216261 [0,1,0,0,0,1|0,0,2]=4 3837 B15R1.882 C=C(C)COCC(=O)c1ccc(cc1)O 34a_100000210245_100009814261 [0,1,0,0,0,1|0,0,2]=4 3838 B15R1.882 CC(=CCCC(=O)c1ccc(cc1)Br)C 1458a_100000185839_100011217483 [0,1,0,0,0,1|1,0,1]=4 3839 B15R1.882 CC(=CCCC(=O)c1ccc(cc1)C)C 1458a_100000188618_100011217483 [0,1,0,0,0,1|1,0,1]=4 3840 B15R1.882 CC(=CCCC(=O)c1ccc(cc1)Cl)C 1458a_100000210187_100011217483 [0,1,0,0,0,1|1,0,1]=4 3841 B15R1.882 CC(=CCCC(=O)c1ccc(cc1)F)C 1458a_100000187176_100011217483 [0,1,0,0,0,1|1,0,1]=4 3842 B15R1.882 CC(=CCCC(=O)c1ccc(cc1)I)C 1458a_100000187904_100011217483 [0,1,0,0,0,1|1,0,1]=4 3843 B15R1.882 CC(=CCCC(=O)c1ccc(cc1)O)C 1458a_100000212099_100011217483 [0,1,0,0,0,1|1,0,1]=4 3844 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Br)C 11a_100000718196_100000185839 [0,1,0,0,0,1|1,0,1]=4 3845 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Br)C 1626a_100000718196_100000185839 [0,1,0,0,0,1|1,0,1]=4 3846 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Br)C 527a_100000718196_100000185839 [0,1,0,0,0,1|1,0,1]=4 3847 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)C)C 11a_100000718196_100000188618 [0,1,0,0,0,1|1,0,1]=4 3848 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)C)C 1626a_100000718196_100000188618 [0,1,0,0,0,1|1,0,1]=4 3849 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)C)C 527a_100000718196_100000188618 [0,1,0,0,0,1|1,0,1]=4 3850 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Cl)C 11a_100000718196_100000210187 [0,1,0,0,0,1|1,0,1]=4 3851 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Cl)C 1626a_100000718196_100000210187 [0,1,0,0,0,1|1,0,1]=4 3852 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Cl)C 527a_100000718196_100000210187 [0,1,0,0,0,1|1,0,1]=4 3853 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)F)C 11a_100000718196_100000187176 [0,1,0,0,0,1|1,0,1]=4 3854 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)F)C 1626a_100000718196_100000187176 [0,1,0,0,0,1|1,0,1]=4 3855 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)F)C 527a_100000718196_100000187176 [0,1,0,0,0,1|1,0,1]=4 3856 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)I)C 11a_100000718196_100000187904 [0,1,0,0,0,1|1,0,1]=4 3857 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)I)C 1626a_100000718196_100000187904 [0,1,0,0,0,1|1,0,1]=4 3858 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)I)C 527a_100000718196_100000187904 [0,1,0,0,0,1|1,0,1]=4 3859 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)O)C 527a_100000718196_100000212099 [0,1,0,0,0,1|1,0,1]=4 3860 B15R1.882 CC(=O)COCC(=O)c1ccc(cc1)Br 34a_100000211253_100000188085 [0,1,0,0,0,1|1,0,1]=4 3861 B15R1.882 CC(=O)COCC(=O)c1ccc(cc1)C 34a_100000211253_100000211441 [0,1,0,0,0,1|1,0,1]=4 3862 B15R1.882 CC(=O)COCC(=O)c1ccc(cc1)I 34a_100000211253_100011216261 [0,1,0,0,0,1|1,0,1]=4 3863 B15R1.882 CC(=O)COCC(=O)c1ccc(cc1)O 34a_100000211253_100009814261 [0,1,0,0,0,1|1,0,1]=4 3864 B15R1.882 CC(Br)COCC(=O)c1ccc(cc1)Br 34a_100012180447_100000188085 [0,1,0,0,0,1|1,0,0]=3 3865 B15R1.882 CC(Br)COCC(=O)c1ccc(cc1)I 34a_100012180447_100011216261 [0,1,0,0,0,1|1,0,0]=3 3866 B15R1.882 CC(Br)COCC(=O)c1ccc(cc1)O 34a_100012180447_100009814261 [0,1,0,0,0,1|1,0,0]=3 3867 B15R1.882 CC(C)C=NNC(=O)c1ccc(cc1)Br 4a_100000183614_100000210432 [0,1,0,0,0,1|1,0,1]=4 3868 B15R1.882 CC(C)C=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_100000210432 [0,1,0,0,0,1|1,0,1]=4 3869 B15R1.882 CC(C)C=NNC(=O)c1ccc(cc1)F 4a_100000182866_100000210432 [0,1,0,0,0,1|1,0,1]=4 3870 B15R1.882 CC(C)C=NNC(=O)c1ccc(cc1)I 4a_100000189773_100000210432 [0,1,0,0,0,1|1,0,1]=4 3871 B15R1.882 CC(C)CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011214892 [0,1,0,0,0,1|1,0,0]=3 3872 B15R1.882 CC(C)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011214892 [0,1,0,0,0,1|1,0,0]=3 3873 B15R1.882 CC(C)CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011214892 [0,1,0,0,0,1|1,0,0]=3 3874 B15R1.882 CC(C)CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011214892 [0,1,0,0,0,1|1,0,0]=3 3875 B15R1.882 CC(C)CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214892 [0,1,0,0,0,1|1,0,0]=3 3876 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 11a_100000210545_100000185839 [0,1,0,0,0,1|1,0,0]=3 3877 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 1626a_100000210545_100000185839 [0,1,0,0,0,1|1,0,0]=3 3878 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 240690a_100000210545_100000185839 [0,1,0,0,0,1|1,0,0]=3 3879 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 527a_100000210545_100000185839 [0,1,0,0,0,1|1,0,0]=3 3880 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 11a_100000210545_100000210187 [0,1,0,0,0,1|1,0,0]=3 3881 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 1626a_100000210545_100000210187 [0,1,0,0,0,1|1,0,0]=3 3882 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 240690a_100000210545_100000210187 [0,1,0,0,0,1|1,0,0]=3 3883 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 527a_100000210545_100000210187 [0,1,0,0,0,1|1,0,0]=3 3884 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 11a_100000210545_100000187176 [0,1,0,0,0,1|1,0,0]=3 3885 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 1626a_100000210545_100000187176 [0,1,0,0,0,1|1,0,0]=3 3886 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 240690a_100000210545_100000187176 [0,1,0,0,0,1|1,0,0]=3 3887 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 527a_100000210545_100000187176 [0,1,0,0,0,1|1,0,0]=3 3888 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 11a_100000210545_100000187904 [0,1,0,0,0,1|1,0,0]=3 3889 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 1626a_100000210545_100000187904 [0,1,0,0,0,1|1,0,0]=3 3890 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 240690a_100000210545_100000187904 [0,1,0,0,0,1|1,0,0]=3 3891 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 527a_100000210545_100000187904 [0,1,0,0,0,1|1,0,0]=3 3892 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)O 240690a_100000210545_100000212099 [0,1,0,0,0,1|1,0,0]=3 3893 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)O 527a_100000210545_100000212099 [0,1,0,0,0,1|1,0,0]=3 3894 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)Br 34a_100000210254_100000755118 [0,1,0,0,0,1|1,0,1]=4 3895 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210312 [0,1,0,0,0,1|1,0,1]=4 3896 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210626 [0,1,0,0,0,1|1,0,1]=4 3897 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)Cl 7a_100000210254_100000684792 [0,1,0,0,0,1|1,0,1]=4 3898 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210312 [0,1,0,0,0,1|1,0,1]=4 3899 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)F 34a_100000210254_100000743420 [0,1,0,0,0,1|1,0,1]=4 3900 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210626 [0,1,0,0,0,1|1,0,1]=4 3901 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)F 7a_100000210254_100000743420 [0,1,0,0,0,1|1,0,1]=4 3902 B15R1.882 CC(C)CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210312 [0,1,0,0,0,1|1,0,1]=4 3903 B15R1.882 CC(C)CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210312 [0,1,0,0,0,1|1,0,1]=4 3904 B15R1.882 CC(C)CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210626 [0,1,0,0,0,1|1,0,1]=4 3905 B15R1.882 CC(C)CNCC(=O)c1ccc(cc1)Br 34a_100000210953_100000188085 [0,1,0,0,0,1|1,0,0]=3 3906 B15R1.882 CC(C)CNCC(=O)c1ccc(cc1)I 34a_100000210953_100011216261 [0,1,0,0,0,1|1,0,0]=3 3907 B15R1.882 CC(C)CNCC(=O)c1ccc(cc1)O 34a_100000210953_100009814261 [0,1,0,0,0,1|1,0,0]=3 3908 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)Br 22a_100000696102_100000185839 [0,1,0,0,0,1|1,0,0]=3 3909 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)Cl 22a_100000696102_100000210187 [0,1,0,0,0,1|1,0,0]=3 3910 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)F 22a_100000696102_100000187176 [0,1,0,0,0,1|1,0,0]=3 3911 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)I 22a_100000696102_100000187904 [0,1,0,0,0,1|1,0,0]=3 3912 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)O 22a_100000696102_100000212099 [0,1,0,0,0,1|1,0,0]=3 3913 B15R1.882 CC(C)COCC(=O)c1ccc(cc1)Br 34a_100000210257_100000188085 [0,1,0,0,0,1|0,0,0]=2 3914 B15R1.882 CC(C)COCC(=O)c1ccc(cc1)F 34a_100000246311_100000210624 [0,1,0,0,0,1|0,0,0]=2 3915 B15R1.882 CC(C)COCC(=O)c1ccc(cc1)I 34a_100000210257_100011216261 [0,1,0,0,0,1|0,0,0]=2 3916 B15R1.882 CC(C)COCC(=O)c1ccc(cc1)O 34a_100000210257_100009814261 [0,1,0,0,0,1|0,0,0]=2 3917 B15R1.882 CC(C)COCC(N)c1ccc(cc1)Br 34a_100000734186_100000210624 [0,1,0,0,0,1|1,0,1]=4 3918 B15R1.882 CC(C)COCC(N)c1ccc(cc1)F 34a_100000705410_100000210624 [0,1,0,0,0,1|1,0,1]=4 3919 B15R1.882 CC(C)COCC(O)c1ccc(cc1)Cl 34a_100000210257_200011996143 [0,1,0,0,0,1|0,0,2]=4 3920 B15R1.882 CC(C)COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_100000210624 [0,1,0,0,0,1|1,0,1]=4 3921 B15R1.882 CC(C)COC[C@H](O)c1ccc(cc1)F 34a_100000210257_100000720402 [0,1,0,0,0,1|0,0,2]=4 3922 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210760 [0,1,0,0,0,1|0,1,0]=3 3923 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)Cl 62a_100000210624_100000211071 [0,1,0,0,0,1|0,1,0]=3 3924 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210760 [0,1,0,0,0,1|0,1,0]=3 3925 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)F 62a_100000210624_100000211279 [0,1,0,0,0,1|0,1,0]=3 3926 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210760 [0,1,0,0,0,1|0,1,0]=3 3927 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)I 62a_100000210624_100011216261 [0,1,0,0,0,1|0,1,0]=3 3928 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210760 [0,1,0,0,0,1|0,1,0]=3 3929 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)O 62a_100000210624_100009814261 [0,1,0,0,0,1|0,1,0]=3 3930 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210760 [0,1,0,0,0,1|0,1,0]=3 3931 B15R1.882 CC(C)CSCC(=O)c1ccc(cn1)Cl 62a_100000210624_100016989621 [0,1,0,0,0,1|1,1,0]=4 3932 B15R1.882 CC(C)CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100000210760 [0,1,0,0,0,1|1,1,0]=4 3933 B15R1.882 CC(C)CSCC(=O)c1ccc(nc1)Cl 62a_100000210624_100009864725 [0,1,0,0,0,1|1,1,0]=4 3934 B15R1.882 CC(C)CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100000210760 [0,1,0,0,0,1|1,1,0]=4 3935 B15R1.882 CC(C)NCCC(=O)c1ccc(cc1)F 2230a_100138425928_100000211231 [0,1,0,0,0,1|1,0,0]=3 3936 B15R1.882 CC(C)NCCC(=O)c1ccc(cc1)O 2230a_100138425928_100009879949 [0,1,0,0,0,1|1,0,0]=3 3937 B15R1.882 CC(C)OCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000211751 [0,1,0,0,0,1|1,0,0]=3 3938 B15R1.882 CC(C)OCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000211751 [0,1,0,0,0,1|1,0,0]=3 3939 B15R1.882 CC(C)OCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000211751 [0,1,0,0,0,1|1,0,0]=3 3940 B15R1.882 CC(C)OCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000211751 [0,1,0,0,0,1|1,0,0]=3 3941 B15R1.882 CC(C)OCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000211751 [0,1,0,0,0,1|1,0,0]=3 3942 B15R1.882 CC(C)OCOC(C)c1ccc(cc1)Br 34a_100000745893_100000709892 [0,1,0,0,0,1|1,0,1]=4 3943 B15R1.882 CC(C)OCOC(C)c1ccc(cc1)F 34a_100000181323_100000709892 [0,1,0,0,0,1|1,0,1]=4 3944 B15R1.882 CC(C)OCOC(C)c1ccc(cc1)N 34a_100011216399_100000709892 [0,1,0,0,0,1|1,0,1]=4 3945 B15R1.882 CC(C)OCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000709892 [0,1,0,0,0,1|1,0,1]=4 3946 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000730970 [0,1,0,0,0,1|1,0,0]=3 3947 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Br 62a_100000210206_100011215963 [0,1,0,0,0,1|1,0,0]=3 3948 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Br 62a_100011215963_100000210206 [0,1,0,0,0,1|1,0,0]=3 3949 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000730970 [0,1,0,0,0,1|1,0,0]=3 3950 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Cl 62a_100000210206_100011216492 [0,1,0,0,0,1|1,0,0]=3 3951 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210206 [0,1,0,0,0,1|1,0,0]=3 3952 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000730970 [0,1,0,0,0,1|1,0,0]=3 3953 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)F 62a_100000210206_100000211231 [0,1,0,0,0,1|1,0,0]=3 3954 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)F 62a_100000211231_100000210206 [0,1,0,0,0,1|1,0,0]=3 3955 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000730970 [0,1,0,0,0,1|1,0,0]=3 3956 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000730970 [0,1,0,0,0,1|1,0,0]=3 3957 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)O 62a_100000210206_100009879949 [0,1,0,0,0,1|1,0,0]=3 3958 B15R1.882 CC(F)COCC(=O)c1ccc(cc1)Br 34a_100015925927_100000188085 [0,1,0,0,0,1|1,0,0]=3 3959 B15R1.882 CC(F)COCC(=O)c1ccc(cc1)I 34a_100015925927_100011216261 [0,1,0,0,0,1|1,0,0]=3 3960 B15R1.882 CC(F)COCC(=O)c1ccc(cc1)O 34a_100015925927_100009814261 [0,1,0,0,0,1|1,0,0]=3 3961 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_200000718107 [0,1,0,0,0,1|2,0,0]=4 3962 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000718107 [0,1,0,0,0,1|2,0,0]=4 3963 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)F 1458a_100000187176_200000718107 [0,1,0,0,0,1|2,0,0]=4 3964 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)I 1458a_100000187904_200000718107 [0,1,0,0,0,1|2,0,0]=4 3965 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)O 1458a_100000212099_200000718107 [0,1,0,0,0,1|2,0,0]=4 3966 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Br 240690a_200000755665_100000185839 [0,1,0,0,0,1|2,0,0]=4 3967 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Br 527a_200000755665_100000185839 [0,1,0,0,0,1|2,0,0]=4 3968 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Cl 240690a_200000755665_100000210187 [0,1,0,0,0,1|2,0,0]=4 3969 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Cl 527a_200000755665_100000210187 [0,1,0,0,0,1|2,0,0]=4 3970 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)F 240690a_200000755665_100000187176 [0,1,0,0,0,1|2,0,0]=4 3971 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)F 527a_200000755665_100000187176 [0,1,0,0,0,1|2,0,0]=4 3972 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)I 240690a_200000755665_100000187904 [0,1,0,0,0,1|2,0,0]=4 3973 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)I 527a_200000755665_100000187904 [0,1,0,0,0,1|2,0,0]=4 3974 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)O 240690a_200000755665_100000212099 [0,1,0,0,0,1|2,0,0]=4 3975 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)O 527a_200000755665_100000212099 [0,1,0,0,0,1|2,0,0]=4 3976 B15R1.882 CC(O)CNCC(=O)c1ccc(cc1)Br 34a_100000210904_100000188085 [0,1,0,0,0,1|2,0,0]=4 3977 B15R1.882 CC(O)CNCC(=O)c1ccc(cc1)I 34a_100000210904_100011216261 [0,1,0,0,0,1|2,0,0]=4 3978 B15R1.882 CC(O)CNCC(=O)c1ccc(cc1)O 34a_100000210904_100009814261 [0,1,0,0,0,1|2,0,0]=4 3979 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)Br 22a_200000730056_100000185839 [0,1,0,0,0,1|2,0,0]=4 3980 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)Cl 22a_200000730056_100000210187 [0,1,0,0,0,1|2,0,0]=4 3981 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)F 22a_200000730056_100000187176 [0,1,0,0,0,1|2,0,0]=4 3982 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)I 22a_200000730056_100000187904 [0,1,0,0,0,1|2,0,0]=4 3983 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)O 22a_200000730056_100000212099 [0,1,0,0,0,1|2,0,0]=4 3984 B15R1.882 CC(O)COCC(=O)c1ccc(cc1)F 34a_100000246311_100011218427 [0,1,0,0,0,1|1,0,0]=3 3985 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)Br 62a_100000188085_100011218427 [0,1,0,0,0,1|1,1,0]=4 3986 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100011218427 [0,1,0,0,0,1|1,1,0]=4 3987 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)Cl 62a_100011218427_100000211071 [0,1,0,0,0,1|1,1,0]=4 3988 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)F 62a_100000211279_100011218427 [0,1,0,0,0,1|1,1,0]=4 3989 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)F 62a_100011218427_100000211279 [0,1,0,0,0,1|1,1,0]=4 3990 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)I 62a_100011216261_100011218427 [0,1,0,0,0,1|1,1,0]=4 3991 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)I 62a_100011218427_100011216261 [0,1,0,0,0,1|1,1,0]=4 3992 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)O 62a_100009814261_100011218427 [0,1,0,0,0,1|1,1,0]=4 3993 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)O 62a_100011218427_100009814261 [0,1,0,0,0,1|1,1,0]=4 3994 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000695564 [0,1,0,0,0,1|2,0,0]=4 3995 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Br 2230a_100102631434_100000211046 [0,1,0,0,0,1|2,0,0]=4 3996 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Br 269982a_100102631434_100000211046 [0,1,0,0,0,1|2,0,0]=4 3997 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000695564 [0,1,0,0,0,1|2,0,0]=4 3998 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Cl 269982a_100102631434_200011217871 [0,1,0,0,0,1|2,0,0]=4 3999 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000695564 [0,1,0,0,0,1|2,0,0]=4 4000 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)F 2230a_100102631434_100000211961 [0,1,0,0,0,1|2,0,0]=4 4001 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)F 269982a_100102631434_100000211961 [0,1,0,0,0,1|2,0,0]=4 4002 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000695564 [0,1,0,0,0,1|2,0,0]=4 4003 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000695564 [0,1,0,0,0,1|2,0,0]=4 4004 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)O 2230a_100102631434_100000039620 [0,1,0,0,0,1|2,0,0]=4 4005 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)O 269982a_100102631434_100000039620 [0,1,0,0,0,1|2,0,0]=4 4006 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Br 240690a_100000210585_100000185839 [0,1,0,0,0,1|2,0,0]=4 4007 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Br 527a_100000210585_100000185839 [0,1,0,0,0,1|2,0,0]=4 4008 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Cl 240690a_100000210585_100000210187 [0,1,0,0,0,1|2,0,0]=4 4009 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Cl 527a_100000210585_100000210187 [0,1,0,0,0,1|2,0,0]=4 4010 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)F 240690a_100000210585_100000187176 [0,1,0,0,0,1|2,0,0]=4 4011 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)F 527a_100000210585_100000187176 [0,1,0,0,0,1|2,0,0]=4 4012 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)I 240690a_100000210585_100000187904 [0,1,0,0,0,1|2,0,0]=4 4013 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)I 527a_100000210585_100000187904 [0,1,0,0,0,1|2,0,0]=4 4014 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)O 240690a_100000210585_100000212099 [0,1,0,0,0,1|2,0,0]=4 4015 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)O 527a_100000210585_100000212099 [0,1,0,0,0,1|2,0,0]=4 4016 B15R1.882 C[C@@H](Cl)COCC(=O)c1ccc(cc1)Br 34a_100016084084_100000188085 [0,1,0,0,0,1|1,0,0]=3 4017 B15R1.882 C[C@@H](Cl)COCC(=O)c1ccc(cc1)I 34a_100016084084_100011216261 [0,1,0,0,0,1|1,0,0]=3 4018 B15R1.882 C[C@@H](Cl)COCC(=O)c1ccc(cc1)O 34a_100016084084_100009814261 [0,1,0,0,0,1|1,0,0]=3 4019 B15R1.882 C[C@@H](N)COCC(=O)c1ccc(cc1)Br 34a_100000737577_100000188085 [0,1,0,0,0,1|1,0,0]=3 4020 B15R1.882 C[C@@H](N)COCC(=O)c1ccc(cc1)I 34a_100000737577_100011216261 [0,1,0,0,0,1|1,0,0]=3 4021 B15R1.882 C[C@@H](N)COCC(=O)c1ccc(cc1)O 34a_100000737577_100009814261 [0,1,0,0,0,1|1,0,0]=3 4022 B15R1.882 C[C@@H](O)COCC(=O)c1ccc(cc1)F 34a_100000246311_100009817552 [0,1,0,0,0,1|1,0,0]=3 4023 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)Br 62a_100000188085_100009817552 [0,1,0,0,0,1|1,1,0]=4 4024 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100009817552 [0,1,0,0,0,1|1,1,0]=4 4025 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)Cl 62a_100009817552_100000211071 [0,1,0,0,0,1|1,1,0]=4 4026 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)F 62a_100000211279_100009817552 [0,1,0,0,0,1|1,1,0]=4 4027 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)F 62a_100009817552_100000211279 [0,1,0,0,0,1|1,1,0]=4 4028 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)I 62a_100009817552_100011216261 [0,1,0,0,0,1|1,1,0]=4 4029 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)I 62a_100011216261_100009817552 [0,1,0,0,0,1|1,1,0]=4 4030 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)O 62a_100009814261_100009817552 [0,1,0,0,0,1|1,1,0]=4 4031 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)O 62a_100009817552_100009814261 [0,1,0,0,0,1|1,1,0]=4 4032 B15R1.882 Cc1ccc(cc1)C(=O)CCCC(C)C 1458a_100000188618_100011214892 [0,1,0,0,0,1|1,0,0]=3 4033 B15R1.882 Cc1ccc(cc1)C(=O)CCCC(C)O 1458a_100000188618_200000718107 [0,1,0,0,0,1|2,0,0]=4 4034 B15R1.882 Cc1ccc(cc1)C(=O)CCCN(C)C 1458a_100000188618_100000695564 [0,1,0,0,0,1|2,0,0]=4 4035 B15R1.882 Cc1ccc(cc1)C(=O)CCNC(C)C 2230a_100138425928_100000701375 [0,1,0,0,0,1|1,0,0]=3 4036 B15R1.882 Cc1ccc(cc1)C(=O)CCOC(C)C 1458a_100000188618_100000211751 [0,1,0,0,0,1|1,0,0]=3 4037 B15R1.882 Cc1ccc(cc1)C(=O)CCSC(C)C 1458a_100000188618_100000730970 [0,1,0,0,0,1|1,0,0]=3 4038 B15R1.882 Cc1ccc(cc1)C(=O)CCSC(C)C 62a_100000210206_100000701375 [0,1,0,0,0,1|1,0,0]=3 4039 B15R1.882 Cc1ccc(cc1)C(=O)CCSC(C)C 62a_100000701375_100000210206 [0,1,0,0,0,1|1,0,0]=3 4040 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)C 2230a_100000210953_100000211441 [0,1,0,0,0,1|1,0,0]=3 4041 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)C 34a_100000210953_100000211441 [0,1,0,0,0,1|1,0,0]=3 4042 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)O 2230a_100000210904_100000211441 [0,1,0,0,0,1|2,0,0]=4 4043 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)O 34a_100000210904_100000211441 [0,1,0,0,0,1|2,0,0]=4 4044 B15R1.882 Cc1ccc(cc1)C(=O)COCC(C)Br 34a_100012180447_100000211441 [0,1,0,0,0,1|1,0,0]=3 4045 B15R1.882 Cc1ccc(cc1)C(=O)COCC(C)C 34a_100000210257_100000211441 [0,1,0,0,0,1|0,0,0]=2 4046 B15R1.882 Cc1ccc(cc1)C(=O)COCC(C)F 34a_100015925927_100000211441 [0,1,0,0,0,1|1,0,0]=3 4047 B15R1.882 Cc1ccc(cc1)C(=O)COCC(F)F 34a_100000743014_100000211441 [0,1,0,0,0,1|2,0,0]=4 4048 B15R1.882 Cc1ccc(cc1)C(=O)COC[C@@H](C)Cl 34a_100016084084_100000211441 [0,1,0,0,0,1|1,0,0]=3 4049 B15R1.882 Cc1ccc(cc1)C(=O)COC[C@@H](C)N 34a_100000737577_100000211441 [0,1,0,0,0,1|1,0,0]=3 4050 B15R1.882 Cc1ccc(cc1)C(=O)CSCC(C)C 62a_100000210624_100000211441 [0,1,0,0,0,1|0,1,0]=3 4051 B15R1.882 Cc1ccc(cc1)C(=O)CSCC(C)C 62a_100000211441_100000210760 [0,1,0,0,0,1|0,1,0]=3 4052 B15R1.882 Cc1ccc(cc1)C(=O)CSCC(C)O 62a_100000211441_100011218427 [0,1,0,0,0,1|1,1,0]=4 4053 B15R1.882 Cc1ccc(cc1)C(=O)CSCC(C)O 62a_100011218427_100000211441 [0,1,0,0,0,1|1,1,0]=4 4054 B15R1.882 Cc1ccc(cc1)C(=O)CSC[C@@H](C)O 62a_100000211441_100009817552 [0,1,0,0,0,1|1,1,0]=4 4055 B15R1.882 Cc1ccc(cc1)C(=O)CSC[C@@H](C)O 62a_100009817552_100000211441 [0,1,0,0,0,1|1,1,0]=4 4056 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 11a_100000210545_100000188618 [0,1,0,0,0,1|1,0,0]=3 4057 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 1626a_100000210545_100000188618 [0,1,0,0,0,1|1,0,0]=3 4058 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 240690a_100000210545_100000188618 [0,1,0,0,0,1|1,0,0]=3 4059 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 527a_100000210545_100000188618 [0,1,0,0,0,1|1,0,0]=3 4060 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)O 240690a_200000755665_100000188618 [0,1,0,0,0,1|2,0,0]=4 4061 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)O 527a_200000755665_100000188618 [0,1,0,0,0,1|2,0,0]=4 4062 B15R1.882 Cc1ccc(cc1)C(=O)NCCN(C)C 240690a_100000210585_100000188618 [0,1,0,0,0,1|2,0,0]=4 4063 B15R1.882 Cc1ccc(cc1)C(=O)NCCN(C)C 527a_100000210585_100000188618 [0,1,0,0,0,1|2,0,0]=4 4064 B15R1.882 Cc1ccc(cc1)C(=O)NN=CC(C)C 4a_100000189790_100000210432 [0,1,0,0,0,1|1,0,1]=4 4065 B15R1.882 Cc1ccc(cc1)C(=O)NNCC(C)C 22a_100000696102_100000188618 [0,1,0,0,0,1|1,0,0]=3 4066 B15R1.882 Cc1ccc(cc1)C(=O)NNCC(C)O 22a_200000730056_100000188618 [0,1,0,0,0,1|2,0,0]=4 4067 B15R1.882 Cc1ccc(cc1)C(C)OCCC(C)C 34a_100000210254_100011261388 [0,1,0,0,0,1|1,0,1]=4 4068 B15R1.882 Cc1ccc(cc1)C(C)OCCC(C)C 7a_100000210254_100011261388 [0,1,0,0,0,1|1,0,1]=4 4069 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCCC(C)C 34a_100000690690_100000210312 [0,1,0,0,0,1|1,0,1]=4 4070 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCCC(C)C 7a_100000690690_100000210626 [0,1,0,0,0,1|1,0,1]=4 4071 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCOC(C)C 34a_100000690690_100000709892 [0,1,0,0,0,1|1,0,1]=4 4072 B15R1.882 Cc1ccc(cc1)[C@@H](N)COCC(C)C 34a_100009818840_100000210624 [0,1,0,0,0,1|1,0,1]=4 4073 B15R1.882 Cc1ccc(cn1)C(=O)CSCC(C)C 62a_100000210624_100012027583 [0,1,0,0,0,1|1,1,0]=4 4074 B15R1.882 Cc1ccc(cn1)C(=O)CSCC(C)C 62a_100012027583_100000210760 [0,1,0,0,0,1|1,1,0]=4 4075 B15R1.882 O=C(COCC(F)F)c1ccc(cc1)Br 34a_100000743014_100000188085 [0,1,0,0,0,1|2,0,0]=4 4076 B15R1.882 O=C(COCC(F)F)c1ccc(cc1)F 34a_100000246311_100011934356 [0,1,0,0,0,1|2,0,0]=4 4077 B15R1.882 O=C(COCC(F)F)c1ccc(cc1)I 34a_100000743014_100011216261 [0,1,0,0,0,1|2,0,0]=4 4078 B15R1.882 O=C(COCC(F)F)c1ccc(cc1)O 34a_100000743014_100009814261 [0,1,0,0,0,1|2,0,0]=4 4079 B15R1.882 [2H]C(OCCC(C)C)c1ccc(cc1)F 34a_217856618577_100000210312 [0,1,0,0,0,1|1,0,1]=4 4080 B15R1.882 [2H]C(OCCC(C)C)c1ccc(cc1)F 7a_217856618577_100000210626 [0,1,0,0,0,1|1,0,1]=4 4081 B15R1.882 [2H]C(OCOC(C)C)c1ccc(cc1)F 34a_217856618577_100000709892 [0,1,0,0,0,1|1,0,1]=4 4082 B15R1.959 C#CC(C)NCCC(=O)c1ccccc1 2230a_100000707721_100000750707 [0,1,0,0,0,1|1,0,1]=4 4083 B15R1.959 C#CC(C)SCCC(=O)c1ccccc1 62a_200000035995_100000750707 [0,1,0,0,0,1|1,0,1]=4 4084 B15R1.959 C#CC(C)SCOC(=O)c1ccccc1 62a_200000035995_100000073877 [0,1,0,0,0,1|0,0,1]=3 4085 B15R1.959 C#C[C@@H](C)OCCC(=O)c1ccccc1 7a_100009815206_100000750707 [0,1,0,0,0,1|1,0,1]=4 4086 B15R1.959 C#C[C@@H](C)OCOC(=O)c1ccccc1 7a_100009815206_100000073877 [0,1,0,0,0,1|0,0,1]=3 4087 B15R1.959 C=CC(C)COCC(=O)c1ccccc1 7a_100011215527_100000211460 [0,1,0,0,0,1|0,0,1]=3 4088 B15R1.959 C=CC(C)COCC(=O)c1ccccn1 34a_100011215527_100000027445 [0,1,0,0,0,1|1,0,1]=4 4089 B15R1.959 C=CC(C)COCC(=O)c1ccccn1 7a_100011215527_100000027445 [0,1,0,0,0,1|1,0,1]=4 4090 B15R1.959 C=CC(C)COCC(=O)c1ccncc1 7a_100011215527_100015248511 [0,1,0,0,0,1|1,0,1]=4 4091 B15R1.959 C=CC(C)SCCC(=O)c1ccccc1 62a_100011215867_100000750707 [0,1,0,0,0,1|1,0,1]=4 4092 B15R1.959 C=CC(C)SCOC(=O)c1ccccc1 62a_100011215867_100000073877 [0,1,0,0,0,1|0,0,1]=3 4093 B15R1.959 CC(C#N)CNNC(=O)c1ccccc1 22a_100000045663_100000185807 [0,1,0,0,0,1|1,0,1]=4 4094 B15R1.959 CC(C#N)NCCC(=O)c1ccccc1 2230a_100000737613_100000750707 [0,1,0,0,0,1|1,0,1]=4 4095 B15R1.959 CC(C#N)SCCC(=O)c1ccccc1 62a_100000703298_100000750707 [0,1,0,0,0,1|1,0,1]=4 4096 B15R1.959 CC(C#N)SCCC(=O)c1ccccc1 62a_100000750707_100000703298 [0,1,0,0,0,1|1,0,1]=4 4097 B15R1.959 CC(C#N)SCOC(=O)c1ccccc1 62a_100000073877_100000703298 [0,1,0,0,0,1|0,0,1]=3 4098 B15R1.959 CC(C#N)SCOC(=O)c1ccccc1 62a_100000703298_100000073877 [0,1,0,0,0,1|0,0,1]=3 4099 B15R1.959 CC(CF)OCCC(=O)c1ccccc1 7a_100016041109_100000750707 [0,1,0,0,0,1|1,0,0]=3 4100 B15R1.959 CC(CF)OCCS(=O)c1ccccc1 7a_100016041109_100000740319 [0,1,0,0,0,1|2,0,0]=4 4101 B15R1.959 CC(CF)OCOC(=O)c1ccccc1 7a_100016041109_100000073877 [0,1,0,0,0,1|0,0,0]=2 4102 B15R1.959 CC(CN)COCC(=O)c1ccccn1 34a_100000744482_100000027445 [0,1,0,0,0,1|1,0,0]=3 4103 B15R1.959 CC(CN)COCC(C)c1ccccc1 34a_100000744482_100000756946 [0,1,0,0,0,1|1,0,1]=4 4104 B15R1.959 CC(CN)COCC(O)c1ccccc1 34a_100000744482_100000185958 [0,1,0,0,0,1|0,0,2]=4 4105 B15R1.959 CC(CN)COC[C@@H](O)c1ccccc1 34a_100000744482_100011933945 [0,1,0,0,0,1|0,0,2]=4 4106 B15R1.959 CC(CO)CCNC(=O)c1ccccc1 240690a_106354213184_100000185807 [0,1,0,0,0,1|1,0,0]=3 4107 B15R1.959 CC(CO)CCNC(=O)c1ccccc1 527a_106354213184_100000185807 [0,1,0,0,0,1|1,0,0]=3 4108 B15R1.959 CC(CO)CNCC(=O)c1ccccn1 34a_100000744482_100000027445 [0,1,0,0,0,1|2,0,0]=4 4109 B15R1.959 CC(CO)SCCC(=O)c1ccccc1 62a_100012180447_100000750707 [0,1,0,0,0,1|1,0,0]=3 4110 B15R1.959 CC(CO)SCCS(=O)c1ccccc1 62a_100012180447_100000740319 [0,1,0,0,0,1|2,0,0]=4 4111 B15R1.959 CC(CO)SCOC(=O)c1ccccc1 62a_100012180447_100000073877 [0,1,0,0,0,1|0,0,0]=2 4112 B15R1.959 CC(COC[C@@H](C)CO)c1ccccc1 34a_100011215166_100000059175 [0,1,0,0,0,1|1,0,1]=4 4113 B15R1.959 CC(COC[C@@H](C)CO)c1ccccc1 7a_100011215166_100000059175 [0,1,0,0,0,1|1,0,1]=4 4114 B15R1.959 CCC(=O)CCOC(=O)c1ccccc1 1458a_100000210414_100000184176 [0,1,0,0,0,1|1,0,1]=4 4115 B15R1.959 CCC(C)C=NNC(=O)c1ccccc1 4a_100000184135_100000243153 [0,1,0,0,0,1|1,0,1]=4 4116 B15R1.959 CCC(C)CCNC(=O)c1ccccc1 11a_100020591266_100000185807 [0,1,0,0,0,1|1,0,0]=3 4117 B15R1.959 CCC(C)CCNC(=O)c1ccccc1 1626a_100020591266_100000185807 [0,1,0,0,0,1|1,0,0]=3 4118 B15R1.959 CCC(C)CCNC(=O)c1ccccc1 240690a_100020591266_100000185807 [0,1,0,0,0,1|1,0,0]=3 4119 B15R1.959 CCC(C)CCNC(=O)c1ccccc1 527a_100020591266_100000185807 [0,1,0,0,0,1|1,0,0]=3 4120 B15R1.959 CCC(C)CCOC(C)c1ccccc1 7a_100011215188_100000230085 [0,1,0,0,0,1|1,0,1]=4 4121 B15R1.959 CCC(C)COCC(C)c1ccccc1 34a_100011215166_100000748023 [0,1,0,0,0,1|1,0,1]=4 4122 B15R1.959 CCC(C)COCC(C)c1ccccc1 7a_100011215166_100000748023 [0,1,0,0,0,1|1,0,1]=4 4123 B15R1.959 CCC(C)COC[C@@H](N)c1ccccc1 34a_100000751927_100000748023 [0,1,0,0,0,1|1,0,1]=4 4124 B15R1.959 CCC(C)CSCC(=O)c1ccccc1 62a_100000211460_100000748023 [0,1,0,0,0,1|0,1,0]=3 4125 B15R1.959 CCC(C)CSCC(=O)c1ccccc1 62a_100000748023_100000211460 [0,1,0,0,0,1|0,1,0]=3 4126 B15R1.959 CCC(C)CSCC(=O)c1ccccn1 62a_100000027445_100000748023 [0,1,0,0,0,1|1,1,0]=4 4127 B15R1.959 CCC(C)CSCC(=O)c1ccccn1 62a_100000748023_100000027445 [0,1,0,0,0,1|1,1,0]=4 4128 B15R1.959 CCC(C)CSCC(=O)c1cccnc1 62a_100000748023_100000757877 [0,1,0,0,0,1|1,1,0]=4 4129 B15R1.959 CCC(C)CSCC(=O)c1cccnc1 62a_100000757877_100000748023 [0,1,0,0,0,1|1,1,0]=4 4130 B15R1.959 CCC(C)CSCC(=O)c1ccncc1 62a_100000027454_100000748023 [0,1,0,0,0,1|1,1,0]=4 4131 B15R1.959 CCC(C)CSCC(=O)c1ccncc1 62a_100000748023_100000027454 [0,1,0,0,0,1|1,1,0]=4 4132 B15R1.959 CCC(C)CSCS(=O)c1ccccc1 62a_100000748023_100000031784 [0,1,0,0,0,1|1,1,0]=4 4133 B15R1.959 CCC(C)NCCC(=O)c1ccccc1 2230a_100000209981_100000750707 [0,1,0,0,0,1|1,0,0]=3 4134 B15R1.959 CCC(C)NCCS(=O)c1ccccc1 2230a_100000209981_100000740319 [0,1,0,0,0,1|2,0,0]=4 4135 B15R1.959 CCC(C)OCCC(=O)c1ccccc1 7a_100000210228_100000750707 [0,1,0,0,0,1|1,0,0]=3 4136 B15R1.959 CCC(C)OCCS(=O)c1ccccc1 7a_100000210228_100000740319 [0,1,0,0,0,1|2,0,0]=4 4137 B15R1.959 CCC(C)OCOC(=O)c1ccccc1 7a_100000210228_100000073877 [0,1,0,0,0,1|0,0,0]=2 4138 B15R1.959 CCC(C)SCCC(=O)c1ccccc1 62a_100000750707_100000758301 [0,1,0,0,0,1|1,0,0]=3 4139 B15R1.959 CCC(C)SCCC(=O)c1ccccc1 62a_100000758301_100000750707 [0,1,0,0,0,1|1,0,0]=3 4140 B15R1.959 CCC(C)SCCS(=O)c1ccccc1 62a_100000758301_100000740319 [0,1,0,0,0,1|2,0,0]=4 4141 B15R1.959 CCC(C)SCOC(=O)c1ccccc1 62a_100000073877_100000758301 [0,1,0,0,0,1|0,0,0]=2 4142 B15R1.959 CCC(C)SCOC(=O)c1ccccc1 62a_100000758301_100000073877 [0,1,0,0,0,1|0,0,0]=2 4143 B15R1.959 CCC(O)CNNC(=O)c1ccccc1 22a_100015206393_100000185807 [0,1,0,0,0,1|2,0,0]=4 4144 B15R1.959 CCC(O)CSCC(=O)c1ccccc1 62a_100000211460_100011218378 [0,1,0,0,0,1|1,1,0]=4 4145 B15R1.959 CCC(O)CSCC(=O)c1ccccc1 62a_100011218378_100000211460 [0,1,0,0,0,1|1,1,0]=4 4146 B15R1.959 CCN(C)CCCC(=O)c1ccccc1 1458a_100000185807_100015186262 [0,1,0,0,0,1|2,0,0]=4 4147 B15R1.959 CCN(C)CCCC(=O)c1ccccc1 2230a_100000225621_100000211006 [0,1,0,0,0,1|2,0,0]=4 4148 B15R1.959 CCN(C)CCCC(=O)c1ccccc1 269982a_100000225621_100000211006 [0,1,0,0,0,1|2,0,0]=4 4149 B15R1.959 CCN(C)CCNC(=O)c1ccccc1 269982a_100000225621_200011215302 [0,1,0,0,0,1|2,0,0]=4 4150 B15R1.959 CCN(C)CCOC(=O)c1ccccc1 269982a_100000225621_100009812718 [0,1,0,0,0,1|1,0,0]=3 4151 B15R1.959 CC[C@H](C)COCC(=O)c1ccccc1 7a_100009816381_100000211460 [0,1,0,0,0,1|0,0,0]=2 4152 B15R1.959 CC[C@H](C)COCC(=O)c1ccccn1 7a_100009816381_100000027445 [0,1,0,0,0,1|1,0,0]=3 4153 B15R1.959 CC[C@H](C)COCC(=O)c1ccncc1 7a_100009816381_100015248511 [0,1,0,0,0,1|1,0,0]=3 4154 B15R1.959 CC[C@H](C)COCC(C)c1ccccc1 34a_100011215166_100009816398 [0,1,0,0,0,1|1,0,1]=4 4155 B15R1.959 CC[C@H](C)COCC(C)c1ccccc1 7a_100009816381_100000756946 [0,1,0,0,0,1|1,0,1]=4 4156 B15R1.959 CC[C@H](C)COCC(C)c1ccccc1 7a_100011215166_100009816398 [0,1,0,0,0,1|1,0,1]=4 4157 B15R1.959 CC[C@H](C)COCC(O)c1ccccc1 7a_100009816381_100000185958 [0,1,0,0,0,1|0,0,2]=4 4158 B15R1.959 CC[C@H](C)COC[C@@H](N)c1ccccc1 34a_100000751927_100009816398 [0,1,0,0,0,1|1,0,1]=4 4159 B15R1.959 CC[C@H](C)COC[C@@H](O)c1ccccc1 7a_100009816381_100011933945 [0,1,0,0,0,1|0,0,2]=4 4160 B15R1.959 CC[C@H](C)CSCC(=O)c1ccccc1 62a_100000211460_100009816398 [0,1,0,0,0,1|0,1,0]=3 4161 B15R1.959 CC[C@H](C)CSCC(=O)c1ccccc1 62a_100009816398_100000211460 [0,1,0,0,0,1|0,1,0]=3 4162 B15R1.959 CC[C@H](C)CSCC(=O)c1ccccn1 62a_100000027445_100009816398 [0,1,0,0,0,1|1,1,0]=4 4163 B15R1.959 CC[C@H](C)CSCC(=O)c1ccccn1 62a_100009816398_100000027445 [0,1,0,0,0,1|1,1,0]=4 4164 B15R1.959 CC[C@H](C)CSCC(=O)c1cccnc1 62a_100000757877_100009816398 [0,1,0,0,0,1|1,1,0]=4 4165 B15R1.959 CC[C@H](C)CSCC(=O)c1cccnc1 62a_100009816398_100000757877 [0,1,0,0,0,1|1,1,0]=4 4166 B15R1.959 CC[C@H](C)CSCC(=O)c1ccncc1 62a_100000027454_100009816398 [0,1,0,0,0,1|1,1,0]=4 4167 B15R1.959 CC[C@H](C)CSCC(=O)c1ccncc1 62a_100009816398_100000027454 [0,1,0,0,0,1|1,1,0]=4 4168 B15R1.959 CC[C@H](C)CSCS(=O)c1ccccc1 62a_100009816398_100000031784 [0,1,0,0,0,1|1,1,0]=4 4169 B15R1.959 COC(C)CCOC(C)c1ccccc1 7a_100000764861_100000230085 [0,1,0,0,0,1|1,0,1]=4 4170 B15R1.959 COC(C)COCC(=O)c1ccccn1 34a_100000690652_100000027445 [0,1,0,0,0,1|1,0,0]=3 4171 B15R1.959 COC(C)COCC(C)c1ccccc1 34a_100000690652_100000756946 [0,1,0,0,0,1|1,0,1]=4 4172 B15R1.959 COC(C)COCC(O)c1ccccc1 34a_100000690652_100000185958 [0,1,0,0,0,1|0,0,2]=4 4173 B15R1.959 COC(C)COC[C@@H](O)c1ccccc1 34a_100000690652_100011933945 [0,1,0,0,0,1|0,0,2]=4 4174 B15R1.959 COC(C)SCCC(=O)c1ccccc1 62a_100000750707_100009879195 [0,1,0,0,0,1|1,0,0]=3 4175 B15R1.959 COC(C)SCCC(=O)c1ccccc1 62a_100009879195_100000750707 [0,1,0,0,0,1|1,0,0]=3 4176 B15R1.959 COC(C)SCCS(=O)c1ccccc1 62a_100009879195_100000740319 [0,1,0,0,0,1|2,0,0]=4 4177 B15R1.959 COC(C)SCOC(=O)c1ccccc1 62a_100000073877_100009879195 [0,1,0,0,0,1|0,0,0]=2 4178 B15R1.959 COC(C)SCOC(=O)c1ccccc1 62a_100009879195_100000073877 [0,1,0,0,0,1|0,0,0]=2 4179 B15R1.959 C[C@@H](CO)COC[C@@H](N)c1ccccc1 34a_100000751927_100000059175 [0,1,0,0,0,1|1,0,1]=4 4180 B15R1.959 C[C@@H](CO)CSCC(=O)c1ccccc1 62a_100000059175_100000211460 [0,1,0,0,0,1|0,1,0]=3 4181 B15R1.959 C[C@@H](CO)CSCC(=O)c1ccccc1 62a_100000211460_100000059175 [0,1,0,0,0,1|0,1,0]=3 4182 B15R1.959 C[C@@H](CO)CSCC(=O)c1ccccn1 62a_100000027445_100000059175 [0,1,0,0,0,1|1,1,0]=4 4183 B15R1.959 C[C@@H](CO)CSCC(=O)c1ccccn1 62a_100000059175_100000027445 [0,1,0,0,0,1|1,1,0]=4 4184 B15R1.959 C[C@@H](CO)CSCC(=O)c1cccnc1 62a_100000059175_100000757877 [0,1,0,0,0,1|1,1,0]=4 4185 B15R1.959 C[C@@H](CO)CSCC(=O)c1cccnc1 62a_100000757877_100000059175 [0,1,0,0,0,1|1,1,0]=4 4186 B15R1.959 C[C@@H](CO)CSCC(=O)c1ccncc1 62a_100000027454_100000059175 [0,1,0,0,0,1|1,1,0]=4 4187 B15R1.959 C[C@@H](CO)CSCC(=O)c1ccncc1 62a_100000059175_100000027454 [0,1,0,0,0,1|1,1,0]=4 4188 B15R1.959 C[C@@H](CO)CSCS(=O)c1ccccc1 62a_100000059175_100000031784 [0,1,0,0,0,1|1,1,0]=4 4189 B15R1.959 C[C@H](CO)NCCC(=O)c1ccccc1 2230a_100000737577_100000750707 [0,1,0,0,0,1|1,0,0]=3 4190 B15R1.959 C[C@H](CO)NCCS(=O)c1ccccc1 2230a_100000737577_100000740319 [0,1,0,0,0,1|2,0,0]=4 4191 B15R1.959 C[C@H](CO)SCCC(=O)c1ccccc1 62a_100000750707_100016084084 [0,1,0,0,0,1|1,0,0]=3 4192 B15R1.959 C[C@H](CO)SCCC(=O)c1ccccc1 62a_100016084084_100000750707 [0,1,0,0,0,1|1,0,0]=3 4193 B15R1.959 C[C@H](CO)SCCS(=O)c1ccccc1 62a_100016084084_100000740319 [0,1,0,0,0,1|2,0,0]=4 4194 B15R1.959 C[C@H](CO)SCOC(=O)c1ccccc1 62a_100000073877_100016084084 [0,1,0,0,0,1|0,0,0]=2 4195 B15R1.959 C[C@H](CO)SCOC(=O)c1ccccc1 62a_100016084084_100000073877 [0,1,0,0,0,1|0,0,0]=2 4196 B15R1.959 N#CC(F)SCOC(=O)c1ccccc1 62a_100000073877_200000117898 [0,1,0,0,0,1|1,0,1]=4 4197 B15R1.959 N#CC(F)SCOC(=O)c1ccccc1 62a_200000117898_100000073877 [0,1,0,0,0,1|1,0,1]=4 4198 B15R1.959 NC[C@@H](F)COCC(=O)c1ccccn1 34a_100015665980_100000027445 [0,1,0,0,0,1|2,0,0]=4 4199 B15R1.959 O=C(CO)CCOC(=O)c1ccccc1 1458a_100000210174_100000184176 [0,1,0,0,0,1|1,0,1]=4 4200 B15R1.959 O=C(COCC(Cl)CCl)c1ccccn1 34a_100000033668_100000027445 [0,1,0,0,0,1|2,0,0]=4 4201 B15R1.959 O=C(CSCC(O)CO)c1ccccc1 62a_100000211460_100011219619 [0,1,0,0,0,1|1,1,0]=4 4202 B15R1.959 O=C(CSCC(O)CO)c1ccccc1 62a_100011219619_100000211460 [0,1,0,0,0,1|1,1,0]=4 4203 B15R1.959 O=C(CSC[C@@H](O)CF)c1ccccc1 62a_100000211460_100015614560 [0,1,0,0,0,1|1,1,0]=4 4204 B15R1.959 O=C(CSC[C@@H](O)CF)c1ccccc1 62a_100015614560_100000211460 [0,1,0,0,0,1|1,1,0]=4 4205 B15R1.959 O=C(CSC[C@@H](O)CO)c1ccccc1 62a_100000211460_100009815848 [0,1,0,0,0,1|1,1,0]=4 4206 B15R1.959 O=C(CSC[C@@H](O)CO)c1ccccc1 62a_100009815848_100000211460 [0,1,0,0,0,1|1,1,0]=4 4207 B15R1.1076 CC(=CC(=O)CC(C)C)c1ccccc1 1458a_100000743005_100000210624 [0,1,0,0,0,1|2,0,0]=4 4208 B15R1.1076 CC(C)CC(=O)CC(=O)c1ccccc1 1458a_100000210554_100000211460 [0,1,0,0,0,1|1,0,0]=3 4209 B15R1.1076 CC(C)CC(=O)CC(=O)c1ccccn1 1458a_100000210554_100000027445 [0,1,0,0,0,1|2,0,0]=4 4210 B15R1.1076 CC(C)CC(=O)CC(=O)c1cccnc1 1458a_100000210554_100015188593 [0,1,0,0,0,1|2,0,0]=4 4211 B15R1.1076 CC(C)CC(=O)CC(=O)c1ccncc1 1458a_100000210554_100000027454 [0,1,0,0,0,1|2,0,0]=4 4212 B15R1.1076 CC(C)CC(C)NC(=O)c1ccccc1 11a_100000692259_100000185807 [0,1,0,0,0,1|1,0,0]=3 4213 B15R1.1076 CC(C)CC(C)NC(=O)c1ccccc1 1626a_100000692259_100000185807 [0,1,0,0,0,1|1,0,0]=3 4214 B15R1.1076 CC(C)CC(C)NC(=O)c1ccccc1 240690a_100000692259_100000185807 [0,1,0,0,0,1|1,0,0]=3 4215 B15R1.1076 CC(C)CC(C)NC(=O)c1ccccc1 527a_100000692259_100000185807 [0,1,0,0,0,1|1,0,0]=3 4216 B15R1.1076 CC(C)CC(C)OC(C)c1ccccc1 34a_100000211805_100000211855 [0,1,0,0,0,1|1,0,1]=4 4217 B15R1.1076 CC(C)CC(C)OC(C)c1ccccc1 7a_100000211805_100000230085 [0,1,0,0,0,1|1,0,1]=4 4218 B15R1.1076 CC(C)CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000731052 [0,1,0,0,0,1|1,0,1]=4 4219 B15R1.1076 CC(C)CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000731052 [0,1,0,0,0,1|1,0,1]=4 4220 B15R1.1076 CC(C)CN(C)CC(=O)c1ccccc1 269982a_100000747067_100000211460 [0,1,0,0,0,1|1,0,0]=3 4221 B15R1.1076 CC(C)CN(C)CC(=O)c1ccccn1 269982a_100000747067_100000027445 [0,1,0,0,0,1|2,0,0]=4 4222 B15R1.1076 CC(C)CN(C)CC(=O)c1cccnc1 269982a_100000747067_100000757877 [0,1,0,0,0,1|2,0,0]=4 4223 B15R1.1076 CC(C)CN(C)CC(=O)c1ccncc1 269982a_100000747067_100000027454 [0,1,0,0,0,1|2,0,0]=4 4224 B15R1.1076 CC(C)CN(C)CS(=O)c1ccccc1 269982a_100000747067_100000031784 [0,1,0,0,0,1|2,0,0]=4 4225 B15R1.1076 CC(C)NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183996 [0,1,0,0,0,1|1,0,1]=4 4226 B15R1.1076 CC(C)OC(=O)CC(=O)c1ccccc1 1458a_100000185807_100011215430 [0,1,0,0,0,1|1,0,1]=4 4227 B15R1.1076 CC(CN(C)C)NC(=O)c1ccccc1 11a_100016992788_100000185807 [0,1,0,0,0,1|2,0,0]=4 4228 B15R1.1076 CC(CN(C)C)NC(=O)c1ccccc1 240690a_100016992788_100000185807 [0,1,0,0,0,1|2,0,0]=4 4229 B15R1.1076 CC(CN(C)C)NC(=O)c1ccccc1 527a_100016992788_100000185807 [0,1,0,0,0,1|2,0,0]=4 4230 B15R1.1076 CC(O)CN(C)CC(=O)c1ccccc1 269982a_100000227577_100000211460 [0,1,0,0,0,1|2,0,0]=4 4231 B15R1.1076 CN(C)CC(=O)CC(=O)c1ccccc1 1458a_100000750896_100000211460 [0,1,0,0,0,1|2,0,0]=4 4232 B15R1.1076 CN(C)CC(=O)NC(=O)c1ccccc1 269982a_100102631434_100000010347 [0,1,0,0,0,1|2,0,0]=4 4233 B15R1.1076 C[C@@H](O)CC(=O)CC(=O)c1ccccc1 1458a_100011933948_100000211460 [0,1,0,0,0,1|2,0,0]=4 4234 B15R1.1076 C[S+](C)CC(=O)CC(=O)c1ccccc1 1458a_200159257847_100000211460 [0,1,0,0,0,1|2,0,0]=4 4235 B15R1.1078 C=C(C(=O)CCC(C)C)c1ccccc1 1458a_100000065200_100000210312 [0,1,0,0,0,1|2,0,0]=4 4236 B15R1.1078 C=C(C(=O)NCC(C)C)c1ccccc1 1626a_100000210953_100000065200 [0,1,0,0,0,1|2,0,0]=4 4237 B15R1.1078 CC(C)CCC(C)C(=O)c1ccccc1 1458a_100000185807_100011261404 [0,1,0,0,0,1|1,0,0]=3 4238 B15R1.1078 CC(C)CCN(C)C(=O)c1ccccc1 11a_100000742789_100000185807 [0,1,0,0,0,1|1,0,0]=3 4239 B15R1.1078 CC(C)CCN(C)C(=O)c1ccccc1 1626a_100000742789_100000185807 [0,1,0,0,0,1|1,0,0]=3 4240 B15R1.1078 CC(C)CCN(C)C(=O)c1ccccc1 240690a_100000742789_100000185807 [0,1,0,0,0,1|1,0,0]=3 4241 B15R1.1078 CC(C)CCN(C)C(=O)c1ccccc1 527a_100000742789_100000185807 [0,1,0,0,0,1|1,0,0]=3 4242 B15R1.1078 CC(C)CNC(C)C(=O)c1ccccc1 2230a_100000210953_100000239700 [0,1,0,0,0,1|1,0,0]=3 4243 B15R1.1078 CC(C)CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000210624 [0,1,0,0,0,1|1,0,1]=4 4244 B15R1.1078 CC(C)CSC(C)C(=O)c1ccccc1 62a_100000210624_100000239700 [0,1,0,0,0,1|0,1,0]=3 4245 B15R1.1078 CC(C)CSC(C)C(=O)c1ccccc1 62a_100000239700_100000210760 [0,1,0,0,0,1|0,1,0]=3 4246 B15R1.1078 CC(O)CNC(C)C(=O)c1ccccc1 2230a_100000210904_100000239700 [0,1,0,0,0,1|2,0,0]=4 4247 B15R1.1078 CC(O)CSC(C)C(=O)c1ccccc1 62a_100000239700_100011218427 [0,1,0,0,0,1|1,1,0]=4 4248 B15R1.1078 CC(O)CSC(C)C(=O)c1ccccc1 62a_100011218427_100000239700 [0,1,0,0,0,1|1,1,0]=4 4249 B15R1.1078 CC(SC[C@@H](C)O)C(=O)c1ccccc1 62a_100000239700_100009817552 [0,1,0,0,0,1|1,1,0]=4 4250 B15R1.1078 CC(SC[C@@H](C)O)C(=O)c1ccccc1 62a_100009817552_100000239700 [0,1,0,0,0,1|1,1,0]=4 4251 B15R1.1078 CN(C)CCN(C)C(=O)c1ccccc1 2230a_200011982063_200000210301 [0,1,0,0,0,1|2,0,0]=4 4252 B15R1.1078 CN(C)CCN(C)C(=O)c1ccccc1 240690a_100000225618_100000185807 [0,1,0,0,0,1|2,0,0]=4 4253 B15R1.1078 CN(C)CCN(C)C(=O)c1ccccc1 269982a_200011982063_200000210301 [0,1,0,0,0,1|2,0,0]=4 4254 B15R1.1078 CN(C)CCN(C)C(=O)c1ccccc1 527a_100000225618_100000185807 [0,1,0,0,0,1|2,0,0]=4 4255 B15R1.1078 CN([13CH3])CCN(C)C(=O)c1ccccc1 2230a_200011982063_200025704644 [0,1,0,0,0,1|2,0,0]=4 4256 B15R1.1078 CN([13CH3])CCN(C)C(=O)c1ccccc1 269982a_200011982063_200025704644 [0,1,0,0,0,1|2,0,0]=4 4257 B15R1.5331 C#CC(OCCC(C)C)c1ccccc1 34a_100011219616_100000210312 [0,1,0,0,0,1|1,0,1]=4 4258 B15R1.5331 C#CC(OCCC(C)C)c1ccccc1 7a_100011219616_100000210626 [0,1,0,0,0,1|1,0,1]=4 4259 B15R1.5331 C#CC(OCOC(C)C)c1ccccc1 34a_100011219616_100000709892 [0,1,0,0,0,1|1,0,1]=4 4260 B15R1.5331 C=CC(OCCC(C)C)c1ccccc1 34a_100011215659_100000210312 [0,1,0,0,0,1|1,0,1]=4 4261 B15R1.5331 C=CC(OCCC(C)C)c1ccccc1 7a_100011215659_100000210626 [0,1,0,0,0,1|1,0,1]=4 4262 B15R1.5331 C=CC(OCOC(C)C)c1ccccc1 34a_100011215659_100000709892 [0,1,0,0,0,1|1,0,1]=4 4263 B15R1.5331 CC(C)CCOC(C#N)c1ccccc1 7a_100011217353_100000210626 [0,1,0,0,0,1|1,0,1]=4 4264 B15R1.5331 CC(C)CCOC(CBr)c1ccccc1 7a_100000185958_100000210626 [0,1,0,0,0,1|1,0,1]=4 4265 B15R1.5331 CC(C)CCOC(CN)c1ccccc1 34a_100000210709_100000210312 [0,1,0,0,0,1|1,0,1]=4 4266 B15R1.5331 CC(C)CCO[C@H](CCl)c1ccccc1 34a_100011933945_100000210312 [0,1,0,0,0,1|1,0,1]=4 4267 B15R1.5331 CC(C)CCO[C@H](CCl)c1ccccc1 7a_100011933945_100000210626 [0,1,0,0,0,1|1,0,1]=4 4268 B15R1.5331 CC(C)OCOC(CN)c1ccccc1 34a_100000210709_100000709892 [0,1,0,0,0,1|1,0,1]=4 4269 B15R1.5331 CC(C)OCO[C@H](CCl)c1ccccc1 34a_100011933945_100000709892 [0,1,0,0,0,1|1,0,1]=4 4270 B15R1.5331 CCC(COCC(C)C)c1ccccc1 34a_100000752371_100000210624 [0,1,0,0,0,1|1,0,1]=4 4271 B15R1.5331 CCC(COCC(C)C)c1ccccc1 7a_100000752371_100000210760 [0,1,0,0,0,1|1,0,1]=4 4272 B15R1.5331 CCC(OCCC(C)C)c1ccccc1 34a_100000698172_100000210312 [0,1,0,0,0,1|1,0,1]=4 4273 B15R1.5331 CCC(OCCC(C)C)c1ccccc1 7a_100000698172_100000210626 [0,1,0,0,0,1|1,0,1]=4 4274 B15R1.5331 CCC(OCOC(C)C)c1ccccc1 34a_100000698172_100000709892 [0,1,0,0,0,1|1,0,1]=4 4275 B15R1.5331 COC(COCC(C)C)c1ccccc1 34a_100011215540_100000210624 [0,1,0,0,0,1|0,0,2]=4 4276 B15R1.5331 COC(COCC(C)C)c1ccccc1 7a_100011215540_100000210760 [0,1,0,0,0,1|0,0,2]=4 4277 B15R1.8019 C=C(C)COCC(=O)c1ccccc1Br 34a_100000210245_100000199116 [0,1,0,0,0,1|0,0,2]=4 4278 B15R1.8019 C=C(C)COCC(=O)c1ccccc1C 34a_100000210245_100000741374 [0,1,0,0,0,1|0,0,2]=4 4279 B15R1.8019 C=C(C)COCC(=O)c1ccccc1Cl 34a_100000210245_100000211432 [0,1,0,0,0,1|0,0,2]=4 4280 B15R1.8019 C=C(C)COCC(=O)c1ccccc1F 34a_100000210245_100000204681 [0,1,0,0,0,1|0,0,2]=4 4281 B15R1.8019 CC(=CCCC(=O)c1ccccc1Br)C 1458a_100000188424_100011217483 [0,1,0,0,0,1|1,0,1]=4 4282 B15R1.8019 CC(=CCCC(=O)c1ccccc1C)C 1458a_100000212026_100011217483 [0,1,0,0,0,1|1,0,1]=4 4283 B15R1.8019 CC(=CCCC(=O)c1ccccc1Cl)C 1458a_100000185844_100011217483 [0,1,0,0,0,1|1,0,1]=4 4284 B15R1.8019 CC(=CCCC(=O)c1ccccc1F)C 1458a_100000188656_100011217483 [0,1,0,0,0,1|1,0,1]=4 4285 B15R1.8019 CC(=CCCC(=O)c1ccccc1I)C 1458a_100000187884_100011217483 [0,1,0,0,0,1|1,0,1]=4 4286 B15R1.8019 CC(=CCCC(=O)c1ccccc1O)C 1458a_100015234032_100011217483 [0,1,0,0,0,1|1,0,1]=4 4287 B15R1.8019 CC(=CCCC(=O)c1ccccc1[O-])C 1458a_100009911694_100011217483 [0,1,0,0,0,1|1,0,1]=4 4288 B15R1.8019 CC(=CCNC(=O)c1ccccc1Br)C 11a_100000718196_100000188424 [0,1,0,0,0,1|1,0,1]=4 4289 B15R1.8019 CC(=CCNC(=O)c1ccccc1Br)C 1626a_100000718196_100000188424 [0,1,0,0,0,1|1,0,1]=4 4290 B15R1.8019 CC(=CCNC(=O)c1ccccc1Br)C 527a_100000718196_100000188424 [0,1,0,0,0,1|1,0,1]=4 4291 B15R1.8019 CC(=CCNC(=O)c1ccccc1C)C 11a_100000718196_100000212026 [0,1,0,0,0,1|1,0,1]=4 4292 B15R1.8019 CC(=CCNC(=O)c1ccccc1C)C 1626a_100000718196_100000212026 [0,1,0,0,0,1|1,0,1]=4 4293 B15R1.8019 CC(=CCNC(=O)c1ccccc1C)C 527a_100000718196_100000212026 [0,1,0,0,0,1|1,0,1]=4 4294 B15R1.8019 CC(=CCNC(=O)c1ccccc1Cl)C 11a_100000718196_100000185844 [0,1,0,0,0,1|1,0,1]=4 4295 B15R1.8019 CC(=CCNC(=O)c1ccccc1Cl)C 1626a_100000718196_100000185844 [0,1,0,0,0,1|1,0,1]=4 4296 B15R1.8019 CC(=CCNC(=O)c1ccccc1Cl)C 527a_100000718196_100000185844 [0,1,0,0,0,1|1,0,1]=4 4297 B15R1.8019 CC(=CCNC(=O)c1ccccc1F)C 11a_100000718196_100000188656 [0,1,0,0,0,1|1,0,1]=4 4298 B15R1.8019 CC(=CCNC(=O)c1ccccc1F)C 1626a_100000718196_100000188656 [0,1,0,0,0,1|1,0,1]=4 4299 B15R1.8019 CC(=CCNC(=O)c1ccccc1F)C 527a_100000718196_100000188656 [0,1,0,0,0,1|1,0,1]=4 4300 B15R1.8019 CC(=CCNC(=O)c1ccccc1I)C 11a_100000718196_100000187884 [0,1,0,0,0,1|1,0,1]=4 4301 B15R1.8019 CC(=CCNC(=O)c1ccccc1I)C 1626a_100000718196_100000187884 [0,1,0,0,0,1|1,0,1]=4 4302 B15R1.8019 CC(=CCNC(=O)c1ccccc1I)C 527a_100000718196_100000187884 [0,1,0,0,0,1|1,0,1]=4 4303 B15R1.8019 CC(=CCNC(=O)c1ccccc1[O-])C 1626a_100000718196_100009911694 [0,1,0,0,0,1|1,0,1]=4 4304 B15R1.8019 CC(=CCNC(=O)c1ccccc1[O-])C 527a_100000718196_100009911694 [0,1,0,0,0,1|1,0,1]=4 4305 B15R1.8019 CC(=O)COCC(=O)c1ccccc1Br 34a_100000211253_100000199116 [0,1,0,0,0,1|1,0,1]=4 4306 B15R1.8019 CC(=O)COCC(=O)c1ccccc1C 34a_100000211253_100000741374 [0,1,0,0,0,1|1,0,1]=4 4307 B15R1.8019 CC(=O)COCC(=O)c1ccccc1Cl 34a_100000211253_100000211432 [0,1,0,0,0,1|1,0,1]=4 4308 B15R1.8019 CC(=O)COCC(=O)c1ccccc1F 34a_100000211253_100000204681 [0,1,0,0,0,1|1,0,1]=4 4309 B15R1.8019 CC(Br)COCC(=O)c1ccccc1Br 34a_100012180447_100000199116 [0,1,0,0,0,1|1,0,0]=3 4310 B15R1.8019 CC(Br)COCC(=O)c1ccccc1Cl 34a_100012180447_100000211432 [0,1,0,0,0,1|1,0,0]=3 4311 B15R1.8019 CC(Br)COCC(=O)c1ccccc1F 34a_100012180447_100000204681 [0,1,0,0,0,1|1,0,0]=3 4312 B15R1.8019 CC(C)C=NNC(=O)c1ccccc1Br 4a_100000183644_100000210432 [0,1,0,0,0,1|1,0,1]=4 4313 B15R1.8019 CC(C)C=NNC(=O)c1ccccc1Cl 4a_100000186534_100000210432 [0,1,0,0,0,1|1,0,1]=4 4314 B15R1.8019 CC(C)C=NNC(=O)c1ccccc1F 4a_100000183521_100000210432 [0,1,0,0,0,1|1,0,1]=4 4315 B15R1.8019 CC(C)C=NNC(=O)c1ccccc1I 4a_100000190081_100000210432 [0,1,0,0,0,1|1,0,1]=4 4316 B15R1.8019 CC(C)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011214892 [0,1,0,0,0,1|1,0,0]=3 4317 B15R1.8019 CC(C)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011214892 [0,1,0,0,0,1|1,0,0]=3 4318 B15R1.8019 CC(C)CCCC(=O)c1ccccc1F 1458a_100000188656_100011214892 [0,1,0,0,0,1|1,0,0]=3 4319 B15R1.8019 CC(C)CCCC(=O)c1ccccc1I 1458a_100000187884_100011214892 [0,1,0,0,0,1|1,0,0]=3 4320 B15R1.8019 CC(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100011214892 [0,1,0,0,0,1|1,0,0]=3 4321 B15R1.8019 CC(C)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011214892 [0,1,0,0,0,1|1,0,0]=3 4322 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 11a_100000210545_100000188424 [0,1,0,0,0,1|1,0,0]=3 4323 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 1626a_100000210545_100000188424 [0,1,0,0,0,1|1,0,0]=3 4324 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 240690a_100000210545_100000188424 [0,1,0,0,0,1|1,0,0]=3 4325 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 527a_100000210545_100000188424 [0,1,0,0,0,1|1,0,0]=3 4326 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 11a_100000210545_100000185844 [0,1,0,0,0,1|1,0,0]=3 4327 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 1626a_100000210545_100000185844 [0,1,0,0,0,1|1,0,0]=3 4328 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 240690a_100000210545_100000185844 [0,1,0,0,0,1|1,0,0]=3 4329 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 527a_100000210545_100000185844 [0,1,0,0,0,1|1,0,0]=3 4330 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 11a_100000210545_100000188656 [0,1,0,0,0,1|1,0,0]=3 4331 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 1626a_100000210545_100000188656 [0,1,0,0,0,1|1,0,0]=3 4332 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 240690a_100000210545_100000188656 [0,1,0,0,0,1|1,0,0]=3 4333 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 527a_100000210545_100000188656 [0,1,0,0,0,1|1,0,0]=3 4334 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 11a_100000210545_100000187884 [0,1,0,0,0,1|1,0,0]=3 4335 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 1626a_100000210545_100000187884 [0,1,0,0,0,1|1,0,0]=3 4336 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 240690a_100000210545_100000187884 [0,1,0,0,0,1|1,0,0]=3 4337 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 527a_100000210545_100000187884 [0,1,0,0,0,1|1,0,0]=3 4338 B15R1.8019 CC(C)CCNC(=O)c1ccccc1O 240690a_100000210545_100015234032 [0,1,0,0,0,1|1,0,0]=3 4339 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 1626a_100000210545_100009911694 [0,1,0,0,0,1|1,0,0]=3 4340 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 240690a_100000210545_100009911694 [0,1,0,0,0,1|1,0,0]=3 4341 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 527a_100000210545_100009911694 [0,1,0,0,0,1|1,0,0]=3 4342 B15R1.8019 CC(C)CCOC(C)c1ccccc1Br 34a_100000702211_100000210312 [0,1,0,0,0,1|1,0,1]=4 4343 B15R1.8019 CC(C)CCOC(C)c1ccccc1Br 7a_100000702211_100000210626 [0,1,0,0,0,1|1,0,1]=4 4344 B15R1.8019 CC(C)CCOC(C)c1ccccc1Cl 34a_100000740796_100000210312 [0,1,0,0,0,1|1,0,1]=4 4345 B15R1.8019 CC(C)CCOC(C)c1ccccc1Cl 7a_100000210254_100000181259 [0,1,0,0,0,1|1,0,1]=4 4346 B15R1.8019 CC(C)CCOC(C)c1ccccc1Cl 7a_100000740796_100000210626 [0,1,0,0,0,1|1,0,1]=4 4347 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 34a_100000210254_200000741388 [0,1,0,0,0,1|1,0,1]=4 4348 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 34a_100000697922_100000210312 [0,1,0,0,0,1|1,0,1]=4 4349 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 7a_100000210254_200000741388 [0,1,0,0,0,1|1,0,1]=4 4350 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 7a_100000697922_100000210626 [0,1,0,0,0,1|1,0,1]=4 4351 B15R1.8019 CC(C)CCOC(C)c1ccccc1N 7a_100011405641_100000210626 [0,1,0,0,0,1|1,0,1]=4 4352 B15R1.8019 CC(C)CNCC(=O)c1ccccc1Br 34a_100000210953_100000199116 [0,1,0,0,0,1|1,0,0]=3 4353 B15R1.8019 CC(C)CNCC(=O)c1ccccc1Cl 34a_100000210953_100000211432 [0,1,0,0,0,1|1,0,0]=3 4354 B15R1.8019 CC(C)CNCC(=O)c1ccccc1F 34a_100000210953_100000204681 [0,1,0,0,0,1|1,0,0]=3 4355 B15R1.8019 CC(C)CNNC(=O)c1ccccc1Br 22a_100000696102_100000188424 [0,1,0,0,0,1|1,0,0]=3 4356 B15R1.8019 CC(C)CNNC(=O)c1ccccc1Cl 22a_100000696102_100000185844 [0,1,0,0,0,1|1,0,0]=3 4357 B15R1.8019 CC(C)CNNC(=O)c1ccccc1F 22a_100000696102_100000188656 [0,1,0,0,0,1|1,0,0]=3 4358 B15R1.8019 CC(C)CNNC(=O)c1ccccc1I 22a_100000696102_100000187884 [0,1,0,0,0,1|1,0,0]=3 4359 B15R1.8019 CC(C)CNNC(=O)c1ccccc1O 22a_100000696102_100015234032 [0,1,0,0,0,1|1,0,0]=3 4360 B15R1.8019 CC(C)CNNC(=O)c1ccccc1[O-] 22a_100000696102_100009911694 [0,1,0,0,0,1|1,0,0]=3 4361 B15R1.8019 CC(C)COCC(=O)c1ccccc1Br 34a_100000210257_100000199116 [0,1,0,0,0,1|0,0,0]=2 4362 B15R1.8019 CC(C)COCC(=O)c1ccccc1Cl 34a_100000210257_100000211432 [0,1,0,0,0,1|0,0,0]=2 4363 B15R1.8019 CC(C)COCC(=O)c1ccccc1F 34a_100000210257_100000204681 [0,1,0,0,0,1|0,0,0]=2 4364 B15R1.8019 CC(C)COCC(N)c1ccccc1Cl 34a_100138412506_100000210624 [0,1,0,0,0,1|1,0,1]=4 4365 B15R1.8019 CC(C)COC[C@@H](N)c1ccccc1Br 34a_100161155918_100000210624 [0,1,0,0,0,1|1,0,1]=4 4366 B15R1.8019 CC(C)COC[C@H](N)c1ccccc1F 34a_100009818778_100000210624 [0,1,0,0,0,1|1,0,1]=4 4367 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Br 62a_100000199116_100000210760 [0,1,0,0,0,1|0,1,0]=3 4368 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Cl 62a_100000210624_100000211432 [0,1,0,0,0,1|0,1,0]=3 4369 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000210760 [0,1,0,0,0,1|0,1,0]=3 4370 B15R1.8019 CC(C)CSCC(=O)c1ccccc1F 62a_100000204681_100000210760 [0,1,0,0,0,1|0,1,0]=3 4371 B15R1.8019 CC(C)CSCC(=O)c1ccccc1F 62a_100000210624_100000204681 [0,1,0,0,0,1|0,1,0]=3 4372 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000210760 [0,1,0,0,0,1|0,1,0]=3 4373 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000210624_100000188908 [0,1,0,0,0,1|0,1,0]=3 4374 B15R1.8019 CC(C)NCCC(=O)c1ccccc1F 2230a_100138425928_100000086012 [0,1,0,0,0,1|1,0,0]=3 4375 B15R1.8019 CC(C)OCCC(=O)c1ccccc1Br 1458a_100000188424_100000211751 [0,1,0,0,0,1|1,0,0]=3 4376 B15R1.8019 CC(C)OCCC(=O)c1ccccc1Cl 1458a_100000185844_100000211751 [0,1,0,0,0,1|1,0,0]=3 4377 B15R1.8019 CC(C)OCCC(=O)c1ccccc1F 1458a_100000188656_100000211751 [0,1,0,0,0,1|1,0,0]=3 4378 B15R1.8019 CC(C)OCCC(=O)c1ccccc1I 1458a_100000187884_100000211751 [0,1,0,0,0,1|1,0,0]=3 4379 B15R1.8019 CC(C)OCCC(=O)c1ccccc1O 1458a_100015234032_100000211751 [0,1,0,0,0,1|1,0,0]=3 4380 B15R1.8019 CC(C)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000211751 [0,1,0,0,0,1|1,0,0]=3 4381 B15R1.8019 CC(C)OCOC(C)c1ccccc1Br 34a_100000702211_100000709892 [0,1,0,0,0,1|1,0,1]=4 4382 B15R1.8019 CC(C)OCOC(C)c1ccccc1Cl 34a_100000740796_100000709892 [0,1,0,0,0,1|1,0,1]=4 4383 B15R1.8019 CC(C)OCOC(C)c1ccccc1F 34a_100000697922_100000709892 [0,1,0,0,0,1|1,0,1]=4 4384 B15R1.8019 CC(C)SCCC(=O)c1ccccc1Br 1458a_100000188424_100000730970 [0,1,0,0,0,1|1,0,0]=3 4385 B15R1.8019 CC(C)SCCC(=O)c1ccccc1Cl 1458a_100000185844_100000730970 [0,1,0,0,0,1|1,0,0]=3 4386 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 1458a_100000188656_100000730970 [0,1,0,0,0,1|1,0,0]=3 4387 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 62a_100000086012_100000210206 [0,1,0,0,0,1|1,0,0]=3 4388 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 62a_100000210206_100000086012 [0,1,0,0,0,1|1,0,0]=3 4389 B15R1.8019 CC(C)SCCC(=O)c1ccccc1I 1458a_100000187884_100000730970 [0,1,0,0,0,1|1,0,0]=3 4390 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 1458a_100015234032_100000730970 [0,1,0,0,0,1|1,0,0]=3 4391 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 62a_100000210206_100009873196 [0,1,0,0,0,1|1,0,0]=3 4392 B15R1.8019 CC(C)SCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730970 [0,1,0,0,0,1|1,0,0]=3 4393 B15R1.8019 CC(F)COCC(=O)c1ccccc1Br 34a_100015925927_100000199116 [0,1,0,0,0,1|1,0,0]=3 4394 B15R1.8019 CC(F)COCC(=O)c1ccccc1Cl 34a_100015925927_100000211432 [0,1,0,0,0,1|1,0,0]=3 4395 B15R1.8019 CC(F)COCC(=O)c1ccccc1F 34a_100015925927_100000204681 [0,1,0,0,0,1|1,0,0]=3 4396 B15R1.8019 CC(O)CCCC(=O)c1ccccc1Br 1458a_100000188424_200000718107 [0,1,0,0,0,1|2,0,0]=4 4397 B15R1.8019 CC(O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_200000718107 [0,1,0,0,0,1|2,0,0]=4 4398 B15R1.8019 CC(O)CCCC(=O)c1ccccc1F 1458a_100000188656_200000718107 [0,1,0,0,0,1|2,0,0]=4 4399 B15R1.8019 CC(O)CCCC(=O)c1ccccc1I 1458a_100000187884_200000718107 [0,1,0,0,0,1|2,0,0]=4 4400 B15R1.8019 CC(O)CCCC(=O)c1ccccc1O 1458a_100015234032_200000718107 [0,1,0,0,0,1|2,0,0]=4 4401 B15R1.8019 CC(O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_200000718107 [0,1,0,0,0,1|2,0,0]=4 4402 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Br 240690a_200000755665_100000188424 [0,1,0,0,0,1|2,0,0]=4 4403 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Br 527a_200000755665_100000188424 [0,1,0,0,0,1|2,0,0]=4 4404 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Cl 240690a_200000755665_100000185844 [0,1,0,0,0,1|2,0,0]=4 4405 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Cl 527a_200000755665_100000185844 [0,1,0,0,0,1|2,0,0]=4 4406 B15R1.8019 CC(O)CCNC(=O)c1ccccc1F 240690a_200000755665_100000188656 [0,1,0,0,0,1|2,0,0]=4 4407 B15R1.8019 CC(O)CCNC(=O)c1ccccc1F 527a_200000755665_100000188656 [0,1,0,0,0,1|2,0,0]=4 4408 B15R1.8019 CC(O)CCNC(=O)c1ccccc1I 240690a_200000755665_100000187884 [0,1,0,0,0,1|2,0,0]=4 4409 B15R1.8019 CC(O)CCNC(=O)c1ccccc1I 527a_200000755665_100000187884 [0,1,0,0,0,1|2,0,0]=4 4410 B15R1.8019 CC(O)CCNC(=O)c1ccccc1O 240690a_200000755665_100015234032 [0,1,0,0,0,1|2,0,0]=4 4411 B15R1.8019 CC(O)CCNC(=O)c1ccccc1[O-] 240690a_200000755665_100009911694 [0,1,0,0,0,1|2,0,0]=4 4412 B15R1.8019 CC(O)CCNC(=O)c1ccccc1[O-] 527a_200000755665_100009911694 [0,1,0,0,0,1|2,0,0]=4 4413 B15R1.8019 CC(O)CNCC(=O)c1ccccc1Br 34a_100000210904_100000199116 [0,1,0,0,0,1|2,0,0]=4 4414 B15R1.8019 CC(O)CNCC(=O)c1ccccc1Cl 34a_100000210904_100000211432 [0,1,0,0,0,1|2,0,0]=4 4415 B15R1.8019 CC(O)CNCC(=O)c1ccccc1F 34a_100000210904_100000204681 [0,1,0,0,0,1|2,0,0]=4 4416 B15R1.8019 CC(O)CNNC(=O)c1ccccc1Br 22a_200000730056_100000188424 [0,1,0,0,0,1|2,0,0]=4 4417 B15R1.8019 CC(O)CNNC(=O)c1ccccc1Cl 22a_200000730056_100000185844 [0,1,0,0,0,1|2,0,0]=4 4418 B15R1.8019 CC(O)CNNC(=O)c1ccccc1F 22a_200000730056_100000188656 [0,1,0,0,0,1|2,0,0]=4 4419 B15R1.8019 CC(O)CNNC(=O)c1ccccc1I 22a_200000730056_100000187884 [0,1,0,0,0,1|2,0,0]=4 4420 B15R1.8019 CC(O)CNNC(=O)c1ccccc1O 22a_200000730056_100015234032 [0,1,0,0,0,1|2,0,0]=4 4421 B15R1.8019 CC(O)CNNC(=O)c1ccccc1[O-] 22a_200000730056_100009911694 [0,1,0,0,0,1|2,0,0]=4 4422 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Br 62a_100000199116_100011218427 [0,1,0,0,0,1|1,1,0]=4 4423 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100011218427 [0,1,0,0,0,1|1,1,0]=4 4424 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Cl 62a_100011218427_100000211432 [0,1,0,0,0,1|1,1,0]=4 4425 B15R1.8019 CC(O)CSCC(=O)c1ccccc1F 62a_100000204681_100011218427 [0,1,0,0,0,1|1,1,0]=4 4426 B15R1.8019 CC(O)CSCC(=O)c1ccccc1F 62a_100011218427_100000204681 [0,1,0,0,0,1|1,1,0]=4 4427 B15R1.8019 CC(O)CSCC(=O)c1ccccc1O 62a_100000188908_100011218427 [0,1,0,0,0,1|1,1,0]=4 4428 B15R1.8019 CC(O)CSCC(=O)c1ccccc1O 62a_100011218427_100000188908 [0,1,0,0,0,1|1,1,0]=4 4429 B15R1.8019 CN(C)CCCC(=O)c1ccccc1Br 1458a_100000188424_100000695564 [0,1,0,0,0,1|2,0,0]=4 4430 B15R1.8019 CN(C)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000695564 [0,1,0,0,0,1|2,0,0]=4 4431 B15R1.8019 CN(C)CCCC(=O)c1ccccc1F 1458a_100000188656_100000695564 [0,1,0,0,0,1|2,0,0]=4 4432 B15R1.8019 CN(C)CCCC(=O)c1ccccc1I 1458a_100000187884_100000695564 [0,1,0,0,0,1|2,0,0]=4 4433 B15R1.8019 CN(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100000695564 [0,1,0,0,0,1|2,0,0]=4 4434 B15R1.8019 CN(C)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000695564 [0,1,0,0,0,1|2,0,0]=4 4435 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Br 240690a_100000210585_100000188424 [0,1,0,0,0,1|2,0,0]=4 4436 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Br 527a_100000210585_100000188424 [0,1,0,0,0,1|2,0,0]=4 4437 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Cl 240690a_100000210585_100000185844 [0,1,0,0,0,1|2,0,0]=4 4438 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Cl 527a_100000210585_100000185844 [0,1,0,0,0,1|2,0,0]=4 4439 B15R1.8019 CN(C)CCNC(=O)c1ccccc1F 240690a_100000210585_100000188656 [0,1,0,0,0,1|2,0,0]=4 4440 B15R1.8019 CN(C)CCNC(=O)c1ccccc1F 527a_100000210585_100000188656 [0,1,0,0,0,1|2,0,0]=4 4441 B15R1.8019 CN(C)CCNC(=O)c1ccccc1I 240690a_100000210585_100000187884 [0,1,0,0,0,1|2,0,0]=4 4442 B15R1.8019 CN(C)CCNC(=O)c1ccccc1I 527a_100000210585_100000187884 [0,1,0,0,0,1|2,0,0]=4 4443 B15R1.8019 CN(C)CCNC(=O)c1ccccc1O 240690a_100000210585_100015234032 [0,1,0,0,0,1|2,0,0]=4 4444 B15R1.8019 CN(C)CCNC(=O)c1ccccc1[O-] 240690a_100000210585_100009911694 [0,1,0,0,0,1|2,0,0]=4 4445 B15R1.8019 CN(C)CCNC(=O)c1ccccc1[O-] 527a_100000210585_100009911694 [0,1,0,0,0,1|2,0,0]=4 4446 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1Br 34a_100016084084_100000199116 [0,1,0,0,0,1|1,0,0]=3 4447 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1Cl 34a_100016084084_100000211432 [0,1,0,0,0,1|1,0,0]=3 4448 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1F 34a_100016084084_100000204681 [0,1,0,0,0,1|1,0,0]=3 4449 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1Br 34a_100000737577_100000199116 [0,1,0,0,0,1|1,0,0]=3 4450 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1Cl 34a_100000737577_100000211432 [0,1,0,0,0,1|1,0,0]=3 4451 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1F 34a_100000737577_100000204681 [0,1,0,0,0,1|1,0,0]=3 4452 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Br 62a_100000199116_100009817552 [0,1,0,0,0,1|1,1,0]=4 4453 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100009817552 [0,1,0,0,0,1|1,1,0]=4 4454 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Cl 62a_100009817552_100000211432 [0,1,0,0,0,1|1,1,0]=4 4455 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1F 62a_100000204681_100009817552 [0,1,0,0,0,1|1,1,0]=4 4456 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1F 62a_100009817552_100000204681 [0,1,0,0,0,1|1,1,0]=4 4457 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1O 62a_100000188908_100009817552 [0,1,0,0,0,1|1,1,0]=4 4458 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1O 62a_100009817552_100000188908 [0,1,0,0,0,1|1,1,0]=4 4459 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)C 1458a_100000212026_100011214892 [0,1,0,0,0,1|1,0,0]=3 4460 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)O 1458a_100000212026_200000718107 [0,1,0,0,0,1|2,0,0]=4 4461 B15R1.8019 Cc1ccccc1C(=O)CCCN(C)C 1458a_100000212026_100000695564 [0,1,0,0,0,1|2,0,0]=4 4462 B15R1.8019 Cc1ccccc1C(=O)CCOC(C)C 1458a_100000212026_100000211751 [0,1,0,0,0,1|1,0,0]=3 4463 B15R1.8019 Cc1ccccc1C(=O)CCSC(C)C 1458a_100000212026_100000730970 [0,1,0,0,0,1|1,0,0]=3 4464 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)C 2230a_100000210953_100000741374 [0,1,0,0,0,1|1,0,0]=3 4465 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)C 34a_100000210953_100000741374 [0,1,0,0,0,1|1,0,0]=3 4466 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 2230a_100000210904_100000741374 [0,1,0,0,0,1|2,0,0]=4 4467 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000741374 [0,1,0,0,0,1|2,0,0]=4 4468 B15R1.8019 Cc1ccccc1C(=O)COCC(C)Br 34a_100012180447_100000741374 [0,1,0,0,0,1|1,0,0]=3 4469 B15R1.8019 Cc1ccccc1C(=O)COCC(C)C 34a_100000210257_100000741374 [0,1,0,0,0,1|0,0,0]=2 4470 B15R1.8019 Cc1ccccc1C(=O)COCC(C)F 34a_100015925927_100000741374 [0,1,0,0,0,1|1,0,0]=3 4471 B15R1.8019 Cc1ccccc1C(=O)COCC(F)F 34a_100000743014_100000741374 [0,1,0,0,0,1|2,0,0]=4 4472 B15R1.8019 Cc1ccccc1C(=O)COC[C@@H](C)Cl 34a_100016084084_100000741374 [0,1,0,0,0,1|1,0,0]=3 4473 B15R1.8019 Cc1ccccc1C(=O)COC[C@@H](C)N 34a_100000737577_100000741374 [0,1,0,0,0,1|1,0,0]=3 4474 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)C 62a_100000210624_100000741374 [0,1,0,0,0,1|0,1,0]=3 4475 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)C 62a_100000741374_100000210760 [0,1,0,0,0,1|0,1,0]=3 4476 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100000741374_100011218427 [0,1,0,0,0,1|1,1,0]=4 4477 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100011218427_100000741374 [0,1,0,0,0,1|1,1,0]=4 4478 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000741374_100009817552 [0,1,0,0,0,1|1,1,0]=4 4479 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100009817552_100000741374 [0,1,0,0,0,1|1,1,0]=4 4480 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000212026 [0,1,0,0,0,1|1,0,0]=3 4481 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000212026 [0,1,0,0,0,1|1,0,0]=3 4482 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000212026 [0,1,0,0,0,1|1,0,0]=3 4483 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000212026 [0,1,0,0,0,1|1,0,0]=3 4484 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000212026 [0,1,0,0,0,1|2,0,0]=4 4485 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000212026 [0,1,0,0,0,1|2,0,0]=4 4486 B15R1.8019 Cc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000212026 [0,1,0,0,0,1|2,0,0]=4 4487 B15R1.8019 Cc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000212026 [0,1,0,0,0,1|2,0,0]=4 4488 B15R1.8019 Cc1ccccc1C(=O)NN=CC(C)C 4a_100000181371_100000210432 [0,1,0,0,0,1|1,0,1]=4 4489 B15R1.8019 Cc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000212026 [0,1,0,0,0,1|1,0,0]=3 4490 B15R1.8019 Cc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000212026 [0,1,0,0,0,1|2,0,0]=4 4491 B15R1.8019 Cc1ccccc1C(C)OCCC(C)C 34a_100000742021_100000210312 [0,1,0,0,0,1|1,0,1]=4 4492 B15R1.8019 Cc1ccccc1C(C)OCCC(C)C 7a_100000742021_100000210626 [0,1,0,0,0,1|1,0,1]=4 4493 B15R1.8019 Cc1ccccc1C(C)OCOC(C)C 34a_100000742021_100000709892 [0,1,0,0,0,1|1,0,1]=4 4494 B15R1.8019 O=C(COCC(F)F)c1ccccc1Br 34a_100000743014_100000199116 [0,1,0,0,0,1|2,0,0]=4 4495 B15R1.8019 O=C(COCC(F)F)c1ccccc1Cl 34a_100000743014_100000211432 [0,1,0,0,0,1|2,0,0]=4 4496 B15R1.8019 O=C(COCC(F)F)c1ccccc1F 34a_100000743014_100000204681 [0,1,0,0,0,1|2,0,0]=4 4497 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)Br 34a_100000210245_100000212080 [0,1,0,0,0,1|0,0,2]=4 4498 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)C 34a_100000210245_100000739480 [0,1,0,0,0,1|0,0,2]=4 4499 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)Cl 34a_100000210245_100000211444 [0,1,0,0,0,1|0,0,2]=4 4500 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)Cl 7a_200011592804_100000748629 [0,1,0,0,0,1|0,0,2]=4 4501 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)F 34a_100000210245_100000215616 [0,1,0,0,0,1|0,0,2]=4 4502 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)F 34a_100011592800_100000748629 [0,1,0,0,0,1|0,0,2]=4 4503 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)F 7a_100011592800_100000748629 [0,1,0,0,0,1|0,0,2]=4 4504 B15R1.8273 C=C(C)COCC(=O)c1cccc(c1)O 34a_100000210245_100009813753 [0,1,0,0,0,1|0,0,2]=4 4505 B15R1.8273 CC(=CCCC(=O)c1cccc(c1)Br)C 1458a_100000210664_100011217483 [0,1,0,0,0,1|1,0,1]=4 4506 B15R1.8273 CC(=CCCC(=O)c1cccc(c1)C)C 1458a_100000189346_100011217483 [0,1,0,0,0,1|1,0,1]=4 4507 B15R1.8273 CC(=CCCC(=O)c1cccc(c1)Cl)C 1458a_100000210390_100011217483 [0,1,0,0,0,1|1,0,1]=4 4508 B15R1.8273 CC(=CCCC(=O)c1cccc(c1)F)C 1458a_100000210950_100011217483 [0,1,0,0,0,1|1,0,1]=4 4509 B15R1.8273 CC(=CCCC(=O)c1cccc(c1)I)C 1458a_100000184098_100011217483 [0,1,0,0,0,1|1,0,1]=4 4510 B15R1.8273 CC(=CCCC(=O)c1cccc(c1)O)C 1458a_100000183914_100011217483 [0,1,0,0,0,1|1,0,1]=4 4511 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)Br)C 11a_100000718196_100000210664 [0,1,0,0,0,1|1,0,1]=4 4512 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)Br)C 1626a_100000718196_100000210664 [0,1,0,0,0,1|1,0,1]=4 4513 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)Br)C 527a_100000718196_100000210664 [0,1,0,0,0,1|1,0,1]=4 4514 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)C)C 11a_100000718196_100000189346 [0,1,0,0,0,1|1,0,1]=4 4515 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)C)C 1626a_100000718196_100000189346 [0,1,0,0,0,1|1,0,1]=4 4516 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)C)C 527a_100000718196_100000189346 [0,1,0,0,0,1|1,0,1]=4 4517 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)Cl)C 11a_100000718196_100000210390 [0,1,0,0,0,1|1,0,1]=4 4518 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)Cl)C 1626a_100000718196_100000210390 [0,1,0,0,0,1|1,0,1]=4 4519 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)Cl)C 527a_100000718196_100000210390 [0,1,0,0,0,1|1,0,1]=4 4520 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)F)C 11a_100000718196_100000210950 [0,1,0,0,0,1|1,0,1]=4 4521 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)F)C 1626a_100000718196_100000210950 [0,1,0,0,0,1|1,0,1]=4 4522 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)F)C 527a_100000718196_100000210950 [0,1,0,0,0,1|1,0,1]=4 4523 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)I)C 11a_100000718196_100000184098 [0,1,0,0,0,1|1,0,1]=4 4524 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)I)C 1626a_100000718196_100000184098 [0,1,0,0,0,1|1,0,1]=4 4525 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)I)C 527a_100000718196_100000184098 [0,1,0,0,0,1|1,0,1]=4 4526 B15R1.8273 CC(=CCNC(=O)c1cccc(c1)O)C 527a_100000718196_100000183914 [0,1,0,0,0,1|1,0,1]=4 4527 B15R1.8273 CC(=O)COCC(=O)c1cccc(c1)Br 34a_100000211253_100000212080 [0,1,0,0,0,1|1,0,1]=4 4528 B15R1.8273 CC(=O)COCC(=O)c1cccc(c1)C 34a_100000211253_100000739480 [0,1,0,0,0,1|1,0,1]=4 4529 B15R1.8273 CC(=O)COCC(=O)c1cccc(c1)Cl 34a_100000211253_100000211444 [0,1,0,0,0,1|1,0,1]=4 4530 B15R1.8273 CC(=O)COCC(=O)c1cccc(c1)F 34a_100000211253_100000215616 [0,1,0,0,0,1|1,0,1]=4 4531 B15R1.8273 CC(=O)COCC(=O)c1cccc(c1)O 34a_100000211253_100009813753 [0,1,0,0,0,1|1,0,1]=4 4532 B15R1.8273 CC(Br)COCC(=O)c1cccc(c1)Br 34a_100012180447_100000212080 [0,1,0,0,0,1|1,0,0]=3 4533 B15R1.8273 CC(Br)COCC(=O)c1cccc(c1)Cl 34a_100012180447_100000211444 [0,1,0,0,0,1|1,0,0]=3 4534 B15R1.8273 CC(Br)COCC(=O)c1cccc(c1)F 34a_100012180447_100000215616 [0,1,0,0,0,1|1,0,0]=3 4535 B15R1.8273 CC(Br)COCC(=O)c1cccc(c1)O 34a_100012180447_100009813753 [0,1,0,0,0,1|1,0,0]=3 4536 B15R1.8273 CC(C)C=NNC(=O)c1cccc(c1)Br 4a_100000189783_100000210432 [0,1,0,0,0,1|1,0,1]=4 4537 B15R1.8273 CC(C)C=NNC(=O)c1cccc(c1)Cl 4a_100000183659_100000210432 [0,1,0,0,0,1|1,0,1]=4 4538 B15R1.8273 CC(C)C=NNC(=O)c1cccc(c1)F 4a_100000189798_100000210432 [0,1,0,0,0,1|1,0,1]=4 4539 B15R1.8273 CC(C)C=NNC(=O)c1cccc(c1)I 4a_100000186306_100000210432 [0,1,0,0,0,1|1,0,1]=4 4540 B15R1.8273 CC(C)CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100011214892 [0,1,0,0,0,1|1,0,0]=3 4541 B15R1.8273 CC(C)CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011214892 [0,1,0,0,0,1|1,0,0]=3 4542 B15R1.8273 CC(C)CCCC(=O)c1cccc(c1)F 1458a_100000210950_100011214892 [0,1,0,0,0,1|1,0,0]=3 4543 B15R1.8273 CC(C)CCCC(=O)c1cccc(c1)I 1458a_100000184098_100011214892 [0,1,0,0,0,1|1,0,0]=3 4544 B15R1.8273 CC(C)CCCC(=O)c1cccc(c1)O 1458a_100000183914_100011214892 [0,1,0,0,0,1|1,0,0]=3 4545 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Br 11a_100000210545_100000210664 [0,1,0,0,0,1|1,0,0]=3 4546 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Br 1626a_100000210545_100000210664 [0,1,0,0,0,1|1,0,0]=3 4547 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Br 240690a_100000210545_100000210664 [0,1,0,0,0,1|1,0,0]=3 4548 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Br 527a_100000210545_100000210664 [0,1,0,0,0,1|1,0,0]=3 4549 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Cl 11a_100000210545_100000210390 [0,1,0,0,0,1|1,0,0]=3 4550 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Cl 1626a_100000210545_100000210390 [0,1,0,0,0,1|1,0,0]=3 4551 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Cl 240690a_100000210545_100000210390 [0,1,0,0,0,1|1,0,0]=3 4552 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)Cl 527a_100000210545_100000210390 [0,1,0,0,0,1|1,0,0]=3 4553 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)F 11a_100000210545_100000210950 [0,1,0,0,0,1|1,0,0]=3 4554 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)F 1626a_100000210545_100000210950 [0,1,0,0,0,1|1,0,0]=3 4555 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)F 240690a_100000210545_100000210950 [0,1,0,0,0,1|1,0,0]=3 4556 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)F 527a_100000210545_100000210950 [0,1,0,0,0,1|1,0,0]=3 4557 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)I 11a_100000210545_100000184098 [0,1,0,0,0,1|1,0,0]=3 4558 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)I 1626a_100000210545_100000184098 [0,1,0,0,0,1|1,0,0]=3 4559 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)I 240690a_100000210545_100000184098 [0,1,0,0,0,1|1,0,0]=3 4560 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)I 527a_100000210545_100000184098 [0,1,0,0,0,1|1,0,0]=3 4561 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)O 240690a_100000210545_100000183914 [0,1,0,0,0,1|1,0,0]=3 4562 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)O 527a_100000210545_100000183914 [0,1,0,0,0,1|1,0,0]=3 4563 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)Br 34a_100000246457_100000210312 [0,1,0,0,0,1|1,0,1]=4 4564 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)Br 7a_100000246457_100000210626 [0,1,0,0,0,1|1,0,1]=4 4565 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)F 34a_100000744526_100000210312 [0,1,0,0,0,1|1,0,1]=4 4566 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)F 7a_100000744526_100000210626 [0,1,0,0,0,1|1,0,1]=4 4567 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)I 34a_100013085317_100000210312 [0,1,0,0,0,1|1,0,1]=4 4568 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)I 7a_100013085317_100000210626 [0,1,0,0,0,1|1,0,1]=4 4569 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)N 34a_100011217120_100000210312 [0,1,0,0,0,1|1,0,1]=4 4570 B15R1.8273 CC(C)CCOC(C)c1cccc(c1)N 7a_100011217120_100000210626 [0,1,0,0,0,1|1,0,1]=4 4571 B15R1.8273 CC(C)CCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210312 [0,1,0,0,0,1|1,0,1]=4 4572 B15R1.8273 CC(C)CCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210626 [0,1,0,0,0,1|1,0,1]=4 4573 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)Br 2230a_100000210953_100000212080 [0,1,0,0,0,1|1,0,0]=3 4574 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)Br 34a_100000210953_100000212080 [0,1,0,0,0,1|1,0,0]=3 4575 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)Cl 2230a_100000210953_100000211444 [0,1,0,0,0,1|1,0,0]=3 4576 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)Cl 34a_100000210953_100000211444 [0,1,0,0,0,1|1,0,0]=3 4577 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)F 2230a_100000210953_100000215616 [0,1,0,0,0,1|1,0,0]=3 4578 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)F 34a_100000210953_100000215616 [0,1,0,0,0,1|1,0,0]=3 4579 B15R1.8273 CC(C)CNCC(=O)c1cccc(c1)O 34a_100000210953_100009813753 [0,1,0,0,0,1|1,0,0]=3 4580 B15R1.8273 CC(C)CNNC(=O)c1cccc(c1)Br 22a_100000696102_100000210664 [0,1,0,0,0,1|1,0,0]=3 4581 B15R1.8273 CC(C)CNNC(=O)c1cccc(c1)Cl 22a_100000696102_100000210390 [0,1,0,0,0,1|1,0,0]=3 4582 B15R1.8273 CC(C)CNNC(=O)c1cccc(c1)F 22a_100000696102_100000210950 [0,1,0,0,0,1|1,0,0]=3 4583 B15R1.8273 CC(C)CNNC(=O)c1cccc(c1)I 22a_100000696102_100000184098 [0,1,0,0,0,1|1,0,0]=3 4584 B15R1.8273 CC(C)CNNC(=O)c1cccc(c1)O 22a_100000696102_100000183914 [0,1,0,0,0,1|1,0,0]=3 4585 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)Br 34a_100000210257_100000212080 [0,1,0,0,0,1|0,0,0]=2 4586 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)Cl 34a_100000210257_100000211444 [0,1,0,0,0,1|0,0,0]=2 4587 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)Cl 7a_200011592804_100000210760 [0,1,0,0,0,1|0,0,0]=2 4588 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)F 34a_100000210257_100000215616 [0,1,0,0,0,1|0,0,0]=2 4589 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)F 34a_100011592800_100000210624 [0,1,0,0,0,1|0,0,0]=2 4590 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)F 7a_100011592800_100000210760 [0,1,0,0,0,1|0,0,0]=2 4591 B15R1.8273 CC(C)COCC(=O)c1cccc(c1)O 34a_100000210257_100009813753 [0,1,0,0,0,1|0,0,0]=2 4592 B15R1.8273 CC(C)COCC(N)c1cccc(c1)Br 34a_100000690078_100000210624 [0,1,0,0,0,1|1,0,1]=4 4593 B15R1.8273 CC(C)COC[C@@H](N)c1cccc(c1)F 34a_100020641251_100000210624 [0,1,0,0,0,1|1,0,1]=4 4594 B15R1.8273 CC(C)COC[C@H](N)c1cccc(c1)Cl 34a_100032004910_100000210624 [0,1,0,0,0,1|1,0,1]=4 4595 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)Br 62a_100000210624_100000212080 [0,1,0,0,0,1|0,1,0]=3 4596 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)Br 62a_100000212080_100000210760 [0,1,0,0,0,1|0,1,0]=3 4597 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)Cl 62a_100000210624_100000211444 [0,1,0,0,0,1|0,1,0]=3 4598 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)Cl 62a_100000211444_100000210760 [0,1,0,0,0,1|0,1,0]=3 4599 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)F 62a_100000210624_100000215616 [0,1,0,0,0,1|0,1,0]=3 4600 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)F 62a_100000215616_100000210760 [0,1,0,0,0,1|0,1,0]=3 4601 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)O 62a_100000210624_100009813753 [0,1,0,0,0,1|0,1,0]=3 4602 B15R1.8273 CC(C)CSCC(=O)c1cccc(c1)O 62a_100009813753_100000210760 [0,1,0,0,0,1|0,1,0]=3 4603 B15R1.8273 CC(C)CSCC(=O)c1ccnc(c1)Cl 62a_100000210624_100009817076 [0,1,0,0,0,1|1,1,0]=4 4604 B15R1.8273 CC(C)CSCC(=O)c1ccnc(c1)Cl 62a_100009817076_100000210760 [0,1,0,0,0,1|1,1,0]=4 4605 B15R1.8273 CC(C)OCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000211751 [0,1,0,0,0,1|1,0,0]=3 4606 B15R1.8273 CC(C)OCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000211751 [0,1,0,0,0,1|1,0,0]=3 4607 B15R1.8273 CC(C)OCCC(=O)c1cccc(c1)F 1458a_100000210950_100000211751 [0,1,0,0,0,1|1,0,0]=3 4608 B15R1.8273 CC(C)OCCC(=O)c1cccc(c1)I 1458a_100000184098_100000211751 [0,1,0,0,0,1|1,0,0]=3 4609 B15R1.8273 CC(C)OCCC(=O)c1cccc(c1)O 1458a_100000183914_100000211751 [0,1,0,0,0,1|1,0,0]=3 4610 B15R1.8273 CC(C)OCOC(C)c1cccc(c1)Br 34a_100000246457_100000709892 [0,1,0,0,0,1|1,0,1]=4 4611 B15R1.8273 CC(C)OCOC(C)c1cccc(c1)F 34a_100000744526_100000709892 [0,1,0,0,0,1|1,0,1]=4 4612 B15R1.8273 CC(C)OCOC(C)c1cccc(c1)I 34a_100013085317_100000709892 [0,1,0,0,0,1|1,0,1]=4 4613 B15R1.8273 CC(C)OCOC(C)c1cccc(c1)N 34a_100011217120_100000709892 [0,1,0,0,0,1|1,0,1]=4 4614 B15R1.8273 CC(C)OCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000709892 [0,1,0,0,0,1|1,0,1]=4 4615 B15R1.8273 CC(C)SCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000730970 [0,1,0,0,0,1|1,0,0]=3 4616 B15R1.8273 CC(C)SCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000730970 [0,1,0,0,0,1|1,0,0]=3 4617 B15R1.8273 CC(C)SCCC(=O)c1cccc(c1)F 1458a_100000210950_100000730970 [0,1,0,0,0,1|1,0,0]=3 4618 B15R1.8273 CC(C)SCCC(=O)c1cccc(c1)I 1458a_100000184098_100000730970 [0,1,0,0,0,1|1,0,0]=3 4619 B15R1.8273 CC(C)SCCC(=O)c1cccc(c1)O 1458a_100000183914_100000730970 [0,1,0,0,0,1|1,0,0]=3 4620 B15R1.8273 CC(F)COCC(=O)c1cccc(c1)Br 34a_100015925927_100000212080 [0,1,0,0,0,1|1,0,0]=3 4621 B15R1.8273 CC(F)COCC(=O)c1cccc(c1)Cl 34a_100015925927_100000211444 [0,1,0,0,0,1|1,0,0]=3 4622 B15R1.8273 CC(F)COCC(=O)c1cccc(c1)F 34a_100015925927_100000215616 [0,1,0,0,0,1|1,0,0]=3 4623 B15R1.8273 CC(F)COCC(=O)c1cccc(c1)O 34a_100015925927_100009813753 [0,1,0,0,0,1|1,0,0]=3 4624 B15R1.8273 CC(O)CCCC(=O)c1cccc(c1)Br 1458a_100000210664_200000718107 [0,1,0,0,0,1|2,0,0]=4 4625 B15R1.8273 CC(O)CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_200000718107 [0,1,0,0,0,1|2,0,0]=4 4626 B15R1.8273 CC(O)CCCC(=O)c1cccc(c1)F 1458a_100000210950_200000718107 [0,1,0,0,0,1|2,0,0]=4 4627 B15R1.8273 CC(O)CCCC(=O)c1cccc(c1)I 1458a_100000184098_200000718107 [0,1,0,0,0,1|2,0,0]=4 4628 B15R1.8273 CC(O)CCCC(=O)c1cccc(c1)O 1458a_100000183914_200000718107 [0,1,0,0,0,1|2,0,0]=4 4629 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)Br 240690a_200000755665_100000210664 [0,1,0,0,0,1|2,0,0]=4 4630 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)Br 527a_200000755665_100000210664 [0,1,0,0,0,1|2,0,0]=4 4631 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)Cl 240690a_200000755665_100000210390 [0,1,0,0,0,1|2,0,0]=4 4632 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)Cl 527a_200000755665_100000210390 [0,1,0,0,0,1|2,0,0]=4 4633 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)F 240690a_200000755665_100000210950 [0,1,0,0,0,1|2,0,0]=4 4634 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)F 527a_200000755665_100000210950 [0,1,0,0,0,1|2,0,0]=4 4635 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)I 240690a_200000755665_100000184098 [0,1,0,0,0,1|2,0,0]=4 4636 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)I 527a_200000755665_100000184098 [0,1,0,0,0,1|2,0,0]=4 4637 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)O 240690a_200000755665_100000183914 [0,1,0,0,0,1|2,0,0]=4 4638 B15R1.8273 CC(O)CCNC(=O)c1cccc(c1)O 527a_200000755665_100000183914 [0,1,0,0,0,1|2,0,0]=4 4639 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)Br 2230a_100000210904_100000212080 [0,1,0,0,0,1|2,0,0]=4 4640 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)Br 34a_100000210904_100000212080 [0,1,0,0,0,1|2,0,0]=4 4641 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)Cl 2230a_100000210904_100000211444 [0,1,0,0,0,1|2,0,0]=4 4642 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)Cl 34a_100000210904_100000211444 [0,1,0,0,0,1|2,0,0]=4 4643 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)F 2230a_100000210904_100000215616 [0,1,0,0,0,1|2,0,0]=4 4644 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)F 34a_100000210904_100000215616 [0,1,0,0,0,1|2,0,0]=4 4645 B15R1.8273 CC(O)CNCC(=O)c1cccc(c1)O 34a_100000210904_100009813753 [0,1,0,0,0,1|2,0,0]=4 4646 B15R1.8273 CC(O)CNNC(=O)c1cccc(c1)Br 22a_200000730056_100000210664 [0,1,0,0,0,1|2,0,0]=4 4647 B15R1.8273 CC(O)CNNC(=O)c1cccc(c1)Cl 22a_200000730056_100000210390 [0,1,0,0,0,1|2,0,0]=4 4648 B15R1.8273 CC(O)CNNC(=O)c1cccc(c1)F 22a_200000730056_100000210950 [0,1,0,0,0,1|2,0,0]=4 4649 B15R1.8273 CC(O)CNNC(=O)c1cccc(c1)I 22a_200000730056_100000184098 [0,1,0,0,0,1|2,0,0]=4 4650 B15R1.8273 CC(O)CNNC(=O)c1cccc(c1)O 22a_200000730056_100000183914 [0,1,0,0,0,1|2,0,0]=4 4651 B15R1.8273 CC(O)COCC(=O)c1cccc(c1)Cl 7a_200011592804_100011218427 [0,1,0,0,0,1|1,0,0]=3 4652 B15R1.8273 CC(O)COCC(=O)c1cccc(c1)F 34a_100011592800_100011218427 [0,1,0,0,0,1|1,0,0]=3 4653 B15R1.8273 CC(O)COCC(=O)c1cccc(c1)F 7a_100011592800_100011218427 [0,1,0,0,0,1|1,0,0]=3 4654 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)Br 62a_100000212080_100011218427 [0,1,0,0,0,1|1,1,0]=4 4655 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)Br 62a_100011218427_100000212080 [0,1,0,0,0,1|1,1,0]=4 4656 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)Cl 62a_100000211444_100011218427 [0,1,0,0,0,1|1,1,0]=4 4657 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)Cl 62a_100011218427_100000211444 [0,1,0,0,0,1|1,1,0]=4 4658 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)F 62a_100000215616_100011218427 [0,1,0,0,0,1|1,1,0]=4 4659 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)F 62a_100011218427_100000215616 [0,1,0,0,0,1|1,1,0]=4 4660 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)O 62a_100009813753_100011218427 [0,1,0,0,0,1|1,1,0]=4 4661 B15R1.8273 CC(O)CSCC(=O)c1cccc(c1)O 62a_100011218427_100009813753 [0,1,0,0,0,1|1,1,0]=4 4662 B15R1.8273 CN(C)CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000695564 [0,1,0,0,0,1|2,0,0]=4 4663 B15R1.8273 CN(C)CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000695564 [0,1,0,0,0,1|2,0,0]=4 4664 B15R1.8273 CN(C)CCCC(=O)c1cccc(c1)F 1458a_100000210950_100000695564 [0,1,0,0,0,1|2,0,0]=4 4665 B15R1.8273 CN(C)CCCC(=O)c1cccc(c1)I 1458a_100000184098_100000695564 [0,1,0,0,0,1|2,0,0]=4 4666 B15R1.8273 CN(C)CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000695564 [0,1,0,0,0,1|2,0,0]=4 4667 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)Br 240690a_100000210585_100000210664 [0,1,0,0,0,1|2,0,0]=4 4668 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)Br 527a_100000210585_100000210664 [0,1,0,0,0,1|2,0,0]=4 4669 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)Cl 240690a_100000210585_100000210390 [0,1,0,0,0,1|2,0,0]=4 4670 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)Cl 527a_100000210585_100000210390 [0,1,0,0,0,1|2,0,0]=4 4671 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)F 240690a_100000210585_100000210950 [0,1,0,0,0,1|2,0,0]=4 4672 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)F 527a_100000210585_100000210950 [0,1,0,0,0,1|2,0,0]=4 4673 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)I 240690a_100000210585_100000184098 [0,1,0,0,0,1|2,0,0]=4 4674 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)I 527a_100000210585_100000184098 [0,1,0,0,0,1|2,0,0]=4 4675 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)O 240690a_100000210585_100000183914 [0,1,0,0,0,1|2,0,0]=4 4676 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)O 527a_100000210585_100000183914 [0,1,0,0,0,1|2,0,0]=4 4677 B15R1.8273 C[C@@H](Cl)COCC(=O)c1cccc(c1)Br 34a_100016084084_100000212080 [0,1,0,0,0,1|1,0,0]=3 4678 B15R1.8273 C[C@@H](Cl)COCC(=O)c1cccc(c1)Cl 34a_100016084084_100000211444 [0,1,0,0,0,1|1,0,0]=3 4679 B15R1.8273 C[C@@H](Cl)COCC(=O)c1cccc(c1)F 34a_100016084084_100000215616 [0,1,0,0,0,1|1,0,0]=3 4680 B15R1.8273 C[C@@H](Cl)COCC(=O)c1cccc(c1)O 34a_100016084084_100009813753 [0,1,0,0,0,1|1,0,0]=3 4681 B15R1.8273 C[C@@H](N)COCC(=O)c1cccc(c1)Br 34a_100000737577_100000212080 [0,1,0,0,0,1|1,0,0]=3 4682 B15R1.8273 C[C@@H](N)COCC(=O)c1cccc(c1)Cl 34a_100000737577_100000211444 [0,1,0,0,0,1|1,0,0]=3 4683 B15R1.8273 C[C@@H](N)COCC(=O)c1cccc(c1)F 34a_100000737577_100000215616 [0,1,0,0,0,1|1,0,0]=3 4684 B15R1.8273 C[C@@H](N)COCC(=O)c1cccc(c1)O 34a_100000737577_100009813753 [0,1,0,0,0,1|1,0,0]=3 4685 B15R1.8273 C[C@@H](O)COCC(=O)c1cccc(c1)Cl 7a_200011592804_100009817552 [0,1,0,0,0,1|1,0,0]=3 4686 B15R1.8273 C[C@@H](O)COCC(=O)c1cccc(c1)F 34a_100011592800_100009817552 [0,1,0,0,0,1|1,0,0]=3 4687 B15R1.8273 C[C@@H](O)COCC(=O)c1cccc(c1)F 7a_100011592800_100009817552 [0,1,0,0,0,1|1,0,0]=3 4688 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)Br 62a_100000212080_100009817552 [0,1,0,0,0,1|1,1,0]=4 4689 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)Br 62a_100009817552_100000212080 [0,1,0,0,0,1|1,1,0]=4 4690 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)Cl 62a_100000211444_100009817552 [0,1,0,0,0,1|1,1,0]=4 4691 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)Cl 62a_100009817552_100000211444 [0,1,0,0,0,1|1,1,0]=4 4692 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)F 62a_100000215616_100009817552 [0,1,0,0,0,1|1,1,0]=4 4693 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)F 62a_100009817552_100000215616 [0,1,0,0,0,1|1,1,0]=4 4694 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)O 62a_100009813753_100009817552 [0,1,0,0,0,1|1,1,0]=4 4695 B15R1.8273 C[C@@H](O)CSCC(=O)c1cccc(c1)O 62a_100009817552_100009813753 [0,1,0,0,0,1|1,1,0]=4 4696 B15R1.8273 Cc1cccc(c1)C(=O)CCCC(C)C 1458a_100000189346_100011214892 [0,1,0,0,0,1|1,0,0]=3 4697 B15R1.8273 Cc1cccc(c1)C(=O)CCCC(C)O 1458a_100000189346_200000718107 [0,1,0,0,0,1|2,0,0]=4 4698 B15R1.8273 Cc1cccc(c1)C(=O)CCCN(C)C 1458a_100000189346_100000695564 [0,1,0,0,0,1|2,0,0]=4 4699 B15R1.8273 Cc1cccc(c1)C(=O)CCOC(C)C 1458a_100000189346_100000211751 [0,1,0,0,0,1|1,0,0]=3 4700 B15R1.8273 Cc1cccc(c1)C(=O)CCSC(C)C 1458a_100000189346_100000730970 [0,1,0,0,0,1|1,0,0]=3 4701 B15R1.8273 Cc1cccc(c1)C(=O)CNCC(C)C 2230a_100000210953_100000739480 [0,1,0,0,0,1|1,0,0]=3 4702 B15R1.8273 Cc1cccc(c1)C(=O)CNCC(C)C 34a_100000210953_100000739480 [0,1,0,0,0,1|1,0,0]=3 4703 B15R1.8273 Cc1cccc(c1)C(=O)CNCC(C)O 2230a_100000210904_100000739480 [0,1,0,0,0,1|2,0,0]=4 4704 B15R1.8273 Cc1cccc(c1)C(=O)CNCC(C)O 34a_100000210904_100000739480 [0,1,0,0,0,1|2,0,0]=4 4705 B15R1.8273 Cc1cccc(c1)C(=O)COCC(C)Br 34a_100012180447_100000739480 [0,1,0,0,0,1|1,0,0]=3 4706 B15R1.8273 Cc1cccc(c1)C(=O)COCC(C)C 34a_100000210257_100000739480 [0,1,0,0,0,1|0,0,0]=2 4707 B15R1.8273 Cc1cccc(c1)C(=O)COCC(C)F 34a_100015925927_100000739480 [0,1,0,0,0,1|1,0,0]=3 4708 B15R1.8273 Cc1cccc(c1)C(=O)COCC(F)F 34a_100000743014_100000739480 [0,1,0,0,0,1|2,0,0]=4 4709 B15R1.8273 Cc1cccc(c1)C(=O)COC[C@@H](C)Cl 34a_100016084084_100000739480 [0,1,0,0,0,1|1,0,0]=3 4710 B15R1.8273 Cc1cccc(c1)C(=O)COC[C@@H](C)N 34a_100000737577_100000739480 [0,1,0,0,0,1|1,0,0]=3 4711 B15R1.8273 Cc1cccc(c1)C(=O)CSCC(C)C 62a_100000210624_100000739480 [0,1,0,0,0,1|0,1,0]=3 4712 B15R1.8273 Cc1cccc(c1)C(=O)CSCC(C)C 62a_100000739480_100000210760 [0,1,0,0,0,1|0,1,0]=3 4713 B15R1.8273 Cc1cccc(c1)C(=O)CSCC(C)O 62a_100000739480_100011218427 [0,1,0,0,0,1|1,1,0]=4 4714 B15R1.8273 Cc1cccc(c1)C(=O)CSCC(C)O 62a_100011218427_100000739480 [0,1,0,0,0,1|1,1,0]=4 4715 B15R1.8273 Cc1cccc(c1)C(=O)CSC[C@@H](C)O 62a_100000739480_100009817552 [0,1,0,0,0,1|1,1,0]=4 4716 B15R1.8273 Cc1cccc(c1)C(=O)CSC[C@@H](C)O 62a_100009817552_100000739480 [0,1,0,0,0,1|1,1,0]=4 4717 B15R1.8273 Cc1cccc(c1)C(=O)NCCC(C)C 11a_100000210545_100000189346 [0,1,0,0,0,1|1,0,0]=3 4718 B15R1.8273 Cc1cccc(c1)C(=O)NCCC(C)C 1626a_100000210545_100000189346 [0,1,0,0,0,1|1,0,0]=3 4719 B15R1.8273 Cc1cccc(c1)C(=O)NCCC(C)C 240690a_100000210545_100000189346 [0,1,0,0,0,1|1,0,0]=3 4720 B15R1.8273 Cc1cccc(c1)C(=O)NCCC(C)C 527a_100000210545_100000189346 [0,1,0,0,0,1|1,0,0]=3 4721 B15R1.8273 Cc1cccc(c1)C(=O)NCCC(C)O 240690a_200000755665_100000189346 [0,1,0,0,0,1|2,0,0]=4 4722 B15R1.8273 Cc1cccc(c1)C(=O)NCCC(C)O 527a_200000755665_100000189346 [0,1,0,0,0,1|2,0,0]=4 4723 B15R1.8273 Cc1cccc(c1)C(=O)NCCN(C)C 240690a_100000210585_100000189346 [0,1,0,0,0,1|2,0,0]=4 4724 B15R1.8273 Cc1cccc(c1)C(=O)NCCN(C)C 527a_100000210585_100000189346 [0,1,0,0,0,1|2,0,0]=4 4725 B15R1.8273 Cc1cccc(c1)C(=O)NN=CC(C)C 4a_100000189845_100000210432 [0,1,0,0,0,1|1,0,1]=4 4726 B15R1.8273 Cc1cccc(c1)C(=O)NNCC(C)C 22a_100000696102_100000189346 [0,1,0,0,0,1|1,0,0]=3 4727 B15R1.8273 Cc1cccc(c1)C(=O)NNCC(C)O 22a_200000730056_100000189346 [0,1,0,0,0,1|2,0,0]=4 4728 B15R1.8273 Cc1cccc(c1)C(C)OCCC(C)C 34a_100000757818_100000210312 [0,1,0,0,0,1|1,0,1]=4 4729 B15R1.8273 Cc1cccc(c1)C(C)OCCC(C)C 7a_100000757818_100000210626 [0,1,0,0,0,1|1,0,1]=4 4730 B15R1.8273 Cc1cccc(c1)C(C)OCOC(C)C 34a_100000757818_100000709892 [0,1,0,0,0,1|1,0,1]=4 4731 B15R1.8273 Cc1cccc(c1)[C@H](N)COCC(C)C 34a_100009818812_100000210624 [0,1,0,0,0,1|1,0,1]=4 4732 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)Br 34a_100000743014_100000212080 [0,1,0,0,0,1|2,0,0]=4 4733 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)Cl 34a_100000743014_100000211444 [0,1,0,0,0,1|2,0,0]=4 4734 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)Cl 7a_200011592804_100011934356 [0,1,0,0,0,1|2,0,0]=4 4735 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)F 34a_100000743014_100000215616 [0,1,0,0,0,1|2,0,0]=4 4736 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)F 34a_100011592800_100011934356 [0,1,0,0,0,1|2,0,0]=4 4737 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)F 7a_100011592800_100011934356 [0,1,0,0,0,1|2,0,0]=4 4738 B15R1.8273 O=C(COCC(F)F)c1cccc(c1)O 34a_100000743014_100009813753 [0,1,0,0,0,1|2,0,0]=4 4739 B15R1.9094 CC(C)(C)CCNC(=O)c1ccccc1 11a_100000738805_100000185807 [0,1,0,0,0,1|1,0,0]=3 4740 B15R1.9094 CC(C)(C)CCNC(=O)c1ccccc1 1626a_100000738805_100000185807 [0,1,0,0,0,1|1,0,0]=3 4741 B15R1.9094 CC(C)(C)CCNC(=O)c1ccccc1 240690a_100000738805_100000185807 [0,1,0,0,0,1|1,0,0]=3 4742 B15R1.9094 CC(C)(C)CCNC(=O)c1ccccc1 527a_100000738805_100000185807 [0,1,0,0,0,1|1,0,0]=3 4743 B15R1.9094 CC(C)(C)COC[C@@H](N)c1ccccc1 34a_100000751927_100011219605 [0,1,0,0,0,1|1,0,1]=4 4744 B15R1.9094 CC(C)(C)CSCC(=O)c1ccccc1 62a_100000211460_100011219605 [0,1,0,0,0,1|0,1,0]=3 4745 B15R1.9094 CC(C)(C)CSCC(=O)c1ccccc1 62a_100011219605_100000211460 [0,1,0,0,0,1|0,1,0]=3 4746 B15R1.9094 CC(C)(C)CSCC(=O)c1ccccn1 62a_100000027445_100011219605 [0,1,0,0,0,1|1,1,0]=4 4747 B15R1.9094 CC(C)(C)CSCC(=O)c1ccccn1 62a_100011219605_100000027445 [0,1,0,0,0,1|1,1,0]=4 4748 B15R1.9094 CC(C)(C)CSCC(=O)c1cccnc1 62a_100000757877_100011219605 [0,1,0,0,0,1|1,1,0]=4 4749 B15R1.9094 CC(C)(C)CSCC(=O)c1cccnc1 62a_100011219605_100000757877 [0,1,0,0,0,1|1,1,0]=4 4750 B15R1.9094 CC(C)(C)CSCC(=O)c1ccncc1 62a_100000027454_100011219605 [0,1,0,0,0,1|1,1,0]=4 4751 B15R1.9094 CC(C)(C)CSCC(=O)c1ccncc1 62a_100011219605_100000027454 [0,1,0,0,0,1|1,1,0]=4 4752 B15R1.9094 CC(C)(C)CSCS(=O)c1ccccc1 62a_100011219605_100000031784 [0,1,0,0,0,1|1,1,0]=4 4753 B15R1.9094 CC(C)(C)NCCC(=O)c1ccccc1 2230a_100000715429_100000750707 [0,1,0,0,0,1|1,0,0]=3 4754 B15R1.9094 CC(C)(C)NCCS(=O)c1ccccc1 2230a_100000715429_100000740319 [0,1,0,0,0,1|2,0,0]=4 4755 B15R1.9094 CC(C)(C)OCCC(=O)c1ccccc1 7a_100015890283_100000750707 [0,1,0,0,0,1|1,0,0]=3 4756 B15R1.9094 CC(C)(C)OCCS(=O)c1ccccc1 7a_100015890283_100000740319 [0,1,0,0,0,1|2,0,0]=4 4757 B15R1.9094 CC(C)(C)OCOC(=O)c1ccccc1 7a_100015890283_100000073877 [0,1,0,0,0,1|0,0,0]=2 4758 B15R1.9094 CC(C)(C)SCCC(=O)c1ccccc1 62a_100000211941_100000750707 [0,1,0,0,0,1|1,0,0]=3 4759 B15R1.9094 CC(C)(C)SCCC(=O)c1ccccc1 62a_100000750707_100000211941 [0,1,0,0,0,1|1,0,0]=3 4760 B15R1.9094 CC(C)(C)SCCS(=O)c1ccccc1 62a_100000211941_100000740319 [0,1,0,0,0,1|2,0,0]=4 4761 B15R1.9094 CC(C)(C)SCOC(=O)c1ccccc1 62a_100000073877_100000211941 [0,1,0,0,0,1|0,0,0]=2 4762 B15R1.9094 CC(C)(C)SCOC(=O)c1ccccc1 62a_100000211941_100000073877 [0,1,0,0,0,1|0,0,0]=2 4763 B15R1.9094 CC(C)(F)CCNC(=O)c1ccccc1 11a_100016253952_100000185807 [0,1,0,0,0,1|1,0,0]=3 4764 B15R1.9094 CC(C)(F)CCNC(=O)c1ccccc1 1626a_100016253952_100000185807 [0,1,0,0,0,1|1,0,0]=3 4765 B15R1.9094 CC(C)(F)CCNC(=O)c1ccccc1 240690a_100016253952_100000185807 [0,1,0,0,0,1|1,0,0]=3 4766 B15R1.9094 CC(C)(F)CCNC(=O)c1ccccc1 527a_100016253952_100000185807 [0,1,0,0,0,1|1,0,0]=3 4767 B15R1.9094 CC(C)(F)COCC(=O)c1ccccn1 34a_100000716592_100000027445 [0,1,0,0,0,1|1,0,0]=3 4768 B15R1.9094 CC(C)(F)COCC(O)c1ccccc1 34a_100000716592_100000185958 [0,1,0,0,0,1|0,0,2]=4 4769 B15R1.9094 CC(C)(F)COC[C@@H](N)c1ccccc1 34a_100000751927_100011997219 [0,1,0,0,0,1|1,0,1]=4 4770 B15R1.9094 CC(C)(F)COC[C@@H](O)c1ccccc1 34a_100000716592_100011933945 [0,1,0,0,0,1|0,0,2]=4 4771 B15R1.9094 CC(C)(F)CSCC(=O)c1ccccc1 62a_100000211460_100011997219 [0,1,0,0,0,1|0,1,0]=3 4772 B15R1.9094 CC(C)(F)CSCC(=O)c1ccccc1 62a_100011997219_100000211460 [0,1,0,0,0,1|0,1,0]=3 4773 B15R1.9094 CC(C)(F)CSCC(=O)c1ccccn1 62a_100000027445_100011997219 [0,1,0,0,0,1|1,1,0]=4 4774 B15R1.9094 CC(C)(F)CSCC(=O)c1ccccn1 62a_100011997219_100000027445 [0,1,0,0,0,1|1,1,0]=4 4775 B15R1.9094 CC(C)(F)CSCC(=O)c1cccnc1 62a_100000757877_100011997219 [0,1,0,0,0,1|1,1,0]=4 4776 B15R1.9094 CC(C)(F)CSCC(=O)c1cccnc1 62a_100011997219_100000757877 [0,1,0,0,0,1|1,1,0]=4 4777 B15R1.9094 CC(C)(F)CSCC(=O)c1ccncc1 62a_100000027454_100011997219 [0,1,0,0,0,1|1,1,0]=4 4778 B15R1.9094 CC(C)(F)CSCC(=O)c1ccncc1 62a_100011997219_100000027454 [0,1,0,0,0,1|1,1,0]=4 4779 B15R1.9094 CC(C)(F)CSCS(=O)c1ccccc1 62a_100011997219_100000031784 [0,1,0,0,0,1|1,1,0]=4 4780 B15R1.9094 CC(C)(O)CCNC(=O)c1ccccc1 1626a_100000707701_100000185807 [0,1,0,0,0,1|1,0,0]=3 4781 B15R1.9094 CC(C)(O)CCNC(=O)c1ccccc1 527a_100000707701_100000185807 [0,1,0,0,0,1|1,0,0]=3 4782 B15R1.9094 CC(C)(O)COC[C@@H](N)c1ccccc1 34a_100000751927_100000764493 [0,1,0,0,0,1|1,0,1]=4 4783 B15R1.9094 CC(C)(O)CSCC(=O)c1ccccc1 62a_100000211460_100000764493 [0,1,0,0,0,1|0,1,0]=3 4784 B15R1.9094 CC(C)(O)CSCC(=O)c1ccccc1 62a_100000764493_100000211460 [0,1,0,0,0,1|0,1,0]=3 4785 B15R1.9094 CC(C)(O)CSCC(=O)c1ccccn1 62a_100000027445_100000764493 [0,1,0,0,0,1|1,1,0]=4 4786 B15R1.9094 CC(C)(O)CSCC(=O)c1ccccn1 62a_100000764493_100000027445 [0,1,0,0,0,1|1,1,0]=4 4787 B15R1.9094 CC(C)(O)CSCC(=O)c1cccnc1 62a_100000757877_100000764493 [0,1,0,0,0,1|1,1,0]=4 4788 B15R1.9094 CC(C)(O)CSCC(=O)c1cccnc1 62a_100000764493_100000757877 [0,1,0,0,0,1|1,1,0]=4 4789 B15R1.9094 CC(C)(O)CSCC(=O)c1ccncc1 62a_100000027454_100000764493 [0,1,0,0,0,1|1,1,0]=4 4790 B15R1.9094 CC(C)(O)CSCC(=O)c1ccncc1 62a_100000764493_100000027454 [0,1,0,0,0,1|1,1,0]=4 4791 B15R1.9094 CC(C)(O)CSCS(=O)c1ccccc1 62a_100000764493_100000031784 [0,1,0,0,0,1|1,1,0]=4 4792 B15R1.9094 CC(COCC(C)(C)C)c1ccccc1 34a_100011215166_100011219605 [0,1,0,0,0,1|1,0,1]=4 4793 B15R1.9094 CC(COCC(C)(C)F)c1ccccc1 34a_100000716592_100000756946 [0,1,0,0,0,1|1,0,1]=4 4794 B15R1.9094 CC(COCC(C)(C)F)c1ccccc1 34a_100011215166_100011997219 [0,1,0,0,0,1|1,0,1]=4 4795 B15R1.9094 CC(COCC(C)(C)O)c1ccccc1 34a_100011215166_100000764493 [0,1,0,0,0,1|1,0,1]=4 4796 B15R1.9094 CC(COCC(C)(C)O)c1ccccc1 7a_100011215166_100000764493 [0,1,0,0,0,1|1,0,1]=4 4797 B15R1.9094 CC(F)(F)COCC(=O)c1ccccn1 34a_100000068830_100000027445 [0,1,0,0,0,1|2,0,0]=4 4798 B15R1.9094 CC(OCCC(C)(C)C)c1ccccc1 7a_100000765024_100000230085 [0,1,0,0,0,1|1,0,1]=4 4799 B15R1.9094 C[C@@H](OCCC(C)(C)C)c1ccccc1 34a_100000761318_100000755188 [0,1,0,0,0,1|1,0,1]=4 4800 B15R1.9094 C[C@@H](OCCC(C)(C)C)c1ccccc1 7a_100000761318_100000755188 [0,1,0,0,0,1|1,0,1]=4 4801 B15R1.9094 C[C@@H](OCCC(C)(C)O)c1ccccc1 34a_100000761318_100000702414 [0,1,0,0,0,1|1,0,1]=4 4802 B15R1.9094 C[C@@H](OCCC(C)(C)O)c1ccccc1 7a_100000761318_100000702414 [0,1,0,0,0,1|1,0,1]=4 4803 B15R1.9094 C[N+](C)(C)CCCC(=O)c1ccccc1 1458a_100000185807_100016990835 [0,1,0,0,0,1|2,0,0]=4 4804 B15R1.9094 C[N+](C)(C)CCNC(=O)c1ccccc1 1626a_100000106457_100000185807 [0,1,0,0,0,1|2,0,0]=4 4805 B15R1.9094 C[N+](C)(C)CCNC(=O)c1ccccc1 240690a_100000106457_100000185807 [0,1,0,0,0,1|2,0,0]=4 4806 B15R1.9094 C[N+](C)(C)CCNC(=O)c1ccccc1 527a_100000106457_100000185807 [0,1,0,0,0,1|2,0,0]=4 4807 B15R1.9094 C[N+](C)(C)CSCC(=O)c1ccccc1 62a_100000211460_200000036245 [0,1,0,0,0,1|1,1,0]=4 4808 B15R1.9094 C[N+](C)(C)CSCC(=O)c1ccccc1 62a_200000036245_100000211460 [0,1,0,0,0,1|1,1,0]=4 4809 B15R1.9094 C[Si](C)(C)CCCC(=O)c1ccccc1 1458a_100000185807_100011219597 [0,1,0,0,0,1|1,1,0]=4 4810 B15R1.9094 C[Si](C)(C)CSCC(=O)c1ccccc1 62a_100000037933_100000211460 [0,1,0,0,0,1|0,2,0]=4 4811 B15R1.9094 C[Si](C)(C)CSCC(=O)c1ccccc1 62a_100000211460_100000037933 [0,1,0,0,0,1|0,2,0]=4 4812 B15R1.9094 C[Si](C)(C)OCCC(=O)c1ccccc1 1458a_100000185807_200000032530 [0,1,0,0,0,1|1,1,0]=4 4813 B15R1.9094 O=C(OCSC(F)(F)F)c1ccccc1 62a_100000073877_200103152311 [0,1,0,0,0,1|2,0,0]=4 4814 B15R1.9094 O=C(OCSC(F)(F)F)c1ccccc1 62a_200000243211_100000073877 [0,1,0,0,0,1|2,0,0]=4 4815 B15R1.111 CC(C)C=CC(=O)Cc1ccc(cc1)Br 1458a_100016268746_100000189115 [0,1,0,0,0,1|1,0,1]=4 4816 B15R1.111 CC(C)C=CC(=O)Cc1ccc(cc1)Cl 1458a_100016268746_100000694040 [0,1,0,0,0,1|1,0,1]=4 4817 B15R1.111 CC(C)C=CC(=O)Cc1ccc(cc1)F 1458a_100016268746_100000198546 [0,1,0,0,0,1|1,0,1]=4 4818 B15R1.111 CC(C)C=CC(=O)Cc1ccc(cc1)I 1458a_100016268746_100000189116 [0,1,0,0,0,1|1,0,1]=4 4819 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100016268746 [0,1,0,0,0,1|1,0,1]=4 4820 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100016268746 [0,1,0,0,0,1|1,0,1]=4 4821 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100016268746 [0,1,0,0,0,1|1,0,1]=4 4822 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100016268746 [0,1,0,0,0,1|1,0,1]=4 4823 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100016268746 [0,1,0,0,0,1|1,0,1]=4 4824 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100016268746 [0,1,0,0,0,1|1,0,1]=4 4825 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)F 11a_100000185862_100016268746 [0,1,0,0,0,1|1,0,1]=4 4826 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100016268746 [0,1,0,0,0,1|1,0,1]=4 4827 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100016268746 [0,1,0,0,0,1|1,0,1]=4 4828 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)I 11a_100000185761_100016268746 [0,1,0,0,0,1|1,0,1]=4 4829 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100016268746 [0,1,0,0,0,1|1,0,1]=4 4830 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100016268746 [0,1,0,0,0,1|1,0,1]=4 4831 B15R1.111 CC(C)C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100016268746 [0,1,0,0,0,1|1,0,1]=4 4832 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)Br 1458a_100000181311_100000189115 [0,1,0,0,0,1|1,0,0]=3 4833 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210312 [0,1,0,0,0,1|1,0,0]=3 4834 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000181311_100000694040 [0,1,0,0,0,1|1,0,0]=3 4835 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210312 [0,1,0,0,0,1|1,0,0]=3 4836 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)F 1458a_100000181311_100000198546 [0,1,0,0,0,1|1,0,0]=3 4837 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210312 [0,1,0,0,0,1|1,0,0]=3 4838 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)I 1458a_100000181311_100000189116 [0,1,0,0,0,1|1,0,0]=3 4839 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210312 [0,1,0,0,0,1|1,0,0]=3 4840 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210312 [0,1,0,0,0,1|1,0,0]=3 4841 B15R1.111 CC(C)CCC(=O)Cc1ccc(cn1)Br 1458a_100000181311_100000702658 [0,1,0,0,0,1|2,0,0]=4 4842 B15R1.111 CC(C)CCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210312 [0,1,0,0,0,1|2,0,0]=4 4843 B15R1.111 CC(C)CCC(=O)Cc1ccc(cn1)Cl 1458a_100000181311_100012066911 [0,1,0,0,0,1|2,0,0]=4 4844 B15R1.111 CC(C)CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210312 [0,1,0,0,0,1|2,0,0]=4 4845 B15R1.111 CC(C)CCC(=O)Cc1ccc(cn1)F 1458a_100000181311_100000703193 [0,1,0,0,0,1|2,0,0]=4 4846 B15R1.111 CC(C)CCC(=O)Cc1ccc(nc1)Br 1458a_100000181311_100009831999 [0,1,0,0,0,1|2,0,0]=4 4847 B15R1.111 CC(C)CCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210312 [0,1,0,0,0,1|2,0,0]=4 4848 B15R1.111 CC(C)CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210312 [0,1,0,0,0,1|2,0,0]=4 4849 B15R1.111 CC(C)CCC(=O)Cc1ccc(nc1)Cl 1458a_100000181311_100000735431 [0,1,0,0,0,1|2,0,0]=4 4850 B15R1.111 CC(C)CCC(=O)Cc1ccc(nc1)F 1458a_100000181311_100009820150 [0,1,0,0,0,1|2,0,0]=4 4851 B15R1.111 CC(C)CCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210312 [0,1,0,0,0,1|2,0,0]=4 4852 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000181311 [0,1,0,0,0,1|1,0,0]=3 4853 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000181311 [0,1,0,0,0,1|1,0,0]=3 4854 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000181311 [0,1,0,0,0,1|1,0,0]=3 4855 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000181311 [0,1,0,0,0,1|1,0,0]=3 4856 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000181311 [0,1,0,0,0,1|1,0,0]=3 4857 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000181311 [0,1,0,0,0,1|1,0,0]=3 4858 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000181311 [0,1,0,0,0,1|1,0,0]=3 4859 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000181311 [0,1,0,0,0,1|1,0,0]=3 4860 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000181311 [0,1,0,0,0,1|1,0,0]=3 4861 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000181311 [0,1,0,0,0,1|1,0,0]=3 4862 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000181311 [0,1,0,0,0,1|1,0,0]=3 4863 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000181311 [0,1,0,0,0,1|1,0,0]=3 4864 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000181311 [0,1,0,0,0,1|1,0,0]=3 4865 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000181311 [0,1,0,0,0,1|1,0,0]=3 4866 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000181311 [0,1,0,0,0,1|1,0,0]=3 4867 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000181311 [0,1,0,0,0,1|1,0,0]=3 4868 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000181311 [0,1,0,0,0,1|1,0,0]=3 4869 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Br 11a_100000210953_100000198978 [0,1,0,0,0,1|1,0,0]=3 4870 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Br 240690a_100000210953_100000198978 [0,1,0,0,0,1|1,0,0]=3 4871 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Br 527a_100000210953_100000198978 [0,1,0,0,0,1|1,0,0]=3 4872 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl 11a_100000210953_100000211027 [0,1,0,0,0,1|1,0,0]=3 4873 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000210953_100000211027 [0,1,0,0,0,1|1,0,0]=3 4874 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl 527a_100000210953_100000211027 [0,1,0,0,0,1|1,0,0]=3 4875 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 11a_100000210953_100000210951 [0,1,0,0,0,1|1,0,0]=3 4876 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 1626a_100000210953_100000210951 [0,1,0,0,0,1|1,0,0]=3 4877 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 240690a_100000210953_100000210951 [0,1,0,0,0,1|1,0,0]=3 4878 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 527a_100000210953_100000210951 [0,1,0,0,0,1|1,0,0]=3 4879 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 11a_100000210953_100000688869 [0,1,0,0,0,1|1,0,0]=3 4880 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 1626a_100000210953_100000688869 [0,1,0,0,0,1|1,0,0]=3 4881 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 240690a_100000210953_100000688869 [0,1,0,0,0,1|1,0,0]=3 4882 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 527a_100000210953_100000688869 [0,1,0,0,0,1|1,0,0]=3 4883 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)O 1626a_100000210953_100000198540 [0,1,0,0,0,1|1,0,0]=3 4884 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)O 240690a_100000210953_100000198540 [0,1,0,0,0,1|1,0,0]=3 4885 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)O 527a_100000210953_100000198540 [0,1,0,0,0,1|1,0,0]=3 4886 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Br 11a_100000210953_100020629044 [0,1,0,0,0,1|2,0,0]=4 4887 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Br 240690a_100000210953_100020629044 [0,1,0,0,0,1|2,0,0]=4 4888 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 11a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 4889 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 1626a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 4890 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 240690a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 4891 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 527a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 4892 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Br 11a_100000210953_100010067268 [0,1,0,0,0,1|2,0,0]=4 4893 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Br 240690a_100000210953_100010067268 [0,1,0,0,0,1|2,0,0]=4 4894 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Br 527a_100000210953_100010067268 [0,1,0,0,0,1|2,0,0]=4 4895 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 11a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 4896 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 1626a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 4897 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 240690a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 4898 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 527a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 4899 B15R1.111 CC(C)CNC(=O)Cn1ccc(=O)cc1 11a_100000210953_200000238563 [0,1,0,0,0,1|2,0,0]=4 4900 B15R1.111 CC(C)CNC(=O)Cn1ccc(=O)cc1 1626a_100000210953_200000238563 [0,1,0,0,0,1|2,0,0]=4 4901 B15R1.111 CC(C)CNC(=O)Cn1ccc(=O)cc1 240690a_100000210953_200000238563 [0,1,0,0,0,1|2,0,0]=4 4902 B15R1.111 CC(C)CNC(=O)Cn1ccc(=O)cc1 527a_100000210953_200000238563 [0,1,0,0,0,1|2,0,0]=4 4903 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000210953 [0,1,0,0,0,1|1,0,0]=3 4904 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000210953 [0,1,0,0,0,1|1,0,0]=3 4905 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000210953 [0,1,0,0,0,1|1,0,0]=3 4906 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000210953 [0,1,0,0,0,1|1,0,0]=3 4907 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000210953 [0,1,0,0,0,1|1,0,0]=3 4908 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200009814596 [0,1,0,0,0,1|1,0,0]=3 4909 B15R1.111 CC(C)COC(C)Cc1ccc(cc1)F 34a_100011351027_100000210624 [0,1,0,0,0,1|1,0,1]=4 4910 B15R1.111 CC(C)COC(C)Cc1ccc(cc1)F 7a_100011351027_100000210760 [0,1,0,0,0,1|1,0,1]=4 4911 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_100000210206 [0,1,0,0,0,1|2,0,0]=4 4912 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)Br 2230a_100138425928_100000183692 [0,1,0,0,0,1|2,0,0]=4 4913 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)Br 34a_100138425928_100000183692 [0,1,0,0,0,1|2,0,0]=4 4914 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)Cl 2230a_100138425928_100000182960 [0,1,0,0,0,1|2,0,0]=4 4915 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)Cl 34a_100138425928_100000182960 [0,1,0,0,0,1|2,0,0]=4 4916 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)F 2230a_100025683178_100000210206 [0,1,0,0,0,1|2,0,0]=4 4917 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)F 2230a_100138425928_100000181725 [0,1,0,0,0,1|2,0,0]=4 4918 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)F 34a_100025683178_100000210206 [0,1,0,0,0,1|2,0,0]=4 4919 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)F 34a_100138425928_100000181725 [0,1,0,0,0,1|2,0,0]=4 4920 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)I 2230a_100138425928_100000183000 [0,1,0,0,0,1|2,0,0]=4 4921 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)I 34a_100138425928_100000183000 [0,1,0,0,0,1|2,0,0]=4 4922 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)O 2230a_100138425928_100000233757 [0,1,0,0,0,1|2,0,0]=4 4923 B15R1.111 CC(C)NCC(=O)Nc1ccc(cc1)O 34a_100138425928_100000233757 [0,1,0,0,0,1|2,0,0]=4 4924 B15R1.111 CC(C)NCC(=O)Oc1ccc(cc1)Br 2230a_100138425928_200010760497 [0,1,0,0,0,1|2,0,0]=4 4925 B15R1.111 CC(C)NCC(=O)Oc1ccc(cc1)Br 34a_100138425928_200010760497 [0,1,0,0,0,1|2,0,0]=4 4926 B15R1.111 CC(C)NNC(=O)Cc1ccc(cc1)Br 22a_100000741168_100000198978 [0,1,0,0,0,1|2,0,0]=4 4927 B15R1.111 CC(C)NNC(=O)Cc1ccc(cc1)Cl 22a_100000741168_100000211027 [0,1,0,0,0,1|2,0,0]=4 4928 B15R1.111 CC(C)NNC(=O)Cc1ccc(cc1)F 22a_100000741168_100000210951 [0,1,0,0,0,1|2,0,0]=4 4929 B15R1.111 CC(C)NNC(=O)Cc1ccc(cc1)I 22a_100000741168_100000688869 [0,1,0,0,0,1|2,0,0]=4 4930 B15R1.111 CC(C)NNC(=O)Cc1ccc(cc1)O 22a_100000741168_100000198540 [0,1,0,0,0,1|2,0,0]=4 4931 B15R1.111 CC(C)OCC(=O)Cc1ccc(cc1)Br 1458a_100000745533_100000189115 [0,1,0,0,0,1|2,0,0]=4 4932 B15R1.111 CC(C)OCC(=O)Cc1ccc(cc1)Cl 1458a_100000745533_100000694040 [0,1,0,0,0,1|2,0,0]=4 4933 B15R1.111 CC(C)OCC(=O)Cc1ccc(cc1)F 1458a_100000745533_100000198546 [0,1,0,0,0,1|2,0,0]=4 4934 B15R1.111 CC(C)OCC(=O)Cc1ccc(cc1)I 1458a_100000745533_100000189116 [0,1,0,0,0,1|2,0,0]=4 4935 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000745533 [0,1,0,0,0,1|2,0,0]=4 4936 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000745533 [0,1,0,0,0,1|2,0,0]=4 4937 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000745533 [0,1,0,0,0,1|2,0,0]=4 4938 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Br 34a_100000212225_100000183692 [0,1,0,0,0,1|2,0,0]=4 4939 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000745533 [0,1,0,0,0,1|2,0,0]=4 4940 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000745533 [0,1,0,0,0,1|2,0,0]=4 4941 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000745533 [0,1,0,0,0,1|2,0,0]=4 4942 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000745533 [0,1,0,0,0,1|2,0,0]=4 4943 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Cl 34a_100000212225_100000182960 [0,1,0,0,0,1|2,0,0]=4 4944 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000745533 [0,1,0,0,0,1|2,0,0]=4 4945 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000745533 [0,1,0,0,0,1|2,0,0]=4 4946 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000745533 [0,1,0,0,0,1|2,0,0]=4 4947 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000745533 [0,1,0,0,0,1|2,0,0]=4 4948 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F 34a_100000212225_100000181725 [0,1,0,0,0,1|2,0,0]=4 4949 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000745533 [0,1,0,0,0,1|2,0,0]=4 4950 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000745533 [0,1,0,0,0,1|2,0,0]=4 4951 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000745533 [0,1,0,0,0,1|2,0,0]=4 4952 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000745533 [0,1,0,0,0,1|2,0,0]=4 4953 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I 34a_100000212225_100000183000 [0,1,0,0,0,1|2,0,0]=4 4954 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000745533 [0,1,0,0,0,1|2,0,0]=4 4955 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)N 34a_100011269904_100000210206 [0,1,0,0,0,1|2,0,0]=4 4956 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000745533 [0,1,0,0,0,1|2,0,0]=4 4957 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)O 34a_100000212225_100000233757 [0,1,0,0,0,1|2,0,0]=4 4958 B15R1.111 CC(C)OCC(=O)Oc1ccc(cc1)Br 34a_100000212225_200010760497 [0,1,0,0,0,1|2,0,0]=4 4959 B15R1.111 CC(C)SCC(=O)Cc1ccc(cc1)Br 1458a_100000241585_100000189115 [0,1,0,0,0,1|2,0,0]=4 4960 B15R1.111 CC(C)SCC(=O)Cc1ccc(cc1)Cl 1458a_100000241585_100000694040 [0,1,0,0,0,1|2,0,0]=4 4961 B15R1.111 CC(C)SCC(=O)Cc1ccc(cc1)F 1458a_100000241585_100000198546 [0,1,0,0,0,1|2,0,0]=4 4962 B15R1.111 CC(C)SCC(=O)Cc1ccc(cc1)I 1458a_100000241585_100000189116 [0,1,0,0,0,1|2,0,0]=4 4963 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000241585 [0,1,0,0,0,1|2,0,0]=4 4964 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000241585 [0,1,0,0,0,1|2,0,0]=4 4965 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000241585 [0,1,0,0,0,1|2,0,0]=4 4966 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000241585 [0,1,0,0,0,1|2,0,0]=4 4967 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Br 62a_100000183692_100000210206 [0,1,0,0,0,1|2,0,0]=4 4968 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Br 62a_100000210206_100000183692 [0,1,0,0,0,1|2,0,0]=4 4969 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000241585 [0,1,0,0,0,1|2,0,0]=4 4970 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000241585 [0,1,0,0,0,1|2,0,0]=4 4971 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000241585 [0,1,0,0,0,1|2,0,0]=4 4972 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000241585 [0,1,0,0,0,1|2,0,0]=4 4973 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Cl 62a_100000210206_100000182960 [0,1,0,0,0,1|2,0,0]=4 4974 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210206 [0,1,0,0,0,1|2,0,0]=4 4975 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000241585 [0,1,0,0,0,1|2,0,0]=4 4976 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000241585 [0,1,0,0,0,1|2,0,0]=4 4977 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000241585 [0,1,0,0,0,1|2,0,0]=4 4978 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000241585 [0,1,0,0,0,1|2,0,0]=4 4979 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)F 62a_100000210206_100000181725 [0,1,0,0,0,1|2,0,0]=4 4980 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)F 62a_200000243717_100000210206 [0,1,0,0,0,1|2,0,0]=4 4981 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000241585 [0,1,0,0,0,1|2,0,0]=4 4982 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000241585 [0,1,0,0,0,1|2,0,0]=4 4983 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000241585 [0,1,0,0,0,1|2,0,0]=4 4984 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000241585 [0,1,0,0,0,1|2,0,0]=4 4985 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)I 62a_100000183000_100000210206 [0,1,0,0,0,1|2,0,0]=4 4986 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)I 62a_100000210206_100000183000 [0,1,0,0,0,1|2,0,0]=4 4987 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000241585 [0,1,0,0,0,1|2,0,0]=4 4988 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)O 62a_100000210206_100000233757 [0,1,0,0,0,1|2,0,0]=4 4989 B15R1.111 CC(C)SCC(=O)Oc1ccc(cc1)Br 62a_100000210206_200010760497 [0,1,0,0,0,1|2,0,0]=4 4990 B15R1.111 CC(C)SCC(=O)Oc1ccc(cc1)Br 62a_200010760497_100000210206 [0,1,0,0,0,1|2,0,0]=4 4991 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100012276601 [0,1,0,0,0,1|2,0,0]=4 4992 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100012276601 [0,1,0,0,0,1|2,0,0]=4 4993 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100012276601 [0,1,0,0,0,1|2,0,0]=4 4994 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100012276601 [0,1,0,0,0,1|2,0,0]=4 4995 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100012276601 [0,1,0,0,0,1|2,0,0]=4 4996 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000718519 [0,1,0,0,0,1|2,0,0]=4 4997 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000718519 [0,1,0,0,0,1|2,0,0]=4 4998 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000718519 [0,1,0,0,0,1|2,0,0]=4 4999 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000718519 [0,1,0,0,0,1|2,0,0]=4 5000 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Br 11a_100000210904_100000198978 [0,1,0,0,0,1|2,0,0]=4 5001 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Br 240690a_100000210904_100000198978 [0,1,0,0,0,1|2,0,0]=4 5002 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Br 527a_100000210904_100000198978 [0,1,0,0,0,1|2,0,0]=4 5003 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Cl 11a_100000210904_100000211027 [0,1,0,0,0,1|2,0,0]=4 5004 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000210904_100000211027 [0,1,0,0,0,1|2,0,0]=4 5005 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Cl 527a_100000210904_100000211027 [0,1,0,0,0,1|2,0,0]=4 5006 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)F 11a_100000210904_100000210951 [0,1,0,0,0,1|2,0,0]=4 5007 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)F 240690a_100000210904_100000210951 [0,1,0,0,0,1|2,0,0]=4 5008 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)F 527a_100000210904_100000210951 [0,1,0,0,0,1|2,0,0]=4 5009 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)I 11a_100000210904_100000688869 [0,1,0,0,0,1|2,0,0]=4 5010 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)I 240690a_100000210904_100000688869 [0,1,0,0,0,1|2,0,0]=4 5011 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)I 527a_100000210904_100000688869 [0,1,0,0,0,1|2,0,0]=4 5012 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)O 240690a_100000210904_100000198540 [0,1,0,0,0,1|2,0,0]=4 5013 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)O 527a_100000210904_100000198540 [0,1,0,0,0,1|2,0,0]=4 5014 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000210904 [0,1,0,0,0,1|2,0,0]=4 5015 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000210904 [0,1,0,0,0,1|2,0,0]=4 5016 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000210904 [0,1,0,0,0,1|2,0,0]=4 5017 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000210904 [0,1,0,0,0,1|2,0,0]=4 5018 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000210904 [0,1,0,0,0,1|2,0,0]=4 5019 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000689311 [0,1,0,0,0,1|2,0,0]=4 5020 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br 2230a_100102631434_100000740023 [0,1,0,0,0,1|2,0,0]=4 5021 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000689311 [0,1,0,0,0,1|2,0,0]=4 5022 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br 269982a_100102631434_100000740023 [0,1,0,0,0,1|2,0,0]=4 5023 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000689311 [0,1,0,0,0,1|2,0,0]=4 5024 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000689311 [0,1,0,0,0,1|2,0,0]=4 5025 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Cl 2230a_100102631434_100000188356 [0,1,0,0,0,1|2,0,0]=4 5026 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000689311 [0,1,0,0,0,1|2,0,0]=4 5027 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Cl 269982a_100102631434_100000188356 [0,1,0,0,0,1|2,0,0]=4 5028 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000689311 [0,1,0,0,0,1|2,0,0]=4 5029 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000689311 [0,1,0,0,0,1|2,0,0]=4 5030 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)F 2230a_100102631434_100000736363 [0,1,0,0,0,1|2,0,0]=4 5031 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000689311 [0,1,0,0,0,1|2,0,0]=4 5032 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)F 269982a_100102631434_100000736363 [0,1,0,0,0,1|2,0,0]=4 5033 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000689311 [0,1,0,0,0,1|2,0,0]=4 5034 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000689311 [0,1,0,0,0,1|2,0,0]=4 5035 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000689311 [0,1,0,0,0,1|2,0,0]=4 5036 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000689311 [0,1,0,0,0,1|2,0,0]=4 5037 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)O 2230a_100102631434_100011302330 [0,1,0,0,0,1|2,0,0]=4 5038 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000689311 [0,1,0,0,0,1|2,0,0]=4 5039 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)O 269982a_100102631434_100011302330 [0,1,0,0,0,1|2,0,0]=4 5040 B15R1.111 C[S+](C)CCC(=O)Cc1ccc(cc1)Br 1458a_100009452791_100000189115 [0,1,0,0,0,1|2,0,0]=4 5041 B15R1.111 C[S+](C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100009452791_100000694040 [0,1,0,0,0,1|2,0,0]=4 5042 B15R1.111 C[S+](C)CCC(=O)Cc1ccc(cc1)F 1458a_100009452791_100000198546 [0,1,0,0,0,1|2,0,0]=4 5043 B15R1.111 C[S+](C)CCC(=O)Cc1ccc(cc1)I 1458a_100009452791_100000189116 [0,1,0,0,0,1|2,0,0]=4 5044 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100009452791 [0,1,0,0,0,1|2,0,0]=4 5045 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100009452791 [0,1,0,0,0,1|2,0,0]=4 5046 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100009452791 [0,1,0,0,0,1|2,0,0]=4 5047 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100009452791 [0,1,0,0,0,1|2,0,0]=4 5048 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100009452791 [0,1,0,0,0,1|2,0,0]=4 5049 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100009452791 [0,1,0,0,0,1|2,0,0]=4 5050 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100009452791 [0,1,0,0,0,1|2,0,0]=4 5051 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100009452791 [0,1,0,0,0,1|2,0,0]=4 5052 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100009452791 [0,1,0,0,0,1|2,0,0]=4 5053 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100009452791 [0,1,0,0,0,1|2,0,0]=4 5054 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100009452791 [0,1,0,0,0,1|2,0,0]=4 5055 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100009452791 [0,1,0,0,0,1|2,0,0]=4 5056 B15R1.111 C[S+](C)CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100009452791 [0,1,0,0,0,1|2,0,0]=4 5057 B15R1.111 Cc1ccc(cc1)CC(=O)C=CC(C)C 1458a_100016268746_100000210814 [0,1,0,0,0,1|1,0,1]=4 5058 B15R1.111 Cc1ccc(cc1)CC(=O)CCC(C)C 1458a_100000181311_100000210814 [0,1,0,0,0,1|1,0,0]=3 5059 B15R1.111 Cc1ccc(cc1)CC(=O)CCC(C)C 1458a_100000212244_100000210312 [0,1,0,0,0,1|1,0,0]=3 5060 B15R1.111 Cc1ccc(cc1)CC(=O)CCC(C)O 1458a_100000212244_100012276601 [0,1,0,0,0,1|2,0,0]=4 5061 B15R1.111 Cc1ccc(cc1)CC(=O)CC[S+](C)C 1458a_100009452791_100000210814 [0,1,0,0,0,1|2,0,0]=4 5062 B15R1.111 Cc1ccc(cc1)CC(=O)COC(C)C 1458a_100000745533_100000210814 [0,1,0,0,0,1|2,0,0]=4 5063 B15R1.111 Cc1ccc(cc1)CC(=O)CSC(C)C 1458a_100000241585_100000210814 [0,1,0,0,0,1|2,0,0]=4 5064 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)C 11a_100000210953_100000212244 [0,1,0,0,0,1|1,0,0]=3 5065 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)C 240690a_100000210953_100000212244 [0,1,0,0,0,1|1,0,0]=3 5066 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)C 527a_100000210953_100000212244 [0,1,0,0,0,1|1,0,0]=3 5067 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)O 11a_100000210904_100000212244 [0,1,0,0,0,1|2,0,0]=4 5068 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)O 240690a_100000210904_100000212244 [0,1,0,0,0,1|2,0,0]=4 5069 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)O 527a_100000210904_100000212244 [0,1,0,0,0,1|2,0,0]=4 5070 B15R1.111 Cc1ccc(cc1)CC(=O)NNC(C)C 22a_100000741168_100000212244 [0,1,0,0,0,1|2,0,0]=4 5071 B15R1.111 Cc1ccc(cc1)NC(=O)C=CC(C)C 11a_100000124888_100016268746 [0,1,0,0,0,1|1,0,1]=4 5072 B15R1.111 Cc1ccc(cc1)NC(=O)C=CC(C)C 1626a_100000124888_100016268746 [0,1,0,0,0,1|1,0,1]=4 5073 B15R1.111 Cc1ccc(cc1)NC(=O)C=CC(C)C 22a_100000124888_100016268746 [0,1,0,0,0,1|1,0,1]=4 5074 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)C 11a_100000124888_100000181311 [0,1,0,0,0,1|1,0,0]=3 5075 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)C 1626a_100000124888_100000181311 [0,1,0,0,0,1|1,0,0]=3 5076 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)C 22a_100000124888_100000181311 [0,1,0,0,0,1|1,0,0]=3 5077 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)C 527a_100000124888_100000181311 [0,1,0,0,0,1|1,0,0]=3 5078 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)O 1626a_100000124888_100000718519 [0,1,0,0,0,1|2,0,0]=4 5079 B15R1.111 Cc1ccc(cc1)NC(=O)CCN(C)C 11a_100000124888_100000689311 [0,1,0,0,0,1|2,0,0]=4 5080 B15R1.111 Cc1ccc(cc1)NC(=O)CCN(C)C 2230a_100102631434_200000187088 [0,1,0,0,0,1|2,0,0]=4 5081 B15R1.111 Cc1ccc(cc1)NC(=O)CCN(C)C 22a_100000124888_100000689311 [0,1,0,0,0,1|2,0,0]=4 5082 B15R1.111 Cc1ccc(cc1)NC(=O)CCN(C)C 269982a_100102631434_200000187088 [0,1,0,0,0,1|2,0,0]=4 5083 B15R1.111 Cc1ccc(cc1)NC(=O)CCN(C)C 527a_100000124888_100000689311 [0,1,0,0,0,1|2,0,0]=4 5084 B15R1.111 Cc1ccc(cc1)NC(=O)CC[S+](C)C 11a_100000124888_100009452791 [0,1,0,0,0,1|2,0,0]=4 5085 B15R1.111 Cc1ccc(cc1)NC(=O)CC[S+](C)C 1626a_100000124888_100009452791 [0,1,0,0,0,1|2,0,0]=4 5086 B15R1.111 Cc1ccc(cc1)NC(=O)CC[S+](C)C 22a_100000124888_100009452791 [0,1,0,0,0,1|2,0,0]=4 5087 B15R1.111 Cc1ccc(cc1)NC(=O)CNC(C)C 2230a_100138425928_100000182914 [0,1,0,0,0,1|2,0,0]=4 5088 B15R1.111 Cc1ccc(cc1)NC(=O)CNC(C)C 34a_100138425928_100000182914 [0,1,0,0,0,1|2,0,0]=4 5089 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C 11a_100000124888_100000745533 [0,1,0,0,0,1|2,0,0]=4 5090 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C 1626a_100000124888_100000745533 [0,1,0,0,0,1|2,0,0]=4 5091 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C 22a_100000124888_100000745533 [0,1,0,0,0,1|2,0,0]=4 5092 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C 34a_100000212225_100000182914 [0,1,0,0,0,1|2,0,0]=4 5093 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C 527a_100000124888_100000745533 [0,1,0,0,0,1|2,0,0]=4 5094 B15R1.111 Cc1ccc(cc1)NC(=O)CSC(C)C 11a_100000124888_100000241585 [0,1,0,0,0,1|2,0,0]=4 5095 B15R1.111 Cc1ccc(cc1)NC(=O)CSC(C)C 1626a_100000124888_100000241585 [0,1,0,0,0,1|2,0,0]=4 5096 B15R1.111 Cc1ccc(cc1)NC(=O)CSC(C)C 22a_100000124888_100000241585 [0,1,0,0,0,1|2,0,0]=4 5097 B15R1.111 Cc1ccc(cc1)NC(=O)CSC(C)C 527a_100000124888_100000241585 [0,1,0,0,0,1|2,0,0]=4 5098 B15R1.111 Cc1ccc(cc1)NC(=O)CSC(C)C 62a_100000210206_100000182914 [0,1,0,0,0,1|2,0,0]=4 5099 B15R1.111 Cc1ccc(cc1)NC(=O)NCC(C)C 2430a_100000124888_100000210953 [0,1,0,0,0,1|1,0,0]=3 5100 B15R1.111 Cc1ccc(cc1)NC(=O)NCC(C)O 2430a_100000124888_100000210904 [0,1,0,0,0,1|2,0,0]=4 5101 B15R1.111 Cc1ccc(cn1)CC(=O)CCC(C)C 1458a_100000181311_100016987292 [0,1,0,0,0,1|2,0,0]=4 5102 B15R1.111 Cc1ccc(cn1)CC(=O)CCC(C)C 1458a_100000740413_100000210312 [0,1,0,0,0,1|2,0,0]=4 5103 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)C 11a_100000210953_100000740413 [0,1,0,0,0,1|2,0,0]=4 5104 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)C 1626a_100000210953_100000740413 [0,1,0,0,0,1|2,0,0]=4 5105 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)C 240690a_100000210953_100000740413 [0,1,0,0,0,1|2,0,0]=4 5106 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)C 527a_100000210953_100000740413 [0,1,0,0,0,1|2,0,0]=4 5107 B15R1.111 Cc1ccc(nc1)CC(=O)CCC(C)C 1458a_100000181311_100000691093 [0,1,0,0,0,1|2,0,0]=4 5108 B15R1.111 Cc1ccc(nc1)CC(=O)CCC(C)C 1458a_100025705728_100000210312 [0,1,0,0,0,1|2,0,0]=4 5109 B15R1.111 Cc1ccc(nc1)CC(=O)NCC(C)C 11a_100000210953_100025705728 [0,1,0,0,0,1|2,0,0]=4 5110 B15R1.111 Cc1ccc(nc1)CC(=O)NCC(C)C 1626a_100000210953_100025705728 [0,1,0,0,0,1|2,0,0]=4 5111 B15R1.111 Cc1ccc(nc1)CC(=O)NCC(C)C 240690a_100000210953_100025705728 [0,1,0,0,0,1|2,0,0]=4 5112 B15R1.120 CC(C)C=CC(=O)Cc1cccc(c1)Br 1458a_100016268746_100000211773 [0,1,0,0,0,1|1,0,1]=4 5113 B15R1.120 CC(C)C=CC(=O)Cc1cccc(c1)Cl 1458a_100016268746_100000181238 [0,1,0,0,0,1|1,0,1]=4 5114 B15R1.120 CC(C)C=CC(=O)Cc1cccc(c1)F 1458a_100016268746_100000230114 [0,1,0,0,0,1|1,0,1]=4 5115 B15R1.120 CC(C)C=CC(=O)Cc1cccc(c1)I 1458a_100016268746_100011218688 [0,1,0,0,0,1|1,0,1]=4 5116 B15R1.120 CC(C)C=CC(=O)Cc1cccc(c1)O 1458a_100016268746_100011660834 [0,1,0,0,0,1|1,0,1]=4 5117 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)Br 11a_100000210019_100016268746 [0,1,0,0,0,1|1,0,1]=4 5118 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100016268746 [0,1,0,0,0,1|1,0,1]=4 5119 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100016268746 [0,1,0,0,0,1|1,0,1]=4 5120 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100016268746 [0,1,0,0,0,1|1,0,1]=4 5121 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100016268746 [0,1,0,0,0,1|1,0,1]=4 5122 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100016268746 [0,1,0,0,0,1|1,0,1]=4 5123 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)F 11a_100000210047_100016268746 [0,1,0,0,0,1|1,0,1]=4 5124 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100016268746 [0,1,0,0,0,1|1,0,1]=4 5125 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100016268746 [0,1,0,0,0,1|1,0,1]=4 5126 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)I 11a_100000211102_100016268746 [0,1,0,0,0,1|1,0,1]=4 5127 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100016268746 [0,1,0,0,0,1|1,0,1]=4 5128 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100016268746 [0,1,0,0,0,1|1,0,1]=4 5129 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100016268746 [0,1,0,0,0,1|1,0,1]=4 5130 B15R1.120 CC(C)C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100016268746 [0,1,0,0,0,1|1,0,1]=4 5131 B15R1.120 CC(C)CCC(=O)Cc1cc(ccn1)Br 1458a_100000181311_100010173614 [0,1,0,0,0,1|2,0,0]=4 5132 B15R1.120 CC(C)CCC(=O)Cc1cc(ccn1)Cl 1458a_100000181311_100016988179 [0,1,0,0,0,1|2,0,0]=4 5133 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)Br 1458a_100000181311_100000211773 [0,1,0,0,0,1|1,0,0]=3 5134 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210312 [0,1,0,0,0,1|1,0,0]=3 5135 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)Cl 1458a_100000181311_100000181238 [0,1,0,0,0,1|1,0,0]=3 5136 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210312 [0,1,0,0,0,1|1,0,0]=3 5137 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)F 1458a_100000181311_100000230114 [0,1,0,0,0,1|1,0,0]=3 5138 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210312 [0,1,0,0,0,1|1,0,0]=3 5139 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)I 1458a_100000181311_100011218688 [0,1,0,0,0,1|1,0,0]=3 5140 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210312 [0,1,0,0,0,1|1,0,0]=3 5141 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)O 1458a_100000181311_100011660834 [0,1,0,0,0,1|1,0,0]=3 5142 B15R1.120 CC(C)CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210312 [0,1,0,0,0,1|1,0,0]=3 5143 B15R1.120 CC(C)CCC(=O)Cc1cccc(n1)Br 1458a_100000181311_100009889011 [0,1,0,0,0,1|2,0,0]=4 5144 B15R1.120 CC(C)CCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210312 [0,1,0,0,0,1|2,0,0]=4 5145 B15R1.120 CC(C)CCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210312 [0,1,0,0,0,1|2,0,0]=4 5146 B15R1.120 CC(C)CCC(=O)Cc1cccc(n1)Cl 1458a_100000181311_100000086093 [0,1,0,0,0,1|2,0,0]=4 5147 B15R1.120 CC(C)CCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210312 [0,1,0,0,0,1|2,0,0]=4 5148 B15R1.120 CC(C)CCC(=O)Cc1cccc(n1)F 1458a_100000181311_100009819644 [0,1,0,0,0,1|2,0,0]=4 5149 B15R1.120 CC(C)CCC(=O)Cc1ccnc(c1)Br 1458a_100000181311_100010243470 [0,1,0,0,0,1|2,0,0]=4 5150 B15R1.120 CC(C)CCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210312 [0,1,0,0,0,1|2,0,0]=4 5151 B15R1.120 CC(C)CCC(=O)Cc1ccnc(c1)Cl 1458a_100000181311_100000764220 [0,1,0,0,0,1|2,0,0]=4 5152 B15R1.120 CC(C)CCC(=O)Cc1cncc(c1)Br 1458a_100000181311_100011740620 [0,1,0,0,0,1|2,0,0]=4 5153 B15R1.120 CC(C)CCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210312 [0,1,0,0,0,1|2,0,0]=4 5154 B15R1.120 CC(C)CCC(=O)Cc1cncc(c1)Cl 1458a_100000181311_100016992070 [0,1,0,0,0,1|2,0,0]=4 5155 B15R1.120 CC(C)CCC(=O)Cc1cncc(c1)F 1458a_100000181311_100000725299 [0,1,0,0,0,1|2,0,0]=4 5156 B15R1.120 CC(C)CCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210312 [0,1,0,0,0,1|2,0,0]=4 5157 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000181311 [0,1,0,0,0,1|1,0,0]=3 5158 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000181311 [0,1,0,0,0,1|1,0,0]=3 5159 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000181311 [0,1,0,0,0,1|1,0,0]=3 5160 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000181311 [0,1,0,0,0,1|1,0,0]=3 5161 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000181311 [0,1,0,0,0,1|1,0,0]=3 5162 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000181311 [0,1,0,0,0,1|1,0,0]=3 5163 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000181311 [0,1,0,0,0,1|1,0,0]=3 5164 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000181311 [0,1,0,0,0,1|1,0,0]=3 5165 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000181311 [0,1,0,0,0,1|1,0,0]=3 5166 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000181311 [0,1,0,0,0,1|1,0,0]=3 5167 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000181311 [0,1,0,0,0,1|1,0,0]=3 5168 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000181311 [0,1,0,0,0,1|1,0,0]=3 5169 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000181311 [0,1,0,0,0,1|1,0,0]=3 5170 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000181311 [0,1,0,0,0,1|1,0,0]=3 5171 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000181311 [0,1,0,0,0,1|1,0,0]=3 5172 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000181311 [0,1,0,0,0,1|1,0,0]=3 5173 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000181311 [0,1,0,0,0,1|1,0,0]=3 5174 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000181311 [0,1,0,0,0,1|1,0,0]=3 5175 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Br 11a_100000210953_100000747190 [0,1,0,0,0,1|1,0,0]=3 5176 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Br 240690a_100000210953_100000747190 [0,1,0,0,0,1|1,0,0]=3 5177 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Br 527a_100000210953_100000747190 [0,1,0,0,0,1|1,0,0]=3 5178 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Cl 11a_100000210953_100000749307 [0,1,0,0,0,1|1,0,0]=3 5179 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Cl 1626a_100000210953_100000749307 [0,1,0,0,0,1|1,0,0]=3 5180 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Cl 240690a_100000210953_100000749307 [0,1,0,0,0,1|1,0,0]=3 5181 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)Cl 527a_100000210953_100000749307 [0,1,0,0,0,1|1,0,0]=3 5182 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)F 11a_100000210953_100000211661 [0,1,0,0,0,1|1,0,0]=3 5183 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)F 1626a_100000210953_100000211661 [0,1,0,0,0,1|1,0,0]=3 5184 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)F 240690a_100000210953_100000211661 [0,1,0,0,0,1|1,0,0]=3 5185 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)F 527a_100000210953_100000211661 [0,1,0,0,0,1|1,0,0]=3 5186 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)I 11a_100000210953_100000238430 [0,1,0,0,0,1|1,0,0]=3 5187 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)I 1626a_100000210953_100000238430 [0,1,0,0,0,1|1,0,0]=3 5188 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)I 240690a_100000210953_100000238430 [0,1,0,0,0,1|1,0,0]=3 5189 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)I 527a_100000210953_100000238430 [0,1,0,0,0,1|1,0,0]=3 5190 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)O 240690a_100000210953_100000745134 [0,1,0,0,0,1|1,0,0]=3 5191 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)O 527a_100000210953_100000745134 [0,1,0,0,0,1|1,0,0]=3 5192 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)Br 11a_100000210953_100010201708 [0,1,0,0,0,1|2,0,0]=4 5193 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)Br 240690a_100000210953_100010201708 [0,1,0,0,0,1|2,0,0]=4 5194 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)Br 527a_100000210953_100010201708 [0,1,0,0,0,1|2,0,0]=4 5195 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)Cl 11a_100000210953_100000090259 [0,1,0,0,0,1|2,0,0]=4 5196 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)Cl 1626a_100000210953_100000090259 [0,1,0,0,0,1|2,0,0]=4 5197 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)Cl 240690a_100000210953_100000090259 [0,1,0,0,0,1|2,0,0]=4 5198 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)F 11a_100000210953_100000096803 [0,1,0,0,0,1|2,0,0]=4 5199 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)F 1626a_100000210953_100000096803 [0,1,0,0,0,1|2,0,0]=4 5200 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)F 240690a_100000210953_100000096803 [0,1,0,0,0,1|2,0,0]=4 5201 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Br 11a_100000210953_100010126891 [0,1,0,0,0,1|2,0,0]=4 5202 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Br 240690a_100000210953_100010126891 [0,1,0,0,0,1|2,0,0]=4 5203 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Br 527a_100000210953_100010126891 [0,1,0,0,0,1|2,0,0]=4 5204 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Cl 11a_100000210953_100000085289 [0,1,0,0,0,1|2,0,0]=4 5205 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Cl 1626a_100000210953_100000085289 [0,1,0,0,0,1|2,0,0]=4 5206 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Cl 240690a_100000210953_100000085289 [0,1,0,0,0,1|2,0,0]=4 5207 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Cl 527a_100000210953_100000085289 [0,1,0,0,0,1|2,0,0]=4 5208 B15R1.120 CC(C)CNC(=O)Cc1cncc(c1)Br 11a_100000210953_100000239331 [0,1,0,0,0,1|2,0,0]=4 5209 B15R1.120 CC(C)CNC(=O)Cc1cncc(c1)Br 240690a_100000210953_100000239331 [0,1,0,0,0,1|2,0,0]=4 5210 B15R1.120 CC(C)CNC(=O)Cc1cncc(c1)Br 527a_100000210953_100000239331 [0,1,0,0,0,1|2,0,0]=4 5211 B15R1.120 CC(C)CNC(=O)Cc1cncc(c1)F 11a_100000210953_100011667516 [0,1,0,0,0,1|2,0,0]=4 5212 B15R1.120 CC(C)CNC(=O)Cc1cncc(c1)F 240690a_100000210953_100011667516 [0,1,0,0,0,1|2,0,0]=4 5213 B15R1.120 CC(C)CNC(=O)Cc1cncc(c1)F 527a_100000210953_100011667516 [0,1,0,0,0,1|2,0,0]=4 5214 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000210953 [0,1,0,0,0,1|1,0,0]=3 5215 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000210953 [0,1,0,0,0,1|1,0,0]=3 5216 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000210953 [0,1,0,0,0,1|1,0,0]=3 5217 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000210953 [0,1,0,0,0,1|1,0,0]=3 5218 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)F 512a_100000210047_100000210953 [0,1,0,0,0,1|1,0,0]=3 5219 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000210953 [0,1,0,0,0,1|1,0,0]=3 5220 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)I 512a_100000211102_100000210953 [0,1,0,0,0,1|1,0,0]=3 5221 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000210953 [0,1,0,0,0,1|1,0,0]=3 5222 B15R1.120 CC(C)CNC(=O)Nc1cccc(c1)O 512a_100000210217_100000210953 [0,1,0,0,0,1|1,0,0]=3 5223 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)Br 2230a_100138425928_100000183509 [0,1,0,0,0,1|2,0,0]=4 5224 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)Br 34a_100138425928_100000183509 [0,1,0,0,0,1|2,0,0]=4 5225 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_100000210206 [0,1,0,0,0,1|2,0,0]=4 5226 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)Cl 2230a_100138425928_100000182995 [0,1,0,0,0,1|2,0,0]=4 5227 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)Cl 34a_100138425928_100000182995 [0,1,0,0,0,1|2,0,0]=4 5228 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)F 2230a_100000168492_100000210206 [0,1,0,0,0,1|2,0,0]=4 5229 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)F 2230a_100138425928_100000183335 [0,1,0,0,0,1|2,0,0]=4 5230 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)F 34a_100000168492_100000210206 [0,1,0,0,0,1|2,0,0]=4 5231 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)F 34a_100138425928_100000183335 [0,1,0,0,0,1|2,0,0]=4 5232 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)O 2230a_100138425928_100011236192 [0,1,0,0,0,1|2,0,0]=4 5233 B15R1.120 CC(C)NCC(=O)Nc1cccc(c1)O 34a_100138425928_100011236192 [0,1,0,0,0,1|2,0,0]=4 5234 B15R1.120 CC(C)NNC(=O)Cc1cccc(c1)Br 22a_100000741168_100000747190 [0,1,0,0,0,1|2,0,0]=4 5235 B15R1.120 CC(C)NNC(=O)Cc1cccc(c1)Cl 22a_100000741168_100000749307 [0,1,0,0,0,1|2,0,0]=4 5236 B15R1.120 CC(C)NNC(=O)Cc1cccc(c1)F 22a_100000741168_100000211661 [0,1,0,0,0,1|2,0,0]=4 5237 B15R1.120 CC(C)NNC(=O)Cc1cccc(c1)I 22a_100000741168_100000238430 [0,1,0,0,0,1|2,0,0]=4 5238 B15R1.120 CC(C)NNC(=O)Cc1cccc(c1)O 22a_100000741168_100000745134 [0,1,0,0,0,1|2,0,0]=4 5239 B15R1.120 CC(C)NNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000741168 [0,1,0,0,0,1|2,0,0]=4 5240 B15R1.120 CC(C)NNC(=O)Nc1cccc(c1)F 512a_100000210047_100000741168 [0,1,0,0,0,1|2,0,0]=4 5241 B15R1.120 CC(C)NNC(=O)Nc1cccc(c1)I 512a_100000211102_100000741168 [0,1,0,0,0,1|2,0,0]=4 5242 B15R1.120 CC(C)NNC(=O)Nc1cccc(c1)O 512a_100000210217_100000741168 [0,1,0,0,0,1|2,0,0]=4 5243 B15R1.120 CC(C)OCC(=O)Cc1cccc(c1)Br 1458a_100000745533_100000211773 [0,1,0,0,0,1|2,0,0]=4 5244 B15R1.120 CC(C)OCC(=O)Cc1cccc(c1)Cl 1458a_100000745533_100000181238 [0,1,0,0,0,1|2,0,0]=4 5245 B15R1.120 CC(C)OCC(=O)Cc1cccc(c1)F 1458a_100000745533_100000230114 [0,1,0,0,0,1|2,0,0]=4 5246 B15R1.120 CC(C)OCC(=O)Cc1cccc(c1)I 1458a_100000745533_100011218688 [0,1,0,0,0,1|2,0,0]=4 5247 B15R1.120 CC(C)OCC(=O)Cc1cccc(c1)O 1458a_100000745533_100011660834 [0,1,0,0,0,1|2,0,0]=4 5248 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000745533 [0,1,0,0,0,1|2,0,0]=4 5249 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000745533 [0,1,0,0,0,1|2,0,0]=4 5250 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000745533 [0,1,0,0,0,1|2,0,0]=4 5251 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Br 34a_100000212225_100000183509 [0,1,0,0,0,1|2,0,0]=4 5252 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000745533 [0,1,0,0,0,1|2,0,0]=4 5253 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000745533 [0,1,0,0,0,1|2,0,0]=4 5254 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000745533 [0,1,0,0,0,1|2,0,0]=4 5255 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000745533 [0,1,0,0,0,1|2,0,0]=4 5256 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)Cl 34a_100000212225_100000182995 [0,1,0,0,0,1|2,0,0]=4 5257 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)F 11a_100000210047_100000745533 [0,1,0,0,0,1|2,0,0]=4 5258 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000745533 [0,1,0,0,0,1|2,0,0]=4 5259 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)F 22a_100000210047_100000745533 [0,1,0,0,0,1|2,0,0]=4 5260 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)F 34a_100000212225_100000183335 [0,1,0,0,0,1|2,0,0]=4 5261 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)F 527a_100000210047_100000745533 [0,1,0,0,0,1|2,0,0]=4 5262 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)I 11a_100000211102_100000745533 [0,1,0,0,0,1|2,0,0]=4 5263 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000745533 [0,1,0,0,0,1|2,0,0]=4 5264 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)I 22a_100000211102_100000745533 [0,1,0,0,0,1|2,0,0]=4 5265 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)I 527a_100000211102_100000745533 [0,1,0,0,0,1|2,0,0]=4 5266 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000745533 [0,1,0,0,0,1|2,0,0]=4 5267 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)O 22a_100000210217_100000745533 [0,1,0,0,0,1|2,0,0]=4 5268 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)O 34a_100000212225_100011236192 [0,1,0,0,0,1|2,0,0]=4 5269 B15R1.120 CC(C)OCC(=O)Nc1cccc(c1)O 527a_100000210217_100000745533 [0,1,0,0,0,1|2,0,0]=4 5270 B15R1.120 CC(C)SCC(=O)Cc1cccc(c1)Br 1458a_100000241585_100000211773 [0,1,0,0,0,1|2,0,0]=4 5271 B15R1.120 CC(C)SCC(=O)Cc1cccc(c1)Cl 1458a_100000241585_100000181238 [0,1,0,0,0,1|2,0,0]=4 5272 B15R1.120 CC(C)SCC(=O)Cc1cccc(c1)F 1458a_100000241585_100000230114 [0,1,0,0,0,1|2,0,0]=4 5273 B15R1.120 CC(C)SCC(=O)Cc1cccc(c1)I 1458a_100000241585_100011218688 [0,1,0,0,0,1|2,0,0]=4 5274 B15R1.120 CC(C)SCC(=O)Cc1cccc(c1)O 1458a_100000241585_100011660834 [0,1,0,0,0,1|2,0,0]=4 5275 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000241585 [0,1,0,0,0,1|2,0,0]=4 5276 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000241585 [0,1,0,0,0,1|2,0,0]=4 5277 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000241585 [0,1,0,0,0,1|2,0,0]=4 5278 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000241585 [0,1,0,0,0,1|2,0,0]=4 5279 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Br 62a_100000183509_100000210206 [0,1,0,0,0,1|2,0,0]=4 5280 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Br 62a_100000210206_100000183509 [0,1,0,0,0,1|2,0,0]=4 5281 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000241585 [0,1,0,0,0,1|2,0,0]=4 5282 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000241585 [0,1,0,0,0,1|2,0,0]=4 5283 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000241585 [0,1,0,0,0,1|2,0,0]=4 5284 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)Cl 62a_100000210206_100000182995 [0,1,0,0,0,1|2,0,0]=4 5285 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)F 11a_100000210047_100000241585 [0,1,0,0,0,1|2,0,0]=4 5286 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000241585 [0,1,0,0,0,1|2,0,0]=4 5287 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)F 22a_100000210047_100000241585 [0,1,0,0,0,1|2,0,0]=4 5288 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)F 527a_100000210047_100000241585 [0,1,0,0,0,1|2,0,0]=4 5289 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)F 62a_100000183335_100000210206 [0,1,0,0,0,1|2,0,0]=4 5290 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)F 62a_100000210206_100000183335 [0,1,0,0,0,1|2,0,0]=4 5291 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)I 11a_100000211102_100000241585 [0,1,0,0,0,1|2,0,0]=4 5292 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000241585 [0,1,0,0,0,1|2,0,0]=4 5293 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)I 22a_100000211102_100000241585 [0,1,0,0,0,1|2,0,0]=4 5294 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)I 527a_100000211102_100000241585 [0,1,0,0,0,1|2,0,0]=4 5295 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000241585 [0,1,0,0,0,1|2,0,0]=4 5296 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)O 22a_100000210217_100000241585 [0,1,0,0,0,1|2,0,0]=4 5297 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)O 527a_100000210217_100000241585 [0,1,0,0,0,1|2,0,0]=4 5298 B15R1.120 CC(C)SCC(=O)Nc1cccc(c1)O 62a_100000210206_100011236192 [0,1,0,0,0,1|2,0,0]=4 5299 B15R1.120 CC(O)CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100012276601 [0,1,0,0,0,1|2,0,0]=4 5300 B15R1.120 CC(O)CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100012276601 [0,1,0,0,0,1|2,0,0]=4 5301 B15R1.120 CC(O)CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100012276601 [0,1,0,0,0,1|2,0,0]=4 5302 B15R1.120 CC(O)CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100012276601 [0,1,0,0,0,1|2,0,0]=4 5303 B15R1.120 CC(O)CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100012276601 [0,1,0,0,0,1|2,0,0]=4 5304 B15R1.120 CC(O)CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000718519 [0,1,0,0,0,1|2,0,0]=4 5305 B15R1.120 CC(O)CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000718519 [0,1,0,0,0,1|2,0,0]=4 5306 B15R1.120 CC(O)CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000718519 [0,1,0,0,0,1|2,0,0]=4 5307 B15R1.120 CC(O)CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000718519 [0,1,0,0,0,1|2,0,0]=4 5308 B15R1.120 CC(O)CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000718519 [0,1,0,0,0,1|2,0,0]=4 5309 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)Br 11a_100000210904_100000747190 [0,1,0,0,0,1|2,0,0]=4 5310 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)Br 240690a_100000210904_100000747190 [0,1,0,0,0,1|2,0,0]=4 5311 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)Br 527a_100000210904_100000747190 [0,1,0,0,0,1|2,0,0]=4 5312 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)Cl 11a_100000210904_100000749307 [0,1,0,0,0,1|2,0,0]=4 5313 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)Cl 240690a_100000210904_100000749307 [0,1,0,0,0,1|2,0,0]=4 5314 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)Cl 527a_100000210904_100000749307 [0,1,0,0,0,1|2,0,0]=4 5315 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)F 11a_100000210904_100000211661 [0,1,0,0,0,1|2,0,0]=4 5316 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)F 240690a_100000210904_100000211661 [0,1,0,0,0,1|2,0,0]=4 5317 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)F 527a_100000210904_100000211661 [0,1,0,0,0,1|2,0,0]=4 5318 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)I 11a_100000210904_100000238430 [0,1,0,0,0,1|2,0,0]=4 5319 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)I 240690a_100000210904_100000238430 [0,1,0,0,0,1|2,0,0]=4 5320 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)I 527a_100000210904_100000238430 [0,1,0,0,0,1|2,0,0]=4 5321 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)O 240690a_100000210904_100000745134 [0,1,0,0,0,1|2,0,0]=4 5322 B15R1.120 CC(O)CNC(=O)Cc1cccc(c1)O 527a_100000210904_100000745134 [0,1,0,0,0,1|2,0,0]=4 5323 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000210904 [0,1,0,0,0,1|2,0,0]=4 5324 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000210904 [0,1,0,0,0,1|2,0,0]=4 5325 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000210904 [0,1,0,0,0,1|2,0,0]=4 5326 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000210904 [0,1,0,0,0,1|2,0,0]=4 5327 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)F 512a_100000210047_100000210904 [0,1,0,0,0,1|2,0,0]=4 5328 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000210904 [0,1,0,0,0,1|2,0,0]=4 5329 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)I 512a_100000211102_100000210904 [0,1,0,0,0,1|2,0,0]=4 5330 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000210904 [0,1,0,0,0,1|2,0,0]=4 5331 B15R1.120 CC(O)CNC(=O)Nc1cccc(c1)O 512a_100000210217_100000210904 [0,1,0,0,0,1|2,0,0]=4 5332 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000689311 [0,1,0,0,0,1|2,0,0]=4 5333 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000689311 [0,1,0,0,0,1|2,0,0]=4 5334 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000689311 [0,1,0,0,0,1|2,0,0]=4 5335 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000689311 [0,1,0,0,0,1|2,0,0]=4 5336 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Cl 2230a_100102631434_100000242061 [0,1,0,0,0,1|2,0,0]=4 5337 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000689311 [0,1,0,0,0,1|2,0,0]=4 5338 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)Cl 269982a_100102631434_100000242061 [0,1,0,0,0,1|2,0,0]=4 5339 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000689311 [0,1,0,0,0,1|2,0,0]=4 5340 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)F 2230a_100102631434_100000242062 [0,1,0,0,0,1|2,0,0]=4 5341 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000689311 [0,1,0,0,0,1|2,0,0]=4 5342 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)F 269982a_100102631434_100000242062 [0,1,0,0,0,1|2,0,0]=4 5343 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000689311 [0,1,0,0,0,1|2,0,0]=4 5344 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000689311 [0,1,0,0,0,1|2,0,0]=4 5345 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000689311 [0,1,0,0,0,1|2,0,0]=4 5346 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000689311 [0,1,0,0,0,1|2,0,0]=4 5347 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)O 2230a_100102631434_200011436826 [0,1,0,0,0,1|2,0,0]=4 5348 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000689311 [0,1,0,0,0,1|2,0,0]=4 5349 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)O 269982a_100102631434_200011436826 [0,1,0,0,0,1|2,0,0]=4 5350 B15R1.120 CN(C)CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000689311 [0,1,0,0,0,1|2,0,0]=4 5351 B15R1.120 C[S+](C)CCC(=O)Cc1cccc(c1)Br 1458a_100009452791_100000211773 [0,1,0,0,0,1|2,0,0]=4 5352 B15R1.120 C[S+](C)CCC(=O)Cc1cccc(c1)Cl 1458a_100009452791_100000181238 [0,1,0,0,0,1|2,0,0]=4 5353 B15R1.120 C[S+](C)CCC(=O)Cc1cccc(c1)F 1458a_100009452791_100000230114 [0,1,0,0,0,1|2,0,0]=4 5354 B15R1.120 C[S+](C)CCC(=O)Cc1cccc(c1)I 1458a_100009452791_100011218688 [0,1,0,0,0,1|2,0,0]=4 5355 B15R1.120 C[S+](C)CCC(=O)Cc1cccc(c1)O 1458a_100009452791_100011660834 [0,1,0,0,0,1|2,0,0]=4 5356 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100009452791 [0,1,0,0,0,1|2,0,0]=4 5357 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100009452791 [0,1,0,0,0,1|2,0,0]=4 5358 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100009452791 [0,1,0,0,0,1|2,0,0]=4 5359 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100009452791 [0,1,0,0,0,1|2,0,0]=4 5360 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100009452791 [0,1,0,0,0,1|2,0,0]=4 5361 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100009452791 [0,1,0,0,0,1|2,0,0]=4 5362 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)F 11a_100000210047_100009452791 [0,1,0,0,0,1|2,0,0]=4 5363 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100009452791 [0,1,0,0,0,1|2,0,0]=4 5364 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)F 22a_100000210047_100009452791 [0,1,0,0,0,1|2,0,0]=4 5365 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)I 11a_100000211102_100009452791 [0,1,0,0,0,1|2,0,0]=4 5366 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100009452791 [0,1,0,0,0,1|2,0,0]=4 5367 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)I 22a_100000211102_100009452791 [0,1,0,0,0,1|2,0,0]=4 5368 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100009452791 [0,1,0,0,0,1|2,0,0]=4 5369 B15R1.120 C[S+](C)CCC(=O)Nc1cccc(c1)O 22a_100000210217_100009452791 [0,1,0,0,0,1|2,0,0]=4 5370 B15R1.120 Cc1cc(ccn1)CC(=O)CCC(C)C 1458a_100000181311_200020672517 [0,1,0,0,0,1|2,0,0]=4 5371 B15R1.120 Cc1cccc(c1)CC(=O)C=CC(C)C 1458a_100016268746_100000211840 [0,1,0,0,0,1|1,0,1]=4 5372 B15R1.120 Cc1cccc(c1)CC(=O)CCC(C)C 1458a_100000181311_100000211840 [0,1,0,0,0,1|1,0,0]=3 5373 B15R1.120 Cc1cccc(c1)CC(=O)CCC(C)C 1458a_100011206899_100000210312 [0,1,0,0,0,1|1,0,0]=3 5374 B15R1.120 Cc1cccc(c1)CC(=O)CCC(C)O 1458a_100011206899_100012276601 [0,1,0,0,0,1|2,0,0]=4 5375 B15R1.120 Cc1cccc(c1)CC(=O)CC[S+](C)C 1458a_100009452791_100000211840 [0,1,0,0,0,1|2,0,0]=4 5376 B15R1.120 Cc1cccc(c1)CC(=O)COC(C)C 1458a_100000745533_100000211840 [0,1,0,0,0,1|2,0,0]=4 5377 B15R1.120 Cc1cccc(c1)CC(=O)CSC(C)C 1458a_100000241585_100000211840 [0,1,0,0,0,1|2,0,0]=4 5378 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)C 11a_100000210953_100011206899 [0,1,0,0,0,1|1,0,0]=3 5379 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)C 1626a_100000210953_100011206899 [0,1,0,0,0,1|1,0,0]=3 5380 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)C 240690a_100000210953_100011206899 [0,1,0,0,0,1|1,0,0]=3 5381 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)C 527a_100000210953_100011206899 [0,1,0,0,0,1|1,0,0]=3 5382 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)O 11a_100000210904_100011206899 [0,1,0,0,0,1|2,0,0]=4 5383 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)O 240690a_100000210904_100011206899 [0,1,0,0,0,1|2,0,0]=4 5384 B15R1.120 Cc1cccc(c1)CC(=O)NCC(C)O 527a_100000210904_100011206899 [0,1,0,0,0,1|2,0,0]=4 5385 B15R1.120 Cc1cccc(c1)CC(=O)NNC(C)C 22a_100000741168_100011206899 [0,1,0,0,0,1|2,0,0]=4 5386 B15R1.120 Cc1cccc(c1)NC(=O)C=CC(C)C 11a_100000188690_100016268746 [0,1,0,0,0,1|1,0,1]=4 5387 B15R1.120 Cc1cccc(c1)NC(=O)C=CC(C)C 1626a_100000188690_100016268746 [0,1,0,0,0,1|1,0,1]=4 5388 B15R1.120 Cc1cccc(c1)NC(=O)C=CC(C)C 22a_100000188690_100016268746 [0,1,0,0,0,1|1,0,1]=4 5389 B15R1.120 Cc1cccc(c1)NC(=O)CCC(C)C 11a_100000188690_100000181311 [0,1,0,0,0,1|1,0,0]=3 5390 B15R1.120 Cc1cccc(c1)NC(=O)CCC(C)C 1626a_100000188690_100000181311 [0,1,0,0,0,1|1,0,0]=3 5391 B15R1.120 Cc1cccc(c1)NC(=O)CCC(C)C 22a_100000188690_100000181311 [0,1,0,0,0,1|1,0,0]=3 5392 B15R1.120 Cc1cccc(c1)NC(=O)CCC(C)C 527a_100000188690_100000181311 [0,1,0,0,0,1|1,0,0]=3 5393 B15R1.120 Cc1cccc(c1)NC(=O)CCC(C)O 1626a_100000188690_100000718519 [0,1,0,0,0,1|2,0,0]=4 5394 B15R1.120 Cc1cccc(c1)NC(=O)CCN(C)C 11a_100000188690_100000689311 [0,1,0,0,0,1|2,0,0]=4 5395 B15R1.120 Cc1cccc(c1)NC(=O)CCN(C)C 2230a_100102631434_100011194834 [0,1,0,0,0,1|2,0,0]=4 5396 B15R1.120 Cc1cccc(c1)NC(=O)CCN(C)C 22a_100000188690_100000689311 [0,1,0,0,0,1|2,0,0]=4 5397 B15R1.120 Cc1cccc(c1)NC(=O)CCN(C)C 269982a_100102631434_100011194834 [0,1,0,0,0,1|2,0,0]=4 5398 B15R1.120 Cc1cccc(c1)NC(=O)CCN(C)C 527a_100000188690_100000689311 [0,1,0,0,0,1|2,0,0]=4 5399 B15R1.120 Cc1cccc(c1)NC(=O)CC[S+](C)C 11a_100000188690_100009452791 [0,1,0,0,0,1|2,0,0]=4 5400 B15R1.120 Cc1cccc(c1)NC(=O)CC[S+](C)C 1626a_100000188690_100009452791 [0,1,0,0,0,1|2,0,0]=4 5401 B15R1.120 Cc1cccc(c1)NC(=O)CC[S+](C)C 22a_100000188690_100009452791 [0,1,0,0,0,1|2,0,0]=4 5402 B15R1.120 Cc1cccc(c1)NC(=O)CNC(C)C 2230a_100138425928_100000182861 [0,1,0,0,0,1|2,0,0]=4 5403 B15R1.120 Cc1cccc(c1)NC(=O)CNC(C)C 34a_100138425928_100000182861 [0,1,0,0,0,1|2,0,0]=4 5404 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C 11a_100000188690_100000745533 [0,1,0,0,0,1|2,0,0]=4 5405 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C 1626a_100000188690_100000745533 [0,1,0,0,0,1|2,0,0]=4 5406 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C 22a_100000188690_100000745533 [0,1,0,0,0,1|2,0,0]=4 5407 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C 34a_100000212225_100000182861 [0,1,0,0,0,1|2,0,0]=4 5408 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C 34a_100000749660_100000210206 [0,1,0,0,0,1|2,0,0]=4 5409 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C 527a_100000188690_100000745533 [0,1,0,0,0,1|2,0,0]=4 5410 B15R1.120 Cc1cccc(c1)NC(=O)CSC(C)C 11a_100000188690_100000241585 [0,1,0,0,0,1|2,0,0]=4 5411 B15R1.120 Cc1cccc(c1)NC(=O)CSC(C)C 1626a_100000188690_100000241585 [0,1,0,0,0,1|2,0,0]=4 5412 B15R1.120 Cc1cccc(c1)NC(=O)CSC(C)C 22a_100000188690_100000241585 [0,1,0,0,0,1|2,0,0]=4 5413 B15R1.120 Cc1cccc(c1)NC(=O)CSC(C)C 527a_100000188690_100000241585 [0,1,0,0,0,1|2,0,0]=4 5414 B15R1.120 Cc1cccc(c1)NC(=O)CSC(C)C 62a_100000210206_100000182861 [0,1,0,0,0,1|2,0,0]=4 5415 B15R1.120 Cc1cccc(c1)NC(=O)CSC(C)C 62a_100000243722_100000210206 [0,1,0,0,0,1|2,0,0]=4 5416 B15R1.120 Cc1cccc(c1)NC(=O)NCC(C)C 2430a_100000188690_100000210953 [0,1,0,0,0,1|1,0,0]=3 5417 B15R1.120 Cc1cccc(c1)NC(=O)NCC(C)C 512a_100000188690_100000210953 [0,1,0,0,0,1|1,0,0]=3 5418 B15R1.120 Cc1cccc(c1)NC(=O)NCC(C)O 2430a_100000188690_100000210904 [0,1,0,0,0,1|2,0,0]=4 5419 B15R1.120 Cc1cccc(c1)NC(=O)NCC(C)O 512a_100000188690_100000210904 [0,1,0,0,0,1|2,0,0]=4 5420 B15R1.120 Cc1cccc(c1)NC(=O)NNC(C)C 512a_100000188690_100000741168 [0,1,0,0,0,1|2,0,0]=4 5421 B15R1.120 Cc1cccc(n1)CC(=O)CCC(C)C 1458a_100000181311_100000757606 [0,1,0,0,0,1|2,0,0]=4 5422 B15R1.120 Cc1cccc(n1)CC(=O)CCC(C)C 1458a_100012001110_100000210312 [0,1,0,0,0,1|2,0,0]=4 5423 B15R1.120 Cc1cccc(n1)CC(=O)NCC(C)C 11a_100000210953_100012001110 [0,1,0,0,0,1|2,0,0]=4 5424 B15R1.120 Cc1cccc(n1)CC(=O)NCC(C)C 1626a_100000210953_100012001110 [0,1,0,0,0,1|2,0,0]=4 5425 B15R1.120 Cc1cccc(n1)CC(=O)NCC(C)C 240690a_100000210953_100012001110 [0,1,0,0,0,1|2,0,0]=4 5426 B15R1.120 Cc1cccc(n1)CC(=O)NCC(C)C 527a_100000210953_100012001110 [0,1,0,0,0,1|2,0,0]=4 5427 B15R1.120 Cc1ccnc(c1)CC(=O)CCC(C)C 1458a_100000181311_100000718516 [0,1,0,0,0,1|2,0,0]=4 5428 B15R1.120 Cc1cncc(c1)CC(=O)CCC(C)C 1458a_100000181311_100000716715 [0,1,0,0,0,1|2,0,0]=4 5429 B15R1.256 CC(C)C=CC(=O)Cc1ccccc1Br 1458a_100016268746_100000184730 [0,1,0,0,0,1|1,0,1]=4 5430 B15R1.256 CC(C)C=CC(=O)Cc1ccccc1Cl 1458a_100016268746_100000187162 [0,1,0,0,0,1|1,0,1]=4 5431 B15R1.256 CC(C)C=CC(=O)Cc1ccccc1F 1458a_100016268746_100000187165 [0,1,0,0,0,1|1,0,1]=4 5432 B15R1.256 CC(C)C=CC(=O)Cc1ccccc1I 1458a_100016268746_100011216222 [0,1,0,0,0,1|1,0,1]=4 5433 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1Br 11a_100000210017_100016268746 [0,1,0,0,0,1|1,0,1]=4 5434 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1Br 1626a_100000210017_100016268746 [0,1,0,0,0,1|1,0,1]=4 5435 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1Cl 11a_100000185783_100016268746 [0,1,0,0,0,1|1,0,1]=4 5436 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100016268746 [0,1,0,0,0,1|1,0,1]=4 5437 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1Cl 22a_100000185783_100016268746 [0,1,0,0,0,1|1,0,1]=4 5438 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1F 11a_100000210422_100016268746 [0,1,0,0,0,1|1,0,1]=4 5439 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1F 1626a_100000210422_100016268746 [0,1,0,0,0,1|1,0,1]=4 5440 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1F 22a_100000210422_100016268746 [0,1,0,0,0,1|1,0,1]=4 5441 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1I 11a_100000210053_100016268746 [0,1,0,0,0,1|1,0,1]=4 5442 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1I 1626a_100000210053_100016268746 [0,1,0,0,0,1|1,0,1]=4 5443 B15R1.256 CC(C)C=CC(=O)Nc1ccccc1O 22a_100000185747_100016268746 [0,1,0,0,0,1|1,0,1]=4 5444 B15R1.256 CC(C)CCC(=O)Cc1ccccc1Br 1458a_100000181311_100000184730 [0,1,0,0,0,1|1,0,0]=3 5445 B15R1.256 CC(C)CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210312 [0,1,0,0,0,1|1,0,0]=3 5446 B15R1.256 CC(C)CCC(=O)Cc1ccccc1Cl 1458a_100000181311_100000187162 [0,1,0,0,0,1|1,0,0]=3 5447 B15R1.256 CC(C)CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210312 [0,1,0,0,0,1|1,0,0]=3 5448 B15R1.256 CC(C)CCC(=O)Cc1ccccc1F 1458a_100000181311_100000187165 [0,1,0,0,0,1|1,0,0]=3 5449 B15R1.256 CC(C)CCC(=O)Cc1ccccc1F 1458a_100000212012_100000210312 [0,1,0,0,0,1|1,0,0]=3 5450 B15R1.256 CC(C)CCC(=O)Cc1ccccc1I 1458a_100000036491_100000210312 [0,1,0,0,0,1|1,0,0]=3 5451 B15R1.256 CC(C)CCC(=O)Cc1ccccc1I 1458a_100000181311_100011216222 [0,1,0,0,0,1|1,0,0]=3 5452 B15R1.256 CC(C)CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210312 [0,1,0,0,0,1|1,0,0]=3 5453 B15R1.256 CC(C)CCC(=O)Cc1cccnc1Br 1458a_100000181311_100010140945 [0,1,0,0,0,1|2,0,0]=4 5454 B15R1.256 CC(C)CCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210312 [0,1,0,0,0,1|2,0,0]=4 5455 B15R1.256 CC(C)CCC(=O)Cc1cccnc1Cl 1458a_100000181311_100000045678 [0,1,0,0,0,1|2,0,0]=4 5456 B15R1.256 CC(C)CCC(=O)Cc1cccnc1F 1458a_100000181311_100000099810 [0,1,0,0,0,1|2,0,0]=4 5457 B15R1.256 CC(C)CCC(=O)Cc1ccncc1Cl 1458a_100000181311_100000763264 [0,1,0,0,0,1|2,0,0]=4 5458 B15R1.256 CC(C)CCC(=O)Cc1ncccc1Br 1458a_100000181311_100025702911 [0,1,0,0,0,1|2,0,0]=4 5459 B15R1.256 CC(C)CCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210312 [0,1,0,0,0,1|2,0,0]=4 5460 B15R1.256 CC(C)CCC(=O)Cc1ncccc1Cl 1458a_100000181311_100000099807 [0,1,0,0,0,1|2,0,0]=4 5461 B15R1.256 CC(C)CCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210312 [0,1,0,0,0,1|2,0,0]=4 5462 B15R1.256 CC(C)CCC(=O)Cc1ncccc1F 1458a_100000181311_100000104219 [0,1,0,0,0,1|2,0,0]=4 5463 B15R1.256 CC(C)CCC(=O)Cc1ncccc1O 1458a_100000181311_200020655725 [0,1,0,0,0,1|2,0,0]=4 5464 B15R1.256 CC(C)CCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210312 [0,1,0,0,0,1|2,0,0]=4 5465 B15R1.256 CC(C)CCC(=O)Nc1ccccc1Br 11a_100000210017_100000181311 [0,1,0,0,0,1|1,0,0]=3 5466 B15R1.256 CC(C)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000181311 [0,1,0,0,0,1|1,0,0]=3 5467 B15R1.256 CC(C)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000181311 [0,1,0,0,0,1|1,0,0]=3 5468 B15R1.256 CC(C)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000181311 [0,1,0,0,0,1|1,0,0]=3 5469 B15R1.256 CC(C)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000181311 [0,1,0,0,0,1|1,0,0]=3 5470 B15R1.256 CC(C)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000181311 [0,1,0,0,0,1|1,0,0]=3 5471 B15R1.256 CC(C)CCC(=O)Nc1ccccc1F 11a_100000210422_100000181311 [0,1,0,0,0,1|1,0,0]=3 5472 B15R1.256 CC(C)CCC(=O)Nc1ccccc1F 1626a_100000210422_100000181311 [0,1,0,0,0,1|1,0,0]=3 5473 B15R1.256 CC(C)CCC(=O)Nc1ccccc1F 22a_100000210422_100000181311 [0,1,0,0,0,1|1,0,0]=3 5474 B15R1.256 CC(C)CCC(=O)Nc1ccccc1F 527a_100000210422_100000181311 [0,1,0,0,0,1|1,0,0]=3 5475 B15R1.256 CC(C)CCC(=O)Nc1ccccc1I 11a_100000210053_100000181311 [0,1,0,0,0,1|1,0,0]=3 5476 B15R1.256 CC(C)CCC(=O)Nc1ccccc1I 1626a_100000210053_100000181311 [0,1,0,0,0,1|1,0,0]=3 5477 B15R1.256 CC(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000181311 [0,1,0,0,0,1|1,0,0]=3 5478 B15R1.256 CC(C)CCC(=O)Nc1ccccc1O 527a_100000185747_100000181311 [0,1,0,0,0,1|1,0,0]=3 5479 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Br 11a_100000210953_100000751119 [0,1,0,0,0,1|1,0,0]=3 5480 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Br 240690a_100000210953_100000751119 [0,1,0,0,0,1|1,0,0]=3 5481 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Br 527a_100000210953_100000751119 [0,1,0,0,0,1|1,0,0]=3 5482 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Cl 11a_100000210953_100000183793 [0,1,0,0,0,1|1,0,0]=3 5483 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Cl 1626a_100000210953_100000183793 [0,1,0,0,0,1|1,0,0]=3 5484 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Cl 240690a_100000210953_100000183793 [0,1,0,0,0,1|1,0,0]=3 5485 B15R1.256 CC(C)CNC(=O)Cc1ccccc1Cl 527a_100000210953_100000183793 [0,1,0,0,0,1|1,0,0]=3 5486 B15R1.256 CC(C)CNC(=O)Cc1ccccc1F 11a_100000210953_100000212012 [0,1,0,0,0,1|1,0,0]=3 5487 B15R1.256 CC(C)CNC(=O)Cc1ccccc1F 1626a_100000210953_100000212012 [0,1,0,0,0,1|1,0,0]=3 5488 B15R1.256 CC(C)CNC(=O)Cc1ccccc1F 240690a_100000210953_100000212012 [0,1,0,0,0,1|1,0,0]=3 5489 B15R1.256 CC(C)CNC(=O)Cc1ccccc1F 527a_100000210953_100000212012 [0,1,0,0,0,1|1,0,0]=3 5490 B15R1.256 CC(C)CNC(=O)Cc1ccccc1I 11a_100000210953_100000036491 [0,1,0,0,0,1|1,0,0]=3 5491 B15R1.256 CC(C)CNC(=O)Cc1ccccc1I 1626a_100000210953_100000036491 [0,1,0,0,0,1|1,0,0]=3 5492 B15R1.256 CC(C)CNC(=O)Cc1ccccc1I 240690a_100000210953_100000036491 [0,1,0,0,0,1|1,0,0]=3 5493 B15R1.256 CC(C)CNC(=O)Cc1ccccc1I 527a_100000210953_100000036491 [0,1,0,0,0,1|1,0,0]=3 5494 B15R1.256 CC(C)CNC(=O)Cc1ccccc1O 240690a_100000210953_100000743006 [0,1,0,0,0,1|1,0,0]=3 5495 B15R1.256 CC(C)CNC(=O)Cc1ccccc1O 527a_100000210953_100000743006 [0,1,0,0,0,1|1,0,0]=3 5496 B15R1.256 CC(C)CNC(=O)Cc1cccnc1Cl 11a_100000210953_100000093521 [0,1,0,0,0,1|2,0,0]=4 5497 B15R1.256 CC(C)CNC(=O)Cc1cccnc1Cl 1626a_100000210953_100000093521 [0,1,0,0,0,1|2,0,0]=4 5498 B15R1.256 CC(C)CNC(=O)Cc1cccnc1Cl 240690a_100000210953_100000093521 [0,1,0,0,0,1|2,0,0]=4 5499 B15R1.256 CC(C)CNC(=O)Cc1cccnc1Cl 527a_100000210953_100000093521 [0,1,0,0,0,1|2,0,0]=4 5500 B15R1.256 CC(C)CNC(=O)Cc1ncccc1Br 11a_100000210953_200012357574 [0,1,0,0,0,1|2,0,0]=4 5501 B15R1.256 CC(C)CNC(=O)Cc1ncccc1Br 240690a_100000210953_200012357574 [0,1,0,0,0,1|2,0,0]=4 5502 B15R1.256 CC(C)CNC(=O)Cc1ncccc1Cl 11a_100000210953_100011998755 [0,1,0,0,0,1|2,0,0]=4 5503 B15R1.256 CC(C)CNC(=O)Cc1ncccc1Cl 240690a_100000210953_100011998755 [0,1,0,0,0,1|2,0,0]=4 5504 B15R1.256 CC(C)CNC(=O)Cc1ncccc1Cl 527a_100000210953_100011998755 [0,1,0,0,0,1|2,0,0]=4 5505 B15R1.256 CC(C)CNC(=O)Cn1ccccc1=O 1626a_100000210953_100000189665 [0,1,0,0,0,1|2,0,0]=4 5506 B15R1.256 CC(C)CNC(=O)Cn1ccccc1=O 240690a_100000210953_100000189665 [0,1,0,0,0,1|2,0,0]=4 5507 B15R1.256 CC(C)CNC(=O)Cn1ccccc1=O 527a_100000210953_100000189665 [0,1,0,0,0,1|2,0,0]=4 5508 B15R1.256 CC(C)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100000210953 [0,1,0,0,0,1|1,0,0]=3 5509 B15R1.256 CC(C)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000210953 [0,1,0,0,0,1|1,0,0]=3 5510 B15R1.256 CC(C)CNC(=O)Nc1ccccc1F 2430a_100000210422_100000210953 [0,1,0,0,0,1|1,0,0]=3 5511 B15R1.256 CC(C)CNC(=O)Nc1ccccc1I 2430a_100000210053_100000210953 [0,1,0,0,0,1|1,0,0]=3 5512 B15R1.256 CC(C)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000210953 [0,1,0,0,0,1|1,0,0]=3 5513 B15R1.256 CC(C)NCC(=O)Cc1ccccc1Br 2230a_100138425928_100000700504 [0,1,0,0,0,1|2,0,0]=4 5514 B15R1.256 CC(C)NCC(=O)Cc1ccccc1Br 34a_100138425928_100000700504 [0,1,0,0,0,1|2,0,0]=4 5515 B15R1.256 CC(C)NCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210206 [0,1,0,0,0,1|2,0,0]=4 5516 B15R1.256 CC(C)NCC(=O)Nc1ccccc1Br 2230a_100138425928_100000182372 [0,1,0,0,0,1|2,0,0]=4 5517 B15R1.256 CC(C)NCC(=O)Nc1ccccc1Cl 2230a_100138425928_100000182448 [0,1,0,0,0,1|2,0,0]=4 5518 B15R1.256 CC(C)NCC(=O)Nc1ccccc1Cl 34a_100138425928_100000182448 [0,1,0,0,0,1|2,0,0]=4 5519 B15R1.256 CC(C)NCC(=O)Nc1ccccc1F 2230a_100138425928_100000182988 [0,1,0,0,0,1|2,0,0]=4 5520 B15R1.256 CC(C)NCC(=O)Nc1ccccc1F 34a_100138425928_100000243840 [0,1,0,0,0,1|2,0,0]=4 5521 B15R1.256 CC(C)NCC(=O)Nc1ccccc1I 2230a_100138425928_100000180142 [0,1,0,0,0,1|2,0,0]=4 5522 B15R1.256 CC(C)NCC(=O)Nc1ccccc1I 34a_100138425928_100000180142 [0,1,0,0,0,1|2,0,0]=4 5523 B15R1.256 CC(C)NNC(=O)Cc1ccccc1Br 22a_100000741168_100000751119 [0,1,0,0,0,1|2,0,0]=4 5524 B15R1.256 CC(C)NNC(=O)Cc1ccccc1Cl 22a_100000741168_100000183793 [0,1,0,0,0,1|2,0,0]=4 5525 B15R1.256 CC(C)NNC(=O)Cc1ccccc1F 22a_100000741168_100000212012 [0,1,0,0,0,1|2,0,0]=4 5526 B15R1.256 CC(C)NNC(=O)Cc1ccccc1I 22a_100000741168_100000036491 [0,1,0,0,0,1|2,0,0]=4 5527 B15R1.256 CC(C)NNC(=O)Cc1ccccc1O 22a_100000741168_100000743006 [0,1,0,0,0,1|2,0,0]=4 5528 B15R1.256 CC(C)OCC(=O)Cc1ccccc1Br 1458a_100000745533_100000184730 [0,1,0,0,0,1|2,0,0]=4 5529 B15R1.256 CC(C)OCC(=O)Cc1ccccc1Br 34a_100000212225_100000700504 [0,1,0,0,0,1|2,0,0]=4 5530 B15R1.256 CC(C)OCC(=O)Cc1ccccc1Cl 1458a_100000745533_100000187162 [0,1,0,0,0,1|2,0,0]=4 5531 B15R1.256 CC(C)OCC(=O)Cc1ccccc1F 1458a_100000745533_100000187165 [0,1,0,0,0,1|2,0,0]=4 5532 B15R1.256 CC(C)OCC(=O)Cc1ccccc1I 1458a_100000745533_100011216222 [0,1,0,0,0,1|2,0,0]=4 5533 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Br 11a_100000210017_100000745533 [0,1,0,0,0,1|2,0,0]=4 5534 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Br 1626a_100000210017_100000745533 [0,1,0,0,0,1|2,0,0]=4 5535 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Cl 11a_100000185783_100000745533 [0,1,0,0,0,1|2,0,0]=4 5536 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000745533 [0,1,0,0,0,1|2,0,0]=4 5537 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Cl 22a_100000185783_100000745533 [0,1,0,0,0,1|2,0,0]=4 5538 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Cl 34a_100000212225_100000182448 [0,1,0,0,0,1|2,0,0]=4 5539 B15R1.256 CC(C)OCC(=O)Nc1ccccc1Cl 527a_100000185783_100000745533 [0,1,0,0,0,1|2,0,0]=4 5540 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F 11a_100000210422_100000745533 [0,1,0,0,0,1|2,0,0]=4 5541 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F 1626a_100000210422_100000745533 [0,1,0,0,0,1|2,0,0]=4 5542 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F 22a_100000210422_100000745533 [0,1,0,0,0,1|2,0,0]=4 5543 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F 34a_100000212225_100000243840 [0,1,0,0,0,1|2,0,0]=4 5544 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F 527a_100000210422_100000745533 [0,1,0,0,0,1|2,0,0]=4 5545 B15R1.256 CC(C)OCC(=O)Nc1ccccc1I 11a_100000210053_100000745533 [0,1,0,0,0,1|2,0,0]=4 5546 B15R1.256 CC(C)OCC(=O)Nc1ccccc1I 1626a_100000210053_100000745533 [0,1,0,0,0,1|2,0,0]=4 5547 B15R1.256 CC(C)OCC(=O)Nc1ccccc1I 34a_100000212225_100000180142 [0,1,0,0,0,1|2,0,0]=4 5548 B15R1.256 CC(C)OCC(=O)Nc1ccccc1O 22a_100000185747_100000745533 [0,1,0,0,0,1|2,0,0]=4 5549 B15R1.256 CC(C)OCC(=O)Nc1ccccc1O 527a_100000185747_100000745533 [0,1,0,0,0,1|2,0,0]=4 5550 B15R1.256 CC(C)SCC(=O)Cc1ccccc1Br 1458a_100000241585_100000184730 [0,1,0,0,0,1|2,0,0]=4 5551 B15R1.256 CC(C)SCC(=O)Cc1ccccc1Br 62a_100000210206_100000700504 [0,1,0,0,0,1|2,0,0]=4 5552 B15R1.256 CC(C)SCC(=O)Cc1ccccc1Br 62a_100000700504_100000210206 [0,1,0,0,0,1|2,0,0]=4 5553 B15R1.256 CC(C)SCC(=O)Cc1ccccc1Cl 1458a_100000241585_100000187162 [0,1,0,0,0,1|2,0,0]=4 5554 B15R1.256 CC(C)SCC(=O)Cc1ccccc1F 1458a_100000241585_100000187165 [0,1,0,0,0,1|2,0,0]=4 5555 B15R1.256 CC(C)SCC(=O)Cc1ccccc1I 1458a_100000241585_100011216222 [0,1,0,0,0,1|2,0,0]=4 5556 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Br 11a_100000210017_100000241585 [0,1,0,0,0,1|2,0,0]=4 5557 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Br 1626a_100000210017_100000241585 [0,1,0,0,0,1|2,0,0]=4 5558 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Br 62a_100000182372_100000210206 [0,1,0,0,0,1|2,0,0]=4 5559 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Br 62a_100000210206_100000182372 [0,1,0,0,0,1|2,0,0]=4 5560 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl 11a_100000185783_100000241585 [0,1,0,0,0,1|2,0,0]=4 5561 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000241585 [0,1,0,0,0,1|2,0,0]=4 5562 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl 22a_100000185783_100000241585 [0,1,0,0,0,1|2,0,0]=4 5563 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl 527a_100000185783_100000241585 [0,1,0,0,0,1|2,0,0]=4 5564 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl 62a_100000210206_100000182448 [0,1,0,0,0,1|2,0,0]=4 5565 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210206 [0,1,0,0,0,1|2,0,0]=4 5566 B15R1.256 CC(C)SCC(=O)Nc1ccccc1F 11a_100000210422_100000241585 [0,1,0,0,0,1|2,0,0]=4 5567 B15R1.256 CC(C)SCC(=O)Nc1ccccc1F 1626a_100000210422_100000241585 [0,1,0,0,0,1|2,0,0]=4 5568 B15R1.256 CC(C)SCC(=O)Nc1ccccc1F 22a_100000210422_100000241585 [0,1,0,0,0,1|2,0,0]=4 5569 B15R1.256 CC(C)SCC(=O)Nc1ccccc1F 527a_100000210422_100000241585 [0,1,0,0,0,1|2,0,0]=4 5570 B15R1.256 CC(C)SCC(=O)Nc1ccccc1F 62a_100000182988_100000210206 [0,1,0,0,0,1|2,0,0]=4 5571 B15R1.256 CC(C)SCC(=O)Nc1ccccc1F 62a_100000210206_100000182988 [0,1,0,0,0,1|2,0,0]=4 5572 B15R1.256 CC(C)SCC(=O)Nc1ccccc1I 11a_100000210053_100000241585 [0,1,0,0,0,1|2,0,0]=4 5573 B15R1.256 CC(C)SCC(=O)Nc1ccccc1I 1626a_100000210053_100000241585 [0,1,0,0,0,1|2,0,0]=4 5574 B15R1.256 CC(C)SCC(=O)Nc1ccccc1I 62a_100000180142_100000210206 [0,1,0,0,0,1|2,0,0]=4 5575 B15R1.256 CC(C)SCC(=O)Nc1ccccc1I 62a_100000210206_100000180142 [0,1,0,0,0,1|2,0,0]=4 5576 B15R1.256 CC(C)SCC(=O)Nc1ccccc1O 22a_100000185747_100000241585 [0,1,0,0,0,1|2,0,0]=4 5577 B15R1.256 CC(C)SCC(=O)Nc1ccccc1O 527a_100000185747_100000241585 [0,1,0,0,0,1|2,0,0]=4 5578 B15R1.256 CC(C)SCC(=O)Nc1ccccc1O 62a_100000210206_100000014494 [0,1,0,0,0,1|2,0,0]=4 5579 B15R1.256 CC(O)CCC(=O)Cc1ccccc1Br 1458a_100000751119_100012276601 [0,1,0,0,0,1|2,0,0]=4 5580 B15R1.256 CC(O)CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100012276601 [0,1,0,0,0,1|2,0,0]=4 5581 B15R1.256 CC(O)CCC(=O)Cc1ccccc1F 1458a_100000212012_100012276601 [0,1,0,0,0,1|2,0,0]=4 5582 B15R1.256 CC(O)CCC(=O)Cc1ccccc1I 1458a_100000036491_100012276601 [0,1,0,0,0,1|2,0,0]=4 5583 B15R1.256 CC(O)CCC(=O)Cc1ccccc1O 1458a_100000743006_100012276601 [0,1,0,0,0,1|2,0,0]=4 5584 B15R1.256 CC(O)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000718519 [0,1,0,0,0,1|2,0,0]=4 5585 B15R1.256 CC(O)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000718519 [0,1,0,0,0,1|2,0,0]=4 5586 B15R1.256 CC(O)CCC(=O)Nc1ccccc1F 1626a_100000210422_100000718519 [0,1,0,0,0,1|2,0,0]=4 5587 B15R1.256 CC(O)CCC(=O)Nc1ccccc1I 1626a_100000210053_100000718519 [0,1,0,0,0,1|2,0,0]=4 5588 B15R1.256 CC(O)CNC(=O)Cc1ccccc1Br 11a_100000210904_100000751119 [0,1,0,0,0,1|2,0,0]=4 5589 B15R1.256 CC(O)CNC(=O)Cc1ccccc1Br 240690a_100000210904_100000751119 [0,1,0,0,0,1|2,0,0]=4 5590 B15R1.256 CC(O)CNC(=O)Cc1ccccc1Br 527a_100000210904_100000751119 [0,1,0,0,0,1|2,0,0]=4 5591 B15R1.256 CC(O)CNC(=O)Cc1ccccc1Cl 11a_100000210904_100000183793 [0,1,0,0,0,1|2,0,0]=4 5592 B15R1.256 CC(O)CNC(=O)Cc1ccccc1Cl 240690a_100000210904_100000183793 [0,1,0,0,0,1|2,0,0]=4 5593 B15R1.256 CC(O)CNC(=O)Cc1ccccc1Cl 527a_100000210904_100000183793 [0,1,0,0,0,1|2,0,0]=4 5594 B15R1.256 CC(O)CNC(=O)Cc1ccccc1F 11a_100000210904_100000212012 [0,1,0,0,0,1|2,0,0]=4 5595 B15R1.256 CC(O)CNC(=O)Cc1ccccc1F 240690a_100000210904_100000212012 [0,1,0,0,0,1|2,0,0]=4 5596 B15R1.256 CC(O)CNC(=O)Cc1ccccc1F 527a_100000210904_100000212012 [0,1,0,0,0,1|2,0,0]=4 5597 B15R1.256 CC(O)CNC(=O)Cc1ccccc1I 11a_100000210904_100000036491 [0,1,0,0,0,1|2,0,0]=4 5598 B15R1.256 CC(O)CNC(=O)Cc1ccccc1I 240690a_100000210904_100000036491 [0,1,0,0,0,1|2,0,0]=4 5599 B15R1.256 CC(O)CNC(=O)Cc1ccccc1I 527a_100000210904_100000036491 [0,1,0,0,0,1|2,0,0]=4 5600 B15R1.256 CC(O)CNC(=O)Cc1ccccc1O 240690a_100000210904_100000743006 [0,1,0,0,0,1|2,0,0]=4 5601 B15R1.256 CC(O)CNC(=O)Cc1ccccc1O 527a_100000210904_100000743006 [0,1,0,0,0,1|2,0,0]=4 5602 B15R1.256 CC(O)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100000210904 [0,1,0,0,0,1|2,0,0]=4 5603 B15R1.256 CC(O)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000210904 [0,1,0,0,0,1|2,0,0]=4 5604 B15R1.256 CC(O)CNC(=O)Nc1ccccc1F 2430a_100000210422_100000210904 [0,1,0,0,0,1|2,0,0]=4 5605 B15R1.256 CC(O)CNC(=O)Nc1ccccc1I 2430a_100000210053_100000210904 [0,1,0,0,0,1|2,0,0]=4 5606 B15R1.256 CC(O)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000210904 [0,1,0,0,0,1|2,0,0]=4 5607 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Br 11a_100000210017_100000689311 [0,1,0,0,0,1|2,0,0]=4 5608 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Br 2230a_100102631434_100000181489 [0,1,0,0,0,1|2,0,0]=4 5609 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Br 269982a_100102631434_100000181489 [0,1,0,0,0,1|2,0,0]=4 5610 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000689311 [0,1,0,0,0,1|2,0,0]=4 5611 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Cl 2230a_100102631434_100000242055 [0,1,0,0,0,1|2,0,0]=4 5612 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000689311 [0,1,0,0,0,1|2,0,0]=4 5613 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Cl 269982a_100102631434_100000242055 [0,1,0,0,0,1|2,0,0]=4 5614 B15R1.256 CN(C)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000689311 [0,1,0,0,0,1|2,0,0]=4 5615 B15R1.256 CN(C)CCC(=O)Nc1ccccc1F 11a_100000210422_100000689311 [0,1,0,0,0,1|2,0,0]=4 5616 B15R1.256 CN(C)CCC(=O)Nc1ccccc1F 2230a_100102631434_100000242066 [0,1,0,0,0,1|2,0,0]=4 5617 B15R1.256 CN(C)CCC(=O)Nc1ccccc1F 22a_100000210422_100000689311 [0,1,0,0,0,1|2,0,0]=4 5618 B15R1.256 CN(C)CCC(=O)Nc1ccccc1F 269982a_100102631434_100000242066 [0,1,0,0,0,1|2,0,0]=4 5619 B15R1.256 CN(C)CCC(=O)Nc1ccccc1F 527a_100000210422_100000689311 [0,1,0,0,0,1|2,0,0]=4 5620 B15R1.256 CN(C)CCC(=O)Nc1ccccc1I 11a_100000210053_100000689311 [0,1,0,0,0,1|2,0,0]=4 5621 B15R1.256 CN(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000689311 [0,1,0,0,0,1|2,0,0]=4 5622 B15R1.256 CN(C)CCC(=O)Nc1ccccc1O 527a_100000185747_100000689311 [0,1,0,0,0,1|2,0,0]=4 5623 B15R1.256 C[S+](C)CCC(=O)Cc1ccccc1Br 1458a_100009452791_100000184730 [0,1,0,0,0,1|2,0,0]=4 5624 B15R1.256 C[S+](C)CCC(=O)Cc1ccccc1Cl 1458a_100009452791_100000187162 [0,1,0,0,0,1|2,0,0]=4 5625 B15R1.256 C[S+](C)CCC(=O)Cc1ccccc1F 1458a_100009452791_100000187165 [0,1,0,0,0,1|2,0,0]=4 5626 B15R1.256 C[S+](C)CCC(=O)Cc1ccccc1I 1458a_100009452791_100011216222 [0,1,0,0,0,1|2,0,0]=4 5627 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1Br 11a_100000210017_100009452791 [0,1,0,0,0,1|2,0,0]=4 5628 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100009452791 [0,1,0,0,0,1|2,0,0]=4 5629 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100009452791 [0,1,0,0,0,1|2,0,0]=4 5630 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100009452791 [0,1,0,0,0,1|2,0,0]=4 5631 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100009452791 [0,1,0,0,0,1|2,0,0]=4 5632 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1F 11a_100000210422_100009452791 [0,1,0,0,0,1|2,0,0]=4 5633 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1F 1626a_100000210422_100009452791 [0,1,0,0,0,1|2,0,0]=4 5634 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1F 22a_100000210422_100009452791 [0,1,0,0,0,1|2,0,0]=4 5635 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1I 11a_100000210053_100009452791 [0,1,0,0,0,1|2,0,0]=4 5636 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1I 1626a_100000210053_100009452791 [0,1,0,0,0,1|2,0,0]=4 5637 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1O 22a_100000185747_100009452791 [0,1,0,0,0,1|2,0,0]=4 5638 B15R1.256 Cc1ccccc1CC(=O)C=CC(C)C 1458a_100016268746_100000211839 [0,1,0,0,0,1|1,0,1]=4 5639 B15R1.256 Cc1ccccc1CC(=O)CCC(C)C 1458a_100000181311_100000211839 [0,1,0,0,0,1|1,0,0]=3 5640 B15R1.256 Cc1ccccc1CC(=O)CCC(C)C 1458a_100000212180_100000210312 [0,1,0,0,0,1|1,0,0]=3 5641 B15R1.256 Cc1ccccc1CC(=O)CCC(C)O 1458a_100000212180_100012276601 [0,1,0,0,0,1|2,0,0]=4 5642 B15R1.256 Cc1ccccc1CC(=O)CC[S+](C)C 1458a_100009452791_100000211839 [0,1,0,0,0,1|2,0,0]=4 5643 B15R1.256 Cc1ccccc1CC(=O)CNC(C)C 2230a_100138425928_100011223134 [0,1,0,0,0,1|2,0,0]=4 5644 B15R1.256 Cc1ccccc1CC(=O)COC(C)C 1458a_100000745533_100000211839 [0,1,0,0,0,1|2,0,0]=4 5645 B15R1.256 Cc1ccccc1CC(=O)CSC(C)C 1458a_100000241585_100000211839 [0,1,0,0,0,1|2,0,0]=4 5646 B15R1.256 Cc1ccccc1CC(=O)CSC(C)C 62a_100000210206_100011223134 [0,1,0,0,0,1|2,0,0]=4 5647 B15R1.256 Cc1ccccc1CC(=O)CSC(C)C 62a_100011223134_100000210206 [0,1,0,0,0,1|2,0,0]=4 5648 B15R1.256 Cc1ccccc1CC(=O)NCC(C)C 11a_100000210953_100000212180 [0,1,0,0,0,1|1,0,0]=3 5649 B15R1.256 Cc1ccccc1CC(=O)NCC(C)C 1626a_100000210953_100000212180 [0,1,0,0,0,1|1,0,0]=3 5650 B15R1.256 Cc1ccccc1CC(=O)NCC(C)C 240690a_100000210953_100000212180 [0,1,0,0,0,1|1,0,0]=3 5651 B15R1.256 Cc1ccccc1CC(=O)NCC(C)C 527a_100000210953_100000212180 [0,1,0,0,0,1|1,0,0]=3 5652 B15R1.256 Cc1ccccc1CC(=O)NCC(C)O 11a_100000210904_100000212180 [0,1,0,0,0,1|2,0,0]=4 5653 B15R1.256 Cc1ccccc1CC(=O)NCC(C)O 240690a_100000210904_100000212180 [0,1,0,0,0,1|2,0,0]=4 5654 B15R1.256 Cc1ccccc1CC(=O)NCC(C)O 527a_100000210904_100000212180 [0,1,0,0,0,1|2,0,0]=4 5655 B15R1.256 Cc1ccccc1CC(=O)NNC(C)C 22a_100000741168_100000212180 [0,1,0,0,0,1|2,0,0]=4 5656 B15R1.256 Cc1ccccc1NC(=O)C=CC(C)C 11a_100015192222_100016268746 [0,1,0,0,0,1|1,0,1]=4 5657 B15R1.256 Cc1ccccc1NC(=O)C=CC(C)C 1626a_100015192222_100016268746 [0,1,0,0,0,1|1,0,1]=4 5658 B15R1.256 Cc1ccccc1NC(=O)C=CC(C)C 22a_100015192222_100016268746 [0,1,0,0,0,1|1,0,1]=4 5659 B15R1.256 Cc1ccccc1NC(=O)CCC(C)C 11a_100015192222_100000181311 [0,1,0,0,0,1|1,0,0]=3 5660 B15R1.256 Cc1ccccc1NC(=O)CCC(C)C 1626a_100015192222_100000181311 [0,1,0,0,0,1|1,0,0]=3 5661 B15R1.256 Cc1ccccc1NC(=O)CCC(C)C 22a_100015192222_100000181311 [0,1,0,0,0,1|1,0,0]=3 5662 B15R1.256 Cc1ccccc1NC(=O)CCC(C)C 527a_100015192222_100000181311 [0,1,0,0,0,1|1,0,0]=3 5663 B15R1.256 Cc1ccccc1NC(=O)CCC(C)O 1626a_100015192222_100000718519 [0,1,0,0,0,1|2,0,0]=4 5664 B15R1.256 Cc1ccccc1NC(=O)CCN(C)C 11a_100015192222_100000689311 [0,1,0,0,0,1|2,0,0]=4 5665 B15R1.256 Cc1ccccc1NC(=O)CCN(C)C 2230a_100102631434_200011206476 [0,1,0,0,0,1|2,0,0]=4 5666 B15R1.256 Cc1ccccc1NC(=O)CCN(C)C 22a_100015192222_100000689311 [0,1,0,0,0,1|2,0,0]=4 5667 B15R1.256 Cc1ccccc1NC(=O)CCN(C)C 269982a_100102631434_200011206476 [0,1,0,0,0,1|2,0,0]=4 5668 B15R1.256 Cc1ccccc1NC(=O)CCN(C)C 527a_100015192222_100000689311 [0,1,0,0,0,1|2,0,0]=4 5669 B15R1.256 Cc1ccccc1NC(=O)CC[S+](C)C 11a_100015192222_100009452791 [0,1,0,0,0,1|2,0,0]=4 5670 B15R1.256 Cc1ccccc1NC(=O)CC[S+](C)C 1626a_100015192222_100009452791 [0,1,0,0,0,1|2,0,0]=4 5671 B15R1.256 Cc1ccccc1NC(=O)CC[S+](C)C 22a_100015192222_100009452791 [0,1,0,0,0,1|2,0,0]=4 5672 B15R1.256 Cc1ccccc1NC(=O)CNC(C)C 2230a_100015186652_100000210206 [0,1,0,0,0,1|2,0,0]=4 5673 B15R1.256 Cc1ccccc1NC(=O)CNC(C)C 2230a_100138425928_100000183529 [0,1,0,0,0,1|2,0,0]=4 5674 B15R1.256 Cc1ccccc1NC(=O)CNC(C)C 34a_100138425928_100000183529 [0,1,0,0,0,1|2,0,0]=4 5675 B15R1.256 Cc1ccccc1NC(=O)COC(C)C 11a_100015192222_100000745533 [0,1,0,0,0,1|2,0,0]=4 5676 B15R1.256 Cc1ccccc1NC(=O)COC(C)C 1626a_100015192222_100000745533 [0,1,0,0,0,1|2,0,0]=4 5677 B15R1.256 Cc1ccccc1NC(=O)COC(C)C 22a_100015192222_100000745533 [0,1,0,0,0,1|2,0,0]=4 5678 B15R1.256 Cc1ccccc1NC(=O)COC(C)C 34a_100000212225_100000183529 [0,1,0,0,0,1|2,0,0]=4 5679 B15R1.256 Cc1ccccc1NC(=O)COC(C)C 527a_100015192222_100000745533 [0,1,0,0,0,1|2,0,0]=4 5680 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C 11a_100015192222_100000241585 [0,1,0,0,0,1|2,0,0]=4 5681 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C 1626a_100015192222_100000241585 [0,1,0,0,0,1|2,0,0]=4 5682 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C 22a_100015192222_100000241585 [0,1,0,0,0,1|2,0,0]=4 5683 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C 527a_100015192222_100000241585 [0,1,0,0,0,1|2,0,0]=4 5684 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C 62a_100000210206_100000183529 [0,1,0,0,0,1|2,0,0]=4 5685 B15R1.256 Cc1ccccc1NC(=O)NCC(C)C 2430a_100015192222_100000210953 [0,1,0,0,0,1|1,0,0]=3 5686 B15R1.256 Cc1ccccc1NC(=O)NCC(C)O 2430a_100015192222_100000210904 [0,1,0,0,0,1|2,0,0]=4 5687 B15R1.256 Cc1cccnc1CC(=O)CCC(C)C 1458a_100000181311_100000696600 [0,1,0,0,0,1|2,0,0]=4 5688 B15R1.256 Cc1cccnc1CC(=O)CCC(C)C 1458a_200000722269_100000210312 [0,1,0,0,0,1|2,0,0]=4 5689 B15R1.256 Cc1cccnc1CC(=O)NCC(C)C 11a_100000210953_200000722269 [0,1,0,0,0,1|2,0,0]=4 5690 B15R1.256 Cc1cccnc1CC(=O)NCC(C)C 1626a_100000210953_200000722269 [0,1,0,0,0,1|2,0,0]=4 5691 B15R1.256 Cc1cccnc1CC(=O)NCC(C)C 240690a_100000210953_200000722269 [0,1,0,0,0,1|2,0,0]=4 5692 B15R1.256 Cc1ccncc1CC(=O)CCC(C)C 1458a_100000181311_100000690890 [0,1,0,0,0,1|2,0,0]=4 5693 B15R1.256 Cc1cnccc1CC(=O)CCC(C)C 1458a_100000181311_100020672808 [0,1,0,0,0,1|2,0,0]=4 5694 B15R1.256 Cc1ncccc1CC(=O)CCC(C)C 1458a_100000181311_100000732876 [0,1,0,0,0,1|2,0,0]=4 5695 B15R1.496 C/C(=C\c1ccccc1)/C(=O)CC(C)C 1458a_100016990649_100000210624 [0,1,0,0,0,1|2,0,0]=4 5696 B15R1.496 CC(C)CC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210624 [0,1,0,0,0,1|2,0,0]=4 5697 B15R1.496 CC(C)CC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210624 [0,1,0,0,0,1|2,0,0]=4 5698 B15R1.496 CC(C)CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210624 [0,1,0,0,0,1|1,0,0]=3 5699 B15R1.496 CC(C)CC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_100000731052 [0,1,0,0,0,1|2,0,0]=4 5700 B15R1.496 CC(C)CC(C)C(=O)Cc1ccccn1 1458a_100000233486_100000731052 [0,1,0,0,0,1|2,0,0]=4 5701 B15R1.496 CC(C)CC(C)C(=O)Cc1cccnc1 1458a_100000737805_100000731052 [0,1,0,0,0,1|2,0,0]=4 5702 B15R1.496 CC(C)CN(C)C(=O)C[n+]1ccccc1 11a_100000747067_200000086051 [0,1,0,0,0,1|2,0,0]=4 5703 B15R1.496 CC(C)CN(C)C(=O)C[n+]1ccccc1 240690a_100000747067_200000086051 [0,1,0,0,0,1|2,0,0]=4 5704 B15R1.496 CC(C)CN(C)C(=O)C[n+]1ccccc1 527a_100000747067_200000086051 [0,1,0,0,0,1|2,0,0]=4 5705 B15R1.496 CC(C)CN(C)C(=O)Cc1ccccn1 11a_100000747067_100000233486 [0,1,0,0,0,1|2,0,0]=4 5706 B15R1.496 CC(C)CN(C)C(=O)Cc1cccnc1 11a_100000747067_100000737805 [0,1,0,0,0,1|2,0,0]=4 5707 B15R1.496 CC(C)CN(C)C(=O)Cc1cccnc1 240690a_100000747067_100000737805 [0,1,0,0,0,1|2,0,0]=4 5708 B15R1.496 CC(C)CN(C)C(=O)Cc1cccnc1 527a_100000747067_100000737805 [0,1,0,0,0,1|2,0,0]=4 5709 B15R1.496 CC(C)CN(C)C(=O)Cc1ccncc1 11a_100000747067_100011201483 [0,1,0,0,0,1|2,0,0]=4 5710 B15R1.496 CC(C)CN(C)C(=O)Cc1ccncc1 240690a_100000747067_100011201483 [0,1,0,0,0,1|2,0,0]=4 5711 B15R1.496 CC(C)CN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000747067 [0,1,0,0,0,1|1,0,0]=3 5712 B15R1.496 CC(C)C[C@H](O)C(=O)Cc1ccccc1 1458a_100012027011_100015291786 [0,1,0,0,0,1|1,0,0]=3 5713 B15R1.496 CC(C)C[C@H](O)C(=O)Cc1ccccn1 1458a_100012027011_100000721315 [0,1,0,0,0,1|2,0,0]=4 5714 B15R1.496 CC(C)C[C@H](O)C(=O)Cc1cccnc1 1458a_100012027011_100000733263 [0,1,0,0,0,1|2,0,0]=4 5715 B15R1.496 CC(C)C[C@H](O)C(=O)Cc1ccncc1 1458a_100012027011_100000705612 [0,1,0,0,0,1|2,0,0]=4 5716 B15R1.496 CC(C)C[C@H](O)C(=O)Nc1ccccc1 1626a_100000106764_100012027011 [0,1,0,0,0,1|1,0,0]=3 5717 B15R1.496 CC(C)C[C@H](O)C(=O)Nc1ccccc1 22a_100000106764_100012027011 [0,1,0,0,0,1|1,0,0]=3 5718 B15R1.496 CC(C)NC(=O)C(=O)Cc1ccccc1 1458a_100011220036_100015291786 [0,1,0,0,0,1|2,0,0]=4 5719 B15R1.496 CC(C)NC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100011220036 [0,1,0,0,0,1|2,0,0]=4 5720 B15R1.496 CC(C)NC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011220036 [0,1,0,0,0,1|2,0,0]=4 5721 B15R1.496 CC(C)NC(=O)C(=O)Nc1ccccc1 240690a_100138425928_100000738435 [0,1,0,0,0,1|2,0,0]=4 5722 B15R1.496 CC(C)NC(=O)C(=O)Nc1ccccc1 527a_100000106764_100011220036 [0,1,0,0,0,1|2,0,0]=4 5723 B15R1.496 CC(C)NC(C)C(=O)Nc1ccccc1 2230a_100000754830_100000210206 [0,1,0,0,0,1|2,0,0]=4 5724 B15R1.496 CC(C)NC(C)C(=O)Nc1ccccc1 2230a_100138425928_100000183986 [0,1,0,0,0,1|2,0,0]=4 5725 B15R1.496 CC(C)NC(C)C(=O)Nc1ccccc1 34a_100000754830_100000210206 [0,1,0,0,0,1|2,0,0]=4 5726 B15R1.496 CC(C)NC(C)C(=O)Nc1ccccc1 34a_100138425928_100000183986 [0,1,0,0,0,1|2,0,0]=4 5727 B15R1.496 CC(C)OC(C)C(=O)Nc1ccccc1 34a_100000212225_100000183986 [0,1,0,0,0,1|2,0,0]=4 5728 B15R1.496 CC(C)SC(C)C(=O)Nc1ccccc1 62a_100000183986_100000210206 [0,1,0,0,0,1|2,0,0]=4 5729 B15R1.496 CC(C)SC(C)C(=O)Nc1ccccc1 62a_100000210206_100000183986 [0,1,0,0,0,1|2,0,0]=4 5730 B15R1.496 CC(CN(C)C)C(=O)Cc1ccccc1 1458a_200015186601_100015291786 [0,1,0,0,0,1|2,0,0]=4 5731 B15R1.496 CC(CN(C)C)C(=O)Nc1ccccc1 1626a_100000106764_200015186601 [0,1,0,0,0,1|2,0,0]=4 5732 B15R1.496 CC(CN(C)C)C(=O)Nc1ccccc1 22a_100000106764_200015186601 [0,1,0,0,0,1|2,0,0]=4 5733 B15R1.496 CC(O)CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100011218427 [0,1,0,0,0,1|2,0,0]=4 5734 B15R1.496 CC(O)CN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000227577 [0,1,0,0,0,1|2,0,0]=4 5735 B15R1.964 CC(CF)OCC(=O)Cc1ccccc1 7a_100016041109_100000233483 [0,1,0,0,0,1|2,0,0]=4 5736 B15R1.964 CC(CF)OCC(=O)Nc1ccccc1 34a_100016041109_100000182850 [0,1,0,0,0,1|2,0,0]=4 5737 B15R1.964 CC(CF)OCC(=O)Nc1ccccc1 7a_100016041109_100000182850 [0,1,0,0,0,1|2,0,0]=4 5738 B15R1.964 CC(CF)OCC(=O)Oc1ccccc1 34a_100016041109_100009813826 [0,1,0,0,0,1|2,0,0]=4 5739 B15R1.964 CC(CF)OCC(=O)Oc1ccccc1 7a_100016041109_100009813826 [0,1,0,0,0,1|2,0,0]=4 5740 B15R1.964 CC(CN)COC(C)Cc1ccccc1 34a_100000744482_200011218536 [0,1,0,0,0,1|1,0,1]=4 5741 B15R1.964 CC(CN)OCC(=O)Nc1ccccc1 34a_100000210904_100000182850 [0,1,0,0,0,1|2,0,0]=4 5742 B15R1.964 CC(CN)OCC(=O)Oc1ccccc1 34a_100000210904_100009813826 [0,1,0,0,0,1|2,0,0]=4 5743 B15R1.964 CC(CO)CNC(=O)C[n+]1ccccc1 240690a_100000744482_200000086051 [0,1,0,0,0,1|2,0,0]=4 5744 B15R1.964 CC(CO)CNC(=O)C[n+]1ccccc1 527a_100000744482_200000086051 [0,1,0,0,0,1|2,0,0]=4 5745 B15R1.964 CC(CO)CNC(=O)Cc1cccnc1 240690a_100000744482_100000737805 [0,1,0,0,0,1|2,0,0]=4 5746 B15R1.964 CC(CO)CNC(=O)Cc1cccnc1 527a_100000744482_100000737805 [0,1,0,0,0,1|2,0,0]=4 5747 B15R1.964 CC(CO)CNC(=O)Cc1ccncc1 240690a_100000744482_100011201483 [0,1,0,0,0,1|2,0,0]=4 5748 B15R1.964 CC(CO)CNC(=O)Nc1ccccc1 2430a_100000106764_100000744482 [0,1,0,0,0,1|1,0,0]=3 5749 B15R1.964 CC(CO)OCC(=O)Nc1ccccc1 34a_100000246334_100012180447 [0,1,0,0,0,1|2,0,0]=4 5750 B15R1.964 CC(CO)SCC(=O)Cc1ccccc1 62a_100012180447_100000233483 [0,1,0,0,0,1|2,0,0]=4 5751 B15R1.964 CC(CO)SCC(=O)Nc1ccccc1 62a_100012180447_100000182850 [0,1,0,0,0,1|2,0,0]=4 5752 B15R1.964 CC(CO)SCC(=O)Oc1ccccc1 62a_100012180447_100009813826 [0,1,0,0,0,1|2,0,0]=4 5753 B15R1.964 CC(Cc1ccccc1)OC[C@@H](C)CO 34a_100000748627_100000059175 [0,1,0,0,0,1|1,0,1]=4 5754 B15R1.964 CC(Cc1ccccc1)OC[C@@H](C)CO 7a_100000748627_100000059175 [0,1,0,0,0,1|1,0,1]=4 5755 B15R1.964 CCC(C)CCC(=O)Cc1ccccc1 1458a_100000701222_100015291786 [0,1,0,0,0,1|1,0,0]=3 5756 B15R1.964 CCC(C)CCC(=O)Cc1ccccn1 1458a_100000701222_100000721315 [0,1,0,0,0,1|2,0,0]=4 5757 B15R1.964 CCC(C)CCC(=O)Cc1cccnc1 1458a_100000701222_100000733263 [0,1,0,0,0,1|2,0,0]=4 5758 B15R1.964 CCC(C)CCC(=O)Cc1ccncc1 1458a_100000701222_100000705612 [0,1,0,0,0,1|2,0,0]=4 5759 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000701222 [0,1,0,0,0,1|1,0,0]=3 5760 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100000701222 [0,1,0,0,0,1|1,0,0]=3 5761 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000701222 [0,1,0,0,0,1|1,0,0]=3 5762 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000701222 [0,1,0,0,0,1|1,0,0]=3 5763 B15R1.964 CCC(C)CNC(=O)C[n+]1ccccc1 11a_100020588543_200000086051 [0,1,0,0,0,1|2,0,0]=4 5764 B15R1.964 CCC(C)CNC(=O)C[n+]1ccccc1 240690a_100020588543_200000086051 [0,1,0,0,0,1|2,0,0]=4 5765 B15R1.964 CCC(C)CNC(=O)C[n+]1ccccc1 527a_100020588543_200000086051 [0,1,0,0,0,1|2,0,0]=4 5766 B15R1.964 CCC(C)CNC(=O)Cc1ccccn1 11a_100020588543_100000233486 [0,1,0,0,0,1|2,0,0]=4 5767 B15R1.964 CCC(C)CNC(=O)Cc1cccnc1 11a_100020588543_100000737805 [0,1,0,0,0,1|2,0,0]=4 5768 B15R1.964 CCC(C)CNC(=O)Cc1cccnc1 240690a_100020588543_100000737805 [0,1,0,0,0,1|2,0,0]=4 5769 B15R1.964 CCC(C)CNC(=O)Cc1cccnc1 527a_100020588543_100000737805 [0,1,0,0,0,1|2,0,0]=4 5770 B15R1.964 CCC(C)CNC(=O)Cc1ccncc1 11a_100020588543_100011201483 [0,1,0,0,0,1|2,0,0]=4 5771 B15R1.964 CCC(C)CNC(=O)Cc1ccncc1 240690a_100020588543_100011201483 [0,1,0,0,0,1|2,0,0]=4 5772 B15R1.964 CCC(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100020588543 [0,1,0,0,0,1|1,0,0]=3 5773 B15R1.964 CCC(C)COC(C)Cc1ccccc1 34a_100000748627_100000748023 [0,1,0,0,0,1|1,0,1]=4 5774 B15R1.964 CCC(C)COC(C)Cc1ccccc1 7a_100000748627_100000748023 [0,1,0,0,0,1|1,0,1]=4 5775 B15R1.964 CCC(C)NCC(=O)Cc1ccccc1 2230a_100000209981_100000233483 [0,1,0,0,0,1|2,0,0]=4 5776 B15R1.964 CCC(C)NCC(=O)Nc1ccccc1 2230a_100000209981_100000182850 [0,1,0,0,0,1|2,0,0]=4 5777 B15R1.964 CCC(C)NCC(=O)Oc1ccccc1 2230a_100000209981_100009813826 [0,1,0,0,0,1|2,0,0]=4 5778 B15R1.964 CCC(C)OCC(=O)Cc1ccccc1 7a_100000210228_100000233483 [0,1,0,0,0,1|2,0,0]=4 5779 B15R1.964 CCC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100011215416 [0,1,0,0,0,1|2,0,0]=4 5780 B15R1.964 CCC(C)OCC(=O)Nc1ccccc1 7a_100000210228_100000182850 [0,1,0,0,0,1|2,0,0]=4 5781 B15R1.964 CCC(C)OCC(=O)Oc1ccccc1 7a_100000210228_100009813826 [0,1,0,0,0,1|2,0,0]=4 5782 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000758301 [0,1,0,0,0,1|2,0,0]=4 5783 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 62a_100000758301_100000233483 [0,1,0,0,0,1|2,0,0]=4 5784 B15R1.964 CCC(C)SCC(=O)Nc1ccccc1 62a_100000758301_100000182850 [0,1,0,0,0,1|2,0,0]=4 5785 B15R1.964 CCC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000758301 [0,1,0,0,0,1|2,0,0]=4 5786 B15R1.964 CCC(C)SCC(=O)Oc1ccccc1 62a_100000758301_100009813826 [0,1,0,0,0,1|2,0,0]=4 5787 B15R1.964 CCC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000758301 [0,1,0,0,0,1|2,0,0]=4 5788 B15R1.964 CCC(O)CCC(=O)Nc1ccccc1 1626a_100000106764_203496584001 [0,1,0,0,0,1|2,0,0]=4 5789 B15R1.964 CCC(O)CCC(=O)Nc1ccccc1 22a_100000106764_203496584001 [0,1,0,0,0,1|2,0,0]=4 5790 B15R1.964 CCC(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100011218483 [0,1,0,0,0,1|2,0,0]=4 5791 B15R1.964 CCN(C)CCC(=O)Cc1ccccc1 1458a_100000755305_100015291786 [0,1,0,0,0,1|2,0,0]=4 5792 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 2230a_100000225621_100000242058 [0,1,0,0,0,1|2,0,0]=4 5793 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000755305 [0,1,0,0,0,1|2,0,0]=4 5794 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 269982a_100000225621_100000242058 [0,1,0,0,0,1|2,0,0]=4 5795 B15R1.964 CCN(C)CCC(=O)Oc1ccccc1 2230a_100000225621_200000035796 [0,1,0,0,0,1|2,0,0]=4 5796 B15R1.964 CCN(C)CCC(=O)Oc1ccccc1 269982a_100000225621_200000035796 [0,1,0,0,0,1|2,0,0]=4 5797 B15R1.964 CC[C@H](C)COC(C)Cc1ccccc1 34a_100000748627_100009816398 [0,1,0,0,0,1|1,0,1]=4 5798 B15R1.964 CC[C@H](C)COC(C)Cc1ccccc1 7a_100000748627_100009816398 [0,1,0,0,0,1|1,0,1]=4 5799 B15R1.964 CC[C@H](C)COC(C)Cc1ccccc1 7a_100009816381_200011218536 [0,1,0,0,0,1|1,0,1]=4 5800 B15R1.964 COC(C)COC(C)Cc1ccccc1 34a_100000690652_200011218536 [0,1,0,0,0,1|1,0,1]=4 5801 B15R1.964 COC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100009879195 [0,1,0,0,0,1|2,0,0]=4 5802 B15R1.964 COC(C)SCC(=O)Cc1ccccc1 62a_100009879195_100000233483 [0,1,0,0,0,1|2,0,0]=4 5803 B15R1.964 COC(C)SCC(=O)Nc1ccccc1 62a_100009879195_100000182850 [0,1,0,0,0,1|2,0,0]=4 5804 B15R1.964 COC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100009879195 [0,1,0,0,0,1|2,0,0]=4 5805 B15R1.964 COC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100009879195 [0,1,0,0,0,1|2,0,0]=4 5806 B15R1.964 COC(C)SCC(=O)Oc1ccccc1 62a_100009879195_100009813826 [0,1,0,0,0,1|2,0,0]=4 5807 B15R1.964 CO[C@H](C)CNC(=O)C[n+]1ccccc1 11a_100020591295_200000086051 [0,1,0,0,0,1|2,0,0]=4 5808 B15R1.964 CO[C@H](C)CNC(=O)C[n+]1ccccc1 240690a_100020591295_200000086051 [0,1,0,0,0,1|2,0,0]=4 5809 B15R1.964 CO[C@H](C)CNC(=O)C[n+]1ccccc1 527a_100020591295_200000086051 [0,1,0,0,0,1|2,0,0]=4 5810 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccccn1 11a_100020591295_100000233486 [0,1,0,0,0,1|2,0,0]=4 5811 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 11a_100020591295_100000737805 [0,1,0,0,0,1|2,0,0]=4 5812 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 240690a_100020591295_100000737805 [0,1,0,0,0,1|2,0,0]=4 5813 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 527a_100020591295_100000737805 [0,1,0,0,0,1|2,0,0]=4 5814 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccncc1 11a_100020591295_100011201483 [0,1,0,0,0,1|2,0,0]=4 5815 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccncc1 240690a_100020591295_100011201483 [0,1,0,0,0,1|2,0,0]=4 5816 B15R1.964 CO[C@H](C)CNC(=O)Nc1ccccc1 2430a_100000106764_100020591295 [0,1,0,0,0,1|1,0,0]=3 5817 B15R1.964 C[C@H](CO)NCC(=O)Cc1ccccc1 2230a_100000737577_100000233483 [0,1,0,0,0,1|2,0,0]=4 5818 B15R1.964 C[C@H](CO)NCC(=O)Nc1ccccc1 2230a_100000737577_100000182850 [0,1,0,0,0,1|2,0,0]=4 5819 B15R1.964 C[C@H](CO)NCC(=O)Oc1ccccc1 2230a_100000737577_100009813826 [0,1,0,0,0,1|2,0,0]=4 5820 B15R1.964 C[C@H](CO)SCC(=O)Cc1ccccc1 62a_100000233483_100016084084 [0,1,0,0,0,1|2,0,0]=4 5821 B15R1.964 C[C@H](CO)SCC(=O)Cc1ccccc1 62a_100016084084_100000233483 [0,1,0,0,0,1|2,0,0]=4 5822 B15R1.964 C[C@H](CO)SCC(=O)Nc1ccccc1 62a_100012148978_100016084084 [0,1,0,0,0,1|2,0,0]=4 5823 B15R1.964 C[C@H](CO)SCC(=O)Nc1ccccc1 62a_100016084084_100000182850 [0,1,0,0,0,1|2,0,0]=4 5824 B15R1.964 C[C@H](CO)SCC(=O)Oc1ccccc1 62a_100009813826_100016084084 [0,1,0,0,0,1|2,0,0]=4 5825 B15R1.964 C[C@H](CO)SCC(=O)Oc1ccccc1 62a_100016084084_100009813826 [0,1,0,0,0,1|2,0,0]=4 5826 B15R1.964 O=C(NC[C@@H](F)CO)Nc1ccccc1 2430a_100000106764_100015665980 [0,1,0,0,0,1|2,0,0]=4 5827 B15R1.964 O=C(NC[C@H](O)CO)Nc1ccccc1 2430a_100000106764_100020644852 [0,1,0,0,0,1|2,0,0]=4 5828 B15R1.3675 CC(=O)C(C)OC(=O)Nc1ccccc1 1458a_100000032784_200000210301 [0,1,0,0,0,1|1,0,1]=4 5829 B15R1.3675 CC(C)C(=O)CC(=O)Cc1ccccc1 1458a_100000210198_100000233483 [0,1,0,0,0,1|1,0,1]=4 5830 B15R1.3675 CC(C)C(=O)CC(=O)Nc1ccccc1 1458a_100000210198_100000182850 [0,1,0,0,0,1|1,0,1]=4 5831 B15R1.3675 CC(C)C(=O)CC(=O)Oc1ccccc1 1458a_100000210198_100009813826 [0,1,0,0,0,1|1,0,1]=4 5832 B15R1.3675 CC(C)C(C)NC(=O)C[n+]1ccccc1 11a_100000211541_200000086051 [0,1,0,0,0,1|2,0,0]=4 5833 B15R1.3675 CC(C)C(C)NC(=O)C[n+]1ccccc1 240690a_100000211541_200000086051 [0,1,0,0,0,1|2,0,0]=4 5834 B15R1.3675 CC(C)C(C)NC(=O)C[n+]1ccccc1 527a_100000211541_200000086051 [0,1,0,0,0,1|2,0,0]=4 5835 B15R1.3675 CC(C)C(C)NC(=O)Cc1ccccn1 11a_100000211541_100000233486 [0,1,0,0,0,1|2,0,0]=4 5836 B15R1.3675 CC(C)C(C)NC(=O)Cc1cccnc1 11a_100000211541_100000737805 [0,1,0,0,0,1|2,0,0]=4 5837 B15R1.3675 CC(C)C(C)NC(=O)Cc1cccnc1 240690a_100000211541_100000737805 [0,1,0,0,0,1|2,0,0]=4 5838 B15R1.3675 CC(C)C(C)NC(=O)Cc1cccnc1 527a_100000211541_100000737805 [0,1,0,0,0,1|2,0,0]=4 5839 B15R1.3675 CC(C)C(C)NC(=O)Cc1ccncc1 11a_100000211541_100011201483 [0,1,0,0,0,1|2,0,0]=4 5840 B15R1.3675 CC(C)C(C)NC(=O)Cc1ccncc1 240690a_100000211541_100011201483 [0,1,0,0,0,1|2,0,0]=4 5841 B15R1.3675 CC(C)C(C)NC(=O)Nc1ccccc1 2430a_100000106764_100000211541 [0,1,0,0,0,1|1,0,0]=3 5842 B15R1.3675 CC(C)N(C)CC(=O)Cc1ccccc1 1458a_100000743827_100015291786 [0,1,0,0,0,1|2,0,0]=4 5843 B15R1.3675 CC(C)N(C)CC(=O)Cc1ccccc1 269982a_200000211004_100000233483 [0,1,0,0,0,1|2,0,0]=4 5844 B15R1.3675 CC(C)N(C)CC(=O)Nc1ccccc1 11a_100000106764_100000743827 [0,1,0,0,0,1|2,0,0]=4 5845 B15R1.3675 CC(C)N(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000743827 [0,1,0,0,0,1|2,0,0]=4 5846 B15R1.3675 CC(C)N(C)CC(=O)Nc1ccccc1 22a_100000106764_100000743827 [0,1,0,0,0,1|2,0,0]=4 5847 B15R1.3675 CC(C)N(C)CC(=O)Nc1ccccc1 269982a_200000211004_100000182850 [0,1,0,0,0,1|2,0,0]=4 5848 B15R1.3675 CC(C)N(C)CC(=O)Nc1ccccc1 527a_100000106764_100000743827 [0,1,0,0,0,1|2,0,0]=4 5849 B15R1.3675 CC(C)N(C)CC(=O)Oc1ccccc1 269982a_200000211004_100009813826 [0,1,0,0,0,1|2,0,0]=4 5850 B15R1.3675 CC(CC(=O)Cc1ccccc1)N(C)C 1458a_100011311895_100015291786 [0,1,0,0,0,1|2,0,0]=4 5851 B15R1.3675 CC(CC(=O)Nc1ccccc1)N(C)C 1626a_100000106764_100011311895 [0,1,0,0,0,1|2,0,0]=4 5852 B15R1.3675 CC(CC(=O)Nc1ccccc1)N(C)C 22a_100000106764_100011311895 [0,1,0,0,0,1|2,0,0]=4 5853 B15R1.3675 CC(Cc1ccccc1)OC(C)C(C)C 7a_100000748068_200011218536 [0,1,0,0,0,1|1,0,1]=4 5854 B15R1.3675 CC(OC(=O)Nc1ccccc1)C(=O)[13CH3] 1458a_100000032784_200025704644 [0,1,0,0,0,1|1,0,1]=4 5855 B15R1.4008 C#CC(Cc1ccccc1)OCC(C)C 34a_100000685211_100000210624 [0,1,0,0,0,1|1,0,1]=4 5856 B15R1.4008 C#CC(Cc1ccccc1)OCC(C)C 7a_100000685211_100000210760 [0,1,0,0,0,1|1,0,1]=4 5857 B15R1.4008 CC(C)COC(CN)Cc1ccccc1 34a_100000752270_100000210624 [0,1,0,0,0,1|1,0,1]=4 5858 B15R1.4008 CC(C)CO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000210760 [0,1,0,0,0,1|1,0,1]=4 5859 B15R1.4008 CCC(Cc1ccccc1)OCC(C)C 7a_100000760156_100000210760 [0,1,0,0,0,1|1,0,1]=4 5860 B15R1.9108 CC(C)(C)C#CC(=O)Cc1ccccc1 1458a_100011966651_100015291786 [0,1,0,0,0,1|1,0,1]=4 5861 B15R1.9108 CC(C)(C)C#CC(=O)Nc1ccccc1 22a_100000106764_100011966651 [0,1,0,0,0,1|1,0,1]=4 5862 B15R1.9108 CC(C)(C)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000755188 [0,1,0,0,0,1|2,0,0]=4 5863 B15R1.9108 CC(C)(C)CCC(=O)Cc1ccccc1 1458a_100000757465_100015291786 [0,1,0,0,0,1|1,0,0]=3 5864 B15R1.9108 CC(C)(C)CCC(=O)Cc1ccccn1 1458a_100000233486_100000755188 [0,1,0,0,0,1|2,0,0]=4 5865 B15R1.9108 CC(C)(C)CCC(=O)Cc1ccccn1 1458a_100000757465_100000721315 [0,1,0,0,0,1|2,0,0]=4 5866 B15R1.9108 CC(C)(C)CCC(=O)Cc1cccnc1 1458a_100000737805_100000755188 [0,1,0,0,0,1|2,0,0]=4 5867 B15R1.9108 CC(C)(C)CCC(=O)Cc1cccnc1 1458a_100000757465_100000733263 [0,1,0,0,0,1|2,0,0]=4 5868 B15R1.9108 CC(C)(C)CCC(=O)Cc1ccncc1 1458a_100000757465_100000705612 [0,1,0,0,0,1|2,0,0]=4 5869 B15R1.9108 CC(C)(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000757465 [0,1,0,0,0,1|1,0,0]=3 5870 B15R1.9108 CC(C)(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100000757465 [0,1,0,0,0,1|1,0,0]=3 5871 B15R1.9108 CC(C)(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000757465 [0,1,0,0,0,1|1,0,0]=3 5872 B15R1.9108 CC(C)(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000757465 [0,1,0,0,0,1|1,0,0]=3 5873 B15R1.9108 CC(C)(C)CNC(=O)C[n+]1ccccc1 11a_100000743828_200000086051 [0,1,0,0,0,1|2,0,0]=4 5874 B15R1.9108 CC(C)(C)CNC(=O)C[n+]1ccccc1 240690a_100000743828_200000086051 [0,1,0,0,0,1|2,0,0]=4 5875 B15R1.9108 CC(C)(C)CNC(=O)C[n+]1ccccc1 527a_100000743828_200000086051 [0,1,0,0,0,1|2,0,0]=4 5876 B15R1.9108 CC(C)(C)CNC(=O)Cc1ccccn1 11a_100000743828_100000233486 [0,1,0,0,0,1|2,0,0]=4 5877 B15R1.9108 CC(C)(C)CNC(=O)Cc1cccnc1 11a_100000743828_100000737805 [0,1,0,0,0,1|2,0,0]=4 5878 B15R1.9108 CC(C)(C)CNC(=O)Cc1cccnc1 240690a_100000743828_100000737805 [0,1,0,0,0,1|2,0,0]=4 5879 B15R1.9108 CC(C)(C)CNC(=O)Cc1cccnc1 527a_100000743828_100000737805 [0,1,0,0,0,1|2,0,0]=4 5880 B15R1.9108 CC(C)(C)CNC(=O)Cc1ccncc1 11a_100000743828_100011201483 [0,1,0,0,0,1|2,0,0]=4 5881 B15R1.9108 CC(C)(C)CNC(=O)Cc1ccncc1 240690a_100000743828_100011201483 [0,1,0,0,0,1|2,0,0]=4 5882 B15R1.9108 CC(C)(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100000743828 [0,1,0,0,0,1|1,0,0]=3 5883 B15R1.9108 CC(C)(C)NCC(=O)Cc1ccccc1 2230a_100000715429_100000233483 [0,1,0,0,0,1|2,0,0]=4 5884 B15R1.9108 CC(C)(C)NCC(=O)Nc1ccccc1 2230a_100000715429_100000182850 [0,1,0,0,0,1|2,0,0]=4 5885 B15R1.9108 CC(C)(C)NCC(=O)Oc1ccccc1 2230a_100000715429_100009813826 [0,1,0,0,0,1|2,0,0]=4 5886 B15R1.9108 CC(C)(C)OCC(=O)Cc1ccccc1 1458a_100000686494_100015291786 [0,1,0,0,0,1|2,0,0]=4 5887 B15R1.9108 CC(C)(C)OCC(=O)Cc1ccccc1 7a_100015890283_100000233483 [0,1,0,0,0,1|2,0,0]=4 5888 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 11a_100000106764_100000686494 [0,1,0,0,0,1|2,0,0]=4 5889 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 1626a_100000106764_100000686494 [0,1,0,0,0,1|2,0,0]=4 5890 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 22a_100000106764_100000686494 [0,1,0,0,0,1|2,0,0]=4 5891 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 34a_100000246334_100000210625 [0,1,0,0,0,1|2,0,0]=4 5892 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 34a_100015890283_100000182850 [0,1,0,0,0,1|2,0,0]=4 5893 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 527a_100000106764_100000686494 [0,1,0,0,0,1|2,0,0]=4 5894 B15R1.9108 CC(C)(C)OCC(=O)Nc1ccccc1 7a_100015890283_100000182850 [0,1,0,0,0,1|2,0,0]=4 5895 B15R1.9108 CC(C)(C)OCC(=O)Oc1ccccc1 34a_100015890283_100009813826 [0,1,0,0,0,1|2,0,0]=4 5896 B15R1.9108 CC(C)(C)OCC(=O)Oc1ccccc1 7a_100015890283_100009813826 [0,1,0,0,0,1|2,0,0]=4 5897 B15R1.9108 CC(C)(C)SCC(=O)Cc1ccccc1 62a_100000211941_100000233483 [0,1,0,0,0,1|2,0,0]=4 5898 B15R1.9108 CC(C)(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000211941 [0,1,0,0,0,1|2,0,0]=4 5899 B15R1.9108 CC(C)(C)SCC(=O)Nc1ccccc1 62a_100000211941_100000182850 [0,1,0,0,0,1|2,0,0]=4 5900 B15R1.9108 CC(C)(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000211941 [0,1,0,0,0,1|2,0,0]=4 5901 B15R1.9108 CC(C)(C)SCC(=O)Oc1ccccc1 62a_100000211941_100009813826 [0,1,0,0,0,1|2,0,0]=4 5902 B15R1.9108 CC(C)(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000211941 [0,1,0,0,0,1|2,0,0]=4 5903 B15R1.9108 CC(C)(F)CNC(=O)C[n+]1ccccc1 11a_100020643315_200000086051 [0,1,0,0,0,1|2,0,0]=4 5904 B15R1.9108 CC(C)(F)CNC(=O)C[n+]1ccccc1 240690a_100020643315_200000086051 [0,1,0,0,0,1|2,0,0]=4 5905 B15R1.9108 CC(C)(F)CNC(=O)C[n+]1ccccc1 527a_100020643315_200000086051 [0,1,0,0,0,1|2,0,0]=4 5906 B15R1.9108 CC(C)(F)CNC(=O)Cc1ccccn1 11a_100020643315_100000233486 [0,1,0,0,0,1|2,0,0]=4 5907 B15R1.9108 CC(C)(F)CNC(=O)Cc1cccnc1 11a_100020643315_100000737805 [0,1,0,0,0,1|2,0,0]=4 5908 B15R1.9108 CC(C)(F)CNC(=O)Cc1cccnc1 240690a_100020643315_100000737805 [0,1,0,0,0,1|2,0,0]=4 5909 B15R1.9108 CC(C)(F)CNC(=O)Cc1cccnc1 527a_100020643315_100000737805 [0,1,0,0,0,1|2,0,0]=4 5910 B15R1.9108 CC(C)(F)CNC(=O)Cc1ccncc1 11a_100020643315_100011201483 [0,1,0,0,0,1|2,0,0]=4 5911 B15R1.9108 CC(C)(F)CNC(=O)Cc1ccncc1 240690a_100020643315_100011201483 [0,1,0,0,0,1|2,0,0]=4 5912 B15R1.9108 CC(C)(F)CNC(=O)Nc1ccccc1 2430a_100000106764_100020643315 [0,1,0,0,0,1|1,0,0]=3 5913 B15R1.9108 CC(C)(O)CNC(=O)C[n+]1ccccc1 240690a_100000751335_200000086051 [0,1,0,0,0,1|2,0,0]=4 5914 B15R1.9108 CC(C)(O)CNC(=O)C[n+]1ccccc1 527a_100000751335_200000086051 [0,1,0,0,0,1|2,0,0]=4 5915 B15R1.9108 CC(C)(O)CNC(=O)Cc1cccnc1 240690a_100000751335_100000737805 [0,1,0,0,0,1|2,0,0]=4 5916 B15R1.9108 CC(C)(O)CNC(=O)Cc1cccnc1 527a_100000751335_100000737805 [0,1,0,0,0,1|2,0,0]=4 5917 B15R1.9108 CC(C)(O)CNC(=O)Cc1ccncc1 240690a_100000751335_100011201483 [0,1,0,0,0,1|2,0,0]=4 5918 B15R1.9108 CC(C)(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100000751335 [0,1,0,0,0,1|1,0,0]=3 5919 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)C 34a_100000748627_100011219605 [0,1,0,0,0,1|1,0,1]=4 5920 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)F 34a_100000716592_200011218536 [0,1,0,0,0,1|1,0,1]=4 5921 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)F 34a_100000748627_100011997219 [0,1,0,0,0,1|1,0,1]=4 5922 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)O 34a_100000748627_100000764493 [0,1,0,0,0,1|1,0,1]=4 5923 B15R1.9108 CC(Cc1ccccc1)OCC(C)(C)O 7a_100000748627_100000764493 [0,1,0,0,0,1|1,0,1]=4 5924 B15R1.9108 CC(F)(F)CCC(=O)Cc1ccccc1 1458a_100000030992_100015291786 [0,1,0,0,0,1|2,0,0]=4 5925 B15R1.9108 CC(F)(F)CCC(=O)Nc1ccccc1 11a_100000106764_100000030992 [0,1,0,0,0,1|2,0,0]=4 5926 B15R1.9108 CC(F)(F)CCC(=O)Nc1ccccc1 1626a_100000106764_100000030992 [0,1,0,0,0,1|2,0,0]=4 5927 B15R1.9108 CC(F)(F)CCC(=O)Nc1ccccc1 22a_100000106764_100000030992 [0,1,0,0,0,1|2,0,0]=4 5928 B15R1.9108 CC(F)(F)CCC(=O)Nc1ccccc1 527a_100000106764_100000030992 [0,1,0,0,0,1|2,0,0]=4 5929 B15R1.9108 CC(F)(F)CNC(=O)Nc1ccccc1 2430a_100000106764_100000731000 [0,1,0,0,0,1|2,0,0]=4 5930 B15R1.9108 C[Si](C)(C)CCC(=O)Cc1ccccc1 1458a_100011215282_100015291786 [0,1,0,0,0,1|1,1,0]=4 5931 B15R1.9108 C[Si](C)(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100011215282 [0,1,0,0,0,1|1,1,0]=4 5932 B15R1.9108 C[Si](C)(C)CCC(=O)Nc1ccccc1 22a_100000106764_100011215282 [0,1,0,0,0,1|1,1,0]=4 5933 B15R1.9108 C[Si](C)(C)CCC(=O)Nc1ccccc1 527a_100000106764_100011215282 [0,1,0,0,0,1|1,1,0]=4 5934 B15R1.9108 C[Si](C)(C)CNC(=O)Nc1ccccc1 2430a_100000106764_102516607284 [0,1,0,0,0,1|1,1,0]=4 5935 B15R1.12243 CC(C)CCS(=O)(=O)Nc1ccccc1 20a_100000106764_100000750698 [0,1,0,0,0,1|2,0,0]=4 5936 B15R1.12243 CC(C)CCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000750698 [0,1,0,0,0,1|2,0,0]=4 5937 B15R1.12243 CC(C)CNS(=O)(=O)Cc1ccccc1 270084a_100000210953_100000211737 [0,1,0,0,0,1|2,0,0]=4 5938 B15R1.12243 CC(C)CNS(=O)(=O)Cc1ccccc1 274078a_100000210953_100000211737 [0,1,0,0,0,1|2,0,0]=4 5939 B15R1.12243 CC(C)CNS(=O)(=O)Cc1ccccc1 40a_100000210953_100000235865 [0,1,0,0,0,1|2,0,0]=4 5940 B15R1.12243 CC(C)COC(C)(C)Cc1ccccc1 7a_100011215222_100000210760 [0,1,0,0,0,1|1,0,1]=4 5941 B15R1.65 C#Cc1cccc(c1)C(=O)CCC(C)C 1458a_100011997762_100000210312 [0,2,0,0,0,0|1,0,0]=3 5942 B15R1.65 C#Cc1cccc(c1)C(=O)CCC(C)O 1458a_100011997762_100012276601 [0,2,0,0,0,0|2,0,0]=4 5943 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)C 11a_100000210953_100011997762 [0,2,0,0,0,0|1,0,0]=3 5944 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)C 1626a_100000210953_100011997762 [0,2,0,0,0,0|1,0,0]=3 5945 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)C 240690a_100000210953_100011997762 [0,2,0,0,0,0|1,0,0]=3 5946 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)C 527a_100000210953_100011997762 [0,2,0,0,0,0|1,0,0]=3 5947 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)O 11a_100000210904_100011997762 [0,2,0,0,0,0|2,0,0]=4 5948 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)O 240690a_100000210904_100011997762 [0,2,0,0,0,0|2,0,0]=4 5949 B15R1.65 C#Cc1cccc(c1)C(=O)NCC(C)O 527a_100000210904_100011997762 [0,2,0,0,0,0|2,0,0]=4 5950 B15R1.65 C#Cc1cccc(c1)C(=O)NNC(C)C 22a_100000741168_100011997762 [0,2,0,0,0,0|2,0,0]=4 5951 B15R1.65 C=Cc1cccc(c1)C(=O)CCC(C)C 1458a_100011215009_100000210312 [0,2,0,0,0,0|1,0,0]=3 5952 B15R1.65 C=Cc1cccc(c1)C(=O)CCC(C)O 1458a_100011215009_100012276601 [0,2,0,0,0,0|2,0,0]=4 5953 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)C 11a_100000210953_100011215009 [0,2,0,0,0,0|1,0,0]=3 5954 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)C 1626a_100000210953_100011215009 [0,2,0,0,0,0|1,0,0]=3 5955 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)C 240690a_100000210953_100011215009 [0,2,0,0,0,0|1,0,0]=3 5956 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)C 527a_100000210953_100011215009 [0,2,0,0,0,0|1,0,0]=3 5957 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)O 11a_100000210904_100011215009 [0,2,0,0,0,0|2,0,0]=4 5958 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)O 240690a_100000210904_100011215009 [0,2,0,0,0,0|2,0,0]=4 5959 B15R1.65 C=Cc1cccc(c1)C(=O)NCC(C)O 527a_100000210904_100011215009 [0,2,0,0,0,0|2,0,0]=4 5960 B15R1.65 C=Cc1cccc(c1)C(=O)NNC(C)C 22a_100000741168_100011215009 [0,2,0,0,0,0|2,0,0]=4 5961 B15R1.65 CC(C)CCC(=O)c1cccc(c1)C#N 1458a_100000183950_100000210312 [0,2,0,0,0,0|1,0,0]=3 5962 B15R1.65 CC(C)CCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210312 [0,2,0,0,0,0|1,0,0]=3 5963 B15R1.65 CC(C)CNC(=O)c1cccc(c1)C#N 11a_100000210953_100000183950 [0,2,0,0,0,0|1,0,0]=3 5964 B15R1.65 CC(C)CNC(=O)c1cccc(c1)C#N 1626a_100000210953_100000183950 [0,2,0,0,0,0|1,0,0]=3 5965 B15R1.65 CC(C)CNC(=O)c1cccc(c1)C#N 240690a_100000210953_100000183950 [0,2,0,0,0,0|1,0,0]=3 5966 B15R1.65 CC(C)CNC(=O)c1cccc(c1)C#N 527a_100000210953_100000183950 [0,2,0,0,0,0|1,0,0]=3 5967 B15R1.65 CC(C)CNC(=O)c1cccc(c1)CO 240690a_100000210953_100000746274 [0,2,0,0,0,0|1,0,0]=3 5968 B15R1.65 CC(C)CNC(=O)c1cccc(c1)N[13CH3] 2230a_200011193764_200025704644 [0,2,0,0,0,0|1,0,0]=3 5969 B15R1.65 CC(C)CNC(=O)c1cccc(c1)N[13CH3] 34a_200011193764_200025704644 [0,2,0,0,0,0|1,0,0]=3 5970 B15R1.65 CC(C)CNC(=O)c1cccc(c1)N[13CH3] 7a_200011193764_200025704644 [0,2,0,0,0,0|1,0,0]=3 5971 B15R1.65 CC(C)NCC(=O)c1cccc(c1)C#N 2230a_100138425928_100000751541 [0,2,0,0,0,0|2,0,0]=4 5972 B15R1.65 CC(C)NCC(=O)c1cccc(c1)C#N 34a_100138425928_100000751541 [0,2,0,0,0,0|2,0,0]=4 5973 B15R1.65 CC(C)NNC(=O)c1cccc(c1)C#N 22a_100000741168_100000183950 [0,2,0,0,0,0|2,0,0]=4 5974 B15R1.65 CC(C)NNC(=O)c1cccc(c1)CO 22a_100000741168_100000746274 [0,2,0,0,0,0|2,0,0]=4 5975 B15R1.65 CC(C)OCC(=O)c1cccc(c1)C#N 34a_100000212225_100000751541 [0,2,0,0,0,0|2,0,0]=4 5976 B15R1.65 CC(C)SCC(=O)c1cccc(c1)C#N 62a_100000210206_100000751541 [0,2,0,0,0,0|2,0,0]=4 5977 B15R1.65 CC(O)CCC(=O)c1cccc(c1)C#N 1458a_100000183950_100012276601 [0,2,0,0,0,0|2,0,0]=4 5978 B15R1.65 CC(O)CCC(=O)c1cccc(c1)CO 1458a_100000746274_100012276601 [0,2,0,0,0,0|2,0,0]=4 5979 B15R1.65 CC(O)CNC(=O)c1cccc(c1)C#N 11a_100000210904_100000183950 [0,2,0,0,0,0|2,0,0]=4 5980 B15R1.65 CC(O)CNC(=O)c1cccc(c1)C#N 240690a_100000210904_100000183950 [0,2,0,0,0,0|2,0,0]=4 5981 B15R1.65 CC(O)CNC(=O)c1cccc(c1)C#N 527a_100000210904_100000183950 [0,2,0,0,0,0|2,0,0]=4 5982 B15R1.65 CC(O)CNC(=O)c1cccc(c1)CO 240690a_100000210904_100000746274 [0,2,0,0,0,0|2,0,0]=4 5983 B15R1.65 CCc1cccc(c1)C(=O)CCC(C)C 1458a_100011933908_100000210312 [0,2,0,0,0,0|1,0,0]=3 5984 B15R1.65 CCc1cccc(c1)C(=O)CCC(C)O 1458a_100011933908_100012276601 [0,2,0,0,0,0|2,0,0]=4 5985 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)C 11a_100000210953_100011933908 [0,2,0,0,0,0|1,0,0]=3 5986 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)C 1626a_100000210953_100011933908 [0,2,0,0,0,0|1,0,0]=3 5987 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)C 240690a_100000210953_100011933908 [0,2,0,0,0,0|1,0,0]=3 5988 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)C 527a_100000210953_100011933908 [0,2,0,0,0,0|1,0,0]=3 5989 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)O 11a_100000210904_100011933908 [0,2,0,0,0,0|2,0,0]=4 5990 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)O 240690a_100000210904_100011933908 [0,2,0,0,0,0|2,0,0]=4 5991 B15R1.65 CCc1cccc(c1)C(=O)NCC(C)O 527a_100000210904_100011933908 [0,2,0,0,0,0|2,0,0]=4 5992 B15R1.65 CCc1cccc(c1)C(=O)NNC(C)C 22a_100000741168_100011933908 [0,2,0,0,0,0|2,0,0]=4 5993 B15R1.65 CNc1cccc(c1)C(=O)NCC(C)C 2230a_200011193764_200000210301 [0,2,0,0,0,0|1,0,0]=3 5994 B15R1.65 CNc1cccc(c1)C(=O)NCC(C)C 34a_200011193764_200000210301 [0,2,0,0,0,0|1,0,0]=3 5995 B15R1.65 CNc1cccc(c1)C(=O)NCC(C)C 7a_200011193764_200000210301 [0,2,0,0,0,0|1,0,0]=3 5996 B15R1.65 COc1cccc(c1)C(=O)CCC(C)C 1458a_100000188888_100000210312 [0,2,0,0,0,0|1,0,0]=3 5997 B15R1.65 COc1cccc(c1)C(=O)CCC(C)O 1458a_100000188888_100012276601 [0,2,0,0,0,0|2,0,0]=4 5998 B15R1.65 COc1cccc(c1)C(=O)CNC(C)C 34a_100138425928_100000211451 [0,2,0,0,0,0|2,0,0]=4 5999 B15R1.65 COc1cccc(c1)C(=O)COC(C)C 34a_100000212225_100000211451 [0,2,0,0,0,0|2,0,0]=4 6000 B15R1.65 COc1cccc(c1)C(=O)CSC(C)C 62a_100000210206_100000211451 [0,2,0,0,0,0|2,0,0]=4 6001 B15R1.65 COc1cccc(c1)C(=O)CSC(C)C 62a_100000211451_100000210206 [0,2,0,0,0,0|2,0,0]=4 6002 B15R1.65 COc1cccc(c1)C(=O)NCC(C)C 11a_100000210953_100000188888 [0,2,0,0,0,0|1,0,0]=3 6003 B15R1.65 COc1cccc(c1)C(=O)NCC(C)C 1626a_100000210953_100000188888 [0,2,0,0,0,0|1,0,0]=3 6004 B15R1.65 COc1cccc(c1)C(=O)NCC(C)C 240690a_100000210953_100000188888 [0,2,0,0,0,0|1,0,0]=3 6005 B15R1.65 COc1cccc(c1)C(=O)NCC(C)C 527a_100000210953_100000188888 [0,2,0,0,0,0|1,0,0]=3 6006 B15R1.65 COc1cccc(c1)C(=O)NCC(C)O 11a_100000210904_100000188888 [0,2,0,0,0,0|2,0,0]=4 6007 B15R1.65 COc1cccc(c1)C(=O)NCC(C)O 240690a_100000210904_100000188888 [0,2,0,0,0,0|2,0,0]=4 6008 B15R1.65 COc1cccc(c1)C(=O)NCC(C)O 527a_100000210904_100000188888 [0,2,0,0,0,0|2,0,0]=4 6009 B15R1.65 COc1cccc(c1)C(=O)NNC(C)C 22a_100000741168_100000188888 [0,2,0,0,0,0|2,0,0]=4 6010 B15R1.65 COc1cccc(c1)C(C)OCC(C)C 34a_100000246466_100000210624 [0,2,0,0,0,0|1,0,1]=4 6011 B15R1.65 COc1cccc(c1)C(C)OCC(C)C 7a_100000246466_100000210760 [0,2,0,0,0,0|1,0,1]=4 6012 B15R1.65 CSc1cccc(c1)C(=O)CCC(C)C 1458a_100011217804_100000210312 [0,2,0,0,0,0|1,0,0]=3 6013 B15R1.65 CSc1cccc(c1)C(=O)CCC(C)O 1458a_100011217804_100012276601 [0,2,0,0,0,0|2,0,0]=4 6014 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)C 11a_100000210953_100011217804 [0,2,0,0,0,0|1,0,0]=3 6015 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)C 1626a_100000210953_100011217804 [0,2,0,0,0,0|1,0,0]=3 6016 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)C 240690a_100000210953_100011217804 [0,2,0,0,0,0|1,0,0]=3 6017 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)C 527a_100000210953_100011217804 [0,2,0,0,0,0|1,0,0]=3 6018 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)O 11a_100000210904_100011217804 [0,2,0,0,0,0|2,0,0]=4 6019 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)O 240690a_100000210904_100011217804 [0,2,0,0,0,0|2,0,0]=4 6020 B15R1.65 CSc1cccc(c1)C(=O)NCC(C)O 527a_100000210904_100011217804 [0,2,0,0,0,0|2,0,0]=4 6021 B15R1.65 CSc1cccc(c1)C(=O)NNC(C)C 22a_100000741168_100011217804 [0,2,0,0,0,0|2,0,0]=4 6022 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210312 [0,2,0,0,0,0|1,0,0]=3 6023 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210312 [0,2,0,0,0,0|1,0,0]=3 6024 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210312 [0,2,0,0,0,0|1,0,0]=3 6025 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210312 [0,2,0,0,0,0|1,0,0]=3 6026 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210312 [0,2,0,0,0,0|1,0,0]=3 6027 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210312 [0,2,0,0,0,0|1,0,0]=3 6028 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210312 [0,2,0,0,0,0|1,0,0]=3 6029 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210312 [0,2,0,0,0,0|1,0,0]=3 6030 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210312 [0,2,0,0,0,0|1,0,0]=3 6031 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210312 [0,2,0,0,0,0|1,0,0]=3 6032 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210312 [0,2,0,0,0,0|1,0,0]=3 6033 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210312 [0,2,0,0,0,0|1,0,0]=3 6034 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210312 [0,2,0,0,0,0|1,0,0]=3 6035 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210312 [0,2,0,0,0,0|1,0,0]=3 6036 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210312 [0,2,0,0,0,0|1,0,0]=3 6037 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210312 [0,2,0,0,0,0|1,0,0]=3 6038 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210312 [0,2,0,0,0,0|1,0,0]=3 6039 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210312 [0,2,0,0,0,0|1,0,0]=3 6040 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210312 [0,2,0,0,0,0|1,0,0]=3 6041 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210312 [0,2,0,0,0,0|1,0,0]=3 6042 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210312 [0,2,0,0,0,0|1,0,0]=3 6043 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210312 [0,2,0,0,0,0|1,0,0]=3 6044 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210312 [0,2,0,0,0,0|1,0,0]=3 6045 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 11a_100000210953_100012360534 [0,2,0,0,0,0|1,0,0]=3 6046 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 1626a_100000210953_100012360534 [0,2,0,0,0,0|1,0,0]=3 6047 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 240690a_100000210953_100012360534 [0,2,0,0,0,0|1,0,0]=3 6048 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 527a_100000210953_100012360534 [0,2,0,0,0,0|1,0,0]=3 6049 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 11a_100000210953_100012339722 [0,2,0,0,0,0|1,0,0]=3 6050 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 1626a_100000210953_100012339722 [0,2,0,0,0,0|1,0,0]=3 6051 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 240690a_100000210953_100012339722 [0,2,0,0,0,0|1,0,0]=3 6052 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 527a_100000210953_100012339722 [0,2,0,0,0,0|1,0,0]=3 6053 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 11a_100000210953_100011217547 [0,2,0,0,0,0|1,0,0]=3 6054 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 1626a_100000210953_100011217547 [0,2,0,0,0,0|1,0,0]=3 6055 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 240690a_100000210953_100011217547 [0,2,0,0,0,0|1,0,0]=3 6056 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 527a_100000210953_100011217547 [0,2,0,0,0,0|1,0,0]=3 6057 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 11a_100000210953_100010232522 [0,2,0,0,0,0|1,0,0]=3 6058 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 1626a_100000210953_100010232522 [0,2,0,0,0,0|1,0,0]=3 6059 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 240690a_100000210953_100010232522 [0,2,0,0,0,0|1,0,0]=3 6060 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 527a_100000210953_100010232522 [0,2,0,0,0,0|1,0,0]=3 6061 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)O 240690a_100000210953_100010230362 [0,2,0,0,0,0|1,0,0]=3 6062 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)O 527a_100000210953_100010230362 [0,2,0,0,0,0|1,0,0]=3 6063 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 11a_100000210953_100000760540 [0,2,0,0,0,0|1,0,0]=3 6064 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 1626a_100000210953_100000760540 [0,2,0,0,0,0|1,0,0]=3 6065 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 240690a_100000210953_100000760540 [0,2,0,0,0,0|1,0,0]=3 6066 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 527a_100000210953_100000760540 [0,2,0,0,0,0|1,0,0]=3 6067 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 11a_100000210953_100000183631 [0,2,0,0,0,0|1,0,0]=3 6068 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 1626a_100000210953_100000183631 [0,2,0,0,0,0|1,0,0]=3 6069 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 240690a_100000210953_100000183631 [0,2,0,0,0,0|1,0,0]=3 6070 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 527a_100000210953_100000183631 [0,2,0,0,0,0|1,0,0]=3 6071 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 11a_100000210953_100000759904 [0,2,0,0,0,0|1,0,0]=3 6072 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 1626a_100000210953_100000759904 [0,2,0,0,0,0|1,0,0]=3 6073 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 240690a_100000210953_100000759904 [0,2,0,0,0,0|1,0,0]=3 6074 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 527a_100000210953_100000759904 [0,2,0,0,0,0|1,0,0]=3 6075 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 11a_100000210953_100010176783 [0,2,0,0,0,0|1,0,0]=3 6076 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 1626a_100000210953_100010176783 [0,2,0,0,0,0|1,0,0]=3 6077 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 240690a_100000210953_100010176783 [0,2,0,0,0,0|1,0,0]=3 6078 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 527a_100000210953_100010176783 [0,2,0,0,0,0|1,0,0]=3 6079 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)O 240690a_100000210953_100000092362 [0,2,0,0,0,0|1,0,0]=3 6080 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)O 527a_100000210953_100000092362 [0,2,0,0,0,0|1,0,0]=3 6081 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 11a_100000210953_100000756403 [0,2,0,0,0,0|1,0,0]=3 6082 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 1626a_100000210953_100000756403 [0,2,0,0,0,0|1,0,0]=3 6083 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 240690a_100000210953_100000756403 [0,2,0,0,0,0|1,0,0]=3 6084 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 527a_100000210953_100000756403 [0,2,0,0,0,0|1,0,0]=3 6085 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 11a_100000210953_100000688816 [0,2,0,0,0,0|1,0,0]=3 6086 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 1626a_100000210953_100000688816 [0,2,0,0,0,0|1,0,0]=3 6087 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 240690a_100000210953_100000688816 [0,2,0,0,0,0|1,0,0]=3 6088 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 527a_100000210953_100000688816 [0,2,0,0,0,0|1,0,0]=3 6089 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 11a_100000210953_100000748134 [0,2,0,0,0,0|1,0,0]=3 6090 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 1626a_100000210953_100000748134 [0,2,0,0,0,0|1,0,0]=3 6091 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 240690a_100000210953_100000748134 [0,2,0,0,0,0|1,0,0]=3 6092 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 527a_100000210953_100000748134 [0,2,0,0,0,0|1,0,0]=3 6093 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 11a_100000210953_100010185205 [0,2,0,0,0,0|1,0,0]=3 6094 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 1626a_100000210953_100010185205 [0,2,0,0,0,0|1,0,0]=3 6095 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 240690a_100000210953_100010185205 [0,2,0,0,0,0|1,0,0]=3 6096 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 527a_100000210953_100010185205 [0,2,0,0,0,0|1,0,0]=3 6097 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)O 240690a_100000210953_100000037433 [0,2,0,0,0,0|1,0,0]=3 6098 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)O 527a_100000210953_100000037433 [0,2,0,0,0,0|1,0,0]=3 6099 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 11a_100000210953_100000688019 [0,2,0,0,0,0|1,0,0]=3 6100 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 1626a_100000210953_100000688019 [0,2,0,0,0,0|1,0,0]=3 6101 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 240690a_100000210953_100000688019 [0,2,0,0,0,0|1,0,0]=3 6102 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 527a_100000210953_100000688019 [0,2,0,0,0,0|1,0,0]=3 6103 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 11a_100000210953_100010176784 [0,2,0,0,0,0|1,0,0]=3 6104 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 1626a_100000210953_100010176784 [0,2,0,0,0,0|1,0,0]=3 6105 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 240690a_100000210953_100010176784 [0,2,0,0,0,0|1,0,0]=3 6106 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 527a_100000210953_100010176784 [0,2,0,0,0,0|1,0,0]=3 6107 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 11a_100000210953_100000690930 [0,2,0,0,0,0|1,0,0]=3 6108 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 1626a_100000210953_100000690930 [0,2,0,0,0,0|1,0,0]=3 6109 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 240690a_100000210953_100000690930 [0,2,0,0,0,0|1,0,0]=3 6110 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 527a_100000210953_100000690930 [0,2,0,0,0,0|1,0,0]=3 6111 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)O 527a_100000210953_100010084636 [0,2,0,0,0,0|1,0,0]=3 6112 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Br 240690a_100000210953_100000752940 [0,2,0,0,0,0|1,0,0]=3 6113 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Br 527a_100000210953_100000752940 [0,2,0,0,0,0|1,0,0]=3 6114 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Cl 240690a_100000210953_100000742801 [0,2,0,0,0,0|1,0,0]=3 6115 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Cl 527a_100000210953_100000742801 [0,2,0,0,0,0|1,0,0]=3 6116 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)F 240690a_100000210953_100011217230 [0,2,0,0,0,0|1,0,0]=3 6117 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)F 527a_100000210953_100011217230 [0,2,0,0,0,0|1,0,0]=3 6118 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)O 527a_100000210953_100000690420 [0,2,0,0,0,0|1,0,0]=3 6119 B15R1.124 CC(C)COC(C)c1cccc(c1F)Br 34a_200012356376_100000210624 [0,2,0,0,0,0|1,0,1]=4 6120 B15R1.124 CC(C)COC(C)c1cccc(c1F)Br 7a_200012356376_100000210760 [0,2,0,0,0,0|1,0,1]=4 6121 B15R1.124 CC(C)COC(C)c1cccc(c1F)F 34a_100011944069_100000210624 [0,2,0,0,0,0|1,0,1]=4 6122 B15R1.124 CC(C)COC(C)c1cccc(c1F)F 7a_100011944069_100000210760 [0,2,0,0,0,0|1,0,1]=4 6123 B15R1.124 CC(C)NCC(=O)c1cccc(c1F)Br 2230a_100138425928_100012356374 [0,2,0,0,0,0|2,0,0]=4 6124 B15R1.124 CC(C)NCC(=O)c1cccc(c1F)Br 34a_100138425928_100012356374 [0,2,0,0,0,0|2,0,0]=4 6125 B15R1.124 CC(C)NCC(=O)c1cccc(c1F)Cl 2230a_100138425928_200012351890 [0,2,0,0,0,0|2,0,0]=4 6126 B15R1.124 CC(C)NCC(=O)c1cccc(c1F)Cl 34a_100138425928_200012351890 [0,2,0,0,0,0|2,0,0]=4 6127 B15R1.124 CC(C)NNC(=O)c1cccc(c1Br)Br 22a_100000741168_100012360534 [0,2,0,0,0,0|2,0,0]=4 6128 B15R1.124 CC(C)NNC(=O)c1cccc(c1Br)Cl 22a_100000741168_100012339722 [0,2,0,0,0,0|2,0,0]=4 6129 B15R1.124 CC(C)NNC(=O)c1cccc(c1Br)F 22a_100000741168_100011217547 [0,2,0,0,0,0|2,0,0]=4 6130 B15R1.124 CC(C)NNC(=O)c1cccc(c1Br)I 22a_100000741168_100010232522 [0,2,0,0,0,0|2,0,0]=4 6131 B15R1.124 CC(C)NNC(=O)c1cccc(c1Br)O 22a_100000741168_100010230362 [0,2,0,0,0,0|2,0,0]=4 6132 B15R1.124 CC(C)NNC(=O)c1cccc(c1Cl)Br 22a_100000741168_100000760540 [0,2,0,0,0,0|2,0,0]=4 6133 B15R1.124 CC(C)NNC(=O)c1cccc(c1Cl)Cl 22a_100000741168_100000183631 [0,2,0,0,0,0|2,0,0]=4 6134 B15R1.124 CC(C)NNC(=O)c1cccc(c1Cl)F 22a_100000741168_100000759904 [0,2,0,0,0,0|2,0,0]=4 6135 B15R1.124 CC(C)NNC(=O)c1cccc(c1Cl)I 22a_100000741168_100010176783 [0,2,0,0,0,0|2,0,0]=4 6136 B15R1.124 CC(C)NNC(=O)c1cccc(c1Cl)O 22a_100000741168_100000092362 [0,2,0,0,0,0|2,0,0]=4 6137 B15R1.124 CC(C)NNC(=O)c1cccc(c1F)Br 22a_100000741168_100000756403 [0,2,0,0,0,0|2,0,0]=4 6138 B15R1.124 CC(C)NNC(=O)c1cccc(c1F)Cl 22a_100000741168_100000688816 [0,2,0,0,0,0|2,0,0]=4 6139 B15R1.124 CC(C)NNC(=O)c1cccc(c1F)F 22a_100000741168_100000748134 [0,2,0,0,0,0|2,0,0]=4 6140 B15R1.124 CC(C)NNC(=O)c1cccc(c1F)I 22a_100000741168_100010185205 [0,2,0,0,0,0|2,0,0]=4 6141 B15R1.124 CC(C)NNC(=O)c1cccc(c1F)O 22a_100000741168_100000037433 [0,2,0,0,0,0|2,0,0]=4 6142 B15R1.124 CC(C)NNC(=O)c1cccc(c1I)Br 22a_100000741168_100000688019 [0,2,0,0,0,0|2,0,0]=4 6143 B15R1.124 CC(C)NNC(=O)c1cccc(c1I)Cl 22a_100000741168_100010176784 [0,2,0,0,0,0|2,0,0]=4 6144 B15R1.124 CC(C)NNC(=O)c1cccc(c1I)F 22a_100000741168_100000690930 [0,2,0,0,0,0|2,0,0]=4 6145 B15R1.124 CC(C)NNC(=O)c1cccc(c1I)O 22a_100000741168_100010084636 [0,2,0,0,0,0|2,0,0]=4 6146 B15R1.124 CC(C)NNC(=O)c1cccc(c1O)Br 22a_100000741168_100000752940 [0,2,0,0,0,0|2,0,0]=4 6147 B15R1.124 CC(C)NNC(=O)c1cccc(c1O)Cl 22a_100000741168_100000742801 [0,2,0,0,0,0|2,0,0]=4 6148 B15R1.124 CC(C)NNC(=O)c1cccc(c1O)F 22a_100000741168_100011217230 [0,2,0,0,0,0|2,0,0]=4 6149 B15R1.124 CC(C)NNC(=O)c1cccc(c1O)O 22a_100000741168_100000690420 [0,2,0,0,0,0|2,0,0]=4 6150 B15R1.124 CC(C)OCC(=O)c1cccc(c1F)Br 34a_100000212225_100012356374 [0,2,0,0,0,0|2,0,0]=4 6151 B15R1.124 CC(C)OCC(=O)c1cccc(c1F)Cl 34a_100000212225_200012351890 [0,2,0,0,0,0|2,0,0]=4 6152 B15R1.124 CC(C)SCC(=O)c1cccc(c1F)Br 62a_100000210206_100012356374 [0,2,0,0,0,0|2,0,0]=4 6153 B15R1.124 CC(C)SCC(=O)c1cccc(c1F)Br 62a_100012356374_100000210206 [0,2,0,0,0,0|2,0,0]=4 6154 B15R1.124 CC(C)SCC(=O)c1cccc(c1F)Cl 62a_100000210206_200012351890 [0,2,0,0,0,0|2,0,0]=4 6155 B15R1.124 CC(C)SCC(=O)c1cccc(c1F)Cl 62a_200012351890_100000210206 [0,2,0,0,0,0|2,0,0]=4 6156 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100012276601 [0,2,0,0,0,0|2,0,0]=4 6157 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100012276601 [0,2,0,0,0,0|2,0,0]=4 6158 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100012276601 [0,2,0,0,0,0|2,0,0]=4 6159 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100012276601 [0,2,0,0,0,0|2,0,0]=4 6160 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100012276601 [0,2,0,0,0,0|2,0,0]=4 6161 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100012276601 [0,2,0,0,0,0|2,0,0]=4 6162 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100012276601 [0,2,0,0,0,0|2,0,0]=4 6163 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100012276601 [0,2,0,0,0,0|2,0,0]=4 6164 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100012276601 [0,2,0,0,0,0|2,0,0]=4 6165 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100012276601 [0,2,0,0,0,0|2,0,0]=4 6166 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100012276601 [0,2,0,0,0,0|2,0,0]=4 6167 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100012276601 [0,2,0,0,0,0|2,0,0]=4 6168 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)F 1458a_100000748134_100012276601 [0,2,0,0,0,0|2,0,0]=4 6169 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)I 1458a_100010185205_100012276601 [0,2,0,0,0,0|2,0,0]=4 6170 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)O 1458a_100000037433_100012276601 [0,2,0,0,0,0|2,0,0]=4 6171 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100012276601 [0,2,0,0,0,0|2,0,0]=4 6172 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100012276601 [0,2,0,0,0,0|2,0,0]=4 6173 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)F 1458a_100000690930_100012276601 [0,2,0,0,0,0|2,0,0]=4 6174 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)O 1458a_100010084636_100012276601 [0,2,0,0,0,0|2,0,0]=4 6175 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100012276601 [0,2,0,0,0,0|2,0,0]=4 6176 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100012276601 [0,2,0,0,0,0|2,0,0]=4 6177 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100012276601 [0,2,0,0,0,0|2,0,0]=4 6178 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100012276601 [0,2,0,0,0,0|2,0,0]=4 6179 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)Br 11a_100000210904_100012360534 [0,2,0,0,0,0|2,0,0]=4 6180 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)Br 240690a_100000210904_100012360534 [0,2,0,0,0,0|2,0,0]=4 6181 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)Br 527a_100000210904_100012360534 [0,2,0,0,0,0|2,0,0]=4 6182 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)Cl 11a_100000210904_100012339722 [0,2,0,0,0,0|2,0,0]=4 6183 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)Cl 240690a_100000210904_100012339722 [0,2,0,0,0,0|2,0,0]=4 6184 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)Cl 527a_100000210904_100012339722 [0,2,0,0,0,0|2,0,0]=4 6185 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)F 11a_100000210904_100011217547 [0,2,0,0,0,0|2,0,0]=4 6186 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)F 240690a_100000210904_100011217547 [0,2,0,0,0,0|2,0,0]=4 6187 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)F 527a_100000210904_100011217547 [0,2,0,0,0,0|2,0,0]=4 6188 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)I 11a_100000210904_100010232522 [0,2,0,0,0,0|2,0,0]=4 6189 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)I 240690a_100000210904_100010232522 [0,2,0,0,0,0|2,0,0]=4 6190 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)I 527a_100000210904_100010232522 [0,2,0,0,0,0|2,0,0]=4 6191 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)O 240690a_100000210904_100010230362 [0,2,0,0,0,0|2,0,0]=4 6192 B15R1.124 CC(O)CNC(=O)c1cccc(c1Br)O 527a_100000210904_100010230362 [0,2,0,0,0,0|2,0,0]=4 6193 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)Br 11a_100000210904_100000760540 [0,2,0,0,0,0|2,0,0]=4 6194 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)Br 240690a_100000210904_100000760540 [0,2,0,0,0,0|2,0,0]=4 6195 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)Br 527a_100000210904_100000760540 [0,2,0,0,0,0|2,0,0]=4 6196 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)Cl 11a_100000210904_100000183631 [0,2,0,0,0,0|2,0,0]=4 6197 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)Cl 240690a_100000210904_100000183631 [0,2,0,0,0,0|2,0,0]=4 6198 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)Cl 527a_100000210904_100000183631 [0,2,0,0,0,0|2,0,0]=4 6199 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)F 11a_100000210904_100000759904 [0,2,0,0,0,0|2,0,0]=4 6200 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)F 240690a_100000210904_100000759904 [0,2,0,0,0,0|2,0,0]=4 6201 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)F 527a_100000210904_100000759904 [0,2,0,0,0,0|2,0,0]=4 6202 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)I 11a_100000210904_100010176783 [0,2,0,0,0,0|2,0,0]=4 6203 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)I 240690a_100000210904_100010176783 [0,2,0,0,0,0|2,0,0]=4 6204 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)I 527a_100000210904_100010176783 [0,2,0,0,0,0|2,0,0]=4 6205 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)O 240690a_100000210904_100000092362 [0,2,0,0,0,0|2,0,0]=4 6206 B15R1.124 CC(O)CNC(=O)c1cccc(c1Cl)O 527a_100000210904_100000092362 [0,2,0,0,0,0|2,0,0]=4 6207 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)Br 11a_100000210904_100000756403 [0,2,0,0,0,0|2,0,0]=4 6208 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)Br 240690a_100000210904_100000756403 [0,2,0,0,0,0|2,0,0]=4 6209 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)Br 527a_100000210904_100000756403 [0,2,0,0,0,0|2,0,0]=4 6210 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)Cl 11a_100000210904_100000688816 [0,2,0,0,0,0|2,0,0]=4 6211 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)Cl 240690a_100000210904_100000688816 [0,2,0,0,0,0|2,0,0]=4 6212 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)Cl 527a_100000210904_100000688816 [0,2,0,0,0,0|2,0,0]=4 6213 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)F 11a_100000210904_100000748134 [0,2,0,0,0,0|2,0,0]=4 6214 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)F 240690a_100000210904_100000748134 [0,2,0,0,0,0|2,0,0]=4 6215 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)F 527a_100000210904_100000748134 [0,2,0,0,0,0|2,0,0]=4 6216 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)I 11a_100000210904_100010185205 [0,2,0,0,0,0|2,0,0]=4 6217 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)I 240690a_100000210904_100010185205 [0,2,0,0,0,0|2,0,0]=4 6218 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)I 527a_100000210904_100010185205 [0,2,0,0,0,0|2,0,0]=4 6219 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)O 240690a_100000210904_100000037433 [0,2,0,0,0,0|2,0,0]=4 6220 B15R1.124 CC(O)CNC(=O)c1cccc(c1F)O 527a_100000210904_100000037433 [0,2,0,0,0,0|2,0,0]=4 6221 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)Br 11a_100000210904_100000688019 [0,2,0,0,0,0|2,0,0]=4 6222 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)Br 240690a_100000210904_100000688019 [0,2,0,0,0,0|2,0,0]=4 6223 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)Br 527a_100000210904_100000688019 [0,2,0,0,0,0|2,0,0]=4 6224 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)Cl 11a_100000210904_100010176784 [0,2,0,0,0,0|2,0,0]=4 6225 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)Cl 240690a_100000210904_100010176784 [0,2,0,0,0,0|2,0,0]=4 6226 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)Cl 527a_100000210904_100010176784 [0,2,0,0,0,0|2,0,0]=4 6227 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)F 11a_100000210904_100000690930 [0,2,0,0,0,0|2,0,0]=4 6228 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)F 240690a_100000210904_100000690930 [0,2,0,0,0,0|2,0,0]=4 6229 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)F 527a_100000210904_100000690930 [0,2,0,0,0,0|2,0,0]=4 6230 B15R1.124 CC(O)CNC(=O)c1cccc(c1I)O 527a_100000210904_100010084636 [0,2,0,0,0,0|2,0,0]=4 6231 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Br 240690a_100000210904_100000752940 [0,2,0,0,0,0|2,0,0]=4 6232 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Br 527a_100000210904_100000752940 [0,2,0,0,0,0|2,0,0]=4 6233 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Cl 240690a_100000210904_100000742801 [0,2,0,0,0,0|2,0,0]=4 6234 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Cl 527a_100000210904_100000742801 [0,2,0,0,0,0|2,0,0]=4 6235 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)F 240690a_100000210904_100011217230 [0,2,0,0,0,0|2,0,0]=4 6236 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)F 527a_100000210904_100011217230 [0,2,0,0,0,0|2,0,0]=4 6237 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)O 527a_100000210904_100000690420 [0,2,0,0,0,0|2,0,0]=4 6238 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)Br 1458a_100000760464_100000210312 [0,2,0,0,0,0|1,0,0]=3 6239 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)Cl 1458a_100000690184_100000210312 [0,2,0,0,0,0|1,0,0]=3 6240 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)F 1458a_100011218272_100000210312 [0,2,0,0,0,0|1,0,0]=3 6241 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)I 1458a_100000751865_100000210312 [0,2,0,0,0,0|1,0,0]=3 6242 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)O 1458a_100000766327_100000210312 [0,2,0,0,0,0|1,0,0]=3 6243 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)Br 1458a_100000760464_100012276601 [0,2,0,0,0,0|2,0,0]=4 6244 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)Cl 1458a_100000690184_100012276601 [0,2,0,0,0,0|2,0,0]=4 6245 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)F 1458a_100011218272_100012276601 [0,2,0,0,0,0|2,0,0]=4 6246 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)I 1458a_100000751865_100012276601 [0,2,0,0,0,0|2,0,0]=4 6247 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)O 1458a_100000766327_100012276601 [0,2,0,0,0,0|2,0,0]=4 6248 B15R1.124 Cc1c(cccc1C(=O)CNC(C)C)I 34a_100138425928_100160470822 [0,2,0,0,0,0|2,0,0]=4 6249 B15R1.124 Cc1c(cccc1C(=O)COC(C)C)I 34a_100000212225_100160470822 [0,2,0,0,0,0|2,0,0]=4 6250 B15R1.124 Cc1c(cccc1C(=O)CSC(C)C)I 62a_100000210206_100160470822 [0,2,0,0,0,0|2,0,0]=4 6251 B15R1.124 Cc1c(cccc1C(=O)CSC(C)C)I 62a_100160470822_100000210206 [0,2,0,0,0,0|2,0,0]=4 6252 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 11a_100000210953_100000760464 [0,2,0,0,0,0|1,0,0]=3 6253 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000760464 [0,2,0,0,0,0|1,0,0]=3 6254 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000760464 [0,2,0,0,0,0|1,0,0]=3 6255 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 527a_100000210953_100000760464 [0,2,0,0,0,0|1,0,0]=3 6256 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 11a_100000210953_100000690184 [0,2,0,0,0,0|1,0,0]=3 6257 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000690184 [0,2,0,0,0,0|1,0,0]=3 6258 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000690184 [0,2,0,0,0,0|1,0,0]=3 6259 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 527a_100000210953_100000690184 [0,2,0,0,0,0|1,0,0]=3 6260 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 11a_100000210953_100011218272 [0,2,0,0,0,0|1,0,0]=3 6261 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 1626a_100000210953_100011218272 [0,2,0,0,0,0|1,0,0]=3 6262 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 240690a_100000210953_100011218272 [0,2,0,0,0,0|1,0,0]=3 6263 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 527a_100000210953_100011218272 [0,2,0,0,0,0|1,0,0]=3 6264 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 11a_100000210953_100000751865 [0,2,0,0,0,0|1,0,0]=3 6265 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 1626a_100000210953_100000751865 [0,2,0,0,0,0|1,0,0]=3 6266 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 240690a_100000210953_100000751865 [0,2,0,0,0,0|1,0,0]=3 6267 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 527a_100000210953_100000751865 [0,2,0,0,0,0|1,0,0]=3 6268 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)O 240690a_100000210953_100000766327 [0,2,0,0,0,0|1,0,0]=3 6269 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)O 527a_100000210953_100000766327 [0,2,0,0,0,0|1,0,0]=3 6270 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Br 11a_100000210904_100000760464 [0,2,0,0,0,0|2,0,0]=4 6271 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000760464 [0,2,0,0,0,0|2,0,0]=4 6272 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Br 527a_100000210904_100000760464 [0,2,0,0,0,0|2,0,0]=4 6273 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Cl 11a_100000210904_100000690184 [0,2,0,0,0,0|2,0,0]=4 6274 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000690184 [0,2,0,0,0,0|2,0,0]=4 6275 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Cl 527a_100000210904_100000690184 [0,2,0,0,0,0|2,0,0]=4 6276 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)F 11a_100000210904_100011218272 [0,2,0,0,0,0|2,0,0]=4 6277 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)F 240690a_100000210904_100011218272 [0,2,0,0,0,0|2,0,0]=4 6278 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)F 527a_100000210904_100011218272 [0,2,0,0,0,0|2,0,0]=4 6279 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)I 11a_100000210904_100000751865 [0,2,0,0,0,0|2,0,0]=4 6280 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)I 240690a_100000210904_100000751865 [0,2,0,0,0,0|2,0,0]=4 6281 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)I 527a_100000210904_100000751865 [0,2,0,0,0,0|2,0,0]=4 6282 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)O 240690a_100000210904_100000766327 [0,2,0,0,0,0|2,0,0]=4 6283 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)O 527a_100000210904_100000766327 [0,2,0,0,0,0|2,0,0]=4 6284 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)Br 22a_100000741168_100000760464 [0,2,0,0,0,0|2,0,0]=4 6285 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)Cl 22a_100000741168_100000690184 [0,2,0,0,0,0|2,0,0]=4 6286 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)F 22a_100000741168_100011218272 [0,2,0,0,0,0|2,0,0]=4 6287 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)I 22a_100000741168_100000751865 [0,2,0,0,0,0|2,0,0]=4 6288 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)O 22a_100000741168_100000766327 [0,2,0,0,0,0|2,0,0]=4 6289 B15R1.124 Cc1cccc(c1Br)C(=O)CCC(C)C 1458a_100000692419_100000210312 [0,2,0,0,0,0|1,0,0]=3 6290 B15R1.124 Cc1cccc(c1Br)C(=O)CCC(C)O 1458a_100000692419_100012276601 [0,2,0,0,0,0|2,0,0]=4 6291 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 11a_100000210953_100000692419 [0,2,0,0,0,0|1,0,0]=3 6292 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 1626a_100000210953_100000692419 [0,2,0,0,0,0|1,0,0]=3 6293 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 240690a_100000210953_100000692419 [0,2,0,0,0,0|1,0,0]=3 6294 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 527a_100000210953_100000692419 [0,2,0,0,0,0|1,0,0]=3 6295 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)O 11a_100000210904_100000692419 [0,2,0,0,0,0|2,0,0]=4 6296 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)O 240690a_100000210904_100000692419 [0,2,0,0,0,0|2,0,0]=4 6297 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)O 527a_100000210904_100000692419 [0,2,0,0,0,0|2,0,0]=4 6298 B15R1.124 Cc1cccc(c1Br)C(=O)NNC(C)C 22a_100000741168_100000692419 [0,2,0,0,0,0|2,0,0]=4 6299 B15R1.124 Cc1cccc(c1C)C(=O)CCC(C)C 1458a_100000183679_100000210312 [0,2,0,0,0,0|1,0,0]=3 6300 B15R1.124 Cc1cccc(c1C)C(=O)CCC(C)O 1458a_100000183679_100012276601 [0,2,0,0,0,0|2,0,0]=4 6301 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 11a_100000210953_100000183679 [0,2,0,0,0,0|1,0,0]=3 6302 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 1626a_100000210953_100000183679 [0,2,0,0,0,0|1,0,0]=3 6303 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 240690a_100000210953_100000183679 [0,2,0,0,0,0|1,0,0]=3 6304 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 527a_100000210953_100000183679 [0,2,0,0,0,0|1,0,0]=3 6305 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)O 11a_100000210904_100000183679 [0,2,0,0,0,0|2,0,0]=4 6306 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)O 240690a_100000210904_100000183679 [0,2,0,0,0,0|2,0,0]=4 6307 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)O 527a_100000210904_100000183679 [0,2,0,0,0,0|2,0,0]=4 6308 B15R1.124 Cc1cccc(c1C)C(=O)NNC(C)C 22a_100000741168_100000183679 [0,2,0,0,0,0|2,0,0]=4 6309 B15R1.124 Cc1cccc(c1C)C(C)OCC(C)C 34a_100000210257_100012183177 [0,2,0,0,0,0|1,0,1]=4 6310 B15R1.124 Cc1cccc(c1Cl)C(=O)CCC(C)C 1458a_100000693142_100000210312 [0,2,0,0,0,0|1,0,0]=3 6311 B15R1.124 Cc1cccc(c1Cl)C(=O)CCC(C)O 1458a_100000693142_100012276601 [0,2,0,0,0,0|2,0,0]=4 6312 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 11a_100000210953_100000693142 [0,2,0,0,0,0|1,0,0]=3 6313 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 1626a_100000210953_100000693142 [0,2,0,0,0,0|1,0,0]=3 6314 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 240690a_100000210953_100000693142 [0,2,0,0,0,0|1,0,0]=3 6315 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 527a_100000210953_100000693142 [0,2,0,0,0,0|1,0,0]=3 6316 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)O 11a_100000210904_100000693142 [0,2,0,0,0,0|2,0,0]=4 6317 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)O 240690a_100000210904_100000693142 [0,2,0,0,0,0|2,0,0]=4 6318 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)O 527a_100000210904_100000693142 [0,2,0,0,0,0|2,0,0]=4 6319 B15R1.124 Cc1cccc(c1Cl)C(=O)NNC(C)C 22a_100000741168_100000693142 [0,2,0,0,0,0|2,0,0]=4 6320 B15R1.124 Cc1cccc(c1F)C(=O)CCC(C)C 1458a_100000766181_100000210312 [0,2,0,0,0,0|1,0,0]=3 6321 B15R1.124 Cc1cccc(c1F)C(=O)CCC(C)O 1458a_100000766181_100012276601 [0,2,0,0,0,0|2,0,0]=4 6322 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 11a_100000210953_100000766181 [0,2,0,0,0,0|1,0,0]=3 6323 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 1626a_100000210953_100000766181 [0,2,0,0,0,0|1,0,0]=3 6324 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 240690a_100000210953_100000766181 [0,2,0,0,0,0|1,0,0]=3 6325 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 527a_100000210953_100000766181 [0,2,0,0,0,0|1,0,0]=3 6326 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)O 11a_100000210904_100000766181 [0,2,0,0,0,0|2,0,0]=4 6327 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)O 240690a_100000210904_100000766181 [0,2,0,0,0,0|2,0,0]=4 6328 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)O 527a_100000210904_100000766181 [0,2,0,0,0,0|2,0,0]=4 6329 B15R1.124 Cc1cccc(c1F)C(=O)NNC(C)C 22a_100000741168_100000766181 [0,2,0,0,0,0|2,0,0]=4 6330 B15R1.124 Cc1cccc(c1I)C(=O)CCC(C)C 1458a_100000739377_100000210312 [0,2,0,0,0,0|1,0,0]=3 6331 B15R1.124 Cc1cccc(c1I)C(=O)CCC(C)O 1458a_100000739377_100012276601 [0,2,0,0,0,0|2,0,0]=4 6332 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 11a_100000210953_100000739377 [0,2,0,0,0,0|1,0,0]=3 6333 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 1626a_100000210953_100000739377 [0,2,0,0,0,0|1,0,0]=3 6334 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 240690a_100000210953_100000739377 [0,2,0,0,0,0|1,0,0]=3 6335 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 527a_100000210953_100000739377 [0,2,0,0,0,0|1,0,0]=3 6336 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)O 11a_100000210904_100000739377 [0,2,0,0,0,0|2,0,0]=4 6337 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)O 240690a_100000210904_100000739377 [0,2,0,0,0,0|2,0,0]=4 6338 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)O 527a_100000210904_100000739377 [0,2,0,0,0,0|2,0,0]=4 6339 B15R1.124 Cc1cccc(c1I)C(=O)NNC(C)C 22a_100000741168_100000739377 [0,2,0,0,0,0|2,0,0]=4 6340 B15R1.124 Cc1cccc(c1O)C(=O)CCC(C)C 1458a_100000183896_100000210312 [0,2,0,0,0,0|1,0,0]=3 6341 B15R1.124 Cc1cccc(c1O)C(=O)CCC(C)O 1458a_100000183896_100012276601 [0,2,0,0,0,0|2,0,0]=4 6342 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)C 240690a_100000210953_100000183896 [0,2,0,0,0,0|1,0,0]=3 6343 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)C 527a_100000210953_100000183896 [0,2,0,0,0,0|1,0,0]=3 6344 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)O 240690a_100000210904_100000183896 [0,2,0,0,0,0|2,0,0]=4 6345 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)O 527a_100000210904_100000183896 [0,2,0,0,0,0|2,0,0]=4 6346 B15R1.124 Cc1cccc(c1O)C(=O)NNC(C)C 22a_100000741168_100000183896 [0,2,0,0,0,0|2,0,0]=4 6347 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)Br 34a_100016041109_100000212080 [0,2,0,0,0,0|2,0,0]=4 6348 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)Br 7a_100016041109_100000212080 [0,2,0,0,0,0|2,0,0]=4 6349 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)Cl 34a_100016041109_100000211444 [0,2,0,0,0,0|2,0,0]=4 6350 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)Cl 7a_100016041109_100000211444 [0,2,0,0,0,0|2,0,0]=4 6351 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)F 34a_100016041109_100000215616 [0,2,0,0,0,0|2,0,0]=4 6352 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)O 34a_100016041109_100009813753 [0,2,0,0,0,0|2,0,0]=4 6353 B15R1.133 CC(CF)OCC(=O)c1cccc(c1)O 7a_100016041109_100009813753 [0,2,0,0,0,0|2,0,0]=4 6354 B15R1.133 CC(CN)OCC(=O)c1cccc(c1)Br 34a_100000210904_100000212080 [0,2,0,0,0,0|2,0,0]=4 6355 B15R1.133 CC(CN)OCC(=O)c1cccc(c1)Cl 34a_100000210904_100000211444 [0,2,0,0,0,0|2,0,0]=4 6356 B15R1.133 CC(CN)OCC(=O)c1cccc(c1)F 34a_100000210904_100000215616 [0,2,0,0,0,0|2,0,0]=4 6357 B15R1.133 CC(CN)OCC(=O)c1cccc(c1)O 34a_100000210904_100009813753 [0,2,0,0,0,0|2,0,0]=4 6358 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)Br 240690a_100000744482_100000210664 [0,2,0,0,0,0|1,0,0]=3 6359 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)Br 527a_100000744482_100000210664 [0,2,0,0,0,0|1,0,0]=3 6360 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)Cl 240690a_100000744482_100000210390 [0,2,0,0,0,0|1,0,0]=3 6361 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)Cl 527a_100000744482_100000210390 [0,2,0,0,0,0|1,0,0]=3 6362 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)F 240690a_100000744482_100000210950 [0,2,0,0,0,0|1,0,0]=3 6363 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)F 527a_100000744482_100000210950 [0,2,0,0,0,0|1,0,0]=3 6364 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)I 240690a_100000744482_100000184098 [0,2,0,0,0,0|1,0,0]=3 6365 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)I 527a_100000744482_100000184098 [0,2,0,0,0,0|1,0,0]=3 6366 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)O 240690a_100000744482_100000183914 [0,2,0,0,0,0|1,0,0]=3 6367 B15R1.133 CC(CO)CNC(=O)c1cccc(c1)O 527a_100000744482_100000183914 [0,2,0,0,0,0|1,0,0]=3 6368 B15R1.133 CC(CO)OCC(=O)c1cccc(c1)Cl 7a_200011592804_100012180447 [0,2,0,0,0,0|2,0,0]=4 6369 B15R1.133 CC(CO)OCC(=O)c1cccc(c1)F 34a_100011592800_100012180447 [0,2,0,0,0,0|2,0,0]=4 6370 B15R1.133 CC(CO)OCC(=O)c1cccc(c1)F 7a_100011592800_100012180447 [0,2,0,0,0,0|2,0,0]=4 6371 B15R1.133 CC(CO)SCC(=O)c1cccc(c1)Br 62a_100012180447_100000212080 [0,2,0,0,0,0|2,0,0]=4 6372 B15R1.133 CC(CO)SCC(=O)c1cccc(c1)Cl 62a_100012180447_100000211444 [0,2,0,0,0,0|2,0,0]=4 6373 B15R1.133 CC(CO)SCC(=O)c1cccc(c1)F 62a_100012180447_100000215616 [0,2,0,0,0,0|2,0,0]=4 6374 B15R1.133 CC(CO)SCC(=O)c1cccc(c1)O 62a_100012180447_100009813753 [0,2,0,0,0,0|2,0,0]=4 6375 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)Br 34a_100000246457_100000059175 [0,2,0,0,0,0|1,0,1]=4 6376 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)Br 7a_100000246457_100000059175 [0,2,0,0,0,0|1,0,1]=4 6377 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)F 34a_100000744526_100000059175 [0,2,0,0,0,0|1,0,1]=4 6378 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)F 7a_100000744526_100000059175 [0,2,0,0,0,0|1,0,1]=4 6379 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)I 34a_100013085317_100000059175 [0,2,0,0,0,0|1,0,1]=4 6380 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)I 7a_100013085317_100000059175 [0,2,0,0,0,0|1,0,1]=4 6381 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)N 34a_100011217120_100000059175 [0,2,0,0,0,0|1,0,1]=4 6382 B15R1.133 CC(OC[C@@H](C)CO)c1cccc(c1)N 7a_100011217120_100000059175 [0,2,0,0,0,0|1,0,1]=4 6383 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Br 11a_100020588543_100000210664 [0,2,0,0,0,0|1,0,0]=3 6384 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Br 1626a_100020588543_100000210664 [0,2,0,0,0,0|1,0,0]=3 6385 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Br 240690a_100020588543_100000210664 [0,2,0,0,0,0|1,0,0]=3 6386 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Br 527a_100020588543_100000210664 [0,2,0,0,0,0|1,0,0]=3 6387 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)C 11a_100020588543_100000189346 [0,2,0,0,0,0|1,0,0]=3 6388 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)C 1626a_100020588543_100000189346 [0,2,0,0,0,0|1,0,0]=3 6389 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)C 240690a_100020588543_100000189346 [0,2,0,0,0,0|1,0,0]=3 6390 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)C 527a_100020588543_100000189346 [0,2,0,0,0,0|1,0,0]=3 6391 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Cl 11a_100020588543_100000210390 [0,2,0,0,0,0|1,0,0]=3 6392 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Cl 1626a_100020588543_100000210390 [0,2,0,0,0,0|1,0,0]=3 6393 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Cl 240690a_100020588543_100000210390 [0,2,0,0,0,0|1,0,0]=3 6394 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)Cl 527a_100020588543_100000210390 [0,2,0,0,0,0|1,0,0]=3 6395 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)F 11a_100020588543_100000210950 [0,2,0,0,0,0|1,0,0]=3 6396 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)F 1626a_100020588543_100000210950 [0,2,0,0,0,0|1,0,0]=3 6397 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)F 240690a_100020588543_100000210950 [0,2,0,0,0,0|1,0,0]=3 6398 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)F 527a_100020588543_100000210950 [0,2,0,0,0,0|1,0,0]=3 6399 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)I 11a_100020588543_100000184098 [0,2,0,0,0,0|1,0,0]=3 6400 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)I 1626a_100020588543_100000184098 [0,2,0,0,0,0|1,0,0]=3 6401 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)I 240690a_100020588543_100000184098 [0,2,0,0,0,0|1,0,0]=3 6402 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)I 527a_100020588543_100000184098 [0,2,0,0,0,0|1,0,0]=3 6403 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)O 240690a_100020588543_100000183914 [0,2,0,0,0,0|1,0,0]=3 6404 B15R1.133 CCC(C)CNC(=O)c1cccc(c1)O 527a_100020588543_100000183914 [0,2,0,0,0,0|1,0,0]=3 6405 B15R1.133 CCC(C)COC(C)c1cccc(c1)Br 34a_100000246457_100000748023 [0,2,0,0,0,0|1,0,1]=4 6406 B15R1.133 CCC(C)COC(C)c1cccc(c1)Br 7a_100000246457_100000748023 [0,2,0,0,0,0|1,0,1]=4 6407 B15R1.133 CCC(C)COC(C)c1cccc(c1)C 34a_100000757818_100000748023 [0,2,0,0,0,0|1,0,1]=4 6408 B15R1.133 CCC(C)COC(C)c1cccc(c1)C 7a_100000757818_100000748023 [0,2,0,0,0,0|1,0,1]=4 6409 B15R1.133 CCC(C)COC(C)c1cccc(c1)F 34a_100000744526_100000748023 [0,2,0,0,0,0|1,0,1]=4 6410 B15R1.133 CCC(C)COC(C)c1cccc(c1)F 7a_100000744526_100000748023 [0,2,0,0,0,0|1,0,1]=4 6411 B15R1.133 CCC(C)COC(C)c1cccc(c1)I 34a_100013085317_100000748023 [0,2,0,0,0,0|1,0,1]=4 6412 B15R1.133 CCC(C)COC(C)c1cccc(c1)I 7a_100013085317_100000748023 [0,2,0,0,0,0|1,0,1]=4 6413 B15R1.133 CCC(C)COC(C)c1cccc(c1)N 34a_100011217120_100000748023 [0,2,0,0,0,0|1,0,1]=4 6414 B15R1.133 CCC(C)COC(C)c1cccc(c1)N 7a_100011217120_100000748023 [0,2,0,0,0,0|1,0,1]=4 6415 B15R1.133 CCC(C)CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000748023 [0,2,0,0,0,0|1,0,1]=4 6416 B15R1.133 CCC(C)CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000748023 [0,2,0,0,0,0|1,0,1]=4 6417 B15R1.133 CCC(C)NCC(=O)c1cccc(c1)Br 2230a_100000209981_100000212080 [0,2,0,0,0,0|2,0,0]=4 6418 B15R1.133 CCC(C)NCC(=O)c1cccc(c1)C 2230a_100000209981_100000739480 [0,2,0,0,0,0|2,0,0]=4 6419 B15R1.133 CCC(C)NCC(=O)c1cccc(c1)Cl 2230a_100000209981_100000211444 [0,2,0,0,0,0|2,0,0]=4 6420 B15R1.133 CCC(C)NCC(=O)c1cccc(c1)F 2230a_100000209981_100000215616 [0,2,0,0,0,0|2,0,0]=4 6421 B15R1.133 CCC(C)NNC(=O)c1cccc(c1)Br 22a_100000718999_100000210664 [0,2,0,0,0,0|2,0,0]=4 6422 B15R1.133 CCC(C)NNC(=O)c1cccc(c1)C 22a_100000718999_100000189346 [0,2,0,0,0,0|2,0,0]=4 6423 B15R1.133 CCC(C)NNC(=O)c1cccc(c1)Cl 22a_100000718999_100000210390 [0,2,0,0,0,0|2,0,0]=4 6424 B15R1.133 CCC(C)NNC(=O)c1cccc(c1)F 22a_100000718999_100000210950 [0,2,0,0,0,0|2,0,0]=4 6425 B15R1.133 CCC(C)NNC(=O)c1cccc(c1)I 22a_100000718999_100000184098 [0,2,0,0,0,0|2,0,0]=4 6426 B15R1.133 CCC(C)NNC(=O)c1cccc(c1)O 22a_100000718999_100000183914 [0,2,0,0,0,0|2,0,0]=4 6427 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)Br 7a_100000210228_100000212080 [0,2,0,0,0,0|2,0,0]=4 6428 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)C 7a_100000210228_100000739480 [0,2,0,0,0,0|2,0,0]=4 6429 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)Cl 7a_100000210228_100000211444 [0,2,0,0,0,0|2,0,0]=4 6430 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)Cl 7a_200011592804_100000758301 [0,2,0,0,0,0|2,0,0]=4 6431 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)F 34a_100011592800_100011215416 [0,2,0,0,0,0|2,0,0]=4 6432 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)F 7a_100011592800_100000758301 [0,2,0,0,0,0|2,0,0]=4 6433 B15R1.133 CCC(C)OCC(=O)c1cccc(c1)O 7a_100000210228_100009813753 [0,2,0,0,0,0|2,0,0]=4 6434 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)Br 62a_100000212080_100000758301 [0,2,0,0,0,0|2,0,0]=4 6435 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)Br 62a_100000758301_100000212080 [0,2,0,0,0,0|2,0,0]=4 6436 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)C 62a_100000739480_100000758301 [0,2,0,0,0,0|2,0,0]=4 6437 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)C 62a_100000758301_100000739480 [0,2,0,0,0,0|2,0,0]=4 6438 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)Cl 62a_100000211444_100000758301 [0,2,0,0,0,0|2,0,0]=4 6439 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)Cl 62a_100000758301_100000211444 [0,2,0,0,0,0|2,0,0]=4 6440 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)F 62a_100000215616_100000758301 [0,2,0,0,0,0|2,0,0]=4 6441 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)F 62a_100000758301_100000215616 [0,2,0,0,0,0|2,0,0]=4 6442 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)O 62a_100000758301_100009813753 [0,2,0,0,0,0|2,0,0]=4 6443 B15R1.133 CCC(C)SCC(=O)c1cccc(c1)O 62a_100009813753_100000758301 [0,2,0,0,0,0|2,0,0]=4 6444 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)Br 11a_100011218483_100000210664 [0,2,0,0,0,0|2,0,0]=4 6445 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)Br 240690a_100011218483_100000210664 [0,2,0,0,0,0|2,0,0]=4 6446 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)Br 527a_100011218483_100000210664 [0,2,0,0,0,0|2,0,0]=4 6447 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)C 11a_100011218483_100000189346 [0,2,0,0,0,0|2,0,0]=4 6448 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)C 240690a_100011218483_100000189346 [0,2,0,0,0,0|2,0,0]=4 6449 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)C 527a_100011218483_100000189346 [0,2,0,0,0,0|2,0,0]=4 6450 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)Cl 11a_100011218483_100000210390 [0,2,0,0,0,0|2,0,0]=4 6451 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)Cl 240690a_100011218483_100000210390 [0,2,0,0,0,0|2,0,0]=4 6452 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)Cl 527a_100011218483_100000210390 [0,2,0,0,0,0|2,0,0]=4 6453 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)F 11a_100011218483_100000210950 [0,2,0,0,0,0|2,0,0]=4 6454 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)F 240690a_100011218483_100000210950 [0,2,0,0,0,0|2,0,0]=4 6455 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)F 527a_100011218483_100000210950 [0,2,0,0,0,0|2,0,0]=4 6456 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)I 11a_100011218483_100000184098 [0,2,0,0,0,0|2,0,0]=4 6457 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)I 240690a_100011218483_100000184098 [0,2,0,0,0,0|2,0,0]=4 6458 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)I 527a_100011218483_100000184098 [0,2,0,0,0,0|2,0,0]=4 6459 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)O 240690a_100011218483_100000183914 [0,2,0,0,0,0|2,0,0]=4 6460 B15R1.133 CCC(O)CNC(=O)c1cccc(c1)O 527a_100011218483_100000183914 [0,2,0,0,0,0|2,0,0]=4 6461 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)Br 34a_100000246457_100009816398 [0,2,0,0,0,0|1,0,1]=4 6462 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)Br 7a_100000246457_100009816398 [0,2,0,0,0,0|1,0,1]=4 6463 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)C 34a_100000757818_100009816398 [0,2,0,0,0,0|1,0,1]=4 6464 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)C 7a_100000757818_100009816398 [0,2,0,0,0,0|1,0,1]=4 6465 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)F 34a_100000744526_100009816398 [0,2,0,0,0,0|1,0,1]=4 6466 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)F 7a_100000744526_100009816398 [0,2,0,0,0,0|1,0,1]=4 6467 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)I 34a_100013085317_100009816398 [0,2,0,0,0,0|1,0,1]=4 6468 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)I 7a_100013085317_100009816398 [0,2,0,0,0,0|1,0,1]=4 6469 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)N 34a_100011217120_100009816398 [0,2,0,0,0,0|1,0,1]=4 6470 B15R1.133 CC[C@H](C)COC(C)c1cccc(c1)N 7a_100011217120_100009816398 [0,2,0,0,0,0|1,0,1]=4 6471 B15R1.133 CC[C@H](C)CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100009816398 [0,2,0,0,0,0|1,0,1]=4 6472 B15R1.133 CC[C@H](C)CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100009816398 [0,2,0,0,0,0|1,0,1]=4 6473 B15R1.133 COC(C)SCC(=O)c1cccc(c1)Br 62a_100000212080_100009879195 [0,2,0,0,0,0|2,0,0]=4 6474 B15R1.133 COC(C)SCC(=O)c1cccc(c1)Br 62a_100009879195_100000212080 [0,2,0,0,0,0|2,0,0]=4 6475 B15R1.133 COC(C)SCC(=O)c1cccc(c1)C 62a_100000739480_100009879195 [0,2,0,0,0,0|2,0,0]=4 6476 B15R1.133 COC(C)SCC(=O)c1cccc(c1)C 62a_100009879195_100000739480 [0,2,0,0,0,0|2,0,0]=4 6477 B15R1.133 COC(C)SCC(=O)c1cccc(c1)Cl 62a_100000211444_100009879195 [0,2,0,0,0,0|2,0,0]=4 6478 B15R1.133 COC(C)SCC(=O)c1cccc(c1)Cl 62a_100009879195_100000211444 [0,2,0,0,0,0|2,0,0]=4 6479 B15R1.133 COC(C)SCC(=O)c1cccc(c1)F 62a_100000215616_100009879195 [0,2,0,0,0,0|2,0,0]=4 6480 B15R1.133 COC(C)SCC(=O)c1cccc(c1)F 62a_100009879195_100000215616 [0,2,0,0,0,0|2,0,0]=4 6481 B15R1.133 COC(C)SCC(=O)c1cccc(c1)O 62a_100009813753_100009879195 [0,2,0,0,0,0|2,0,0]=4 6482 B15R1.133 COC(C)SCC(=O)c1cccc(c1)O 62a_100009879195_100009813753 [0,2,0,0,0,0|2,0,0]=4 6483 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Br 11a_100020591295_100000210664 [0,2,0,0,0,0|1,0,0]=3 6484 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Br 1626a_100020591295_100000210664 [0,2,0,0,0,0|1,0,0]=3 6485 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Br 240690a_100020591295_100000210664 [0,2,0,0,0,0|1,0,0]=3 6486 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Br 527a_100020591295_100000210664 [0,2,0,0,0,0|1,0,0]=3 6487 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)C 11a_100020591295_100000189346 [0,2,0,0,0,0|1,0,0]=3 6488 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)C 1626a_100020591295_100000189346 [0,2,0,0,0,0|1,0,0]=3 6489 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)C 240690a_100020591295_100000189346 [0,2,0,0,0,0|1,0,0]=3 6490 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)C 527a_100020591295_100000189346 [0,2,0,0,0,0|1,0,0]=3 6491 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Cl 11a_100020591295_100000210390 [0,2,0,0,0,0|1,0,0]=3 6492 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Cl 1626a_100020591295_100000210390 [0,2,0,0,0,0|1,0,0]=3 6493 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Cl 240690a_100020591295_100000210390 [0,2,0,0,0,0|1,0,0]=3 6494 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)Cl 527a_100020591295_100000210390 [0,2,0,0,0,0|1,0,0]=3 6495 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)F 11a_100020591295_100000210950 [0,2,0,0,0,0|1,0,0]=3 6496 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)F 1626a_100020591295_100000210950 [0,2,0,0,0,0|1,0,0]=3 6497 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)F 240690a_100020591295_100000210950 [0,2,0,0,0,0|1,0,0]=3 6498 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)F 527a_100020591295_100000210950 [0,2,0,0,0,0|1,0,0]=3 6499 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)I 11a_100020591295_100000184098 [0,2,0,0,0,0|1,0,0]=3 6500 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)I 1626a_100020591295_100000184098 [0,2,0,0,0,0|1,0,0]=3 6501 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)I 240690a_100020591295_100000184098 [0,2,0,0,0,0|1,0,0]=3 6502 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)I 527a_100020591295_100000184098 [0,2,0,0,0,0|1,0,0]=3 6503 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)O 240690a_100020591295_100000183914 [0,2,0,0,0,0|1,0,0]=3 6504 B15R1.133 CO[C@H](C)CNC(=O)c1cccc(c1)O 527a_100020591295_100000183914 [0,2,0,0,0,0|1,0,0]=3 6505 B15R1.133 C[C@@H](CO)CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000059175 [0,2,0,0,0,0|1,0,1]=4 6506 B15R1.133 C[C@@H](CO)CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000059175 [0,2,0,0,0,0|1,0,1]=4 6507 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)Br 2230a_100000737577_100000212080 [0,2,0,0,0,0|2,0,0]=4 6508 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)Cl 2230a_100000737577_100000211444 [0,2,0,0,0,0|2,0,0]=4 6509 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)F 2230a_100000737577_100000215616 [0,2,0,0,0,0|2,0,0]=4 6510 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)Br 62a_100000212080_100016084084 [0,2,0,0,0,0|2,0,0]=4 6511 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)Br 62a_100016084084_100000212080 [0,2,0,0,0,0|2,0,0]=4 6512 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)Cl 62a_100000211444_100016084084 [0,2,0,0,0,0|2,0,0]=4 6513 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)Cl 62a_100016084084_100000211444 [0,2,0,0,0,0|2,0,0]=4 6514 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)F 62a_100000215616_100016084084 [0,2,0,0,0,0|2,0,0]=4 6515 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)F 62a_100016084084_100000215616 [0,2,0,0,0,0|2,0,0]=4 6516 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)O 62a_100009813753_100016084084 [0,2,0,0,0,0|2,0,0]=4 6517 B15R1.133 C[C@H](CO)SCC(=O)c1cccc(c1)O 62a_100016084084_100009813753 [0,2,0,0,0,0|2,0,0]=4 6518 B15R1.133 Cc1cccc(c1)C(=O)CN[C@H](C)CO 2230a_100000737577_100000739480 [0,2,0,0,0,0|2,0,0]=4 6519 B15R1.133 Cc1cccc(c1)C(=O)COC(C)CF 34a_100016041109_100000739480 [0,2,0,0,0,0|2,0,0]=4 6520 B15R1.133 Cc1cccc(c1)C(=O)COC(C)CF 7a_100016041109_100000739480 [0,2,0,0,0,0|2,0,0]=4 6521 B15R1.133 Cc1cccc(c1)C(=O)COC(C)CN 34a_100000210904_100000739480 [0,2,0,0,0,0|2,0,0]=4 6522 B15R1.133 Cc1cccc(c1)C(=O)CSC(C)CO 62a_100012180447_100000739480 [0,2,0,0,0,0|2,0,0]=4 6523 B15R1.133 Cc1cccc(c1)C(=O)CS[C@H](C)CO 62a_100000739480_100016084084 [0,2,0,0,0,0|2,0,0]=4 6524 B15R1.133 Cc1cccc(c1)C(=O)CS[C@H](C)CO 62a_100016084084_100000739480 [0,2,0,0,0,0|2,0,0]=4 6525 B15R1.133 Cc1cccc(c1)C(=O)NCC(C)CO 240690a_100000744482_100000189346 [0,2,0,0,0,0|1,0,0]=3 6526 B15R1.133 Cc1cccc(c1)C(=O)NCC(C)CO 527a_100000744482_100000189346 [0,2,0,0,0,0|1,0,0]=3 6527 B15R1.133 Cc1cccc(c1)C(=O)NC[C@@H](F)CO 240690a_100015665980_100000189346 [0,2,0,0,0,0|2,0,0]=4 6528 B15R1.133 Cc1cccc(c1)C(=O)NC[C@@H](F)CO 527a_100015665980_100000189346 [0,2,0,0,0,0|2,0,0]=4 6529 B15R1.133 Cc1cccc(c1)C(=O)NC[C@H](O)CO 240690a_100020644852_100000189346 [0,2,0,0,0,0|2,0,0]=4 6530 B15R1.133 Cc1cccc(c1)C(=O)NC[C@H](O)CO 527a_100020644852_100000189346 [0,2,0,0,0,0|2,0,0]=4 6531 B15R1.133 Cc1cccc(c1)C(C)OC[C@@H](C)CO 34a_100000757818_100000059175 [0,2,0,0,0,0|1,0,1]=4 6532 B15R1.133 Cc1cccc(c1)C(C)OC[C@@H](C)CO 7a_100000757818_100000059175 [0,2,0,0,0,0|1,0,1]=4 6533 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)Br 240690a_100015665980_100000210664 [0,2,0,0,0,0|2,0,0]=4 6534 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)Br 527a_100015665980_100000210664 [0,2,0,0,0,0|2,0,0]=4 6535 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)Cl 240690a_100015665980_100000210390 [0,2,0,0,0,0|2,0,0]=4 6536 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)Cl 527a_100015665980_100000210390 [0,2,0,0,0,0|2,0,0]=4 6537 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)F 240690a_100015665980_100000210950 [0,2,0,0,0,0|2,0,0]=4 6538 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)F 527a_100015665980_100000210950 [0,2,0,0,0,0|2,0,0]=4 6539 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)I 240690a_100015665980_100000184098 [0,2,0,0,0,0|2,0,0]=4 6540 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)I 527a_100015665980_100000184098 [0,2,0,0,0,0|2,0,0]=4 6541 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)O 240690a_100015665980_100000183914 [0,2,0,0,0,0|2,0,0]=4 6542 B15R1.133 O=C(NC[C@@H](F)CO)c1cccc(c1)O 527a_100015665980_100000183914 [0,2,0,0,0,0|2,0,0]=4 6543 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)Br 240690a_100020644852_100000210664 [0,2,0,0,0,0|2,0,0]=4 6544 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)Br 527a_100020644852_100000210664 [0,2,0,0,0,0|2,0,0]=4 6545 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)Cl 240690a_100020644852_100000210390 [0,2,0,0,0,0|2,0,0]=4 6546 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)Cl 527a_100020644852_100000210390 [0,2,0,0,0,0|2,0,0]=4 6547 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)F 240690a_100020644852_100000210950 [0,2,0,0,0,0|2,0,0]=4 6548 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)F 527a_100020644852_100000210950 [0,2,0,0,0,0|2,0,0]=4 6549 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)I 240690a_100020644852_100000184098 [0,2,0,0,0,0|2,0,0]=4 6550 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)I 527a_100020644852_100000184098 [0,2,0,0,0,0|2,0,0]=4 6551 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)O 240690a_100020644852_100000183914 [0,2,0,0,0,0|2,0,0]=4 6552 B15R1.133 O=C(NC[C@H](O)CO)c1cccc(c1)O 527a_100020644852_100000183914 [0,2,0,0,0,0|2,0,0]=4 6553 B15R1.660 CCC(OCC(C)C)c1cccc(c1)Cl 34a_100000766619_100000210624 [0,2,0,0,0,0|1,0,1]=4 6554 B15R1.660 CCC(OCC(C)C)c1cccc(c1)Cl 7a_100000766619_100000210760 [0,2,0,0,0,0|1,0,1]=4 6555 B15R1.660 CCC(OCC(C)C)c1cccc(c1)F 34a_100011350881_100000210624 [0,2,0,0,0,0|1,0,1]=4 6556 B15R1.660 CCC(OCC(C)C)c1cccc(c1)F 7a_100011350881_100000210760 [0,2,0,0,0,0|1,0,1]=4 6557 B15R1.660 CCC(OCC(C)C)c1cccc(c1)I 34a_200013212081_100000210624 [0,2,0,0,0,0|1,0,1]=4 6558 B15R1.660 CCC(OCC(C)C)c1cccc(c1)I 7a_200013212081_100000210760 [0,2,0,0,0,0|1,0,1]=4 6559 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210312 [0,2,0,0,0,0|1,0,0]=3 6560 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210312 [0,2,0,0,0,0|1,0,0]=3 6561 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210312 [0,2,0,0,0,0|1,0,0]=3 6562 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210312 [0,2,0,0,0,0|1,0,0]=3 6563 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210312 [0,2,0,0,0,0|1,0,0]=3 6564 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210312 [0,2,0,0,0,0|1,0,0]=3 6565 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210312 [0,2,0,0,0,0|1,0,0]=3 6566 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210312 [0,2,0,0,0,0|1,0,0]=3 6567 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210312 [0,2,0,0,0,0|1,0,0]=3 6568 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210312 [0,2,0,0,0,0|1,0,0]=3 6569 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210312 [0,2,0,0,0,0|1,0,0]=3 6570 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210312 [0,2,0,0,0,0|1,0,0]=3 6571 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210312 [0,2,0,0,0,0|1,0,0]=3 6572 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210312 [0,2,0,0,0,0|1,0,0]=3 6573 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210312 [0,2,0,0,0,0|1,0,0]=3 6574 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210312 [0,2,0,0,0,0|1,0,0]=3 6575 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210312 [0,2,0,0,0,0|1,0,0]=3 6576 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210312 [0,2,0,0,0,0|1,0,0]=3 6577 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210312 [0,2,0,0,0,0|1,0,0]=3 6578 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210312 [0,2,0,0,0,0|1,0,0]=3 6579 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210312 [0,2,0,0,0,0|1,0,0]=3 6580 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210312 [0,2,0,0,0,0|1,0,0]=3 6581 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210312 [0,2,0,0,0,0|1,0,0]=3 6582 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210312 [0,2,0,0,0,0|1,0,0]=3 6583 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210312 [0,2,0,0,0,0|1,0,0]=3 6584 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 11a_100000210953_100012339404 [0,2,0,0,0,0|1,0,0]=3 6585 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 1626a_100000210953_100012339404 [0,2,0,0,0,0|1,0,0]=3 6586 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 240690a_100000210953_100012339404 [0,2,0,0,0,0|1,0,0]=3 6587 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 527a_100000210953_100012339404 [0,2,0,0,0,0|1,0,0]=3 6588 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 11a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 6589 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 6590 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 6591 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 527a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 6592 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 11a_100000210953_100000760357 [0,2,0,0,0,0|1,0,0]=3 6593 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 1626a_100000210953_100000760357 [0,2,0,0,0,0|1,0,0]=3 6594 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 240690a_100000210953_100000760357 [0,2,0,0,0,0|1,0,0]=3 6595 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 527a_100000210953_100000760357 [0,2,0,0,0,0|1,0,0]=3 6596 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 11a_100000210953_100000739115 [0,2,0,0,0,0|1,0,0]=3 6597 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 1626a_100000210953_100000739115 [0,2,0,0,0,0|1,0,0]=3 6598 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 240690a_100000210953_100000739115 [0,2,0,0,0,0|1,0,0]=3 6599 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 527a_100000210953_100000739115 [0,2,0,0,0,0|1,0,0]=3 6600 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)O 240690a_100000210953_100000189672 [0,2,0,0,0,0|1,0,0]=3 6601 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 11a_100000210953_100000687082 [0,2,0,0,0,0|1,0,0]=3 6602 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000210953_100000687082 [0,2,0,0,0,0|1,0,0]=3 6603 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000210953_100000687082 [0,2,0,0,0,0|1,0,0]=3 6604 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 527a_100000210953_100000687082 [0,2,0,0,0,0|1,0,0]=3 6605 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 6606 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 6607 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 6608 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 6609 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 11a_100000210953_100000686462 [0,2,0,0,0,0|1,0,0]=3 6610 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 1626a_100000210953_100000686462 [0,2,0,0,0,0|1,0,0]=3 6611 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 240690a_100000210953_100000686462 [0,2,0,0,0,0|1,0,0]=3 6612 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 527a_100000210953_100000686462 [0,2,0,0,0,0|1,0,0]=3 6613 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 11a_100000210953_100000684831 [0,2,0,0,0,0|1,0,0]=3 6614 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 1626a_100000210953_100000684831 [0,2,0,0,0,0|1,0,0]=3 6615 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 240690a_100000210953_100000684831 [0,2,0,0,0,0|1,0,0]=3 6616 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 527a_100000210953_100000684831 [0,2,0,0,0,0|1,0,0]=3 6617 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)O 240690a_100000210953_100000212196 [0,2,0,0,0,0|1,0,0]=3 6618 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)O 527a_100000210953_100000212196 [0,2,0,0,0,0|1,0,0]=3 6619 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 11a_100000210953_100000743946 [0,2,0,0,0,0|1,0,0]=3 6620 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 1626a_100000210953_100000743946 [0,2,0,0,0,0|1,0,0]=3 6621 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 240690a_100000210953_100000743946 [0,2,0,0,0,0|1,0,0]=3 6622 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 527a_100000210953_100000743946 [0,2,0,0,0,0|1,0,0]=3 6623 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 11a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 6624 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 1626a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 6625 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 240690a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 6626 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 527a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 6627 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 11a_100000210953_100000209822 [0,2,0,0,0,0|1,0,0]=3 6628 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 1626a_100000210953_100000209822 [0,2,0,0,0,0|1,0,0]=3 6629 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 240690a_100000210953_100000209822 [0,2,0,0,0,0|1,0,0]=3 6630 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 527a_100000210953_100000209822 [0,2,0,0,0,0|1,0,0]=3 6631 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 11a_100000210953_100000062624 [0,2,0,0,0,0|1,0,0]=3 6632 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 1626a_100000210953_100000062624 [0,2,0,0,0,0|1,0,0]=3 6633 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 240690a_100000210953_100000062624 [0,2,0,0,0,0|1,0,0]=3 6634 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 527a_100000210953_100000062624 [0,2,0,0,0,0|1,0,0]=3 6635 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)O 240690a_100000210953_100000185466 [0,2,0,0,0,0|1,0,0]=3 6636 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)O 527a_100000210953_100000185466 [0,2,0,0,0,0|1,0,0]=3 6637 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 11a_100000210953_100012343876 [0,2,0,0,0,0|1,0,0]=3 6638 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 1626a_100000210953_100012343876 [0,2,0,0,0,0|1,0,0]=3 6639 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 240690a_100000210953_100012343876 [0,2,0,0,0,0|1,0,0]=3 6640 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 527a_100000210953_100012343876 [0,2,0,0,0,0|1,0,0]=3 6641 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 11a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 6642 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 1626a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 6643 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 240690a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 6644 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 527a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 6645 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 11a_100000210953_100000688015 [0,2,0,0,0,0|1,0,0]=3 6646 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 1626a_100000210953_100000688015 [0,2,0,0,0,0|1,0,0]=3 6647 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 240690a_100000210953_100000688015 [0,2,0,0,0,0|1,0,0]=3 6648 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 527a_100000210953_100000688015 [0,2,0,0,0,0|1,0,0]=3 6649 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 11a_100000210953_100000725830 [0,2,0,0,0,0|1,0,0]=3 6650 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 1626a_100000210953_100000725830 [0,2,0,0,0,0|1,0,0]=3 6651 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 240690a_100000210953_100000725830 [0,2,0,0,0,0|1,0,0]=3 6652 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 527a_100000210953_100000725830 [0,2,0,0,0,0|1,0,0]=3 6653 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)O 1626a_100000210953_100000037485 [0,2,0,0,0,0|1,0,0]=3 6654 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)O 240690a_100000210953_100000037485 [0,2,0,0,0,0|1,0,0]=3 6655 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Br 240690a_100000210953_100000689001 [0,2,0,0,0,0|1,0,0]=3 6656 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Br 527a_100000210953_100000689001 [0,2,0,0,0,0|1,0,0]=3 6657 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000210953_100011933997 [0,2,0,0,0,0|1,0,0]=3 6658 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000210953_100011933997 [0,2,0,0,0,0|1,0,0]=3 6659 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)F 240690a_100000210953_100000035894 [0,2,0,0,0,0|1,0,0]=3 6660 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)F 527a_100000210953_100000035894 [0,2,0,0,0,0|1,0,0]=3 6661 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 1626a_100000210953_100000239334 [0,2,0,0,0,0|1,0,0]=3 6662 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 240690a_100000210953_100000239334 [0,2,0,0,0,0|1,0,0]=3 6663 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 527a_100000210953_100000239334 [0,2,0,0,0,0|1,0,0]=3 6664 B15R1.889 CC(C)COC(C)c1ccc(c(c1)Br)F 34a_100011191524_100000210624 [0,2,0,0,0,0|1,0,1]=4 6665 B15R1.889 CC(C)COC(C)c1ccc(c(c1)Br)F 7a_100011191524_100000210760 [0,2,0,0,0,0|1,0,1]=4 6666 B15R1.889 CC(C)COC(C)c1ccc(c(c1)Cl)Cl 34a_100000742046_100000210624 [0,2,0,0,0,0|1,0,1]=4 6667 B15R1.889 CC(C)COC(C)c1ccc(c(c1)Cl)Cl 7a_100000742046_100000210760 [0,2,0,0,0,0|1,0,1]=4 6668 B15R1.889 CC(C)COC(C)c1ccc(c(c1)F)Cl 34a_100011944057_100000210624 [0,2,0,0,0,0|1,0,1]=4 6669 B15R1.889 CC(C)COC(C)c1ccc(c(c1)F)Cl 7a_100011944057_100000210760 [0,2,0,0,0,0|1,0,1]=4 6670 B15R1.889 CC(C)COC(C)c1ccc(c(c1)F)F 34a_100000246517_100000210624 [0,2,0,0,0,0|1,0,1]=4 6671 B15R1.889 CC(C)COC(C)c1ccc(c(c1)F)F 7a_100000246517_100000210760 [0,2,0,0,0,0|1,0,1]=4 6672 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Br)F 2230a_100138425928_100011217175 [0,2,0,0,0,0|2,0,0]=4 6673 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Br)F 34a_100138425928_100011217175 [0,2,0,0,0,0|2,0,0]=4 6674 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Cl)Br 2230a_100138425928_200012349649 [0,2,0,0,0,0|2,0,0]=4 6675 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Cl)Br 34a_100138425928_200012349649 [0,2,0,0,0,0|2,0,0]=4 6676 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Cl)Cl 2230a_100138425928_100000211430 [0,2,0,0,0,0|2,0,0]=4 6677 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Cl)F 2230a_100138425928_100000757878 [0,2,0,0,0,0|2,0,0]=4 6678 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)Cl)F 34a_100138425928_100000757878 [0,2,0,0,0,0|2,0,0]=4 6679 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)F)Br 2230a_100138425928_100012361357 [0,2,0,0,0,0|2,0,0]=4 6680 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)F)Br 34a_100138425928_100012361357 [0,2,0,0,0,0|2,0,0]=4 6681 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)F)Cl 2230a_100138425928_100012351892 [0,2,0,0,0,0|2,0,0]=4 6682 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)F)Cl 34a_100138425928_100012351892 [0,2,0,0,0,0|2,0,0]=4 6683 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)F)F 2230a_100138425928_100000183380 [0,2,0,0,0,0|2,0,0]=4 6684 B15R1.889 CC(C)NCC(=O)c1ccc(c(c1)F)F 34a_100138425928_100000183380 [0,2,0,0,0,0|2,0,0]=4 6685 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Br)Br 22a_100000741168_100012339404 [0,2,0,0,0,0|2,0,0]=4 6686 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Br)Cl 22a_100000741168_100000691181 [0,2,0,0,0,0|2,0,0]=4 6687 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Br)F 22a_100000741168_100000760357 [0,2,0,0,0,0|2,0,0]=4 6688 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Br)I 22a_100000741168_100000739115 [0,2,0,0,0,0|2,0,0]=4 6689 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Br)O 22a_100000741168_100000189672 [0,2,0,0,0,0|2,0,0]=4 6690 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Cl)Br 22a_100000741168_100000687082 [0,2,0,0,0,0|2,0,0]=4 6691 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Cl)Cl 22a_100000741168_100000210401 [0,2,0,0,0,0|2,0,0]=4 6692 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Cl)F 22a_100000741168_100000686462 [0,2,0,0,0,0|2,0,0]=4 6693 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Cl)I 22a_100000741168_100000684831 [0,2,0,0,0,0|2,0,0]=4 6694 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Cl)O 22a_100000741168_100000212196 [0,2,0,0,0,0|2,0,0]=4 6695 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)F)Br 22a_100000741168_100000743946 [0,2,0,0,0,0|2,0,0]=4 6696 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)F)Cl 22a_100000741168_100000743183 [0,2,0,0,0,0|2,0,0]=4 6697 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)F)F 22a_100000741168_100000209822 [0,2,0,0,0,0|2,0,0]=4 6698 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)F)I 22a_100000741168_100000062624 [0,2,0,0,0,0|2,0,0]=4 6699 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)F)O 22a_100000741168_100000185466 [0,2,0,0,0,0|2,0,0]=4 6700 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)I)Br 22a_100000741168_100012343876 [0,2,0,0,0,0|2,0,0]=4 6701 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)I)Cl 22a_100000741168_100000739381 [0,2,0,0,0,0|2,0,0]=4 6702 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)I)F 22a_100000741168_100000688015 [0,2,0,0,0,0|2,0,0]=4 6703 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)I)I 22a_100000741168_100000725830 [0,2,0,0,0,0|2,0,0]=4 6704 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)I)O 22a_100000741168_100000037485 [0,2,0,0,0,0|2,0,0]=4 6705 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)O)Br 22a_100000741168_100000689001 [0,2,0,0,0,0|2,0,0]=4 6706 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)O)Cl 22a_100000741168_100011933997 [0,2,0,0,0,0|2,0,0]=4 6707 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)O)F 22a_100000741168_100000035894 [0,2,0,0,0,0|2,0,0]=4 6708 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)O)I 22a_100000741168_100000239334 [0,2,0,0,0,0|2,0,0]=4 6709 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)Br)F 34a_100000212225_100011217175 [0,2,0,0,0,0|2,0,0]=4 6710 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)Cl)Br 34a_100000212225_200012349649 [0,2,0,0,0,0|2,0,0]=4 6711 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_100000210206 [0,2,0,0,0,0|2,0,0]=4 6712 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)Cl)F 34a_100000212225_100000757878 [0,2,0,0,0,0|2,0,0]=4 6713 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)F)Br 34a_100000212225_100012361357 [0,2,0,0,0,0|2,0,0]=4 6714 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)F)Cl 34a_100000212225_100012351892 [0,2,0,0,0,0|2,0,0]=4 6715 B15R1.889 CC(C)OCC(=O)c1ccc(c(c1)F)F 34a_100000212225_100000183380 [0,2,0,0,0,0|2,0,0]=4 6716 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Br)F 62a_100000210206_100011217175 [0,2,0,0,0,0|2,0,0]=4 6717 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Br)F 62a_100011217175_100000210206 [0,2,0,0,0,0|2,0,0]=4 6718 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)Br 62a_100000210206_200012349649 [0,2,0,0,0,0|2,0,0]=4 6719 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)Br 62a_200012349649_100000210206 [0,2,0,0,0,0|2,0,0]=4 6720 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000210206_100000211430 [0,2,0,0,0,0|2,0,0]=4 6721 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_100000210206 [0,2,0,0,0,0|2,0,0]=4 6722 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)F 62a_100000210206_100000757878 [0,2,0,0,0,0|2,0,0]=4 6723 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)F 62a_100000757878_100000210206 [0,2,0,0,0,0|2,0,0]=4 6724 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)O 62a_100000210206_200010170092 [0,2,0,0,0,0|2,0,0]=4 6725 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_100000210206 [0,2,0,0,0,0|2,0,0]=4 6726 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)F)Br 62a_100000210206_100012361357 [0,2,0,0,0,0|2,0,0]=4 6727 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)F)Br 62a_100012361357_100000210206 [0,2,0,0,0,0|2,0,0]=4 6728 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)F)Cl 62a_100000210206_100012351892 [0,2,0,0,0,0|2,0,0]=4 6729 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_100000210206 [0,2,0,0,0,0|2,0,0]=4 6730 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)F)F 62a_100000183380_100000210206 [0,2,0,0,0,0|2,0,0]=4 6731 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)F)F 62a_100000210206_100000183380 [0,2,0,0,0,0|2,0,0]=4 6732 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)O)O 62a_100000210206_100000183813 [0,2,0,0,0,0|2,0,0]=4 6733 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100012276601 [0,2,0,0,0,0|2,0,0]=4 6734 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100012276601 [0,2,0,0,0,0|2,0,0]=4 6735 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100012276601 [0,2,0,0,0,0|2,0,0]=4 6736 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100012276601 [0,2,0,0,0,0|2,0,0]=4 6737 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100012276601 [0,2,0,0,0,0|2,0,0]=4 6738 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100012276601 [0,2,0,0,0,0|2,0,0]=4 6739 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100012276601 [0,2,0,0,0,0|2,0,0]=4 6740 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100012276601 [0,2,0,0,0,0|2,0,0]=4 6741 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100012276601 [0,2,0,0,0,0|2,0,0]=4 6742 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100012276601 [0,2,0,0,0,0|2,0,0]=4 6743 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100012276601 [0,2,0,0,0,0|2,0,0]=4 6744 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100012276601 [0,2,0,0,0,0|2,0,0]=4 6745 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100012276601 [0,2,0,0,0,0|2,0,0]=4 6746 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100012276601 [0,2,0,0,0,0|2,0,0]=4 6747 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100012276601 [0,2,0,0,0,0|2,0,0]=4 6748 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100012276601 [0,2,0,0,0,0|2,0,0]=4 6749 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100012276601 [0,2,0,0,0,0|2,0,0]=4 6750 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100012276601 [0,2,0,0,0,0|2,0,0]=4 6751 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100012276601 [0,2,0,0,0,0|2,0,0]=4 6752 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100012276601 [0,2,0,0,0,0|2,0,0]=4 6753 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100012276601 [0,2,0,0,0,0|2,0,0]=4 6754 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100012276601 [0,2,0,0,0,0|2,0,0]=4 6755 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100012276601 [0,2,0,0,0,0|2,0,0]=4 6756 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100012276601 [0,2,0,0,0,0|2,0,0]=4 6757 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100012276601 [0,2,0,0,0,0|2,0,0]=4 6758 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Br 11a_100000210904_100012339404 [0,2,0,0,0,0|2,0,0]=4 6759 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Br 240690a_100000210904_100012339404 [0,2,0,0,0,0|2,0,0]=4 6760 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Br 527a_100000210904_100012339404 [0,2,0,0,0,0|2,0,0]=4 6761 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Cl 11a_100000210904_100000691181 [0,2,0,0,0,0|2,0,0]=4 6762 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000210904_100000691181 [0,2,0,0,0,0|2,0,0]=4 6763 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Cl 527a_100000210904_100000691181 [0,2,0,0,0,0|2,0,0]=4 6764 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)F 11a_100000210904_100000760357 [0,2,0,0,0,0|2,0,0]=4 6765 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)F 240690a_100000210904_100000760357 [0,2,0,0,0,0|2,0,0]=4 6766 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)F 527a_100000210904_100000760357 [0,2,0,0,0,0|2,0,0]=4 6767 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)I 11a_100000210904_100000739115 [0,2,0,0,0,0|2,0,0]=4 6768 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)I 240690a_100000210904_100000739115 [0,2,0,0,0,0|2,0,0]=4 6769 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)I 527a_100000210904_100000739115 [0,2,0,0,0,0|2,0,0]=4 6770 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)O 240690a_100000210904_100000189672 [0,2,0,0,0,0|2,0,0]=4 6771 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Br 11a_100000210904_100000687082 [0,2,0,0,0,0|2,0,0]=4 6772 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000210904_100000687082 [0,2,0,0,0,0|2,0,0]=4 6773 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Br 527a_100000210904_100000687082 [0,2,0,0,0,0|2,0,0]=4 6774 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000210904_100000210401 [0,2,0,0,0,0|2,0,0]=4 6775 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000210904_100000210401 [0,2,0,0,0,0|2,0,0]=4 6776 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000210904_100000210401 [0,2,0,0,0,0|2,0,0]=4 6777 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)F 11a_100000210904_100000686462 [0,2,0,0,0,0|2,0,0]=4 6778 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)F 240690a_100000210904_100000686462 [0,2,0,0,0,0|2,0,0]=4 6779 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)F 527a_100000210904_100000686462 [0,2,0,0,0,0|2,0,0]=4 6780 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)I 11a_100000210904_100000684831 [0,2,0,0,0,0|2,0,0]=4 6781 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)I 240690a_100000210904_100000684831 [0,2,0,0,0,0|2,0,0]=4 6782 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)I 527a_100000210904_100000684831 [0,2,0,0,0,0|2,0,0]=4 6783 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)O 240690a_100000210904_100000212196 [0,2,0,0,0,0|2,0,0]=4 6784 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)O 527a_100000210904_100000212196 [0,2,0,0,0,0|2,0,0]=4 6785 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Br 11a_100000210904_100000743946 [0,2,0,0,0,0|2,0,0]=4 6786 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Br 240690a_100000210904_100000743946 [0,2,0,0,0,0|2,0,0]=4 6787 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Br 527a_100000210904_100000743946 [0,2,0,0,0,0|2,0,0]=4 6788 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Cl 11a_100000210904_100000743183 [0,2,0,0,0,0|2,0,0]=4 6789 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Cl 240690a_100000210904_100000743183 [0,2,0,0,0,0|2,0,0]=4 6790 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Cl 527a_100000210904_100000743183 [0,2,0,0,0,0|2,0,0]=4 6791 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)F 11a_100000210904_100000209822 [0,2,0,0,0,0|2,0,0]=4 6792 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)F 240690a_100000210904_100000209822 [0,2,0,0,0,0|2,0,0]=4 6793 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)F 527a_100000210904_100000209822 [0,2,0,0,0,0|2,0,0]=4 6794 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)I 11a_100000210904_100000062624 [0,2,0,0,0,0|2,0,0]=4 6795 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)I 240690a_100000210904_100000062624 [0,2,0,0,0,0|2,0,0]=4 6796 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)I 527a_100000210904_100000062624 [0,2,0,0,0,0|2,0,0]=4 6797 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)O 240690a_100000210904_100000185466 [0,2,0,0,0,0|2,0,0]=4 6798 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)O 527a_100000210904_100000185466 [0,2,0,0,0,0|2,0,0]=4 6799 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Br 11a_100000210904_100012343876 [0,2,0,0,0,0|2,0,0]=4 6800 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Br 240690a_100000210904_100012343876 [0,2,0,0,0,0|2,0,0]=4 6801 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Br 527a_100000210904_100012343876 [0,2,0,0,0,0|2,0,0]=4 6802 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Cl 11a_100000210904_100000739381 [0,2,0,0,0,0|2,0,0]=4 6803 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Cl 240690a_100000210904_100000739381 [0,2,0,0,0,0|2,0,0]=4 6804 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Cl 527a_100000210904_100000739381 [0,2,0,0,0,0|2,0,0]=4 6805 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)F 11a_100000210904_100000688015 [0,2,0,0,0,0|2,0,0]=4 6806 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)F 240690a_100000210904_100000688015 [0,2,0,0,0,0|2,0,0]=4 6807 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)F 527a_100000210904_100000688015 [0,2,0,0,0,0|2,0,0]=4 6808 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)I 11a_100000210904_100000725830 [0,2,0,0,0,0|2,0,0]=4 6809 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)I 240690a_100000210904_100000725830 [0,2,0,0,0,0|2,0,0]=4 6810 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)I 527a_100000210904_100000725830 [0,2,0,0,0,0|2,0,0]=4 6811 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)O 240690a_100000210904_100000037485 [0,2,0,0,0,0|2,0,0]=4 6812 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Br 240690a_100000210904_100000689001 [0,2,0,0,0,0|2,0,0]=4 6813 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Br 527a_100000210904_100000689001 [0,2,0,0,0,0|2,0,0]=4 6814 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000210904_100011933997 [0,2,0,0,0,0|2,0,0]=4 6815 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000210904_100011933997 [0,2,0,0,0,0|2,0,0]=4 6816 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)F 240690a_100000210904_100000035894 [0,2,0,0,0,0|2,0,0]=4 6817 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)F 527a_100000210904_100000035894 [0,2,0,0,0,0|2,0,0]=4 6818 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)I 240690a_100000210904_100000239334 [0,2,0,0,0,0|2,0,0]=4 6819 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)I 527a_100000210904_100000239334 [0,2,0,0,0,0|2,0,0]=4 6820 B15R1.889 CN(C)CCC(=O)c1ccc(c(c1)Cl)Cl 2230a_100102631434_100012356702 [0,2,0,0,0,0|2,0,0]=4 6821 B15R1.889 CN(C)CCC(=O)c1ccc(c(c1)Cl)Cl 269982a_100102631434_100012356702 [0,2,0,0,0,0|2,0,0]=4 6822 B15R1.889 Cc1cc(ccc1Br)C(=O)CCC(C)C 1458a_100000692631_100000210312 [0,2,0,0,0,0|1,0,0]=3 6823 B15R1.889 Cc1cc(ccc1Br)C(=O)CCC(C)O 1458a_100000692631_100012276601 [0,2,0,0,0,0|2,0,0]=4 6824 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 11a_100000210953_100000692631 [0,2,0,0,0,0|1,0,0]=3 6825 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 1626a_100000210953_100000692631 [0,2,0,0,0,0|1,0,0]=3 6826 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 240690a_100000210953_100000692631 [0,2,0,0,0,0|1,0,0]=3 6827 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 527a_100000210953_100000692631 [0,2,0,0,0,0|1,0,0]=3 6828 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)O 11a_100000210904_100000692631 [0,2,0,0,0,0|2,0,0]=4 6829 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)O 240690a_100000210904_100000692631 [0,2,0,0,0,0|2,0,0]=4 6830 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)O 527a_100000210904_100000692631 [0,2,0,0,0,0|2,0,0]=4 6831 B15R1.889 Cc1cc(ccc1Br)C(=O)NNC(C)C 22a_100000741168_100000692631 [0,2,0,0,0,0|2,0,0]=4 6832 B15R1.889 Cc1cc(ccc1Cl)C(=O)CCC(C)C 1458a_100000686306_100000210312 [0,2,0,0,0,0|1,0,0]=3 6833 B15R1.889 Cc1cc(ccc1Cl)C(=O)CCC(C)O 1458a_100000686306_100012276601 [0,2,0,0,0,0|2,0,0]=4 6834 B15R1.889 Cc1cc(ccc1Cl)C(=O)CSC(C)C 62a_100000210206_200011216723 [0,2,0,0,0,0|2,0,0]=4 6835 B15R1.889 Cc1cc(ccc1Cl)C(=O)CSC(C)C 62a_200011216723_100000210206 [0,2,0,0,0,0|2,0,0]=4 6836 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 11a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 6837 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 1626a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 6838 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 240690a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 6839 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 527a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 6840 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)O 11a_100000210904_100000686306 [0,2,0,0,0,0|2,0,0]=4 6841 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)O 240690a_100000210904_100000686306 [0,2,0,0,0,0|2,0,0]=4 6842 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)O 527a_100000210904_100000686306 [0,2,0,0,0,0|2,0,0]=4 6843 B15R1.889 Cc1cc(ccc1Cl)C(=O)NNC(C)C 22a_100000741168_100000686306 [0,2,0,0,0,0|2,0,0]=4 6844 B15R1.889 Cc1cc(ccc1F)C(=O)CCC(C)C 1458a_100000751819_100000210312 [0,2,0,0,0,0|1,0,0]=3 6845 B15R1.889 Cc1cc(ccc1F)C(=O)CCC(C)O 1458a_100000751819_100012276601 [0,2,0,0,0,0|2,0,0]=4 6846 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 11a_100000210953_100000751819 [0,2,0,0,0,0|1,0,0]=3 6847 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 1626a_100000210953_100000751819 [0,2,0,0,0,0|1,0,0]=3 6848 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 240690a_100000210953_100000751819 [0,2,0,0,0,0|1,0,0]=3 6849 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 527a_100000210953_100000751819 [0,2,0,0,0,0|1,0,0]=3 6850 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)O 11a_100000210904_100000751819 [0,2,0,0,0,0|2,0,0]=4 6851 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)O 240690a_100000210904_100000751819 [0,2,0,0,0,0|2,0,0]=4 6852 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)O 527a_100000210904_100000751819 [0,2,0,0,0,0|2,0,0]=4 6853 B15R1.889 Cc1cc(ccc1F)C(=O)NNC(C)C 22a_100000741168_100000751819 [0,2,0,0,0,0|2,0,0]=4 6854 B15R1.889 Cc1cc(ccc1I)C(=O)CCC(C)C 1458a_100000751300_100000210312 [0,2,0,0,0,0|1,0,0]=3 6855 B15R1.889 Cc1cc(ccc1I)C(=O)CCC(C)O 1458a_100000751300_100012276601 [0,2,0,0,0,0|2,0,0]=4 6856 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 11a_100000210953_100000751300 [0,2,0,0,0,0|1,0,0]=3 6857 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 1626a_100000210953_100000751300 [0,2,0,0,0,0|1,0,0]=3 6858 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 240690a_100000210953_100000751300 [0,2,0,0,0,0|1,0,0]=3 6859 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 527a_100000210953_100000751300 [0,2,0,0,0,0|1,0,0]=3 6860 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)O 11a_100000210904_100000751300 [0,2,0,0,0,0|2,0,0]=4 6861 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)O 240690a_100000210904_100000751300 [0,2,0,0,0,0|2,0,0]=4 6862 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)O 527a_100000210904_100000751300 [0,2,0,0,0,0|2,0,0]=4 6863 B15R1.889 Cc1cc(ccc1I)C(=O)NNC(C)C 22a_100000741168_100000751300 [0,2,0,0,0,0|2,0,0]=4 6864 B15R1.889 Cc1cc(ccc1O)C(=O)CCC(C)C 1458a_100000685612_100000210312 [0,2,0,0,0,0|1,0,0]=3 6865 B15R1.889 Cc1cc(ccc1O)C(=O)CCC(C)O 1458a_100000685612_100012276601 [0,2,0,0,0,0|2,0,0]=4 6866 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(C)C 240690a_100000210953_100000685612 [0,2,0,0,0,0|1,0,0]=3 6867 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(C)O 240690a_100000210904_100000685612 [0,2,0,0,0,0|2,0,0]=4 6868 B15R1.889 Cc1cc(ccc1O)C(=O)NNC(C)C 22a_100000741168_100000685612 [0,2,0,0,0,0|2,0,0]=4 6869 B15R1.889 Cc1ccc(cc1Br)C(=O)CCC(C)C 1458a_100000186397_100000210312 [0,2,0,0,0,0|1,0,0]=3 6870 B15R1.889 Cc1ccc(cc1Br)C(=O)CCC(C)O 1458a_100000186397_100012276601 [0,2,0,0,0,0|2,0,0]=4 6871 B15R1.889 Cc1ccc(cc1Br)C(=O)CNC(C)C 2230a_100138425928_100012346676 [0,2,0,0,0,0|2,0,0]=4 6872 B15R1.889 Cc1ccc(cc1Br)C(=O)CNC(C)C 34a_100138425928_100012346676 [0,2,0,0,0,0|2,0,0]=4 6873 B15R1.889 Cc1ccc(cc1Br)C(=O)COC(C)C 34a_100000212225_100012346676 [0,2,0,0,0,0|2,0,0]=4 6874 B15R1.889 Cc1ccc(cc1Br)C(=O)CSC(C)C 62a_100000210206_100012346676 [0,2,0,0,0,0|2,0,0]=4 6875 B15R1.889 Cc1ccc(cc1Br)C(=O)CSC(C)C 62a_100012346676_100000210206 [0,2,0,0,0,0|2,0,0]=4 6876 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 11a_100000210953_100000186397 [0,2,0,0,0,0|1,0,0]=3 6877 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 1626a_100000210953_100000186397 [0,2,0,0,0,0|1,0,0]=3 6878 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 240690a_100000210953_100000186397 [0,2,0,0,0,0|1,0,0]=3 6879 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 527a_100000210953_100000186397 [0,2,0,0,0,0|1,0,0]=3 6880 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)O 11a_100000210904_100000186397 [0,2,0,0,0,0|2,0,0]=4 6881 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)O 240690a_100000210904_100000186397 [0,2,0,0,0,0|2,0,0]=4 6882 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)O 527a_100000210904_100000186397 [0,2,0,0,0,0|2,0,0]=4 6883 B15R1.889 Cc1ccc(cc1Br)C(=O)NNC(C)C 22a_100000741168_100000186397 [0,2,0,0,0,0|2,0,0]=4 6884 B15R1.889 Cc1ccc(cc1C)C(=O)CCC(C)C 1458a_100000210898_100000210312 [0,2,0,0,0,0|1,0,0]=3 6885 B15R1.889 Cc1ccc(cc1C)C(=O)CCC(C)O 1458a_100000210898_100012276601 [0,2,0,0,0,0|2,0,0]=4 6886 B15R1.889 Cc1ccc(cc1C)C(=O)CNC(C)C 2230a_100138425928_100000183365 [0,2,0,0,0,0|2,0,0]=4 6887 B15R1.889 Cc1ccc(cc1C)C(=O)CSC(C)C 62a_100000183365_100000210206 [0,2,0,0,0,0|2,0,0]=4 6888 B15R1.889 Cc1ccc(cc1C)C(=O)CSC(C)C 62a_100000210206_100000183365 [0,2,0,0,0,0|2,0,0]=4 6889 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 11a_100000210953_100000210898 [0,2,0,0,0,0|1,0,0]=3 6890 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 1626a_100000210953_100000210898 [0,2,0,0,0,0|1,0,0]=3 6891 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 240690a_100000210953_100000210898 [0,2,0,0,0,0|1,0,0]=3 6892 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 527a_100000210953_100000210898 [0,2,0,0,0,0|1,0,0]=3 6893 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)O 11a_100000210904_100000210898 [0,2,0,0,0,0|2,0,0]=4 6894 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)O 240690a_100000210904_100000210898 [0,2,0,0,0,0|2,0,0]=4 6895 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)O 527a_100000210904_100000210898 [0,2,0,0,0,0|2,0,0]=4 6896 B15R1.889 Cc1ccc(cc1C)C(=O)NNC(C)C 22a_100000741168_100000210898 [0,2,0,0,0,0|2,0,0]=4 6897 B15R1.889 Cc1ccc(cc1Cl)C(=O)CCC(C)C 1458a_100000751740_100000210312 [0,2,0,0,0,0|1,0,0]=3 6898 B15R1.889 Cc1ccc(cc1Cl)C(=O)CCC(C)O 1458a_100000751740_100012276601 [0,2,0,0,0,0|2,0,0]=4 6899 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 11a_100000210953_100000751740 [0,2,0,0,0,0|1,0,0]=3 6900 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 1626a_100000210953_100000751740 [0,2,0,0,0,0|1,0,0]=3 6901 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 240690a_100000210953_100000751740 [0,2,0,0,0,0|1,0,0]=3 6902 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 527a_100000210953_100000751740 [0,2,0,0,0,0|1,0,0]=3 6903 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)O 11a_100000210904_100000751740 [0,2,0,0,0,0|2,0,0]=4 6904 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)O 240690a_100000210904_100000751740 [0,2,0,0,0,0|2,0,0]=4 6905 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)O 527a_100000210904_100000751740 [0,2,0,0,0,0|2,0,0]=4 6906 B15R1.889 Cc1ccc(cc1Cl)C(=O)NNC(C)C 22a_100000741168_100000751740 [0,2,0,0,0,0|2,0,0]=4 6907 B15R1.889 Cc1ccc(cc1F)C(=O)CCC(C)C 1458a_100000212313_100000210312 [0,2,0,0,0,0|1,0,0]=3 6908 B15R1.889 Cc1ccc(cc1F)C(=O)CCC(C)O 1458a_100000212313_100012276601 [0,2,0,0,0,0|2,0,0]=4 6909 B15R1.889 Cc1ccc(cc1F)C(=O)CNC(C)C 2230a_100138425928_100011219196 [0,2,0,0,0,0|2,0,0]=4 6910 B15R1.889 Cc1ccc(cc1F)C(=O)CNC(C)C 34a_100138425928_100011219196 [0,2,0,0,0,0|2,0,0]=4 6911 B15R1.889 Cc1ccc(cc1F)C(=O)COC(C)C 34a_100000212225_100011219196 [0,2,0,0,0,0|2,0,0]=4 6912 B15R1.889 Cc1ccc(cc1F)C(=O)CSC(C)C 62a_100000210206_100011219196 [0,2,0,0,0,0|2,0,0]=4 6913 B15R1.889 Cc1ccc(cc1F)C(=O)CSC(C)C 62a_100011219196_100000210206 [0,2,0,0,0,0|2,0,0]=4 6914 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 11a_100000210953_100000212313 [0,2,0,0,0,0|1,0,0]=3 6915 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 1626a_100000210953_100000212313 [0,2,0,0,0,0|1,0,0]=3 6916 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 240690a_100000210953_100000212313 [0,2,0,0,0,0|1,0,0]=3 6917 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 527a_100000210953_100000212313 [0,2,0,0,0,0|1,0,0]=3 6918 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)O 11a_100000210904_100000212313 [0,2,0,0,0,0|2,0,0]=4 6919 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)O 240690a_100000210904_100000212313 [0,2,0,0,0,0|2,0,0]=4 6920 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)O 527a_100000210904_100000212313 [0,2,0,0,0,0|2,0,0]=4 6921 B15R1.889 Cc1ccc(cc1F)C(=O)NNC(C)C 22a_100000741168_100000212313 [0,2,0,0,0,0|2,0,0]=4 6922 B15R1.889 Cc1ccc(cc1I)C(=O)CCC(C)C 1458a_100000751299_100000210312 [0,2,0,0,0,0|1,0,0]=3 6923 B15R1.889 Cc1ccc(cc1I)C(=O)CCC(C)O 1458a_100000751299_100012276601 [0,2,0,0,0,0|2,0,0]=4 6924 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 11a_100000210953_100000751299 [0,2,0,0,0,0|1,0,0]=3 6925 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 1626a_100000210953_100000751299 [0,2,0,0,0,0|1,0,0]=3 6926 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 240690a_100000210953_100000751299 [0,2,0,0,0,0|1,0,0]=3 6927 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 527a_100000210953_100000751299 [0,2,0,0,0,0|1,0,0]=3 6928 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)O 11a_100000210904_100000751299 [0,2,0,0,0,0|2,0,0]=4 6929 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)O 240690a_100000210904_100000751299 [0,2,0,0,0,0|2,0,0]=4 6930 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)O 527a_100000210904_100000751299 [0,2,0,0,0,0|2,0,0]=4 6931 B15R1.889 Cc1ccc(cc1I)C(=O)NNC(C)C 22a_100000741168_100000751299 [0,2,0,0,0,0|2,0,0]=4 6932 B15R1.889 Cc1ccc(cc1O)C(=O)CCC(C)C 1458a_100000233767_100000210312 [0,2,0,0,0,0|1,0,0]=3 6933 B15R1.889 Cc1ccc(cc1O)C(=O)CCC(C)O 1458a_100000233767_100012276601 [0,2,0,0,0,0|2,0,0]=4 6934 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(C)C 240690a_100000210953_100000233767 [0,2,0,0,0,0|1,0,0]=3 6935 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(C)O 240690a_100000210904_100000233767 [0,2,0,0,0,0|2,0,0]=4 6936 B15R1.889 Cc1ccc(cc1O)C(=O)NNC(C)C 22a_100000741168_100000233767 [0,2,0,0,0,0|2,0,0]=4 6937 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210312 [0,2,0,0,0,0|1,0,0]=3 6938 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210312 [0,2,0,0,0,0|1,0,0]=3 6939 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210312 [0,2,0,0,0,0|1,0,0]=3 6940 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210312 [0,2,0,0,0,0|1,0,0]=3 6941 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210312 [0,2,0,0,0,0|1,0,0]=3 6942 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210312 [0,2,0,0,0,0|1,0,0]=3 6943 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210312 [0,2,0,0,0,0|1,0,0]=3 6944 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210312 [0,2,0,0,0,0|1,0,0]=3 6945 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210312 [0,2,0,0,0,0|1,0,0]=3 6946 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210312 [0,2,0,0,0,0|1,0,0]=3 6947 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210312 [0,2,0,0,0,0|1,0,0]=3 6948 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210312 [0,2,0,0,0,0|1,0,0]=3 6949 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210312 [0,2,0,0,0,0|1,0,0]=3 6950 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Br 11a_100000210953_100000687083 [0,2,0,0,0,0|1,0,0]=3 6951 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Br 1626a_100000210953_100000687083 [0,2,0,0,0,0|1,0,0]=3 6952 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Br 240690a_100000210953_100000687083 [0,2,0,0,0,0|1,0,0]=3 6953 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Br 527a_100000210953_100000687083 [0,2,0,0,0,0|1,0,0]=3 6954 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Cl 11a_100000210953_100000687899 [0,2,0,0,0,0|1,0,0]=3 6955 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Cl 1626a_100000210953_100000687899 [0,2,0,0,0,0|1,0,0]=3 6956 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Cl 240690a_100000210953_100000687899 [0,2,0,0,0,0|1,0,0]=3 6957 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)Cl 527a_100000210953_100000687899 [0,2,0,0,0,0|1,0,0]=3 6958 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)F 11a_100000210953_100000739618 [0,2,0,0,0,0|1,0,0]=3 6959 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)F 1626a_100000210953_100000739618 [0,2,0,0,0,0|1,0,0]=3 6960 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)F 240690a_100000210953_100000739618 [0,2,0,0,0,0|1,0,0]=3 6961 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)F 527a_100000210953_100000739618 [0,2,0,0,0,0|1,0,0]=3 6962 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)O 240690a_100000210953_100011934545 [0,2,0,0,0,0|1,0,0]=3 6963 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)O 527a_100000210953_100011934545 [0,2,0,0,0,0|1,0,0]=3 6964 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)Cl 11a_100000210953_100000210701 [0,2,0,0,0,0|1,0,0]=3 6965 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)Cl 1626a_100000210953_100000210701 [0,2,0,0,0,0|1,0,0]=3 6966 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)Cl 240690a_100000210953_100000210701 [0,2,0,0,0,0|1,0,0]=3 6967 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)Cl 527a_100000210953_100000210701 [0,2,0,0,0,0|1,0,0]=3 6968 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)F 11a_100000210953_100000685768 [0,2,0,0,0,0|1,0,0]=3 6969 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)F 1626a_100000210953_100000685768 [0,2,0,0,0,0|1,0,0]=3 6970 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)F 240690a_100000210953_100000685768 [0,2,0,0,0,0|1,0,0]=3 6971 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)F 527a_100000210953_100000685768 [0,2,0,0,0,0|1,0,0]=3 6972 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)O 240690a_100000210953_100011997059 [0,2,0,0,0,0|1,0,0]=3 6973 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)O 527a_100000210953_100011997059 [0,2,0,0,0,0|1,0,0]=3 6974 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)F 11a_100000210953_100000211655 [0,2,0,0,0,0|1,0,0]=3 6975 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)F 1626a_100000210953_100000211655 [0,2,0,0,0,0|1,0,0]=3 6976 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)F 240690a_100000210953_100000211655 [0,2,0,0,0,0|1,0,0]=3 6977 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)F 527a_100000210953_100000211655 [0,2,0,0,0,0|1,0,0]=3 6978 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)O 11a_100000210953_100012017291 [0,2,0,0,0,0|1,0,0]=3 6979 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)O 240690a_100000210953_100012017291 [0,2,0,0,0,0|1,0,0]=3 6980 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)O 527a_100000210953_100012017291 [0,2,0,0,0,0|1,0,0]=3 6981 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Br 11a_100000210953_100000689235 [0,2,0,0,0,0|1,0,0]=3 6982 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Br 1626a_100000210953_100000689235 [0,2,0,0,0,0|1,0,0]=3 6983 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Br 240690a_100000210953_100000689235 [0,2,0,0,0,0|1,0,0]=3 6984 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Br 527a_100000210953_100000689235 [0,2,0,0,0,0|1,0,0]=3 6985 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Cl 11a_100000210953_100012047205 [0,2,0,0,0,0|1,0,0]=3 6986 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Cl 1626a_100000210953_100012047205 [0,2,0,0,0,0|1,0,0]=3 6987 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Cl 240690a_100000210953_100012047205 [0,2,0,0,0,0|1,0,0]=3 6988 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)Cl 527a_100000210953_100012047205 [0,2,0,0,0,0|1,0,0]=3 6989 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)F 11a_100000210953_100012047268 [0,2,0,0,0,0|1,0,0]=3 6990 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)F 1626a_100000210953_100012047268 [0,2,0,0,0,0|1,0,0]=3 6991 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)F 240690a_100000210953_100012047268 [0,2,0,0,0,0|1,0,0]=3 6992 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)F 527a_100000210953_100012047268 [0,2,0,0,0,0|1,0,0]=3 6993 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)I 11a_100000210953_100011204819 [0,2,0,0,0,0|1,0,0]=3 6994 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)I 1626a_100000210953_100011204819 [0,2,0,0,0,0|1,0,0]=3 6995 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)I 240690a_100000210953_100011204819 [0,2,0,0,0,0|1,0,0]=3 6996 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)I)I 527a_100000210953_100011204819 [0,2,0,0,0,0|1,0,0]=3 6997 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)O)O 240690a_100000210953_100000690292 [0,2,0,0,0,0|1,0,0]=3 6998 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)O)O 527a_100000210953_100000690292 [0,2,0,0,0,0|1,0,0]=3 6999 B15R1.5450 CC(C)CO[C@@H](C)c1cc(cc(c1)F)F 34a_100012136759_100000210624 [0,2,0,0,0,0|1,0,1]=4 7000 B15R1.5450 CC(C)CO[C@@H](C)c1cc(cc(c1)F)F 7a_100012136759_100000210760 [0,2,0,0,0,0|1,0,1]=4 7001 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)Cl)Cl 2230a_100138425928_200012340517 [0,2,0,0,0,0|2,0,0]=4 7002 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)Cl)Cl 34a_100138425928_200012340517 [0,2,0,0,0,0|2,0,0]=4 7003 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)F)F 2230a_100138425928_100011216790 [0,2,0,0,0,0|2,0,0]=4 7004 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)F)F 34a_100138425928_100011216790 [0,2,0,0,0,0|2,0,0]=4 7005 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)O)O 2230a_100138425928_100010006762 [0,2,0,0,0,0|2,0,0]=4 7006 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)O)O 34a_100138425928_100010006762 [0,2,0,0,0,0|2,0,0]=4 7007 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Br)Br 22a_100000741168_100000687083 [0,2,0,0,0,0|2,0,0]=4 7008 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Br)Cl 22a_100000741168_100000687899 [0,2,0,0,0,0|2,0,0]=4 7009 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Br)F 22a_100000741168_100000739618 [0,2,0,0,0,0|2,0,0]=4 7010 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Br)O 22a_100000741168_100011934545 [0,2,0,0,0,0|2,0,0]=4 7011 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Cl)Cl 22a_100000741168_100000210701 [0,2,0,0,0,0|2,0,0]=4 7012 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Cl)F 22a_100000741168_100000685768 [0,2,0,0,0,0|2,0,0]=4 7013 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)Cl)O 22a_100000741168_100011997059 [0,2,0,0,0,0|2,0,0]=4 7014 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)F)F 22a_100000741168_100000211655 [0,2,0,0,0,0|2,0,0]=4 7015 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)F)O 22a_100000741168_100012017291 [0,2,0,0,0,0|2,0,0]=4 7016 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)I)Br 22a_100000741168_100000689235 [0,2,0,0,0,0|2,0,0]=4 7017 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)I)Cl 22a_100000741168_100012047205 [0,2,0,0,0,0|2,0,0]=4 7018 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)I)F 22a_100000741168_100012047268 [0,2,0,0,0,0|2,0,0]=4 7019 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)I)I 22a_100000741168_100011204819 [0,2,0,0,0,0|2,0,0]=4 7020 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)O)O 22a_100000741168_100000690292 [0,2,0,0,0,0|2,0,0]=4 7021 B15R1.5450 CC(C)OCC(=O)c1cc(cc(c1)Cl)Cl 34a_100000212225_200012340517 [0,2,0,0,0,0|2,0,0]=4 7022 B15R1.5450 CC(C)OCC(=O)c1cc(cc(c1)F)F 34a_100000212225_100011216790 [0,2,0,0,0,0|2,0,0]=4 7023 B15R1.5450 CC(C)OCC(=O)c1cc(cc(c1)F)F 34a_100012568930_100000210206 [0,2,0,0,0,0|2,0,0]=4 7024 B15R1.5450 CC(C)OCC(=O)c1cc(cc(c1)F)F 7a_100012568930_100000210206 [0,2,0,0,0,0|2,0,0]=4 7025 B15R1.5450 CC(C)OCC(=O)c1cc(cc(c1)O)O 34a_100000212225_100010006762 [0,2,0,0,0,0|2,0,0]=4 7026 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)Cl)Cl 62a_100000210206_200012340517 [0,2,0,0,0,0|2,0,0]=4 7027 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)Cl)Cl 62a_200012340517_100000210206 [0,2,0,0,0,0|2,0,0]=4 7028 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)F)F 62a_100000210206_100011216790 [0,2,0,0,0,0|2,0,0]=4 7029 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)F)F 62a_100011216790_100000210206 [0,2,0,0,0,0|2,0,0]=4 7030 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)O)O 62a_100000210206_100010006762 [0,2,0,0,0,0|2,0,0]=4 7031 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)O)O 62a_100010006762_100000210206 [0,2,0,0,0,0|2,0,0]=4 7032 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100012276601 [0,2,0,0,0,0|2,0,0]=4 7033 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100012276601 [0,2,0,0,0,0|2,0,0]=4 7034 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100012276601 [0,2,0,0,0,0|2,0,0]=4 7035 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100012276601 [0,2,0,0,0,0|2,0,0]=4 7036 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100012276601 [0,2,0,0,0,0|2,0,0]=4 7037 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100012276601 [0,2,0,0,0,0|2,0,0]=4 7038 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100012276601 [0,2,0,0,0,0|2,0,0]=4 7039 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100012276601 [0,2,0,0,0,0|2,0,0]=4 7040 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100012276601 [0,2,0,0,0,0|2,0,0]=4 7041 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100012276601 [0,2,0,0,0,0|2,0,0]=4 7042 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100012276601 [0,2,0,0,0,0|2,0,0]=4 7043 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100012276601 [0,2,0,0,0,0|2,0,0]=4 7044 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100012276601 [0,2,0,0,0,0|2,0,0]=4 7045 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)Br 11a_100000210904_100000687083 [0,2,0,0,0,0|2,0,0]=4 7046 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)Br 240690a_100000210904_100000687083 [0,2,0,0,0,0|2,0,0]=4 7047 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)Br 527a_100000210904_100000687083 [0,2,0,0,0,0|2,0,0]=4 7048 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)Cl 11a_100000210904_100000687899 [0,2,0,0,0,0|2,0,0]=4 7049 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)Cl 240690a_100000210904_100000687899 [0,2,0,0,0,0|2,0,0]=4 7050 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)Cl 527a_100000210904_100000687899 [0,2,0,0,0,0|2,0,0]=4 7051 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)F 11a_100000210904_100000739618 [0,2,0,0,0,0|2,0,0]=4 7052 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)F 240690a_100000210904_100000739618 [0,2,0,0,0,0|2,0,0]=4 7053 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)F 527a_100000210904_100000739618 [0,2,0,0,0,0|2,0,0]=4 7054 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)O 240690a_100000210904_100011934545 [0,2,0,0,0,0|2,0,0]=4 7055 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)O 527a_100000210904_100011934545 [0,2,0,0,0,0|2,0,0]=4 7056 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)Cl 11a_100000210904_100000210701 [0,2,0,0,0,0|2,0,0]=4 7057 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)Cl 240690a_100000210904_100000210701 [0,2,0,0,0,0|2,0,0]=4 7058 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)Cl 527a_100000210904_100000210701 [0,2,0,0,0,0|2,0,0]=4 7059 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)F 11a_100000210904_100000685768 [0,2,0,0,0,0|2,0,0]=4 7060 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)F 240690a_100000210904_100000685768 [0,2,0,0,0,0|2,0,0]=4 7061 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)F 527a_100000210904_100000685768 [0,2,0,0,0,0|2,0,0]=4 7062 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)O 240690a_100000210904_100011997059 [0,2,0,0,0,0|2,0,0]=4 7063 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)O 527a_100000210904_100011997059 [0,2,0,0,0,0|2,0,0]=4 7064 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)F 11a_100000210904_100000211655 [0,2,0,0,0,0|2,0,0]=4 7065 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)F 240690a_100000210904_100000211655 [0,2,0,0,0,0|2,0,0]=4 7066 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)F 527a_100000210904_100000211655 [0,2,0,0,0,0|2,0,0]=4 7067 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)O 11a_100000210904_100012017291 [0,2,0,0,0,0|2,0,0]=4 7068 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)O 240690a_100000210904_100012017291 [0,2,0,0,0,0|2,0,0]=4 7069 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)O 527a_100000210904_100012017291 [0,2,0,0,0,0|2,0,0]=4 7070 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)Br 11a_100000210904_100000689235 [0,2,0,0,0,0|2,0,0]=4 7071 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)Br 240690a_100000210904_100000689235 [0,2,0,0,0,0|2,0,0]=4 7072 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)Br 527a_100000210904_100000689235 [0,2,0,0,0,0|2,0,0]=4 7073 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)Cl 11a_100000210904_100012047205 [0,2,0,0,0,0|2,0,0]=4 7074 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)Cl 240690a_100000210904_100012047205 [0,2,0,0,0,0|2,0,0]=4 7075 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)Cl 527a_100000210904_100012047205 [0,2,0,0,0,0|2,0,0]=4 7076 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)F 11a_100000210904_100012047268 [0,2,0,0,0,0|2,0,0]=4 7077 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)F 240690a_100000210904_100012047268 [0,2,0,0,0,0|2,0,0]=4 7078 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)F 527a_100000210904_100012047268 [0,2,0,0,0,0|2,0,0]=4 7079 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)I 11a_100000210904_100011204819 [0,2,0,0,0,0|2,0,0]=4 7080 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)I 240690a_100000210904_100011204819 [0,2,0,0,0,0|2,0,0]=4 7081 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)I)I 527a_100000210904_100011204819 [0,2,0,0,0,0|2,0,0]=4 7082 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)O)O 240690a_100000210904_100000690292 [0,2,0,0,0,0|2,0,0]=4 7083 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)O)O 527a_100000210904_100000690292 [0,2,0,0,0,0|2,0,0]=4 7084 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)Br 1458a_100000760426_100000210312 [0,2,0,0,0,0|1,0,0]=3 7085 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)C 1458a_100000210874_100000210312 [0,2,0,0,0,0|1,0,0]=3 7086 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)Cl 1458a_100000684526_100000210312 [0,2,0,0,0,0|1,0,0]=3 7087 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)F 1458a_100000763163_100000210312 [0,2,0,0,0,0|1,0,0]=3 7088 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)I 1458a_100000729426_100000210312 [0,2,0,0,0,0|1,0,0]=3 7089 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)O 1458a_100000094094_100000210312 [0,2,0,0,0,0|1,0,0]=3 7090 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)Br 1458a_100000760426_100012276601 [0,2,0,0,0,0|2,0,0]=4 7091 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)C 1458a_100000210874_100012276601 [0,2,0,0,0,0|2,0,0]=4 7092 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)Cl 1458a_100000684526_100012276601 [0,2,0,0,0,0|2,0,0]=4 7093 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)F 1458a_100000763163_100012276601 [0,2,0,0,0,0|2,0,0]=4 7094 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)I 1458a_100000729426_100012276601 [0,2,0,0,0,0|2,0,0]=4 7095 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)O 1458a_100000094094_100012276601 [0,2,0,0,0,0|2,0,0]=4 7096 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Br 11a_100000210953_100000760426 [0,2,0,0,0,0|1,0,0]=3 7097 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Br 1626a_100000210953_100000760426 [0,2,0,0,0,0|1,0,0]=3 7098 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Br 240690a_100000210953_100000760426 [0,2,0,0,0,0|1,0,0]=3 7099 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Br 527a_100000210953_100000760426 [0,2,0,0,0,0|1,0,0]=3 7100 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)C 11a_100000210953_100000210874 [0,2,0,0,0,0|1,0,0]=3 7101 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)C 1626a_100000210953_100000210874 [0,2,0,0,0,0|1,0,0]=3 7102 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)C 240690a_100000210953_100000210874 [0,2,0,0,0,0|1,0,0]=3 7103 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)C 527a_100000210953_100000210874 [0,2,0,0,0,0|1,0,0]=3 7104 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Cl 11a_100000210953_100000684526 [0,2,0,0,0,0|1,0,0]=3 7105 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Cl 1626a_100000210953_100000684526 [0,2,0,0,0,0|1,0,0]=3 7106 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Cl 240690a_100000210953_100000684526 [0,2,0,0,0,0|1,0,0]=3 7107 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)Cl 527a_100000210953_100000684526 [0,2,0,0,0,0|1,0,0]=3 7108 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)F 11a_100000210953_100000763163 [0,2,0,0,0,0|1,0,0]=3 7109 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)F 1626a_100000210953_100000763163 [0,2,0,0,0,0|1,0,0]=3 7110 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)F 240690a_100000210953_100000763163 [0,2,0,0,0,0|1,0,0]=3 7111 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)F 527a_100000210953_100000763163 [0,2,0,0,0,0|1,0,0]=3 7112 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)I 11a_100000210953_100000729426 [0,2,0,0,0,0|1,0,0]=3 7113 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)I 1626a_100000210953_100000729426 [0,2,0,0,0,0|1,0,0]=3 7114 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)I 240690a_100000210953_100000729426 [0,2,0,0,0,0|1,0,0]=3 7115 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)I 527a_100000210953_100000729426 [0,2,0,0,0,0|1,0,0]=3 7116 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)O 240690a_100000210953_100000094094 [0,2,0,0,0,0|1,0,0]=3 7117 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)O 527a_100000210953_100000094094 [0,2,0,0,0,0|1,0,0]=3 7118 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)Br 11a_100000210904_100000760426 [0,2,0,0,0,0|2,0,0]=4 7119 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)Br 240690a_100000210904_100000760426 [0,2,0,0,0,0|2,0,0]=4 7120 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)Br 527a_100000210904_100000760426 [0,2,0,0,0,0|2,0,0]=4 7121 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)C 11a_100000210904_100000210874 [0,2,0,0,0,0|2,0,0]=4 7122 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)C 240690a_100000210904_100000210874 [0,2,0,0,0,0|2,0,0]=4 7123 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)C 527a_100000210904_100000210874 [0,2,0,0,0,0|2,0,0]=4 7124 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)Cl 11a_100000210904_100000684526 [0,2,0,0,0,0|2,0,0]=4 7125 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)Cl 240690a_100000210904_100000684526 [0,2,0,0,0,0|2,0,0]=4 7126 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)Cl 527a_100000210904_100000684526 [0,2,0,0,0,0|2,0,0]=4 7127 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)F 11a_100000210904_100000763163 [0,2,0,0,0,0|2,0,0]=4 7128 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)F 240690a_100000210904_100000763163 [0,2,0,0,0,0|2,0,0]=4 7129 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)F 527a_100000210904_100000763163 [0,2,0,0,0,0|2,0,0]=4 7130 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)I 11a_100000210904_100000729426 [0,2,0,0,0,0|2,0,0]=4 7131 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)I 240690a_100000210904_100000729426 [0,2,0,0,0,0|2,0,0]=4 7132 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)I 527a_100000210904_100000729426 [0,2,0,0,0,0|2,0,0]=4 7133 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)O 240690a_100000210904_100000094094 [0,2,0,0,0,0|2,0,0]=4 7134 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)O 527a_100000210904_100000094094 [0,2,0,0,0,0|2,0,0]=4 7135 B15R1.5450 Cc1cc(cc(c1)C(=O)NNC(C)C)Br 22a_100000741168_100000760426 [0,2,0,0,0,0|2,0,0]=4 7136 B15R1.5450 Cc1cc(cc(c1)C(=O)NNC(C)C)C 22a_100000741168_100000210874 [0,2,0,0,0,0|2,0,0]=4 7137 B15R1.5450 Cc1cc(cc(c1)C(=O)NNC(C)C)Cl 22a_100000741168_100000684526 [0,2,0,0,0,0|2,0,0]=4 7138 B15R1.5450 Cc1cc(cc(c1)C(=O)NNC(C)C)F 22a_100000741168_100000763163 [0,2,0,0,0,0|2,0,0]=4 7139 B15R1.5450 Cc1cc(cc(c1)C(=O)NNC(C)C)I 22a_100000741168_100000729426 [0,2,0,0,0,0|2,0,0]=4 7140 B15R1.5450 Cc1cc(cc(c1)C(=O)NNC(C)C)O 22a_100000741168_100000094094 [0,2,0,0,0,0|2,0,0]=4 7141 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)Br 270084a_100000210953_100000184224 [0,2,0,0,0,0|2,0,0]=4 7142 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)Br 274078a_100000210953_100000184224 [0,2,0,0,0,0|2,0,0]=4 7143 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)Br 40a_100000210953_100010340488 [0,2,0,0,0,0|2,0,0]=4 7144 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)Cl 270084a_100000210953_100000182923 [0,2,0,0,0,0|2,0,0]=4 7145 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)Cl 274078a_100000210953_100000182923 [0,2,0,0,0,0|2,0,0]=4 7146 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)F 270084a_100000210953_100000184201 [0,2,0,0,0,0|2,0,0]=4 7147 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)F 274078a_100000210953_100000184201 [0,2,0,0,0,0|2,0,0]=4 7148 B15R1.5728 CC(C)CNS(=O)(=O)c1cccc(c1)N 40a_100000210953_100000034547 [0,2,0,0,0,0|2,0,0]=4 7149 B15R1.5728 CC(C)COC(C)(C)c1cccc(c1)Br 34a_100011346009_100000210624 [0,2,0,0,0,0|1,0,1]=4 7150 B15R1.5728 CC(C)COC(C)(C)c1cccc(c1)Br 7a_100011346009_100000210760 [0,2,0,0,0,0|1,0,1]=4 7151 B15R1.5728 CC(C)COC(C)(C)c1cccc(c1)Cl 34a_100011345980_100000210624 [0,2,0,0,0,0|1,0,1]=4 7152 B15R1.5728 CC(C)COC(C)(C)c1cccc(c1)Cl 7a_100011345980_100000210760 [0,2,0,0,0,0|1,0,1]=4 7153 B15R1.5728 CC(C)COC(C)(C)c1cccc(c1)F 34a_200011345953_100000210624 [0,2,0,0,0,0|1,0,1]=4 7154 B15R1.5728 CC(C)COC(C)(C)c1cccc(c1)F 7a_200011345953_100000210760 [0,2,0,0,0,0|1,0,1]=4 7155 B15R1.5728 Cc1cccc(c1)S(=O)(=O)NCC(C)C 270084a_100000210953_100000182797 [0,2,0,0,0,0|2,0,0]=4 7156 B15R1.5728 Cc1cccc(c1)S(=O)(=O)NCC(C)C 274078a_100000210953_100000182797 [0,2,0,0,0,0|2,0,0]=4 7157 B15R1.5728 Cc1cccc(c1)S(=O)(=O)NCC(C)C 40a_100000210953_100010983817 [0,2,0,0,0,0|2,0,0]=4 7158 B15R1.8271 CC(C)CC(C)C(=O)c1cccc(c1)Br 1458a_100000210664_100000731052 [0,2,0,0,0,0|1,0,0]=3 7159 B15R1.8271 CC(C)CC(C)C(=O)c1cccc(c1)Cl 1458a_100000210390_100000731052 [0,2,0,0,0,0|1,0,0]=3 7160 B15R1.8271 CC(C)CC(C)C(=O)c1cccc(c1)F 1458a_100000210950_100000731052 [0,2,0,0,0,0|1,0,0]=3 7161 B15R1.8271 CC(C)CC(C)C(=O)c1cccc(c1)I 1458a_100000184098_100000731052 [0,2,0,0,0,0|1,0,0]=3 7162 B15R1.8271 CC(C)CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000731052 [0,2,0,0,0,0|1,0,0]=3 7163 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Br 11a_100000747067_100000210664 [0,2,0,0,0,0|1,0,0]=3 7164 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Br 1626a_100000747067_100000210664 [0,2,0,0,0,0|1,0,0]=3 7165 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Br 240690a_100000747067_100000210664 [0,2,0,0,0,0|1,0,0]=3 7166 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Br 527a_100000747067_100000210664 [0,2,0,0,0,0|1,0,0]=3 7167 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Cl 11a_100000747067_100000210390 [0,2,0,0,0,0|1,0,0]=3 7168 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Cl 1626a_100000747067_100000210390 [0,2,0,0,0,0|1,0,0]=3 7169 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Cl 240690a_100000747067_100000210390 [0,2,0,0,0,0|1,0,0]=3 7170 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)Cl 527a_100000747067_100000210390 [0,2,0,0,0,0|1,0,0]=3 7171 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)F 11a_100000747067_100000210950 [0,2,0,0,0,0|1,0,0]=3 7172 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)F 1626a_100000747067_100000210950 [0,2,0,0,0,0|1,0,0]=3 7173 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)F 240690a_100000747067_100000210950 [0,2,0,0,0,0|1,0,0]=3 7174 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)F 527a_100000747067_100000210950 [0,2,0,0,0,0|1,0,0]=3 7175 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)I 11a_100000747067_100000184098 [0,2,0,0,0,0|1,0,0]=3 7176 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)I 1626a_100000747067_100000184098 [0,2,0,0,0,0|1,0,0]=3 7177 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)I 240690a_100000747067_100000184098 [0,2,0,0,0,0|1,0,0]=3 7178 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)I 527a_100000747067_100000184098 [0,2,0,0,0,0|1,0,0]=3 7179 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)O 240690a_100000747067_100000183914 [0,2,0,0,0,0|1,0,0]=3 7180 B15R1.8271 CC(C)CN(C)C(=O)c1cccc(c1)O 527a_100000747067_100000183914 [0,2,0,0,0,0|1,0,0]=3 7181 B15R1.8271 CC(C)NC(C)C(=O)c1cccc(c1)Br 2230a_100138425928_100012349134 [0,2,0,0,0,0|2,0,0]=4 7182 B15R1.8271 CC(C)NC(C)C(=O)c1cccc(c1)Br 34a_100138425928_100012349134 [0,2,0,0,0,0|2,0,0]=4 7183 B15R1.8271 CC(C)NC(C)C(=O)c1cccc(c1)Cl 2230a_100138425928_100000184413 [0,2,0,0,0,0|2,0,0]=4 7184 B15R1.8271 CC(C)NC(C)C(=O)c1cccc(c1)Cl 34a_100138425928_100000184413 [0,2,0,0,0,0|2,0,0]=4 7185 B15R1.8271 CC(C)NC(C)C(=O)c1cccc(c1)F 2230a_100138425928_100012356231 [0,2,0,0,0,0|2,0,0]=4 7186 B15R1.8271 CC(C)NC(C)C(=O)c1cccc(c1)F 34a_100138425928_100012356231 [0,2,0,0,0,0|2,0,0]=4 7187 B15R1.8271 CC(C)OC(C)C(=O)c1cccc(c1)Br 34a_100000212225_100012349134 [0,2,0,0,0,0|2,0,0]=4 7188 B15R1.8271 CC(C)OC(C)C(=O)c1cccc(c1)Cl 34a_100000212225_100000184413 [0,2,0,0,0,0|2,0,0]=4 7189 B15R1.8271 CC(C)OC(C)C(=O)c1cccc(c1)F 34a_100000212225_100012356231 [0,2,0,0,0,0|2,0,0]=4 7190 B15R1.8271 CC(C)SC(C)C(=O)c1cccc(c1)Br 62a_100000210206_100012349134 [0,2,0,0,0,0|2,0,0]=4 7191 B15R1.8271 CC(C)SC(C)C(=O)c1cccc(c1)Br 62a_100012349134_100000210206 [0,2,0,0,0,0|2,0,0]=4 7192 B15R1.8271 CC(C)SC(C)C(=O)c1cccc(c1)Cl 62a_100000184413_100000210206 [0,2,0,0,0,0|2,0,0]=4 7193 B15R1.8271 CC(C)SC(C)C(=O)c1cccc(c1)Cl 62a_100000210206_100000184413 [0,2,0,0,0,0|2,0,0]=4 7194 B15R1.8271 CC(C)SC(C)C(=O)c1cccc(c1)F 62a_100000210206_100012356231 [0,2,0,0,0,0|2,0,0]=4 7195 B15R1.8271 CC(C)SC(C)C(=O)c1cccc(c1)F 62a_100012356231_100000210206 [0,2,0,0,0,0|2,0,0]=4 7196 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)Br 240690a_100000227577_100000210664 [0,2,0,0,0,0|2,0,0]=4 7197 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)Br 527a_100000227577_100000210664 [0,2,0,0,0,0|2,0,0]=4 7198 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)Cl 240690a_100000227577_100000210390 [0,2,0,0,0,0|2,0,0]=4 7199 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)Cl 527a_100000227577_100000210390 [0,2,0,0,0,0|2,0,0]=4 7200 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)F 240690a_100000227577_100000210950 [0,2,0,0,0,0|2,0,0]=4 7201 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)F 527a_100000227577_100000210950 [0,2,0,0,0,0|2,0,0]=4 7202 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)I 240690a_100000227577_100000184098 [0,2,0,0,0,0|2,0,0]=4 7203 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)I 527a_100000227577_100000184098 [0,2,0,0,0,0|2,0,0]=4 7204 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)O 240690a_100000227577_100000183914 [0,2,0,0,0,0|2,0,0]=4 7205 B15R1.8271 CC(O)CN(C)C(=O)c1cccc(c1)O 527a_100000227577_100000183914 [0,2,0,0,0,0|2,0,0]=4 7206 B15R1.8271 Cc1cccc(c1)C(=O)C(C)CC(C)C 1458a_100000189346_100000731052 [0,2,0,0,0,0|1,0,0]=3 7207 B15R1.8271 Cc1cccc(c1)C(=O)N(C)CC(C)C 11a_100000747067_100000189346 [0,2,0,0,0,0|1,0,0]=3 7208 B15R1.8271 Cc1cccc(c1)C(=O)N(C)CC(C)C 1626a_100000747067_100000189346 [0,2,0,0,0,0|1,0,0]=3 7209 B15R1.8271 Cc1cccc(c1)C(=O)N(C)CC(C)C 240690a_100000747067_100000189346 [0,2,0,0,0,0|1,0,0]=3 7210 B15R1.8271 Cc1cccc(c1)C(=O)N(C)CC(C)C 527a_100000747067_100000189346 [0,2,0,0,0,0|1,0,0]=3 7211 B15R1.8271 Cc1cccc(c1)C(=O)N(C)CC(C)O 240690a_100000227577_100000189346 [0,2,0,0,0,0|2,0,0]=4 7212 B15R1.8271 Cc1cccc(c1)C(=O)N(C)CC(C)O 527a_100000227577_100000189346 [0,2,0,0,0,0|2,0,0]=4 7213 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)Br 1458a_100000210198_100000212080 [0,2,0,0,0,0|1,0,1]=4 7214 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)Br 1458a_100000210664_100000753385 [0,2,0,0,0,0|1,0,1]=4 7215 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)Cl 1458a_100000210198_100000211444 [0,2,0,0,0,0|1,0,1]=4 7216 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)Cl 1458a_100000210390_100000753385 [0,2,0,0,0,0|1,0,1]=4 7217 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)F 1458a_100000210198_100000215616 [0,2,0,0,0,0|1,0,1]=4 7218 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)F 1458a_100000210950_100000753385 [0,2,0,0,0,0|1,0,1]=4 7219 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)I 1458a_100000184098_100000753385 [0,2,0,0,0,0|1,0,1]=4 7220 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000753385 [0,2,0,0,0,0|1,0,1]=4 7221 B15R1.8272 CC(C)C(=O)CC(=O)c1cccc(c1)O 1458a_100000210198_100009813753 [0,2,0,0,0,0|1,0,1]=4 7222 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Br 11a_100000211541_100000210664 [0,2,0,0,0,0|1,0,0]=3 7223 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Br 1626a_100000211541_100000210664 [0,2,0,0,0,0|1,0,0]=3 7224 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Br 240690a_100000211541_100000210664 [0,2,0,0,0,0|1,0,0]=3 7225 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Br 527a_100000211541_100000210664 [0,2,0,0,0,0|1,0,0]=3 7226 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Cl 11a_100000211541_100000210390 [0,2,0,0,0,0|1,0,0]=3 7227 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Cl 1626a_100000211541_100000210390 [0,2,0,0,0,0|1,0,0]=3 7228 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Cl 240690a_100000211541_100000210390 [0,2,0,0,0,0|1,0,0]=3 7229 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)Cl 527a_100000211541_100000210390 [0,2,0,0,0,0|1,0,0]=3 7230 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)F 11a_100000211541_100000210950 [0,2,0,0,0,0|1,0,0]=3 7231 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)F 1626a_100000211541_100000210950 [0,2,0,0,0,0|1,0,0]=3 7232 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)F 240690a_100000211541_100000210950 [0,2,0,0,0,0|1,0,0]=3 7233 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)F 527a_100000211541_100000210950 [0,2,0,0,0,0|1,0,0]=3 7234 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)I 11a_100000211541_100000184098 [0,2,0,0,0,0|1,0,0]=3 7235 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)I 1626a_100000211541_100000184098 [0,2,0,0,0,0|1,0,0]=3 7236 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)I 240690a_100000211541_100000184098 [0,2,0,0,0,0|1,0,0]=3 7237 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)I 527a_100000211541_100000184098 [0,2,0,0,0,0|1,0,0]=3 7238 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)O 240690a_100000211541_100000183914 [0,2,0,0,0,0|1,0,0]=3 7239 B15R1.8272 CC(C)C(C)NC(=O)c1cccc(c1)O 527a_100000211541_100000183914 [0,2,0,0,0,0|1,0,0]=3 7240 B15R1.8272 CC(C)N(C)CC(=O)c1cccc(c1)Br 269982a_200000211004_100000212080 [0,2,0,0,0,0|2,0,0]=4 7241 B15R1.8272 CC(C)N(C)CC(=O)c1cccc(c1)Cl 269982a_200000211004_100000211444 [0,2,0,0,0,0|2,0,0]=4 7242 B15R1.8272 CC(C)N(C)CC(=O)c1cccc(c1)F 269982a_200000211004_100000215616 [0,2,0,0,0,0|2,0,0]=4 7243 B15R1.8272 CC(C)N(C)CC(=O)c1cccc(c1)O 269982a_200000211004_100009813753 [0,2,0,0,0,0|2,0,0]=4 7244 B15R1.8272 Cc1cccc(c1)C(=O)CC(=O)C(C)C 1458a_100000189346_100000753385 [0,2,0,0,0,0|1,0,1]=4 7245 B15R1.8272 Cc1cccc(c1)C(=O)CC(=O)C(C)C 1458a_100000210198_100000739480 [0,2,0,0,0,0|1,0,1]=4 7246 B15R1.8272 Cc1cccc(c1)C(=O)CN(C)C(C)C 269982a_200000211004_100000739480 [0,2,0,0,0,0|2,0,0]=4 7247 B15R1.8272 Cc1cccc(c1)C(=O)NC(C)C(C)C 11a_100000211541_100000189346 [0,2,0,0,0,0|1,0,0]=3 7248 B15R1.8272 Cc1cccc(c1)C(=O)NC(C)C(C)C 1626a_100000211541_100000189346 [0,2,0,0,0,0|1,0,0]=3 7249 B15R1.8272 Cc1cccc(c1)C(=O)NC(C)C(C)C 240690a_100000211541_100000189346 [0,2,0,0,0,0|1,0,0]=3 7250 B15R1.8272 Cc1cccc(c1)C(=O)NC(C)C(C)C 527a_100000211541_100000189346 [0,2,0,0,0,0|1,0,0]=3 7251 B15R1.8277 CC(C)(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000755188 [0,2,0,0,0,0|1,0,0]=3 7252 B15R1.8277 CC(C)(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000755188 [0,2,0,0,0,0|1,0,0]=3 7253 B15R1.8277 CC(C)(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_100000755188 [0,2,0,0,0,0|1,0,0]=3 7254 B15R1.8277 CC(C)(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_100000755188 [0,2,0,0,0,0|1,0,0]=3 7255 B15R1.8277 CC(C)(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000755188 [0,2,0,0,0,0|1,0,0]=3 7256 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Br 11a_100000743828_100000210664 [0,2,0,0,0,0|1,0,0]=3 7257 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Br 1626a_100000743828_100000210664 [0,2,0,0,0,0|1,0,0]=3 7258 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Br 240690a_100000743828_100000210664 [0,2,0,0,0,0|1,0,0]=3 7259 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Br 527a_100000743828_100000210664 [0,2,0,0,0,0|1,0,0]=3 7260 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Cl 11a_100000743828_100000210390 [0,2,0,0,0,0|1,0,0]=3 7261 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Cl 1626a_100000743828_100000210390 [0,2,0,0,0,0|1,0,0]=3 7262 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Cl 240690a_100000743828_100000210390 [0,2,0,0,0,0|1,0,0]=3 7263 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)Cl 527a_100000743828_100000210390 [0,2,0,0,0,0|1,0,0]=3 7264 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)F 11a_100000743828_100000210950 [0,2,0,0,0,0|1,0,0]=3 7265 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)F 1626a_100000743828_100000210950 [0,2,0,0,0,0|1,0,0]=3 7266 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)F 240690a_100000743828_100000210950 [0,2,0,0,0,0|1,0,0]=3 7267 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)F 527a_100000743828_100000210950 [0,2,0,0,0,0|1,0,0]=3 7268 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)I 11a_100000743828_100000184098 [0,2,0,0,0,0|1,0,0]=3 7269 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)I 1626a_100000743828_100000184098 [0,2,0,0,0,0|1,0,0]=3 7270 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)I 240690a_100000743828_100000184098 [0,2,0,0,0,0|1,0,0]=3 7271 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)I 527a_100000743828_100000184098 [0,2,0,0,0,0|1,0,0]=3 7272 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)O 240690a_100000743828_100000183914 [0,2,0,0,0,0|1,0,0]=3 7273 B15R1.8277 CC(C)(C)CNC(=O)c1cccc(c1)O 527a_100000743828_100000183914 [0,2,0,0,0,0|1,0,0]=3 7274 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)Br 2230a_100000715429_100000212080 [0,2,0,0,0,0|2,0,0]=4 7275 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)Cl 2230a_100000715429_100000211444 [0,2,0,0,0,0|2,0,0]=4 7276 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)F 2230a_100000715429_100000215616 [0,2,0,0,0,0|2,0,0]=4 7277 B15R1.8277 CC(C)(C)NNC(=O)c1cccc(c1)Br 22a_100000725372_100000210664 [0,2,0,0,0,0|2,0,0]=4 7278 B15R1.8277 CC(C)(C)NNC(=O)c1cccc(c1)Cl 22a_100000725372_100000210390 [0,2,0,0,0,0|2,0,0]=4 7279 B15R1.8277 CC(C)(C)NNC(=O)c1cccc(c1)F 22a_100000725372_100000210950 [0,2,0,0,0,0|2,0,0]=4 7280 B15R1.8277 CC(C)(C)NNC(=O)c1cccc(c1)I 22a_100000725372_100000184098 [0,2,0,0,0,0|2,0,0]=4 7281 B15R1.8277 CC(C)(C)NNC(=O)c1cccc(c1)O 22a_100000725372_100000183914 [0,2,0,0,0,0|2,0,0]=4 7282 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)Br 34a_100015890283_100000212080 [0,2,0,0,0,0|2,0,0]=4 7283 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)Br 7a_100015890283_100000212080 [0,2,0,0,0,0|2,0,0]=4 7284 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)Cl 34a_100015890283_100000211444 [0,2,0,0,0,0|2,0,0]=4 7285 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)Cl 7a_100015890283_100000211444 [0,2,0,0,0,0|2,0,0]=4 7286 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)F 34a_100011592800_100000210625 [0,2,0,0,0,0|2,0,0]=4 7287 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)F 34a_100015890283_100000215616 [0,2,0,0,0,0|2,0,0]=4 7288 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)O 34a_100015890283_100009813753 [0,2,0,0,0,0|2,0,0]=4 7289 B15R1.8277 CC(C)(C)OCC(=O)c1cccc(c1)O 7a_100015890283_100009813753 [0,2,0,0,0,0|2,0,0]=4 7290 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)Br 62a_100000211941_100000212080 [0,2,0,0,0,0|2,0,0]=4 7291 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)Br 62a_100000212080_100000211941 [0,2,0,0,0,0|2,0,0]=4 7292 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)Cl 62a_100000211444_100000211941 [0,2,0,0,0,0|2,0,0]=4 7293 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)Cl 62a_100000211941_100000211444 [0,2,0,0,0,0|2,0,0]=4 7294 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)F 62a_100000211941_100000215616 [0,2,0,0,0,0|2,0,0]=4 7295 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)F 62a_100000215616_100000211941 [0,2,0,0,0,0|2,0,0]=4 7296 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)O 62a_100000211941_100009813753 [0,2,0,0,0,0|2,0,0]=4 7297 B15R1.8277 CC(C)(C)SCC(=O)c1cccc(c1)O 62a_100009813753_100000211941 [0,2,0,0,0,0|2,0,0]=4 7298 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Br 11a_100020643315_100000210664 [0,2,0,0,0,0|1,0,0]=3 7299 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Br 1626a_100020643315_100000210664 [0,2,0,0,0,0|1,0,0]=3 7300 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Br 240690a_100020643315_100000210664 [0,2,0,0,0,0|1,0,0]=3 7301 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Br 527a_100020643315_100000210664 [0,2,0,0,0,0|1,0,0]=3 7302 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Cl 11a_100020643315_100000210390 [0,2,0,0,0,0|1,0,0]=3 7303 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Cl 1626a_100020643315_100000210390 [0,2,0,0,0,0|1,0,0]=3 7304 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Cl 240690a_100020643315_100000210390 [0,2,0,0,0,0|1,0,0]=3 7305 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)Cl 527a_100020643315_100000210390 [0,2,0,0,0,0|1,0,0]=3 7306 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)F 11a_100020643315_100000210950 [0,2,0,0,0,0|1,0,0]=3 7307 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)F 1626a_100020643315_100000210950 [0,2,0,0,0,0|1,0,0]=3 7308 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)F 240690a_100020643315_100000210950 [0,2,0,0,0,0|1,0,0]=3 7309 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)F 527a_100020643315_100000210950 [0,2,0,0,0,0|1,0,0]=3 7310 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)I 11a_100020643315_100000184098 [0,2,0,0,0,0|1,0,0]=3 7311 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)I 1626a_100020643315_100000184098 [0,2,0,0,0,0|1,0,0]=3 7312 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)I 240690a_100020643315_100000184098 [0,2,0,0,0,0|1,0,0]=3 7313 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)I 527a_100020643315_100000184098 [0,2,0,0,0,0|1,0,0]=3 7314 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)O 240690a_100020643315_100000183914 [0,2,0,0,0,0|1,0,0]=3 7315 B15R1.8277 CC(C)(F)CNC(=O)c1cccc(c1)O 527a_100020643315_100000183914 [0,2,0,0,0,0|1,0,0]=3 7316 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)Br 1626a_100000751335_100000210664 [0,2,0,0,0,0|1,0,0]=3 7317 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)Br 240690a_100000751335_100000210664 [0,2,0,0,0,0|1,0,0]=3 7318 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)Br 527a_100000751335_100000210664 [0,2,0,0,0,0|1,0,0]=3 7319 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)Cl 1626a_100000751335_100000210390 [0,2,0,0,0,0|1,0,0]=3 7320 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)Cl 240690a_100000751335_100000210390 [0,2,0,0,0,0|1,0,0]=3 7321 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)Cl 527a_100000751335_100000210390 [0,2,0,0,0,0|1,0,0]=3 7322 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)F 1626a_100000751335_100000210950 [0,2,0,0,0,0|1,0,0]=3 7323 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)F 240690a_100000751335_100000210950 [0,2,0,0,0,0|1,0,0]=3 7324 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)F 527a_100000751335_100000210950 [0,2,0,0,0,0|1,0,0]=3 7325 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)I 1626a_100000751335_100000184098 [0,2,0,0,0,0|1,0,0]=3 7326 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)I 240690a_100000751335_100000184098 [0,2,0,0,0,0|1,0,0]=3 7327 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)I 527a_100000751335_100000184098 [0,2,0,0,0,0|1,0,0]=3 7328 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)O 240690a_100000751335_100000183914 [0,2,0,0,0,0|1,0,0]=3 7329 B15R1.8277 CC(C)(O)CNC(=O)c1cccc(c1)O 527a_100000751335_100000183914 [0,2,0,0,0,0|1,0,0]=3 7330 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Br 11a_100000731000_100000210664 [0,2,0,0,0,0|2,0,0]=4 7331 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Br 1626a_100000731000_100000210664 [0,2,0,0,0,0|2,0,0]=4 7332 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Br 240690a_100000731000_100000210664 [0,2,0,0,0,0|2,0,0]=4 7333 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Br 527a_100000731000_100000210664 [0,2,0,0,0,0|2,0,0]=4 7334 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Cl 11a_100000731000_100000210390 [0,2,0,0,0,0|2,0,0]=4 7335 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Cl 1626a_100000731000_100000210390 [0,2,0,0,0,0|2,0,0]=4 7336 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Cl 240690a_100000731000_100000210390 [0,2,0,0,0,0|2,0,0]=4 7337 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)Cl 527a_100000731000_100000210390 [0,2,0,0,0,0|2,0,0]=4 7338 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)F 11a_100000731000_100000210950 [0,2,0,0,0,0|2,0,0]=4 7339 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)F 1626a_100000731000_100000210950 [0,2,0,0,0,0|2,0,0]=4 7340 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)F 240690a_100000731000_100000210950 [0,2,0,0,0,0|2,0,0]=4 7341 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)F 527a_100000731000_100000210950 [0,2,0,0,0,0|2,0,0]=4 7342 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)I 11a_100000731000_100000184098 [0,2,0,0,0,0|2,0,0]=4 7343 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)I 1626a_100000731000_100000184098 [0,2,0,0,0,0|2,0,0]=4 7344 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)I 240690a_100000731000_100000184098 [0,2,0,0,0,0|2,0,0]=4 7345 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)I 527a_100000731000_100000184098 [0,2,0,0,0,0|2,0,0]=4 7346 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)O 240690a_100000731000_100000183914 [0,2,0,0,0,0|2,0,0]=4 7347 B15R1.8277 CC(F)(F)CNC(=O)c1cccc(c1)O 527a_100000731000_100000183914 [0,2,0,0,0,0|2,0,0]=4 7348 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)Br 34a_100000246457_100011219605 [0,2,0,0,0,0|1,0,1]=4 7349 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)F 34a_100000744526_100011219605 [0,2,0,0,0,0|1,0,1]=4 7350 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)I 34a_100013085317_100011219605 [0,2,0,0,0,0|1,0,1]=4 7351 B15R1.8277 CC(OCC(C)(C)C)c1cccc(c1)N 34a_100011217120_100011219605 [0,2,0,0,0,0|1,0,1]=4 7352 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)Br 34a_100000246457_100011997219 [0,2,0,0,0,0|1,0,1]=4 7353 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)F 34a_100000744526_100011997219 [0,2,0,0,0,0|1,0,1]=4 7354 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)I 34a_100013085317_100011997219 [0,2,0,0,0,0|1,0,1]=4 7355 B15R1.8277 CC(OCC(C)(C)F)c1cccc(c1)N 34a_100011217120_100011997219 [0,2,0,0,0,0|1,0,1]=4 7356 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)Br 34a_100000246457_100000764493 [0,2,0,0,0,0|1,0,1]=4 7357 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)Br 7a_100000246457_100000764493 [0,2,0,0,0,0|1,0,1]=4 7358 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)F 34a_100000744526_100000764493 [0,2,0,0,0,0|1,0,1]=4 7359 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)F 7a_100000744526_100000764493 [0,2,0,0,0,0|1,0,1]=4 7360 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)I 34a_100013085317_100000764493 [0,2,0,0,0,0|1,0,1]=4 7361 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)I 7a_100013085317_100000764493 [0,2,0,0,0,0|1,0,1]=4 7362 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)N 34a_100011217120_100000764493 [0,2,0,0,0,0|1,0,1]=4 7363 B15R1.8277 CC(OCC(C)(C)O)c1cccc(c1)N 7a_100011217120_100000764493 [0,2,0,0,0,0|1,0,1]=4 7364 B15R1.8277 C[C@@H](OCC(C)(C)C)c1cccc(c1)Cl 34a_100000747380_100011219605 [0,2,0,0,0,0|1,0,1]=4 7365 B15R1.8277 C[C@@H](OCC(C)(C)F)c1cccc(c1)Cl 34a_100000747380_100011997219 [0,2,0,0,0,0|1,0,1]=4 7366 B15R1.8277 C[C@@H](OCC(C)(C)O)c1cccc(c1)Cl 34a_100000747380_100000764493 [0,2,0,0,0,0|1,0,1]=4 7367 B15R1.8277 C[C@@H](OCC(C)(C)O)c1cccc(c1)Cl 7a_100000747380_100000764493 [0,2,0,0,0,0|1,0,1]=4 7368 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000085578 [0,2,0,0,0,0|2,0,0]=4 7369 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000085578 [0,2,0,0,0,0|2,0,0]=4 7370 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_100000085578 [0,2,0,0,0,0|2,0,0]=4 7371 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_100000085578 [0,2,0,0,0,0|2,0,0]=4 7372 B15R1.8277 C[N+](C)(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000085578 [0,2,0,0,0,0|2,0,0]=4 7373 B15R1.8277 C[Si](C)(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_200000733723 [0,2,0,0,0,0|1,1,0]=4 7374 B15R1.8277 C[Si](C)(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_200000733723 [0,2,0,0,0,0|1,1,0]=4 7375 B15R1.8277 C[Si](C)(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_200000733723 [0,2,0,0,0,0|1,1,0]=4 7376 B15R1.8277 C[Si](C)(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_200000733723 [0,2,0,0,0,0|1,1,0]=4 7377 B15R1.8277 C[Si](C)(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_200000733723 [0,2,0,0,0,0|1,1,0]=4 7378 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Br 11a_102516607284_100000210664 [0,2,0,0,0,0|1,1,0]=4 7379 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Br 1626a_102516607284_100000210664 [0,2,0,0,0,0|1,1,0]=4 7380 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Br 240690a_102516607284_100000210664 [0,2,0,0,0,0|1,1,0]=4 7381 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Br 527a_102516607284_100000210664 [0,2,0,0,0,0|1,1,0]=4 7382 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Cl 11a_102516607284_100000210390 [0,2,0,0,0,0|1,1,0]=4 7383 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Cl 1626a_102516607284_100000210390 [0,2,0,0,0,0|1,1,0]=4 7384 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Cl 240690a_102516607284_100000210390 [0,2,0,0,0,0|1,1,0]=4 7385 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)Cl 527a_102516607284_100000210390 [0,2,0,0,0,0|1,1,0]=4 7386 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)F 11a_102516607284_100000210950 [0,2,0,0,0,0|1,1,0]=4 7387 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)F 1626a_102516607284_100000210950 [0,2,0,0,0,0|1,1,0]=4 7388 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)F 240690a_102516607284_100000210950 [0,2,0,0,0,0|1,1,0]=4 7389 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)F 527a_102516607284_100000210950 [0,2,0,0,0,0|1,1,0]=4 7390 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)I 11a_102516607284_100000184098 [0,2,0,0,0,0|1,1,0]=4 7391 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)I 1626a_102516607284_100000184098 [0,2,0,0,0,0|1,1,0]=4 7392 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)I 240690a_102516607284_100000184098 [0,2,0,0,0,0|1,1,0]=4 7393 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)I 527a_102516607284_100000184098 [0,2,0,0,0,0|1,1,0]=4 7394 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)O 240690a_102516607284_100000183914 [0,2,0,0,0,0|1,1,0]=4 7395 B15R1.8277 C[Si](C)(C)CNC(=O)c1cccc(c1)O 527a_102516607284_100000183914 [0,2,0,0,0,0|1,1,0]=4 7396 B15R1.8277 Cc1cccc(c1)C(=O)CCC(C)(C)C 1458a_100000189346_100000755188 [0,2,0,0,0,0|1,0,0]=3 7397 B15R1.8277 Cc1cccc(c1)C(=O)CC[N+](C)(C)C 1458a_100000189346_100000085578 [0,2,0,0,0,0|2,0,0]=4 7398 B15R1.8277 Cc1cccc(c1)C(=O)CC[Si](C)(C)C 1458a_100000189346_200000733723 [0,2,0,0,0,0|1,1,0]=4 7399 B15R1.8277 Cc1cccc(c1)C(=O)CNC(C)(C)C 2230a_100000715429_100000739480 [0,2,0,0,0,0|2,0,0]=4 7400 B15R1.8277 Cc1cccc(c1)C(=O)COC(C)(C)C 34a_100015890283_100000739480 [0,2,0,0,0,0|2,0,0]=4 7401 B15R1.8277 Cc1cccc(c1)C(=O)COC(C)(C)C 7a_100015890283_100000739480 [0,2,0,0,0,0|2,0,0]=4 7402 B15R1.8277 Cc1cccc(c1)C(=O)CSC(C)(C)C 62a_100000211941_100000739480 [0,2,0,0,0,0|2,0,0]=4 7403 B15R1.8277 Cc1cccc(c1)C(=O)CSC(C)(C)C 62a_100000739480_100000211941 [0,2,0,0,0,0|2,0,0]=4 7404 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)C 11a_100000743828_100000189346 [0,2,0,0,0,0|1,0,0]=3 7405 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)C 1626a_100000743828_100000189346 [0,2,0,0,0,0|1,0,0]=3 7406 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)C 240690a_100000743828_100000189346 [0,2,0,0,0,0|1,0,0]=3 7407 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)C 527a_100000743828_100000189346 [0,2,0,0,0,0|1,0,0]=3 7408 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)F 11a_100020643315_100000189346 [0,2,0,0,0,0|1,0,0]=3 7409 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)F 1626a_100020643315_100000189346 [0,2,0,0,0,0|1,0,0]=3 7410 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)F 240690a_100020643315_100000189346 [0,2,0,0,0,0|1,0,0]=3 7411 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)F 527a_100020643315_100000189346 [0,2,0,0,0,0|1,0,0]=3 7412 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)O 1626a_100000751335_100000189346 [0,2,0,0,0,0|1,0,0]=3 7413 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)O 240690a_100000751335_100000189346 [0,2,0,0,0,0|1,0,0]=3 7414 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(C)O 527a_100000751335_100000189346 [0,2,0,0,0,0|1,0,0]=3 7415 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(F)F 11a_100000731000_100000189346 [0,2,0,0,0,0|2,0,0]=4 7416 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(F)F 1626a_100000731000_100000189346 [0,2,0,0,0,0|2,0,0]=4 7417 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(F)F 240690a_100000731000_100000189346 [0,2,0,0,0,0|2,0,0]=4 7418 B15R1.8277 Cc1cccc(c1)C(=O)NCC(C)(F)F 527a_100000731000_100000189346 [0,2,0,0,0,0|2,0,0]=4 7419 B15R1.8277 Cc1cccc(c1)C(=O)NC[Si](C)(C)C 11a_102516607284_100000189346 [0,2,0,0,0,0|1,1,0]=4 7420 B15R1.8277 Cc1cccc(c1)C(=O)NC[Si](C)(C)C 1626a_102516607284_100000189346 [0,2,0,0,0,0|1,1,0]=4 7421 B15R1.8277 Cc1cccc(c1)C(=O)NC[Si](C)(C)C 240690a_102516607284_100000189346 [0,2,0,0,0,0|1,1,0]=4 7422 B15R1.8277 Cc1cccc(c1)C(=O)NC[Si](C)(C)C 527a_102516607284_100000189346 [0,2,0,0,0,0|1,1,0]=4 7423 B15R1.8277 Cc1cccc(c1)C(=O)NNC(C)(C)C 22a_100000725372_100000189346 [0,2,0,0,0,0|2,0,0]=4 7424 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)C 34a_100000757818_100011219605 [0,2,0,0,0,0|1,0,1]=4 7425 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)F 34a_100000757818_100011997219 [0,2,0,0,0,0|1,0,1]=4 7426 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)O 34a_100000757818_100000764493 [0,2,0,0,0,0|1,0,1]=4 7427 B15R1.8277 Cc1cccc(c1)C(C)OCC(C)(C)O 7a_100000757818_100000764493 [0,2,0,0,0,0|1,0,1]=4 7428 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210312 [0,2,0,0,0,0|1,0,0]=3 7429 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210312 [0,2,0,0,0,0|1,0,0]=3 7430 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210312 [0,2,0,0,0,0|1,0,0]=3 7431 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210312 [0,2,0,0,0,0|1,0,0]=3 7432 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210312 [0,2,0,0,0,0|1,0,0]=3 7433 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210312 [0,2,0,0,0,0|1,0,0]=3 7434 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210312 [0,2,0,0,0,0|1,0,0]=3 7435 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210312 [0,2,0,0,0,0|1,0,0]=3 7436 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210312 [0,2,0,0,0,0|1,0,0]=3 7437 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210312 [0,2,0,0,0,0|1,0,0]=3 7438 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210312 [0,2,0,0,0,0|1,0,0]=3 7439 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210312 [0,2,0,0,0,0|1,0,0]=3 7440 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210312 [0,2,0,0,0,0|1,0,0]=3 7441 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210312 [0,2,0,0,0,0|1,0,0]=3 7442 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210312 [0,2,0,0,0,0|1,0,0]=3 7443 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210312 [0,2,0,0,0,0|1,0,0]=3 7444 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210312 [0,2,0,0,0,0|1,0,0]=3 7445 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210312 [0,2,0,0,0,0|1,0,0]=3 7446 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210312 [0,2,0,0,0,0|1,0,0]=3 7447 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210312 [0,2,0,0,0,0|1,0,0]=3 7448 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210312 [0,2,0,0,0,0|1,0,0]=3 7449 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210312 [0,2,0,0,0,0|1,0,0]=3 7450 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210312 [0,2,0,0,0,0|1,0,0]=3 7451 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210312 [0,2,0,0,0,0|1,0,0]=3 7452 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210312 [0,2,0,0,0,0|1,0,0]=3 7453 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 11a_100000210953_100000690610 [0,2,0,0,0,0|1,0,0]=3 7454 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 1626a_100000210953_100000690610 [0,2,0,0,0,0|1,0,0]=3 7455 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 240690a_100000210953_100000690610 [0,2,0,0,0,0|1,0,0]=3 7456 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 527a_100000210953_100000690610 [0,2,0,0,0,0|1,0,0]=3 7457 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 11a_100000210953_100000736951 [0,2,0,0,0,0|1,0,0]=3 7458 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 1626a_100000210953_100000736951 [0,2,0,0,0,0|1,0,0]=3 7459 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 240690a_100000210953_100000736951 [0,2,0,0,0,0|1,0,0]=3 7460 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 527a_100000210953_100000736951 [0,2,0,0,0,0|1,0,0]=3 7461 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 11a_100000210953_100000212315 [0,2,0,0,0,0|1,0,0]=3 7462 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 1626a_100000210953_100000212315 [0,2,0,0,0,0|1,0,0]=3 7463 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 240690a_100000210953_100000212315 [0,2,0,0,0,0|1,0,0]=3 7464 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 527a_100000210953_100000212315 [0,2,0,0,0,0|1,0,0]=3 7465 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 11a_100000210953_100000698340 [0,2,0,0,0,0|1,0,0]=3 7466 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 1626a_100000210953_100000698340 [0,2,0,0,0,0|1,0,0]=3 7467 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 240690a_100000210953_100000698340 [0,2,0,0,0,0|1,0,0]=3 7468 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 527a_100000210953_100000698340 [0,2,0,0,0,0|1,0,0]=3 7469 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)O 240690a_100000210953_100012352043 [0,2,0,0,0,0|1,0,0]=3 7470 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)O 527a_100000210953_100012352043 [0,2,0,0,0,0|1,0,0]=3 7471 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 11a_100000210953_100000211212 [0,2,0,0,0,0|1,0,0]=3 7472 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 1626a_100000210953_100000211212 [0,2,0,0,0,0|1,0,0]=3 7473 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 240690a_100000210953_100000211212 [0,2,0,0,0,0|1,0,0]=3 7474 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 527a_100000210953_100000211212 [0,2,0,0,0,0|1,0,0]=3 7475 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 11a_100000210953_100000210642 [0,2,0,0,0,0|1,0,0]=3 7476 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 1626a_100000210953_100000210642 [0,2,0,0,0,0|1,0,0]=3 7477 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 240690a_100000210953_100000210642 [0,2,0,0,0,0|1,0,0]=3 7478 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 527a_100000210953_100000210642 [0,2,0,0,0,0|1,0,0]=3 7479 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 11a_100000210953_100011219680 [0,2,0,0,0,0|1,0,0]=3 7480 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 1626a_100000210953_100011219680 [0,2,0,0,0,0|1,0,0]=3 7481 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 240690a_100000210953_100011219680 [0,2,0,0,0,0|1,0,0]=3 7482 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 527a_100000210953_100011219680 [0,2,0,0,0,0|1,0,0]=3 7483 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 11a_100000210953_100000688013 [0,2,0,0,0,0|1,0,0]=3 7484 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 1626a_100000210953_100000688013 [0,2,0,0,0,0|1,0,0]=3 7485 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 240690a_100000210953_100000688013 [0,2,0,0,0,0|1,0,0]=3 7486 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 527a_100000210953_100000688013 [0,2,0,0,0,0|1,0,0]=3 7487 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)O 240690a_100000210953_100000719527 [0,2,0,0,0,0|1,0,0]=3 7488 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)O 527a_100000210953_100000719527 [0,2,0,0,0,0|1,0,0]=3 7489 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 11a_100000210953_100000212322 [0,2,0,0,0,0|1,0,0]=3 7490 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 1626a_100000210953_100000212322 [0,2,0,0,0,0|1,0,0]=3 7491 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 240690a_100000210953_100000212322 [0,2,0,0,0,0|1,0,0]=3 7492 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 527a_100000210953_100000212322 [0,2,0,0,0,0|1,0,0]=3 7493 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 11a_100000210953_100000214954 [0,2,0,0,0,0|1,0,0]=3 7494 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 1626a_100000210953_100000214954 [0,2,0,0,0,0|1,0,0]=3 7495 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 240690a_100000210953_100000214954 [0,2,0,0,0,0|1,0,0]=3 7496 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 527a_100000210953_100000214954 [0,2,0,0,0,0|1,0,0]=3 7497 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 11a_100000210953_100000198512 [0,2,0,0,0,0|1,0,0]=3 7498 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 1626a_100000210953_100000198512 [0,2,0,0,0,0|1,0,0]=3 7499 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 240690a_100000210953_100000198512 [0,2,0,0,0,0|1,0,0]=3 7500 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 527a_100000210953_100000198512 [0,2,0,0,0,0|1,0,0]=3 7501 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 11a_100000210953_100000688014 [0,2,0,0,0,0|1,0,0]=3 7502 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 1626a_100000210953_100000688014 [0,2,0,0,0,0|1,0,0]=3 7503 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 240690a_100000210953_100000688014 [0,2,0,0,0,0|1,0,0]=3 7504 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 527a_100000210953_100000688014 [0,2,0,0,0,0|1,0,0]=3 7505 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)O 240690a_100000210953_100000037260 [0,2,0,0,0,0|1,0,0]=3 7506 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)O 527a_100000210953_100000037260 [0,2,0,0,0,0|1,0,0]=3 7507 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Br 11a_100000210953_100000183945 [0,2,0,0,0,0|1,0,0]=3 7508 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Br 1626a_100000210953_100000183945 [0,2,0,0,0,0|1,0,0]=3 7509 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Br 240690a_100000210953_100000183945 [0,2,0,0,0,0|1,0,0]=3 7510 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 11a_100000210953_100000739379 [0,2,0,0,0,0|1,0,0]=3 7511 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 1626a_100000210953_100000739379 [0,2,0,0,0,0|1,0,0]=3 7512 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 240690a_100000210953_100000739379 [0,2,0,0,0,0|1,0,0]=3 7513 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 527a_100000210953_100000739379 [0,2,0,0,0,0|1,0,0]=3 7514 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 11a_100000210953_100000748905 [0,2,0,0,0,0|1,0,0]=3 7515 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 1626a_100000210953_100000748905 [0,2,0,0,0,0|1,0,0]=3 7516 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 240690a_100000210953_100000748905 [0,2,0,0,0,0|1,0,0]=3 7517 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 527a_100000210953_100000748905 [0,2,0,0,0,0|1,0,0]=3 7518 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 11a_100000210953_100000750460 [0,2,0,0,0,0|1,0,0]=3 7519 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 1626a_100000210953_100000750460 [0,2,0,0,0,0|1,0,0]=3 7520 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 240690a_100000210953_100000750460 [0,2,0,0,0,0|1,0,0]=3 7521 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 527a_100000210953_100000750460 [0,2,0,0,0,0|1,0,0]=3 7522 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)O 1626a_100000210953_200009995701 [0,2,0,0,0,0|1,0,0]=3 7523 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)O 240690a_100000210953_200009995701 [0,2,0,0,0,0|1,0,0]=3 7524 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)O 527a_100000210953_200009995701 [0,2,0,0,0,0|1,0,0]=3 7525 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Br 1626a_100000210953_100000212140 [0,2,0,0,0,0|1,0,0]=3 7526 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Br 240690a_100000210953_100000212140 [0,2,0,0,0,0|1,0,0]=3 7527 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Br 527a_100000210953_100000212140 [0,2,0,0,0,0|1,0,0]=3 7528 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 11a_100000210953_100000212143 [0,2,0,0,0,0|1,0,0]=3 7529 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 1626a_100000210953_100000212143 [0,2,0,0,0,0|1,0,0]=3 7530 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 240690a_100000210953_100000212143 [0,2,0,0,0,0|1,0,0]=3 7531 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 527a_100000210953_100000212143 [0,2,0,0,0,0|1,0,0]=3 7532 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)F 240690a_100000210953_100000742286 [0,2,0,0,0,0|1,0,0]=3 7533 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000205877 [0,2,0,0,0,0|1,0,0]=3 7534 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)F 527a_100000210953_100000742286 [0,2,0,0,0,0|1,0,0]=3 7535 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)I 240690a_100000210953_100000212111 [0,2,0,0,0,0|1,0,0]=3 7536 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)I 527a_100000210953_100000212111 [0,2,0,0,0,0|1,0,0]=3 7537 B15R1.8420 CC(C)COC(C)c1cc(ccc1Cl)Cl 34a_100000742519_100000210624 [0,2,0,0,0,0|1,0,1]=4 7538 B15R1.8420 CC(C)COC(C)c1cc(ccc1Cl)Cl 7a_100000742519_100000210760 [0,2,0,0,0,0|1,0,1]=4 7539 B15R1.8420 CC(C)COC(C)c1cc(ccc1F)Br 34a_100011943926_100000210624 [0,2,0,0,0,0|1,0,1]=4 7540 B15R1.8420 CC(C)COC(C)c1cc(ccc1F)Br 7a_100011943926_100000210760 [0,2,0,0,0,0|1,0,1]=4 7541 B15R1.8420 CC(C)COC(C)c1cc(ccc1F)F 34a_100000246540_100000210624 [0,2,0,0,0,0|1,0,1]=4 7542 B15R1.8420 CC(C)COC(C)c1cc(ccc1F)F 7a_100000246540_100000210760 [0,2,0,0,0,0|1,0,1]=4 7543 B15R1.8420 CC(C)CO[C@@H](C)c1cc(ccc1I)F 34a_100134768474_100000210624 [0,2,0,0,0,0|1,0,1]=4 7544 B15R1.8420 CC(C)CO[C@@H](C)c1cc(ccc1I)F 7a_100134768474_100000210760 [0,2,0,0,0,0|1,0,1]=4 7545 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1Br)Cl 2230a_100138425928_100012361344 [0,2,0,0,0,0|2,0,0]=4 7546 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1Br)Cl 34a_100138425928_100012361344 [0,2,0,0,0,0|2,0,0]=4 7547 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1Cl)Cl 2230a_100138425928_100000183120 [0,2,0,0,0,0|2,0,0]=4 7548 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1Cl)F 34a_100138425928_200010187420 [0,2,0,0,0,0|2,0,0]=4 7549 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1F)F 34a_100138425928_100000211571 [0,2,0,0,0,0|2,0,0]=4 7550 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1O)Br 34a_100138425928_200009828000 [0,2,0,0,0,0|2,0,0]=4 7551 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1O)F 34a_100138425928_100009814381 [0,2,0,0,0,0|2,0,0]=4 7552 B15R1.8420 CC(C)NCC(=O)c1cc(ccc1O)O 34a_100138425928_100009814097 [0,2,0,0,0,0|2,0,0]=4 7553 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Br)Br 22a_100000741168_100000690610 [0,2,0,0,0,0|2,0,0]=4 7554 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Br)Cl 22a_100000741168_100000736951 [0,2,0,0,0,0|2,0,0]=4 7555 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Br)F 22a_100000741168_100000212315 [0,2,0,0,0,0|2,0,0]=4 7556 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Br)I 22a_100000741168_100000698340 [0,2,0,0,0,0|2,0,0]=4 7557 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Br)O 22a_100000741168_100012352043 [0,2,0,0,0,0|2,0,0]=4 7558 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Cl)Br 22a_100000741168_100000211212 [0,2,0,0,0,0|2,0,0]=4 7559 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Cl)Cl 22a_100000741168_100000210642 [0,2,0,0,0,0|2,0,0]=4 7560 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Cl)F 22a_100000741168_100011219680 [0,2,0,0,0,0|2,0,0]=4 7561 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Cl)I 22a_100000741168_100000688013 [0,2,0,0,0,0|2,0,0]=4 7562 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1Cl)O 22a_100000741168_100000719527 [0,2,0,0,0,0|2,0,0]=4 7563 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1F)Br 22a_100000741168_100000212322 [0,2,0,0,0,0|2,0,0]=4 7564 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1F)Cl 22a_100000741168_100000214954 [0,2,0,0,0,0|2,0,0]=4 7565 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1F)F 22a_100000741168_100000198512 [0,2,0,0,0,0|2,0,0]=4 7566 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1F)I 22a_100000741168_100000688014 [0,2,0,0,0,0|2,0,0]=4 7567 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1F)O 22a_100000741168_100000037260 [0,2,0,0,0,0|2,0,0]=4 7568 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1I)Br 22a_100000741168_100000183945 [0,2,0,0,0,0|2,0,0]=4 7569 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1I)Cl 22a_100000741168_100000739379 [0,2,0,0,0,0|2,0,0]=4 7570 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1I)F 22a_100000741168_100000748905 [0,2,0,0,0,0|2,0,0]=4 7571 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1I)I 22a_100000741168_100000750460 [0,2,0,0,0,0|2,0,0]=4 7572 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1I)O 22a_100000741168_200009995701 [0,2,0,0,0,0|2,0,0]=4 7573 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1O)Br 22a_100000741168_100000212140 [0,2,0,0,0,0|2,0,0]=4 7574 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1O)Cl 22a_100000741168_100000212143 [0,2,0,0,0,0|2,0,0]=4 7575 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1O)F 22a_100000741168_100000742286 [0,2,0,0,0,0|2,0,0]=4 7576 B15R1.8420 CC(C)NNC(=O)c1cc(ccc1O)I 22a_100000741168_100000212111 [0,2,0,0,0,0|2,0,0]=4 7577 B15R1.8420 CC(C)OCC(=O)c1cc(ccc1Br)Cl 34a_100000212225_100012361344 [0,2,0,0,0,0|2,0,0]=4 7578 B15R1.8420 CC(C)OCC(=O)c1cc(ccc1Cl)F 34a_100000212225_200010187420 [0,2,0,0,0,0|2,0,0]=4 7579 B15R1.8420 CC(C)OCC(=O)c1cc(ccc1F)F 34a_100000212225_100000211571 [0,2,0,0,0,0|2,0,0]=4 7580 B15R1.8420 CC(C)OCC(=O)c1cc(ccc1O)Br 34a_100000212225_200009828000 [0,2,0,0,0,0|2,0,0]=4 7581 B15R1.8420 CC(C)OCC(=O)c1cc(ccc1O)F 34a_100000212225_100009814381 [0,2,0,0,0,0|2,0,0]=4 7582 B15R1.8420 CC(C)OCC(=O)c1cc(ccc1O)O 34a_100000212225_100009814097 [0,2,0,0,0,0|2,0,0]=4 7583 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100000210206 [0,2,0,0,0,0|2,0,0]=4 7584 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100000210206 [0,2,0,0,0,0|2,0,0]=4 7585 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1Cl)F 62a_100000210206_200010187420 [0,2,0,0,0,0|2,0,0]=4 7586 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100000210206 [0,2,0,0,0,0|2,0,0]=4 7587 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1F)F 62a_100000210206_100000211571 [0,2,0,0,0,0|2,0,0]=4 7588 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1F)F 62a_100000211571_100000210206 [0,2,0,0,0,0|2,0,0]=4 7589 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000210206 [0,2,0,0,0,0|2,0,0]=4 7590 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000210206 [0,2,0,0,0,0|2,0,0]=4 7591 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1O)F 62a_100000210206_100009814381 [0,2,0,0,0,0|2,0,0]=4 7592 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1O)F 62a_100009814381_100000210206 [0,2,0,0,0,0|2,0,0]=4 7593 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1O)O 62a_100000210206_100009814097 [0,2,0,0,0,0|2,0,0]=4 7594 B15R1.8420 CC(C)SCC(=O)c1cc(ccc1O)O 62a_100009814097_100000210206 [0,2,0,0,0,0|2,0,0]=4 7595 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100012276601 [0,2,0,0,0,0|2,0,0]=4 7596 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100012276601 [0,2,0,0,0,0|2,0,0]=4 7597 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100012276601 [0,2,0,0,0,0|2,0,0]=4 7598 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100012276601 [0,2,0,0,0,0|2,0,0]=4 7599 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100012276601 [0,2,0,0,0,0|2,0,0]=4 7600 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100012276601 [0,2,0,0,0,0|2,0,0]=4 7601 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100012276601 [0,2,0,0,0,0|2,0,0]=4 7602 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100012276601 [0,2,0,0,0,0|2,0,0]=4 7603 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100012276601 [0,2,0,0,0,0|2,0,0]=4 7604 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100012276601 [0,2,0,0,0,0|2,0,0]=4 7605 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100012276601 [0,2,0,0,0,0|2,0,0]=4 7606 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100012276601 [0,2,0,0,0,0|2,0,0]=4 7607 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100012276601 [0,2,0,0,0,0|2,0,0]=4 7608 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100012276601 [0,2,0,0,0,0|2,0,0]=4 7609 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100012276601 [0,2,0,0,0,0|2,0,0]=4 7610 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100012276601 [0,2,0,0,0,0|2,0,0]=4 7611 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100012276601 [0,2,0,0,0,0|2,0,0]=4 7612 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100012276601 [0,2,0,0,0,0|2,0,0]=4 7613 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100012276601 [0,2,0,0,0,0|2,0,0]=4 7614 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100012276601 [0,2,0,0,0,0|2,0,0]=4 7615 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100012276601 [0,2,0,0,0,0|2,0,0]=4 7616 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100012276601 [0,2,0,0,0,0|2,0,0]=4 7617 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100012276601 [0,2,0,0,0,0|2,0,0]=4 7618 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100012276601 [0,2,0,0,0,0|2,0,0]=4 7619 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100012276601 [0,2,0,0,0,0|2,0,0]=4 7620 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)Br 11a_100000210904_100000690610 [0,2,0,0,0,0|2,0,0]=4 7621 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)Br 240690a_100000210904_100000690610 [0,2,0,0,0,0|2,0,0]=4 7622 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)Br 527a_100000210904_100000690610 [0,2,0,0,0,0|2,0,0]=4 7623 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)Cl 11a_100000210904_100000736951 [0,2,0,0,0,0|2,0,0]=4 7624 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)Cl 240690a_100000210904_100000736951 [0,2,0,0,0,0|2,0,0]=4 7625 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)Cl 527a_100000210904_100000736951 [0,2,0,0,0,0|2,0,0]=4 7626 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)F 11a_100000210904_100000212315 [0,2,0,0,0,0|2,0,0]=4 7627 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)F 240690a_100000210904_100000212315 [0,2,0,0,0,0|2,0,0]=4 7628 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)F 527a_100000210904_100000212315 [0,2,0,0,0,0|2,0,0]=4 7629 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)I 11a_100000210904_100000698340 [0,2,0,0,0,0|2,0,0]=4 7630 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)I 240690a_100000210904_100000698340 [0,2,0,0,0,0|2,0,0]=4 7631 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)I 527a_100000210904_100000698340 [0,2,0,0,0,0|2,0,0]=4 7632 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)O 240690a_100000210904_100012352043 [0,2,0,0,0,0|2,0,0]=4 7633 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Br)O 527a_100000210904_100012352043 [0,2,0,0,0,0|2,0,0]=4 7634 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)Br 11a_100000210904_100000211212 [0,2,0,0,0,0|2,0,0]=4 7635 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)Br 240690a_100000210904_100000211212 [0,2,0,0,0,0|2,0,0]=4 7636 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)Br 527a_100000210904_100000211212 [0,2,0,0,0,0|2,0,0]=4 7637 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)Cl 11a_100000210904_100000210642 [0,2,0,0,0,0|2,0,0]=4 7638 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)Cl 240690a_100000210904_100000210642 [0,2,0,0,0,0|2,0,0]=4 7639 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)Cl 527a_100000210904_100000210642 [0,2,0,0,0,0|2,0,0]=4 7640 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)F 11a_100000210904_100011219680 [0,2,0,0,0,0|2,0,0]=4 7641 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)F 240690a_100000210904_100011219680 [0,2,0,0,0,0|2,0,0]=4 7642 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)F 527a_100000210904_100011219680 [0,2,0,0,0,0|2,0,0]=4 7643 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)I 11a_100000210904_100000688013 [0,2,0,0,0,0|2,0,0]=4 7644 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)I 240690a_100000210904_100000688013 [0,2,0,0,0,0|2,0,0]=4 7645 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)I 527a_100000210904_100000688013 [0,2,0,0,0,0|2,0,0]=4 7646 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)O 240690a_100000210904_100000719527 [0,2,0,0,0,0|2,0,0]=4 7647 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1Cl)O 527a_100000210904_100000719527 [0,2,0,0,0,0|2,0,0]=4 7648 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)Br 11a_100000210904_100000212322 [0,2,0,0,0,0|2,0,0]=4 7649 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)Br 240690a_100000210904_100000212322 [0,2,0,0,0,0|2,0,0]=4 7650 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)Br 527a_100000210904_100000212322 [0,2,0,0,0,0|2,0,0]=4 7651 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)Cl 11a_100000210904_100000214954 [0,2,0,0,0,0|2,0,0]=4 7652 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)Cl 240690a_100000210904_100000214954 [0,2,0,0,0,0|2,0,0]=4 7653 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)Cl 527a_100000210904_100000214954 [0,2,0,0,0,0|2,0,0]=4 7654 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)F 11a_100000210904_100000198512 [0,2,0,0,0,0|2,0,0]=4 7655 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)F 240690a_100000210904_100000198512 [0,2,0,0,0,0|2,0,0]=4 7656 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)F 527a_100000210904_100000198512 [0,2,0,0,0,0|2,0,0]=4 7657 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)I 11a_100000210904_100000688014 [0,2,0,0,0,0|2,0,0]=4 7658 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)I 240690a_100000210904_100000688014 [0,2,0,0,0,0|2,0,0]=4 7659 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)I 527a_100000210904_100000688014 [0,2,0,0,0,0|2,0,0]=4 7660 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)O 240690a_100000210904_100000037260 [0,2,0,0,0,0|2,0,0]=4 7661 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1F)O 527a_100000210904_100000037260 [0,2,0,0,0,0|2,0,0]=4 7662 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)Br 11a_100000210904_100000183945 [0,2,0,0,0,0|2,0,0]=4 7663 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)Br 240690a_100000210904_100000183945 [0,2,0,0,0,0|2,0,0]=4 7664 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)Cl 11a_100000210904_100000739379 [0,2,0,0,0,0|2,0,0]=4 7665 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)Cl 240690a_100000210904_100000739379 [0,2,0,0,0,0|2,0,0]=4 7666 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)Cl 527a_100000210904_100000739379 [0,2,0,0,0,0|2,0,0]=4 7667 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)F 11a_100000210904_100000748905 [0,2,0,0,0,0|2,0,0]=4 7668 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)F 240690a_100000210904_100000748905 [0,2,0,0,0,0|2,0,0]=4 7669 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)F 527a_100000210904_100000748905 [0,2,0,0,0,0|2,0,0]=4 7670 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)I 11a_100000210904_100000750460 [0,2,0,0,0,0|2,0,0]=4 7671 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)I 240690a_100000210904_100000750460 [0,2,0,0,0,0|2,0,0]=4 7672 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)I 527a_100000210904_100000750460 [0,2,0,0,0,0|2,0,0]=4 7673 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)O 240690a_100000210904_200009995701 [0,2,0,0,0,0|2,0,0]=4 7674 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1I)O 527a_100000210904_200009995701 [0,2,0,0,0,0|2,0,0]=4 7675 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Br 240690a_100000210904_100000212140 [0,2,0,0,0,0|2,0,0]=4 7676 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Br 527a_100000210904_100000212140 [0,2,0,0,0,0|2,0,0]=4 7677 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Cl 11a_100000210904_100000212143 [0,2,0,0,0,0|2,0,0]=4 7678 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Cl 240690a_100000210904_100000212143 [0,2,0,0,0,0|2,0,0]=4 7679 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Cl 527a_100000210904_100000212143 [0,2,0,0,0,0|2,0,0]=4 7680 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)F 240690a_100000210904_100000742286 [0,2,0,0,0,0|2,0,0]=4 7681 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)F 527a_100000210904_100000742286 [0,2,0,0,0,0|2,0,0]=4 7682 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)I 240690a_100000210904_100000212111 [0,2,0,0,0,0|2,0,0]=4 7683 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)I 527a_100000210904_100000212111 [0,2,0,0,0,0|2,0,0]=4 7684 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)Br 1458a_100000689033_100000210312 [0,2,0,0,0,0|1,0,0]=3 7685 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)C 1458a_100000195421_100000210312 [0,2,0,0,0,0|1,0,0]=3 7686 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)Cl 1458a_100011290873_100000210312 [0,2,0,0,0,0|1,0,0]=3 7687 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)F 1458a_100000749327_100000210312 [0,2,0,0,0,0|1,0,0]=3 7688 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)I 1458a_100000057929_100000210312 [0,2,0,0,0,0|1,0,0]=3 7689 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)O 1458a_100000229998_100000210312 [0,2,0,0,0,0|1,0,0]=3 7690 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)Br 1458a_100000689033_100012276601 [0,2,0,0,0,0|2,0,0]=4 7691 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)C 1458a_100000195421_100012276601 [0,2,0,0,0,0|2,0,0]=4 7692 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)Cl 1458a_100011290873_100012276601 [0,2,0,0,0,0|2,0,0]=4 7693 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)F 1458a_100000749327_100012276601 [0,2,0,0,0,0|2,0,0]=4 7694 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)I 1458a_100000057929_100012276601 [0,2,0,0,0,0|2,0,0]=4 7695 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)O 1458a_100000229998_100012276601 [0,2,0,0,0,0|2,0,0]=4 7696 B15R1.8420 Cc1ccc(c(c1)C(=O)CNC(C)C)C 2230a_100138425928_100000183774 [0,2,0,0,0,0|2,0,0]=4 7697 B15R1.8420 Cc1ccc(c(c1)C(=O)CNC(C)C)C 34a_100138425928_100000183774 [0,2,0,0,0,0|2,0,0]=4 7698 B15R1.8420 Cc1ccc(c(c1)C(=O)COC(C)C)C 34a_100000212225_100000183774 [0,2,0,0,0,0|2,0,0]=4 7699 B15R1.8420 Cc1ccc(c(c1)C(=O)CSC(C)C)C 62a_100000183774_100000210206 [0,2,0,0,0,0|2,0,0]=4 7700 B15R1.8420 Cc1ccc(c(c1)C(=O)CSC(C)C)C 62a_100000210206_100000183774 [0,2,0,0,0,0|2,0,0]=4 7701 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 11a_100000210953_100000689033 [0,2,0,0,0,0|1,0,0]=3 7702 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 1626a_100000210953_100000689033 [0,2,0,0,0,0|1,0,0]=3 7703 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 240690a_100000210953_100000689033 [0,2,0,0,0,0|1,0,0]=3 7704 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 527a_100000210953_100000689033 [0,2,0,0,0,0|1,0,0]=3 7705 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 11a_100000210953_100000195421 [0,2,0,0,0,0|1,0,0]=3 7706 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 1626a_100000210953_100000195421 [0,2,0,0,0,0|1,0,0]=3 7707 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 240690a_100000210953_100000195421 [0,2,0,0,0,0|1,0,0]=3 7708 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 527a_100000210953_100000195421 [0,2,0,0,0,0|1,0,0]=3 7709 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 11a_100000210953_100011290873 [0,2,0,0,0,0|1,0,0]=3 7710 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 1626a_100000210953_100011290873 [0,2,0,0,0,0|1,0,0]=3 7711 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 240690a_100000210953_100011290873 [0,2,0,0,0,0|1,0,0]=3 7712 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 527a_100000210953_100011290873 [0,2,0,0,0,0|1,0,0]=3 7713 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 11a_100000210953_100000749327 [0,2,0,0,0,0|1,0,0]=3 7714 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 1626a_100000210953_100000749327 [0,2,0,0,0,0|1,0,0]=3 7715 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 240690a_100000210953_100000749327 [0,2,0,0,0,0|1,0,0]=3 7716 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 527a_100000210953_100000749327 [0,2,0,0,0,0|1,0,0]=3 7717 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 11a_100000210953_100000057929 [0,2,0,0,0,0|1,0,0]=3 7718 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 1626a_100000210953_100000057929 [0,2,0,0,0,0|1,0,0]=3 7719 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 240690a_100000210953_100000057929 [0,2,0,0,0,0|1,0,0]=3 7720 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 527a_100000210953_100000057929 [0,2,0,0,0,0|1,0,0]=3 7721 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)O 240690a_100000210953_100000229998 [0,2,0,0,0,0|1,0,0]=3 7722 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)O 527a_100000210953_100000229998 [0,2,0,0,0,0|1,0,0]=3 7723 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)Br 11a_100000210904_100000689033 [0,2,0,0,0,0|2,0,0]=4 7724 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)Br 240690a_100000210904_100000689033 [0,2,0,0,0,0|2,0,0]=4 7725 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)Br 527a_100000210904_100000689033 [0,2,0,0,0,0|2,0,0]=4 7726 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)C 11a_100000210904_100000195421 [0,2,0,0,0,0|2,0,0]=4 7727 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)C 240690a_100000210904_100000195421 [0,2,0,0,0,0|2,0,0]=4 7728 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)C 527a_100000210904_100000195421 [0,2,0,0,0,0|2,0,0]=4 7729 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)Cl 11a_100000210904_100011290873 [0,2,0,0,0,0|2,0,0]=4 7730 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)Cl 240690a_100000210904_100011290873 [0,2,0,0,0,0|2,0,0]=4 7731 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)Cl 527a_100000210904_100011290873 [0,2,0,0,0,0|2,0,0]=4 7732 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)F 11a_100000210904_100000749327 [0,2,0,0,0,0|2,0,0]=4 7733 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)F 240690a_100000210904_100000749327 [0,2,0,0,0,0|2,0,0]=4 7734 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)F 527a_100000210904_100000749327 [0,2,0,0,0,0|2,0,0]=4 7735 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)I 11a_100000210904_100000057929 [0,2,0,0,0,0|2,0,0]=4 7736 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)I 240690a_100000210904_100000057929 [0,2,0,0,0,0|2,0,0]=4 7737 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)I 527a_100000210904_100000057929 [0,2,0,0,0,0|2,0,0]=4 7738 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)O 240690a_100000210904_100000229998 [0,2,0,0,0,0|2,0,0]=4 7739 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)O 527a_100000210904_100000229998 [0,2,0,0,0,0|2,0,0]=4 7740 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)Br 22a_100000741168_100000689033 [0,2,0,0,0,0|2,0,0]=4 7741 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)C 22a_100000741168_100000195421 [0,2,0,0,0,0|2,0,0]=4 7742 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)Cl 22a_100000741168_100011290873 [0,2,0,0,0,0|2,0,0]=4 7743 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)F 22a_100000741168_100000749327 [0,2,0,0,0,0|2,0,0]=4 7744 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)I 22a_100000741168_100000057929 [0,2,0,0,0,0|2,0,0]=4 7745 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)O 22a_100000741168_100000229998 [0,2,0,0,0,0|2,0,0]=4 7746 B15R1.8420 Cc1ccc(c(c1)C(C)OCC(C)C)C 34a_200000246511_100000210624 [0,2,0,0,0,0|1,0,1]=4 7747 B15R1.8420 Cc1ccc(c(c1)C(C)OCC(C)C)C 7a_200000246511_100000210760 [0,2,0,0,0,0|1,0,1]=4 7748 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)Br 1458a_100000759961_100000210312 [0,2,0,0,0,0|1,0,0]=3 7749 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)Cl 1458a_100000692595_100000210312 [0,2,0,0,0,0|1,0,0]=3 7750 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)F 1458a_100000240043_100000210312 [0,2,0,0,0,0|1,0,0]=3 7751 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)I 1458a_100000688012_100000210312 [0,2,0,0,0,0|1,0,0]=3 7752 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)O 1458a_100000687834_100000210312 [0,2,0,0,0,0|1,0,0]=3 7753 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)Br 1458a_100000759961_100012276601 [0,2,0,0,0,0|2,0,0]=4 7754 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)Cl 1458a_100000692595_100012276601 [0,2,0,0,0,0|2,0,0]=4 7755 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)F 1458a_100000240043_100012276601 [0,2,0,0,0,0|2,0,0]=4 7756 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)I 1458a_100000688012_100012276601 [0,2,0,0,0,0|2,0,0]=4 7757 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)O 1458a_100000687834_100012276601 [0,2,0,0,0,0|2,0,0]=4 7758 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 11a_100000210953_100000759961 [0,2,0,0,0,0|1,0,0]=3 7759 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 1626a_100000210953_100000759961 [0,2,0,0,0,0|1,0,0]=3 7760 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 240690a_100000210953_100000759961 [0,2,0,0,0,0|1,0,0]=3 7761 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 527a_100000210953_100000759961 [0,2,0,0,0,0|1,0,0]=3 7762 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 11a_100000210953_100000692595 [0,2,0,0,0,0|1,0,0]=3 7763 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000692595 [0,2,0,0,0,0|1,0,0]=3 7764 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000692595 [0,2,0,0,0,0|1,0,0]=3 7765 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 527a_100000210953_100000692595 [0,2,0,0,0,0|1,0,0]=3 7766 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 11a_100000210953_100000240043 [0,2,0,0,0,0|1,0,0]=3 7767 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 1626a_100000210953_100000240043 [0,2,0,0,0,0|1,0,0]=3 7768 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 240690a_100000210953_100000240043 [0,2,0,0,0,0|1,0,0]=3 7769 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 527a_100000210953_100000240043 [0,2,0,0,0,0|1,0,0]=3 7770 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 11a_100000210953_100000688012 [0,2,0,0,0,0|1,0,0]=3 7771 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 1626a_100000210953_100000688012 [0,2,0,0,0,0|1,0,0]=3 7772 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 240690a_100000210953_100000688012 [0,2,0,0,0,0|1,0,0]=3 7773 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 527a_100000210953_100000688012 [0,2,0,0,0,0|1,0,0]=3 7774 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)O 240690a_100000210953_100000687834 [0,2,0,0,0,0|1,0,0]=3 7775 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Br 11a_100000210904_100000759961 [0,2,0,0,0,0|2,0,0]=4 7776 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Br 240690a_100000210904_100000759961 [0,2,0,0,0,0|2,0,0]=4 7777 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Br 527a_100000210904_100000759961 [0,2,0,0,0,0|2,0,0]=4 7778 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Cl 11a_100000210904_100000692595 [0,2,0,0,0,0|2,0,0]=4 7779 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000692595 [0,2,0,0,0,0|2,0,0]=4 7780 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Cl 527a_100000210904_100000692595 [0,2,0,0,0,0|2,0,0]=4 7781 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)F 11a_100000210904_100000240043 [0,2,0,0,0,0|2,0,0]=4 7782 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)F 240690a_100000210904_100000240043 [0,2,0,0,0,0|2,0,0]=4 7783 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)F 527a_100000210904_100000240043 [0,2,0,0,0,0|2,0,0]=4 7784 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)I 11a_100000210904_100000688012 [0,2,0,0,0,0|2,0,0]=4 7785 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)I 240690a_100000210904_100000688012 [0,2,0,0,0,0|2,0,0]=4 7786 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)I 527a_100000210904_100000688012 [0,2,0,0,0,0|2,0,0]=4 7787 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)O 240690a_100000210904_100000687834 [0,2,0,0,0,0|2,0,0]=4 7788 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)Br 22a_100000741168_100000759961 [0,2,0,0,0,0|2,0,0]=4 7789 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)Cl 22a_100000741168_100000692595 [0,2,0,0,0,0|2,0,0]=4 7790 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)F 22a_100000741168_100000240043 [0,2,0,0,0,0|2,0,0]=4 7791 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)I 22a_100000741168_100000688012 [0,2,0,0,0,0|2,0,0]=4 7792 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)O 22a_100000741168_100000687834 [0,2,0,0,0,0|2,0,0]=4 7793 B15R1.8420 Cc1ccc(cc1C(C)OCC(C)C)Cl 34a_100012002745_100000210624 [0,2,0,0,0,0|1,0,1]=4 7794 B15R1.8420 Cc1ccc(cc1C(C)OCC(C)C)Cl 7a_100012002745_100000210760 [0,2,0,0,0,0|1,0,1]=4 7795 B15R1.86 C#Cc1ccccc1C(=O)CCC(C)C 1458a_100011243808_100000210312 [0,2,0,0,0,0|1,0,0]=3 7796 B15R1.86 C#Cc1ccccc1C(=O)CCC(C)O 1458a_100011243808_100012276601 [0,2,0,0,0,0|2,0,0]=4 7797 B15R1.86 C#Cc1ccccc1C(=O)NCC(C)C 527a_100000210953_100011243808 [0,2,0,0,0,0|1,0,0]=3 7798 B15R1.86 C#Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100011243808 [0,2,0,0,0,0|2,0,0]=4 7799 B15R1.86 C#Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100011243808 [0,2,0,0,0,0|2,0,0]=4 7800 B15R1.86 C=Cc1ccccc1C(=O)CCC(C)C 1458a_100011830265_100000210312 [0,2,0,0,0,0|1,0,0]=3 7801 B15R1.86 C=Cc1ccccc1C(=O)CCC(C)O 1458a_100011830265_100012276601 [0,2,0,0,0,0|2,0,0]=4 7802 B15R1.86 C=Cc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100011830265 [0,2,0,0,0,0|1,0,0]=3 7803 B15R1.86 C=Cc1ccccc1C(=O)NCC(C)C 271570a_100011290941_200000155729 [0,2,0,0,0,0|1,0,0]=3 7804 B15R1.86 C=Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100011830265 [0,2,0,0,0,0|2,0,0]=4 7805 B15R1.86 C=Cc1ccccc1C(=O)OCC(=O)C 271570a_100011290941_201991511838 [0,2,0,0,0,0|1,0,1]=4 7806 B15R1.86 CC(=O)COC(=O)c1ccccc1S[13CH3] 62a_200025704644_201991511838 [0,2,0,0,0,0|1,0,1]=4 7807 B15R1.86 CC(=O)COC(=O)c1ccccc1S[13CH3] 62a_201991511838_200025704644 [0,2,0,0,0,0|1,0,1]=4 7808 B15R1.86 CC(C)CCC(=O)c1ccccc1C#N 1458a_100000742908_100000210312 [0,2,0,0,0,0|1,0,0]=3 7809 B15R1.86 CC(C)CCC(=O)c1ccccc1CO 1458a_100011301526_100000210312 [0,2,0,0,0,0|1,0,0]=3 7810 B15R1.86 CC(C)CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210312 [0,2,0,0,0,0|1,0,0]=3 7811 B15R1.86 CC(C)CNC(=O)c1ccccc1C#N 11a_100000210953_100000742908 [0,2,0,0,0,0|1,0,0]=3 7812 B15R1.86 CC(C)CNC(=O)c1ccccc1C#N 1626a_100000210953_100000742908 [0,2,0,0,0,0|1,0,0]=3 7813 B15R1.86 CC(C)CNC(=O)c1ccccc1C#N 527a_100000210953_100000742908 [0,2,0,0,0,0|1,0,0]=3 7814 B15R1.86 CC(C)CNC(=O)c1ccccc1I=O 1626a_100000210953_100000032414 [0,2,0,0,0,0|1,0,0]=3 7815 B15R1.86 CC(C)CNC(=O)c1ccccc1I=O 240690a_100000210953_100000032414 [0,2,0,0,0,0|1,0,0]=3 7816 B15R1.86 CC(C)CNC(=O)c1ccccc1I=O 527a_100000210953_100000032414 [0,2,0,0,0,0|1,0,0]=3 7817 B15R1.86 CC(C)CNC(=O)c1ccccc1N[13CH3] 2230a_100000180285_200025704644 [0,2,0,0,0,0|1,0,0]=3 7818 B15R1.86 CC(C)CNC(=O)c1ccccc1N[13CH3] 34a_100000180285_200025704644 [0,2,0,0,0,0|1,0,0]=3 7819 B15R1.86 CC(C)CNC(=O)c1ccccc1S[13CH3] 62a_200000155729_200025704644 [0,2,0,0,0,0|1,0,0]=3 7820 B15R1.86 CC(C)CNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000155729 [0,2,0,0,0,0|1,0,0]=3 7821 B15R1.86 CC(C)COC(=O)c1ccccc1O[13CH3] 34a_100000005792_200025704644 [0,2,0,0,0,0|0,0,0]=2 7822 B15R1.86 CC(C)COC(=O)c1ccccc1O[13CH3] 7a_100000005792_200025704644 [0,2,0,0,0,0|0,0,0]=2 7823 B15R1.86 CC(C)NNC(=O)c1ccccc1C#N 22a_100000741168_100000742908 [0,2,0,0,0,0|2,0,0]=4 7824 B15R1.86 CC(C)NNC(=O)c1ccccc1I=O 22a_100000741168_100000032414 [0,2,0,0,0,0|2,0,0]=4 7825 B15R1.86 CC(O)CCC(=O)c1ccccc1C#N 1458a_100000742908_100012276601 [0,2,0,0,0,0|2,0,0]=4 7826 B15R1.86 CC(O)CCC(=O)c1ccccc1CO 1458a_100011301526_100012276601 [0,2,0,0,0,0|2,0,0]=4 7827 B15R1.86 CC(O)CCC(=O)c1ccccc1I=O 1458a_100000032414_100012276601 [0,2,0,0,0,0|2,0,0]=4 7828 B15R1.86 CC(O)CNC(=O)c1ccccc1C#N 11a_100000210904_100000742908 [0,2,0,0,0,0|2,0,0]=4 7829 B15R1.86 CC(O)CNC(=O)c1ccccc1C#N 527a_100000210904_100000742908 [0,2,0,0,0,0|2,0,0]=4 7830 B15R1.86 CC(O)CNC(=O)c1ccccc1I=O 240690a_100000210904_100000032414 [0,2,0,0,0,0|2,0,0]=4 7831 B15R1.86 CC(O)CNC(=O)c1ccccc1I=O 527a_100000210904_100000032414 [0,2,0,0,0,0|2,0,0]=4 7832 B15R1.86 CCc1ccccc1C(=O)CCC(C)C 1458a_100000689120_100000210312 [0,2,0,0,0,0|1,0,0]=3 7833 B15R1.86 CCc1ccccc1C(=O)CCC(C)O 1458a_100000689120_100012276601 [0,2,0,0,0,0|2,0,0]=4 7834 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000689120 [0,2,0,0,0,0|1,0,0]=3 7835 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000689120 [0,2,0,0,0,0|1,0,0]=3 7836 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000689120 [0,2,0,0,0,0|1,0,0]=3 7837 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000689120 [0,2,0,0,0,0|1,0,0]=3 7838 B15R1.86 CCc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000689120 [0,2,0,0,0,0|2,0,0]=4 7839 B15R1.86 CCc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000689120 [0,2,0,0,0,0|2,0,0]=4 7840 B15R1.86 CCc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000689120 [0,2,0,0,0,0|2,0,0]=4 7841 B15R1.86 CCc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000689120 [0,2,0,0,0,0|2,0,0]=4 7842 B15R1.86 CNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_200000210301 [0,2,0,0,0,0|1,0,0]=3 7843 B15R1.86 CNc1ccccc1C(=O)NCC(C)C 27a_100102657272_200000155729 [0,2,0,0,0,0|1,0,0]=3 7844 B15R1.86 CNc1ccccc1C(=O)NCC(C)C 34a_100000180285_200000210301 [0,2,0,0,0,0|1,0,0]=3 7845 B15R1.86 COc1ccccc1C(=O)CCC(C)C 1458a_100000185835_100000210312 [0,2,0,0,0,0|1,0,0]=3 7846 B15R1.86 COc1ccccc1C(=O)CCC(C)O 1458a_100000185835_100012276601 [0,2,0,0,0,0|2,0,0]=4 7847 B15R1.86 COc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000195505 [0,2,0,0,0,0|2,0,0]=4 7848 B15R1.86 COc1ccccc1C(=O)COC(C)C 34a_100000212225_100000195505 [0,2,0,0,0,0|2,0,0]=4 7849 B15R1.86 COc1ccccc1C(=O)CSC(C)C 62a_100000195505_100000210206 [0,2,0,0,0,0|2,0,0]=4 7850 B15R1.86 COc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000185835 [0,2,0,0,0,0|1,0,0]=3 7851 B15R1.86 COc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000185835 [0,2,0,0,0,0|1,0,0]=3 7852 B15R1.86 COc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000185835 [0,2,0,0,0,0|1,0,0]=3 7853 B15R1.86 COc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000185835 [0,2,0,0,0,0|1,0,0]=3 7854 B15R1.86 COc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000185835 [0,2,0,0,0,0|2,0,0]=4 7855 B15R1.86 COc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000185835 [0,2,0,0,0,0|2,0,0]=4 7856 B15R1.86 COc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000185835 [0,2,0,0,0,0|2,0,0]=4 7857 B15R1.86 COc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000185835 [0,2,0,0,0,0|2,0,0]=4 7858 B15R1.86 COc1ccccc1C(=O)OCC(C)C 34a_100000005792_200000210301 [0,2,0,0,0,0|0,0,0]=2 7859 B15R1.86 COc1ccccc1C(=O)OCC(C)C 7a_100000005792_200000210301 [0,2,0,0,0,0|0,0,0]=2 7860 B15R1.86 COc1ccccc1C(C)OCC(C)C 7a_100000742714_100000210760 [0,2,0,0,0,0|1,0,1]=4 7861 B15R1.86 CSc1ccccc1C(=O)CCC(C)C 1458a_100000183967_100000210312 [0,2,0,0,0,0|1,0,0]=3 7862 B15R1.86 CSc1ccccc1C(=O)CCC(C)O 1458a_100000183967_100012276601 [0,2,0,0,0,0|2,0,0]=4 7863 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000183967 [0,2,0,0,0,0|1,0,0]=3 7864 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000183967 [0,2,0,0,0,0|1,0,0]=3 7865 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000183967 [0,2,0,0,0,0|1,0,0]=3 7866 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000183967 [0,2,0,0,0,0|1,0,0]=3 7867 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 62a_200000155729_200000210301 [0,2,0,0,0,0|1,0,0]=3 7868 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 62a_200000210301_200000155729 [0,2,0,0,0,0|1,0,0]=3 7869 B15R1.86 CSc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000183967 [0,2,0,0,0,0|2,0,0]=4 7870 B15R1.86 CSc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000183967 [0,2,0,0,0,0|2,0,0]=4 7871 B15R1.86 CSc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000183967 [0,2,0,0,0,0|2,0,0]=4 7872 B15R1.86 CSc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000183967 [0,2,0,0,0,0|2,0,0]=4 7873 B15R1.86 CSc1ccccc1C(=O)OCC(=O)C 62a_200000210301_201991511838 [0,2,0,0,0,0|1,0,1]=4 7874 B15R1.86 CSc1ccccc1C(=O)OCC(=O)C 62a_201991511838_200000210301 [0,2,0,0,0,0|1,0,1]=4 7875 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000731052 [0,2,0,0,0,0|1,0,0]=3 7876 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000731052 [0,2,0,0,0,0|1,0,0]=3 7877 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1F 1458a_100000188656_100000731052 [0,2,0,0,0,0|1,0,0]=3 7878 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1I 1458a_100000187884_100000731052 [0,2,0,0,0,0|1,0,0]=3 7879 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1O 1458a_100015234032_100000731052 [0,2,0,0,0,0|1,0,0]=3 7880 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000731052 [0,2,0,0,0,0|1,0,0]=3 7881 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 11a_100000747067_100000188424 [0,2,0,0,0,0|1,0,0]=3 7882 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 1626a_100000747067_100000188424 [0,2,0,0,0,0|1,0,0]=3 7883 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 240690a_100000747067_100000188424 [0,2,0,0,0,0|1,0,0]=3 7884 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 527a_100000747067_100000188424 [0,2,0,0,0,0|1,0,0]=3 7885 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 11a_100000747067_100000185844 [0,2,0,0,0,0|1,0,0]=3 7886 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 1626a_100000747067_100000185844 [0,2,0,0,0,0|1,0,0]=3 7887 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 240690a_100000747067_100000185844 [0,2,0,0,0,0|1,0,0]=3 7888 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 527a_100000747067_100000185844 [0,2,0,0,0,0|1,0,0]=3 7889 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 11a_100000747067_100000188656 [0,2,0,0,0,0|1,0,0]=3 7890 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 1626a_100000747067_100000188656 [0,2,0,0,0,0|1,0,0]=3 7891 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 240690a_100000747067_100000188656 [0,2,0,0,0,0|1,0,0]=3 7892 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 527a_100000747067_100000188656 [0,2,0,0,0,0|1,0,0]=3 7893 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 11a_100000747067_100000187884 [0,2,0,0,0,0|1,0,0]=3 7894 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 1626a_100000747067_100000187884 [0,2,0,0,0,0|1,0,0]=3 7895 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 240690a_100000747067_100000187884 [0,2,0,0,0,0|1,0,0]=3 7896 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 527a_100000747067_100000187884 [0,2,0,0,0,0|1,0,0]=3 7897 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1O 240690a_100000747067_100015234032 [0,2,0,0,0,0|1,0,0]=3 7898 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1[O-] 1626a_100000747067_100009911694 [0,2,0,0,0,0|1,0,0]=3 7899 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1[O-] 240690a_100000747067_100009911694 [0,2,0,0,0,0|1,0,0]=3 7900 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1[O-] 527a_100000747067_100009911694 [0,2,0,0,0,0|1,0,0]=3 7901 B15R1.5792 CC(C)NC(C)C(=O)c1ccccc1Cl 2230a_100138425928_100010255250 [0,2,0,0,0,0|2,0,0]=4 7902 B15R1.5792 CC(C)SC(C)C(=O)c1ccccc1Cl 62a_100000210206_100010255250 [0,2,0,0,0,0|2,0,0]=4 7903 B15R1.5792 CC(C)SC(C)C(=O)c1ccccc1Cl 62a_100010255250_100000210206 [0,2,0,0,0,0|2,0,0]=4 7904 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1Br 240690a_100000227577_100000188424 [0,2,0,0,0,0|2,0,0]=4 7905 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1Br 527a_100000227577_100000188424 [0,2,0,0,0,0|2,0,0]=4 7906 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1Cl 240690a_100000227577_100000185844 [0,2,0,0,0,0|2,0,0]=4 7907 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1Cl 527a_100000227577_100000185844 [0,2,0,0,0,0|2,0,0]=4 7908 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1F 240690a_100000227577_100000188656 [0,2,0,0,0,0|2,0,0]=4 7909 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1F 527a_100000227577_100000188656 [0,2,0,0,0,0|2,0,0]=4 7910 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1I 240690a_100000227577_100000187884 [0,2,0,0,0,0|2,0,0]=4 7911 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1I 527a_100000227577_100000187884 [0,2,0,0,0,0|2,0,0]=4 7912 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1O 240690a_100000227577_100015234032 [0,2,0,0,0,0|2,0,0]=4 7913 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1[O-] 240690a_100000227577_100009911694 [0,2,0,0,0,0|2,0,0]=4 7914 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1[O-] 527a_100000227577_100009911694 [0,2,0,0,0,0|2,0,0]=4 7915 B15R1.5792 Cc1ccccc1C(=O)C(C)CC(C)C 1458a_100000212026_100000731052 [0,2,0,0,0,0|1,0,0]=3 7916 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000212026 [0,2,0,0,0,0|1,0,0]=3 7917 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000212026 [0,2,0,0,0,0|1,0,0]=3 7918 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000212026 [0,2,0,0,0,0|1,0,0]=3 7919 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000212026 [0,2,0,0,0,0|1,0,0]=3 7920 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)O 240690a_100000227577_100000212026 [0,2,0,0,0,0|2,0,0]=4 7921 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)O 527a_100000227577_100000212026 [0,2,0,0,0,0|2,0,0]=4 7922 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000753385 [0,2,0,0,0,0|1,0,1]=4 7923 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1Br 1458a_100000210198_100000199116 [0,2,0,0,0,0|1,0,1]=4 7924 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000753385 [0,2,0,0,0,0|1,0,1]=4 7925 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1Cl 1458a_100000210198_100000211432 [0,2,0,0,0,0|1,0,1]=4 7926 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000753385 [0,2,0,0,0,0|1,0,1]=4 7927 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1F 1458a_100000210198_100000204681 [0,2,0,0,0,0|1,0,1]=4 7928 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000753385 [0,2,0,0,0,0|1,0,1]=4 7929 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1O 1458a_100000210198_100000188908 [0,2,0,0,0,0|1,0,1]=4 7930 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000753385 [0,2,0,0,0,0|1,0,1]=4 7931 B15R1.5793 CC(C)C(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000753385 [0,2,0,0,0,0|1,0,1]=4 7932 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 11a_100000211541_100000188424 [0,2,0,0,0,0|1,0,0]=3 7933 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 1626a_100000211541_100000188424 [0,2,0,0,0,0|1,0,0]=3 7934 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 240690a_100000211541_100000188424 [0,2,0,0,0,0|1,0,0]=3 7935 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 527a_100000211541_100000188424 [0,2,0,0,0,0|1,0,0]=3 7936 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 11a_100000211541_100000185844 [0,2,0,0,0,0|1,0,0]=3 7937 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 1626a_100000211541_100000185844 [0,2,0,0,0,0|1,0,0]=3 7938 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 240690a_100000211541_100000185844 [0,2,0,0,0,0|1,0,0]=3 7939 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 527a_100000211541_100000185844 [0,2,0,0,0,0|1,0,0]=3 7940 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 11a_100000211541_100000188656 [0,2,0,0,0,0|1,0,0]=3 7941 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 1626a_100000211541_100000188656 [0,2,0,0,0,0|1,0,0]=3 7942 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 240690a_100000211541_100000188656 [0,2,0,0,0,0|1,0,0]=3 7943 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 527a_100000211541_100000188656 [0,2,0,0,0,0|1,0,0]=3 7944 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 11a_100000211541_100000187884 [0,2,0,0,0,0|1,0,0]=3 7945 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 1626a_100000211541_100000187884 [0,2,0,0,0,0|1,0,0]=3 7946 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 240690a_100000211541_100000187884 [0,2,0,0,0,0|1,0,0]=3 7947 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 527a_100000211541_100000187884 [0,2,0,0,0,0|1,0,0]=3 7948 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1O 240690a_100000211541_100015234032 [0,2,0,0,0,0|1,0,0]=3 7949 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1[O-] 1626a_100000211541_100009911694 [0,2,0,0,0,0|1,0,0]=3 7950 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1[O-] 240690a_100000211541_100009911694 [0,2,0,0,0,0|1,0,0]=3 7951 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1[O-] 527a_100000211541_100009911694 [0,2,0,0,0,0|1,0,0]=3 7952 B15R1.5793 CC(C)N(C)CC(=O)c1ccccc1Br 269982a_200000211004_100000199116 [0,2,0,0,0,0|2,0,0]=4 7953 B15R1.5793 CC(C)N(C)CC(=O)c1ccccc1Cl 269982a_200000211004_100000211432 [0,2,0,0,0,0|2,0,0]=4 7954 B15R1.5793 CC(C)N(C)CC(=O)c1ccccc1F 269982a_200000211004_100000204681 [0,2,0,0,0,0|2,0,0]=4 7955 B15R1.5793 CC(C)N(C)CC(=O)c1ccccc1O 269982a_200000211004_100000188908 [0,2,0,0,0,0|2,0,0]=4 7956 B15R1.5793 CC(OC(C)C(C)C)c1ccccc1Cl 7a_100000748068_100000181259 [0,2,0,0,0,0|1,0,1]=4 7957 B15R1.5793 CC(OC(C)C(C)C)c1ccccc1F 7a_100000748068_200000741388 [0,2,0,0,0,0|1,0,1]=4 7958 B15R1.5793 Cc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000210198_100000741374 [0,2,0,0,0,0|1,0,1]=4 7959 B15R1.5793 Cc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000212026_100000753385 [0,2,0,0,0,0|1,0,1]=4 7960 B15R1.5793 Cc1ccccc1C(=O)CN(C)C(C)C 269982a_200000211004_100000741374 [0,2,0,0,0,0|2,0,0]=4 7961 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000212026 [0,2,0,0,0,0|1,0,0]=3 7962 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000212026 [0,2,0,0,0,0|1,0,0]=3 7963 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000212026 [0,2,0,0,0,0|1,0,0]=3 7964 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000212026 [0,2,0,0,0,0|1,0,0]=3 7965 B15R1.5815 CC(CF)OCC(=O)c1ccccc1Br 34a_100016041109_100000199116 [0,2,0,0,0,0|2,0,0]=4 7966 B15R1.5815 CC(CF)OCC(=O)c1ccccc1Cl 34a_100016041109_100000211432 [0,2,0,0,0,0|2,0,0]=4 7967 B15R1.5815 CC(CF)OCC(=O)c1ccccc1F 34a_100016041109_100000204681 [0,2,0,0,0,0|2,0,0]=4 7968 B15R1.5815 CC(CF)OCC(=O)c1ccccc1F 7a_100016041109_100000204681 [0,2,0,0,0,0|2,0,0]=4 7969 B15R1.5815 CC(CF)OCC(=O)c1ccccc1O 7a_100016041109_100000188908 [0,2,0,0,0,0|2,0,0]=4 7970 B15R1.5815 CC(CN)COC(C)c1ccccc1F 34a_100000744482_200000741388 [0,2,0,0,0,0|1,0,1]=4 7971 B15R1.5815 CC(CN)OCC(=O)c1ccccc1Br 34a_100000210904_100000199116 [0,2,0,0,0,0|2,0,0]=4 7972 B15R1.5815 CC(CN)OCC(=O)c1ccccc1Cl 34a_100000210904_100000211432 [0,2,0,0,0,0|2,0,0]=4 7973 B15R1.5815 CC(CN)OCC(=O)c1ccccc1F 34a_100000210904_100000204681 [0,2,0,0,0,0|2,0,0]=4 7974 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Br 240690a_100000744482_100000188424 [0,2,0,0,0,0|1,0,0]=3 7975 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Br 527a_100000744482_100000188424 [0,2,0,0,0,0|1,0,0]=3 7976 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Cl 240690a_100000744482_100000185844 [0,2,0,0,0,0|1,0,0]=3 7977 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Cl 527a_100000744482_100000185844 [0,2,0,0,0,0|1,0,0]=3 7978 B15R1.5815 CC(CO)CNC(=O)c1ccccc1F 240690a_100000744482_100000188656 [0,2,0,0,0,0|1,0,0]=3 7979 B15R1.5815 CC(CO)CNC(=O)c1ccccc1F 527a_100000744482_100000188656 [0,2,0,0,0,0|1,0,0]=3 7980 B15R1.5815 CC(CO)CNC(=O)c1ccccc1I 240690a_100000744482_100000187884 [0,2,0,0,0,0|1,0,0]=3 7981 B15R1.5815 CC(CO)CNC(=O)c1ccccc1I 527a_100000744482_100000187884 [0,2,0,0,0,0|1,0,0]=3 7982 B15R1.5815 CC(CO)CNC(=O)c1ccccc1O 240690a_100000744482_100015234032 [0,2,0,0,0,0|1,0,0]=3 7983 B15R1.5815 CC(CO)CNC(=O)c1ccccc1[O-] 240690a_100000744482_100009911694 [0,2,0,0,0,0|1,0,0]=3 7984 B15R1.5815 CC(CO)CNC(=O)c1ccccc1[O-] 527a_100000744482_100009911694 [0,2,0,0,0,0|1,0,0]=3 7985 B15R1.5815 CC(CO)SCC(=O)c1ccccc1Cl 62a_100012180447_100000211432 [0,2,0,0,0,0|2,0,0]=4 7986 B15R1.5815 CC(CO)SCC(=O)c1ccccc1F 62a_100012180447_100000204681 [0,2,0,0,0,0|2,0,0]=4 7987 B15R1.5815 CC(CO)SCC(=O)c1ccccc1O 62a_100012180447_100000188908 [0,2,0,0,0,0|2,0,0]=4 7988 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1Br 34a_100000702211_100000059175 [0,2,0,0,0,0|1,0,1]=4 7989 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1Br 7a_100000702211_100000059175 [0,2,0,0,0,0|1,0,1]=4 7990 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1Cl 34a_100000740796_100000059175 [0,2,0,0,0,0|1,0,1]=4 7991 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1Cl 7a_100000740796_100000059175 [0,2,0,0,0,0|1,0,1]=4 7992 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1F 34a_100000697922_100000059175 [0,2,0,0,0,0|1,0,1]=4 7993 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1F 7a_100000697922_100000059175 [0,2,0,0,0,0|1,0,1]=4 7994 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1N 7a_100011405641_100000059175 [0,2,0,0,0,0|1,0,1]=4 7995 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 11a_100020588543_100000188424 [0,2,0,0,0,0|1,0,0]=3 7996 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 1626a_100020588543_100000188424 [0,2,0,0,0,0|1,0,0]=3 7997 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 240690a_100020588543_100000188424 [0,2,0,0,0,0|1,0,0]=3 7998 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 527a_100020588543_100000188424 [0,2,0,0,0,0|1,0,0]=3 7999 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 11a_100020588543_100000212026 [0,2,0,0,0,0|1,0,0]=3 8000 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 1626a_100020588543_100000212026 [0,2,0,0,0,0|1,0,0]=3 8001 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 240690a_100020588543_100000212026 [0,2,0,0,0,0|1,0,0]=3 8002 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 527a_100020588543_100000212026 [0,2,0,0,0,0|1,0,0]=3 8003 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 11a_100020588543_100000185844 [0,2,0,0,0,0|1,0,0]=3 8004 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 1626a_100020588543_100000185844 [0,2,0,0,0,0|1,0,0]=3 8005 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 240690a_100020588543_100000185844 [0,2,0,0,0,0|1,0,0]=3 8006 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 527a_100020588543_100000185844 [0,2,0,0,0,0|1,0,0]=3 8007 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 11a_100020588543_100000188656 [0,2,0,0,0,0|1,0,0]=3 8008 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 1626a_100020588543_100000188656 [0,2,0,0,0,0|1,0,0]=3 8009 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 240690a_100020588543_100000188656 [0,2,0,0,0,0|1,0,0]=3 8010 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 527a_100020588543_100000188656 [0,2,0,0,0,0|1,0,0]=3 8011 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 11a_100020588543_100000187884 [0,2,0,0,0,0|1,0,0]=3 8012 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 1626a_100020588543_100000187884 [0,2,0,0,0,0|1,0,0]=3 8013 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 240690a_100020588543_100000187884 [0,2,0,0,0,0|1,0,0]=3 8014 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 527a_100020588543_100000187884 [0,2,0,0,0,0|1,0,0]=3 8015 B15R1.5815 CCC(C)CNC(=O)c1ccccc1O 240690a_100020588543_100015234032 [0,2,0,0,0,0|1,0,0]=3 8016 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 1626a_100020588543_100009911694 [0,2,0,0,0,0|1,0,0]=3 8017 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 240690a_100020588543_100009911694 [0,2,0,0,0,0|1,0,0]=3 8018 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 527a_100020588543_100009911694 [0,2,0,0,0,0|1,0,0]=3 8019 B15R1.5815 CCC(C)COC(C)c1ccccc1Br 34a_100000702211_100000748023 [0,2,0,0,0,0|1,0,1]=4 8020 B15R1.5815 CCC(C)COC(C)c1ccccc1Br 7a_100000702211_100000748023 [0,2,0,0,0,0|1,0,1]=4 8021 B15R1.5815 CCC(C)COC(C)c1ccccc1C 34a_100000742021_100000748023 [0,2,0,0,0,0|1,0,1]=4 8022 B15R1.5815 CCC(C)COC(C)c1ccccc1C 7a_100000742021_100000748023 [0,2,0,0,0,0|1,0,1]=4 8023 B15R1.5815 CCC(C)COC(C)c1ccccc1Cl 34a_100000740796_100000748023 [0,2,0,0,0,0|1,0,1]=4 8024 B15R1.5815 CCC(C)COC(C)c1ccccc1Cl 7a_100000740796_100000748023 [0,2,0,0,0,0|1,0,1]=4 8025 B15R1.5815 CCC(C)COC(C)c1ccccc1F 34a_100000697922_100000748023 [0,2,0,0,0,0|1,0,1]=4 8026 B15R1.5815 CCC(C)COC(C)c1ccccc1F 7a_100000697922_100000748023 [0,2,0,0,0,0|1,0,1]=4 8027 B15R1.5815 CCC(C)COC(C)c1ccccc1N 7a_100011405641_100000748023 [0,2,0,0,0,0|1,0,1]=4 8028 B15R1.5815 CCC(C)NCC(=O)c1ccccc1C 2230a_100000209981_100000741374 [0,2,0,0,0,0|2,0,0]=4 8029 B15R1.5815 CCC(C)NNC(=O)c1ccccc1Br 22a_100000718999_100000188424 [0,2,0,0,0,0|2,0,0]=4 8030 B15R1.5815 CCC(C)NNC(=O)c1ccccc1C 22a_100000718999_100000212026 [0,2,0,0,0,0|2,0,0]=4 8031 B15R1.5815 CCC(C)NNC(=O)c1ccccc1Cl 22a_100000718999_100000185844 [0,2,0,0,0,0|2,0,0]=4 8032 B15R1.5815 CCC(C)NNC(=O)c1ccccc1F 22a_100000718999_100000188656 [0,2,0,0,0,0|2,0,0]=4 8033 B15R1.5815 CCC(C)NNC(=O)c1ccccc1I 22a_100000718999_100000187884 [0,2,0,0,0,0|2,0,0]=4 8034 B15R1.5815 CCC(C)NNC(=O)c1ccccc1O 22a_100000718999_100015234032 [0,2,0,0,0,0|2,0,0]=4 8035 B15R1.5815 CCC(C)NNC(=O)c1ccccc1[O-] 22a_100000718999_100009911694 [0,2,0,0,0,0|2,0,0]=4 8036 B15R1.5815 CCC(C)OCC(=O)c1ccccc1C 7a_100000210228_100000741374 [0,2,0,0,0,0|2,0,0]=4 8037 B15R1.5815 CCC(C)OCC(=O)c1ccccc1F 7a_100000210228_100000204681 [0,2,0,0,0,0|2,0,0]=4 8038 B15R1.5815 CCC(C)OCC(=O)c1ccccc1O 7a_100000210228_100000188908 [0,2,0,0,0,0|2,0,0]=4 8039 B15R1.5815 CCC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000758301 [0,2,0,0,0,0|2,0,0]=4 8040 B15R1.5815 CCC(C)SCC(=O)c1ccccc1C 62a_100000741374_100000758301 [0,2,0,0,0,0|2,0,0]=4 8041 B15R1.5815 CCC(C)SCC(=O)c1ccccc1C 62a_100000758301_100000741374 [0,2,0,0,0,0|2,0,0]=4 8042 B15R1.5815 CCC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000758301 [0,2,0,0,0,0|2,0,0]=4 8043 B15R1.5815 CCC(C)SCC(=O)c1ccccc1Cl 62a_100000758301_100000211432 [0,2,0,0,0,0|2,0,0]=4 8044 B15R1.5815 CCC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000758301 [0,2,0,0,0,0|2,0,0]=4 8045 B15R1.5815 CCC(C)SCC(=O)c1ccccc1F 62a_100000758301_100000204681 [0,2,0,0,0,0|2,0,0]=4 8046 B15R1.5815 CCC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000758301 [0,2,0,0,0,0|2,0,0]=4 8047 B15R1.5815 CCC(C)SCC(=O)c1ccccc1O 62a_100000758301_100000188908 [0,2,0,0,0,0|2,0,0]=4 8048 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Br 11a_100011218483_100000188424 [0,2,0,0,0,0|2,0,0]=4 8049 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Br 240690a_100011218483_100000188424 [0,2,0,0,0,0|2,0,0]=4 8050 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Br 527a_100011218483_100000188424 [0,2,0,0,0,0|2,0,0]=4 8051 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 11a_100011218483_100000212026 [0,2,0,0,0,0|2,0,0]=4 8052 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 240690a_100011218483_100000212026 [0,2,0,0,0,0|2,0,0]=4 8053 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 527a_100011218483_100000212026 [0,2,0,0,0,0|2,0,0]=4 8054 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Cl 11a_100011218483_100000185844 [0,2,0,0,0,0|2,0,0]=4 8055 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Cl 240690a_100011218483_100000185844 [0,2,0,0,0,0|2,0,0]=4 8056 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Cl 527a_100011218483_100000185844 [0,2,0,0,0,0|2,0,0]=4 8057 B15R1.5815 CCC(O)CNC(=O)c1ccccc1F 11a_100011218483_100000188656 [0,2,0,0,0,0|2,0,0]=4 8058 B15R1.5815 CCC(O)CNC(=O)c1ccccc1F 240690a_100011218483_100000188656 [0,2,0,0,0,0|2,0,0]=4 8059 B15R1.5815 CCC(O)CNC(=O)c1ccccc1F 527a_100011218483_100000188656 [0,2,0,0,0,0|2,0,0]=4 8060 B15R1.5815 CCC(O)CNC(=O)c1ccccc1I 11a_100011218483_100000187884 [0,2,0,0,0,0|2,0,0]=4 8061 B15R1.5815 CCC(O)CNC(=O)c1ccccc1I 240690a_100011218483_100000187884 [0,2,0,0,0,0|2,0,0]=4 8062 B15R1.5815 CCC(O)CNC(=O)c1ccccc1I 527a_100011218483_100000187884 [0,2,0,0,0,0|2,0,0]=4 8063 B15R1.5815 CCC(O)CNC(=O)c1ccccc1O 240690a_100011218483_100015234032 [0,2,0,0,0,0|2,0,0]=4 8064 B15R1.5815 CCC(O)CNC(=O)c1ccccc1[O-] 240690a_100011218483_100009911694 [0,2,0,0,0,0|2,0,0]=4 8065 B15R1.5815 CCC(O)CNC(=O)c1ccccc1[O-] 527a_100011218483_100009911694 [0,2,0,0,0,0|2,0,0]=4 8066 B15R1.5815 CCN(C)CCC(=O)c1ccccc1F 2230a_100000225621_100000086012 [0,2,0,0,0,0|2,0,0]=4 8067 B15R1.5815 CCN(C)CCC(=O)c1ccccc1F 269982a_100000225621_100000086012 [0,2,0,0,0,0|2,0,0]=4 8068 B15R1.5815 CCN(C)CCC(=O)c1ccccc1O 269982a_100000225621_100009873196 [0,2,0,0,0,0|2,0,0]=4 8069 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Br 34a_100000702211_100009816398 [0,2,0,0,0,0|1,0,1]=4 8070 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Br 7a_100000702211_100009816398 [0,2,0,0,0,0|1,0,1]=4 8071 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1C 34a_100000742021_100009816398 [0,2,0,0,0,0|1,0,1]=4 8072 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1C 7a_100000742021_100009816398 [0,2,0,0,0,0|1,0,1]=4 8073 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Cl 34a_100000740796_100009816398 [0,2,0,0,0,0|1,0,1]=4 8074 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Cl 7a_100000740796_100009816398 [0,2,0,0,0,0|1,0,1]=4 8075 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Cl 7a_100009816381_100000181259 [0,2,0,0,0,0|1,0,1]=4 8076 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1F 34a_100000697922_100009816398 [0,2,0,0,0,0|1,0,1]=4 8077 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1F 7a_100000697922_100009816398 [0,2,0,0,0,0|1,0,1]=4 8078 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1F 7a_100009816381_200000741388 [0,2,0,0,0,0|1,0,1]=4 8079 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1N 7a_100011405641_100009816398 [0,2,0,0,0,0|1,0,1]=4 8080 B15R1.5815 CNC(C)COC(=O)c1ccccc1Br 270004a_106832991635_201991511838 [0,2,0,0,0,0|0,0,0]=2 8081 B15R1.5815 COC(C)COC(C)c1ccccc1F 34a_100000690652_200000741388 [0,2,0,0,0,0|1,0,1]=4 8082 B15R1.5815 COC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100009879195 [0,2,0,0,0,0|2,0,0]=4 8083 B15R1.5815 COC(C)SCC(=O)c1ccccc1C 62a_100000741374_100009879195 [0,2,0,0,0,0|2,0,0]=4 8084 B15R1.5815 COC(C)SCC(=O)c1ccccc1C 62a_100009879195_100000741374 [0,2,0,0,0,0|2,0,0]=4 8085 B15R1.5815 COC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100009879195 [0,2,0,0,0,0|2,0,0]=4 8086 B15R1.5815 COC(C)SCC(=O)c1ccccc1Cl 62a_100009879195_100000211432 [0,2,0,0,0,0|2,0,0]=4 8087 B15R1.5815 COC(C)SCC(=O)c1ccccc1F 62a_100000204681_100009879195 [0,2,0,0,0,0|2,0,0]=4 8088 B15R1.5815 COC(C)SCC(=O)c1ccccc1F 62a_100009879195_100000204681 [0,2,0,0,0,0|2,0,0]=4 8089 B15R1.5815 COC(C)SCC(=O)c1ccccc1O 62a_100000188908_100009879195 [0,2,0,0,0,0|2,0,0]=4 8090 B15R1.5815 COC(C)SCC(=O)c1ccccc1O 62a_100009879195_100000188908 [0,2,0,0,0,0|2,0,0]=4 8091 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 11a_100020591295_100000188424 [0,2,0,0,0,0|1,0,0]=3 8092 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 1626a_100020591295_100000188424 [0,2,0,0,0,0|1,0,0]=3 8093 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 240690a_100020591295_100000188424 [0,2,0,0,0,0|1,0,0]=3 8094 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 527a_100020591295_100000188424 [0,2,0,0,0,0|1,0,0]=3 8095 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 11a_100020591295_100000212026 [0,2,0,0,0,0|1,0,0]=3 8096 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 1626a_100020591295_100000212026 [0,2,0,0,0,0|1,0,0]=3 8097 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 240690a_100020591295_100000212026 [0,2,0,0,0,0|1,0,0]=3 8098 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 527a_100020591295_100000212026 [0,2,0,0,0,0|1,0,0]=3 8099 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 11a_100020591295_100000185844 [0,2,0,0,0,0|1,0,0]=3 8100 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 1626a_100020591295_100000185844 [0,2,0,0,0,0|1,0,0]=3 8101 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 240690a_100020591295_100000185844 [0,2,0,0,0,0|1,0,0]=3 8102 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 527a_100020591295_100000185844 [0,2,0,0,0,0|1,0,0]=3 8103 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 11a_100020591295_100000188656 [0,2,0,0,0,0|1,0,0]=3 8104 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 1626a_100020591295_100000188656 [0,2,0,0,0,0|1,0,0]=3 8105 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 240690a_100020591295_100000188656 [0,2,0,0,0,0|1,0,0]=3 8106 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 527a_100020591295_100000188656 [0,2,0,0,0,0|1,0,0]=3 8107 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 11a_100020591295_100000187884 [0,2,0,0,0,0|1,0,0]=3 8108 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 1626a_100020591295_100000187884 [0,2,0,0,0,0|1,0,0]=3 8109 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 240690a_100020591295_100000187884 [0,2,0,0,0,0|1,0,0]=3 8110 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 527a_100020591295_100000187884 [0,2,0,0,0,0|1,0,0]=3 8111 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1O 240690a_100020591295_100015234032 [0,2,0,0,0,0|1,0,0]=3 8112 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 1626a_100020591295_100009911694 [0,2,0,0,0,0|1,0,0]=3 8113 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 240690a_100020591295_100009911694 [0,2,0,0,0,0|1,0,0]=3 8114 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 527a_100020591295_100009911694 [0,2,0,0,0,0|1,0,0]=3 8115 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1Br 62a_100000199116_100016084084 [0,2,0,0,0,0|2,0,0]=4 8116 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1Cl 62a_100000211432_100016084084 [0,2,0,0,0,0|2,0,0]=4 8117 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1Cl 62a_100016084084_100000211432 [0,2,0,0,0,0|2,0,0]=4 8118 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1F 62a_100000204681_100016084084 [0,2,0,0,0,0|2,0,0]=4 8119 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1F 62a_100016084084_100000204681 [0,2,0,0,0,0|2,0,0]=4 8120 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1O 62a_100000188908_100016084084 [0,2,0,0,0,0|2,0,0]=4 8121 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1O 62a_100016084084_100000188908 [0,2,0,0,0,0|2,0,0]=4 8122 B15R1.5815 Cc1ccccc1C(=O)CN[C@H](C)CO 2230a_100000737577_100000741374 [0,2,0,0,0,0|2,0,0]=4 8123 B15R1.5815 Cc1ccccc1C(=O)COC(C)CF 34a_100016041109_100000741374 [0,2,0,0,0,0|2,0,0]=4 8124 B15R1.5815 Cc1ccccc1C(=O)COC(C)CF 7a_100016041109_100000741374 [0,2,0,0,0,0|2,0,0]=4 8125 B15R1.5815 Cc1ccccc1C(=O)COC(C)CN 34a_100000210904_100000741374 [0,2,0,0,0,0|2,0,0]=4 8126 B15R1.5815 Cc1ccccc1C(=O)CSC(C)CO 62a_100012180447_100000741374 [0,2,0,0,0,0|2,0,0]=4 8127 B15R1.5815 Cc1ccccc1C(=O)CS[C@H](C)CO 62a_100000741374_100016084084 [0,2,0,0,0,0|2,0,0]=4 8128 B15R1.5815 Cc1ccccc1C(=O)CS[C@H](C)CO 62a_100016084084_100000741374 [0,2,0,0,0,0|2,0,0]=4 8129 B15R1.5815 Cc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000212026 [0,2,0,0,0,0|1,0,0]=3 8130 B15R1.5815 Cc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000212026 [0,2,0,0,0,0|1,0,0]=3 8131 B15R1.5815 Cc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000212026 [0,2,0,0,0,0|2,0,0]=4 8132 B15R1.5815 Cc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000212026 [0,2,0,0,0,0|2,0,0]=4 8133 B15R1.5815 Cc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000212026 [0,2,0,0,0,0|2,0,0]=4 8134 B15R1.5815 Cc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000212026 [0,2,0,0,0,0|2,0,0]=4 8135 B15R1.5815 Cc1ccccc1C(C)OC[C@@H](C)CO 34a_100000742021_100000059175 [0,2,0,0,0,0|1,0,1]=4 8136 B15R1.5815 Cc1ccccc1C(C)OC[C@@H](C)CO 7a_100000742021_100000059175 [0,2,0,0,0,0|1,0,1]=4 8137 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Br 240690a_100015665980_100000188424 [0,2,0,0,0,0|2,0,0]=4 8138 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Br 527a_100015665980_100000188424 [0,2,0,0,0,0|2,0,0]=4 8139 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Cl 240690a_100015665980_100000185844 [0,2,0,0,0,0|2,0,0]=4 8140 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Cl 527a_100015665980_100000185844 [0,2,0,0,0,0|2,0,0]=4 8141 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1F 240690a_100015665980_100000188656 [0,2,0,0,0,0|2,0,0]=4 8142 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1F 527a_100015665980_100000188656 [0,2,0,0,0,0|2,0,0]=4 8143 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1I 240690a_100015665980_100000187884 [0,2,0,0,0,0|2,0,0]=4 8144 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1I 527a_100015665980_100000187884 [0,2,0,0,0,0|2,0,0]=4 8145 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1O 240690a_100015665980_100015234032 [0,2,0,0,0,0|2,0,0]=4 8146 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1[O-] 240690a_100015665980_100009911694 [0,2,0,0,0,0|2,0,0]=4 8147 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1[O-] 527a_100015665980_100009911694 [0,2,0,0,0,0|2,0,0]=4 8148 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Br 240690a_100020644852_100000188424 [0,2,0,0,0,0|2,0,0]=4 8149 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Br 527a_100020644852_100000188424 [0,2,0,0,0,0|2,0,0]=4 8150 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Cl 240690a_100020644852_100000185844 [0,2,0,0,0,0|2,0,0]=4 8151 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Cl 527a_100020644852_100000185844 [0,2,0,0,0,0|2,0,0]=4 8152 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1F 240690a_100020644852_100000188656 [0,2,0,0,0,0|2,0,0]=4 8153 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1F 527a_100020644852_100000188656 [0,2,0,0,0,0|2,0,0]=4 8154 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1I 240690a_100020644852_100000187884 [0,2,0,0,0,0|2,0,0]=4 8155 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1I 527a_100020644852_100000187884 [0,2,0,0,0,0|2,0,0]=4 8156 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1O 240690a_100020644852_100015234032 [0,2,0,0,0,0|2,0,0]=4 8157 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1[O-] 240690a_100020644852_100009911694 [0,2,0,0,0,0|2,0,0]=4 8158 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1[O-] 527a_100020644852_100009911694 [0,2,0,0,0,0|2,0,0]=4 8159 B15R1.5822 CC(=O)COC(=O)c1ccc(cc1Cl)Cl 1458a_100000070787_100010978946 [0,2,0,0,0,0|1,0,1]=4 8160 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210312 [0,2,0,0,0,0|1,0,0]=3 8161 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210312 [0,2,0,0,0,0|1,0,0]=3 8162 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210312 [0,2,0,0,0,0|1,0,0]=3 8163 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210312 [0,2,0,0,0,0|1,0,0]=3 8164 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210312 [0,2,0,0,0,0|1,0,0]=3 8165 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210312 [0,2,0,0,0,0|1,0,0]=3 8166 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210312 [0,2,0,0,0,0|1,0,0]=3 8167 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210312 [0,2,0,0,0,0|1,0,0]=3 8168 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210312 [0,2,0,0,0,0|1,0,0]=3 8169 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210312 [0,2,0,0,0,0|1,0,0]=3 8170 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210312 [0,2,0,0,0,0|1,0,0]=3 8171 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210312 [0,2,0,0,0,0|1,0,0]=3 8172 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210312 [0,2,0,0,0,0|1,0,0]=3 8173 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210312 [0,2,0,0,0,0|1,0,0]=3 8174 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210312 [0,2,0,0,0,0|1,0,0]=3 8175 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210312 [0,2,0,0,0,0|1,0,0]=3 8176 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210312 [0,2,0,0,0,0|1,0,0]=3 8177 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210312 [0,2,0,0,0,0|1,0,0]=3 8178 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210312 [0,2,0,0,0,0|1,0,0]=3 8179 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210312 [0,2,0,0,0,0|1,0,0]=3 8180 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210312 [0,2,0,0,0,0|1,0,0]=3 8181 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210312 [0,2,0,0,0,0|1,0,0]=3 8182 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210312 [0,2,0,0,0,0|1,0,0]=3 8183 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 11a_100000210953_100000762965 [0,2,0,0,0,0|1,0,0]=3 8184 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 1626a_100000210953_100000762965 [0,2,0,0,0,0|1,0,0]=3 8185 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 240690a_100000210953_100000762965 [0,2,0,0,0,0|1,0,0]=3 8186 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 527a_100000210953_100000762965 [0,2,0,0,0,0|1,0,0]=3 8187 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 11a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 8188 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 1626a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 8189 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 8190 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 527a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 8191 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 11a_100000210953_100000212304 [0,2,0,0,0,0|1,0,0]=3 8192 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 1626a_100000210953_100000212304 [0,2,0,0,0,0|1,0,0]=3 8193 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 240690a_100000210953_100000212304 [0,2,0,0,0,0|1,0,0]=3 8194 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 527a_100000210953_100000212304 [0,2,0,0,0,0|1,0,0]=3 8195 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 11a_100000210953_100012360512 [0,2,0,0,0,0|1,0,0]=3 8196 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 1626a_100000210953_100012360512 [0,2,0,0,0,0|1,0,0]=3 8197 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 240690a_100000210953_100012360512 [0,2,0,0,0,0|1,0,0]=3 8198 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 527a_100000210953_100012360512 [0,2,0,0,0,0|1,0,0]=3 8199 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)O 240690a_100000210953_100012344906 [0,2,0,0,0,0|1,0,0]=3 8200 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)O 527a_100000210953_100012344906 [0,2,0,0,0,0|1,0,0]=3 8201 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 11a_100000210953_100000741628 [0,2,0,0,0,0|1,0,0]=3 8202 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 1626a_100000210953_100000741628 [0,2,0,0,0,0|1,0,0]=3 8203 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 240690a_100000210953_100000741628 [0,2,0,0,0,0|1,0,0]=3 8204 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 527a_100000210953_100000741628 [0,2,0,0,0,0|1,0,0]=3 8205 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 8206 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 1626a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 8207 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 8208 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 8209 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 11a_100000210953_100000211397 [0,2,0,0,0,0|1,0,0]=3 8210 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 1626a_100000210953_100000211397 [0,2,0,0,0,0|1,0,0]=3 8211 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 240690a_100000210953_100000211397 [0,2,0,0,0,0|1,0,0]=3 8212 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 527a_100000210953_100000211397 [0,2,0,0,0,0|1,0,0]=3 8213 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 11a_100000210953_100000751301 [0,2,0,0,0,0|1,0,0]=3 8214 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 1626a_100000210953_100000751301 [0,2,0,0,0,0|1,0,0]=3 8215 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 240690a_100000210953_100000751301 [0,2,0,0,0,0|1,0,0]=3 8216 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 527a_100000210953_100000751301 [0,2,0,0,0,0|1,0,0]=3 8217 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)O 240690a_100000210953_100000702456 [0,2,0,0,0,0|1,0,0]=3 8218 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)O 527a_100000210953_100000702456 [0,2,0,0,0,0|1,0,0]=3 8219 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 11a_100000210953_100000214689 [0,2,0,0,0,0|1,0,0]=3 8220 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 1626a_100000210953_100000214689 [0,2,0,0,0,0|1,0,0]=3 8221 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 240690a_100000210953_100000214689 [0,2,0,0,0,0|1,0,0]=3 8222 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 527a_100000210953_100000214689 [0,2,0,0,0,0|1,0,0]=3 8223 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 11a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 8224 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 1626a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 8225 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 240690a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 8226 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 527a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 8227 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 11a_100000210953_100000211022 [0,2,0,0,0,0|1,0,0]=3 8228 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 1626a_100000210953_100000211022 [0,2,0,0,0,0|1,0,0]=3 8229 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 240690a_100000210953_100000211022 [0,2,0,0,0,0|1,0,0]=3 8230 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 527a_100000210953_100000211022 [0,2,0,0,0,0|1,0,0]=3 8231 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 11a_100000210953_100000037189 [0,2,0,0,0,0|1,0,0]=3 8232 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 1626a_100000210953_100000037189 [0,2,0,0,0,0|1,0,0]=3 8233 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 240690a_100000210953_100000037189 [0,2,0,0,0,0|1,0,0]=3 8234 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 527a_100000210953_100000037189 [0,2,0,0,0,0|1,0,0]=3 8235 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)O 240690a_100000210953_100000689029 [0,2,0,0,0,0|1,0,0]=3 8236 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)O 527a_100000210953_100000689029 [0,2,0,0,0,0|1,0,0]=3 8237 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 11a_100000210953_100000751167 [0,2,0,0,0,0|1,0,0]=3 8238 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 1626a_100000210953_100000751167 [0,2,0,0,0,0|1,0,0]=3 8239 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 240690a_100000210953_100000751167 [0,2,0,0,0,0|1,0,0]=3 8240 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 527a_100000210953_100000751167 [0,2,0,0,0,0|1,0,0]=3 8241 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 11a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 8242 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 1626a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 8243 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 240690a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 8244 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 527a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 8245 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 11a_100000210953_100000739341 [0,2,0,0,0,0|1,0,0]=3 8246 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 1626a_100000210953_100000739341 [0,2,0,0,0,0|1,0,0]=3 8247 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 240690a_100000210953_100000739341 [0,2,0,0,0,0|1,0,0]=3 8248 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 527a_100000210953_100000739341 [0,2,0,0,0,0|1,0,0]=3 8249 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Br 240690a_100000210953_100000744433 [0,2,0,0,0,0|1,0,0]=3 8250 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Br 527a_100000210953_100000744433 [0,2,0,0,0,0|1,0,0]=3 8251 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 11a_100000210953_100000188622 [0,2,0,0,0,0|1,0,0]=3 8252 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 240690a_100000210953_100000188622 [0,2,0,0,0,0|1,0,0]=3 8253 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 527a_100000210953_100000188622 [0,2,0,0,0,0|1,0,0]=3 8254 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)F 240690a_100000210953_100000746061 [0,2,0,0,0,0|1,0,0]=3 8255 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)F 527a_100000210953_100000746061 [0,2,0,0,0,0|1,0,0]=3 8256 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)I 240690a_100000210953_100000091984 [0,2,0,0,0,0|1,0,0]=3 8257 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)I 527a_100000210953_100000091984 [0,2,0,0,0,0|1,0,0]=3 8258 B15R1.5822 CC(C)COC(C)c1ccc(cc1Cl)Cl 34a_100000743050_100000210624 [0,2,0,0,0,0|1,0,1]=4 8259 B15R1.5822 CC(C)COC(C)c1ccc(cc1Cl)Cl 7a_100000743050_100000210760 [0,2,0,0,0,0|1,0,1]=4 8260 B15R1.5822 CC(C)COC(C)c1ccc(cc1Cl)F 34a_200011245020_100000210624 [0,2,0,0,0,0|1,0,1]=4 8261 B15R1.5822 CC(C)COC(C)c1ccc(cc1Cl)F 7a_200011245020_100000210760 [0,2,0,0,0,0|1,0,1]=4 8262 B15R1.5822 CC(C)COC(C)c1ccc(cc1F)Cl 34a_200011805215_100000210624 [0,2,0,0,0,0|1,0,1]=4 8263 B15R1.5822 CC(C)COC(C)c1ccc(cc1F)Cl 7a_200011805215_100000210760 [0,2,0,0,0,0|1,0,1]=4 8264 B15R1.5822 CC(C)COC(C)c1ccc(cc1F)F 34a_200000246518_100000210624 [0,2,0,0,0,0|1,0,1]=4 8265 B15R1.5822 CC(C)COC(C)c1ccc(cc1F)F 7a_200000246518_100000210760 [0,2,0,0,0,0|1,0,1]=4 8266 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1Br)F 34a_100138425928_100012361341 [0,2,0,0,0,0|2,0,0]=4 8267 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1Cl)Cl 2230a_100138425928_100011218845 [0,2,0,0,0,0|2,0,0]=4 8268 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1Cl)F 2230a_100138425928_100012056422 [0,2,0,0,0,0|2,0,0]=4 8269 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1Cl)F 34a_100138425928_100012056422 [0,2,0,0,0,0|2,0,0]=4 8270 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1F)Br 34a_100138425928_200012361339 [0,2,0,0,0,0|2,0,0]=4 8271 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1F)Cl 34a_100138425928_100012351891 [0,2,0,0,0,0|2,0,0]=4 8272 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1F)F 34a_100138425928_100000229962 [0,2,0,0,0,0|2,0,0]=4 8273 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1O)F 34a_100138425928_100009817053 [0,2,0,0,0,0|2,0,0]=4 8274 B15R1.5822 CC(C)NCC(=O)c1ccc(cc1O)O 34a_100138425928_100009814262 [0,2,0,0,0,0|2,0,0]=4 8275 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Br)Br 22a_100000741168_100000762965 [0,2,0,0,0,0|2,0,0]=4 8276 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Br)Cl 22a_100000741168_100000766353 [0,2,0,0,0,0|2,0,0]=4 8277 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Br)F 22a_100000741168_100000212304 [0,2,0,0,0,0|2,0,0]=4 8278 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Br)I 22a_100000741168_100012360512 [0,2,0,0,0,0|2,0,0]=4 8279 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Br)O 22a_100000741168_100012344906 [0,2,0,0,0,0|2,0,0]=4 8280 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Cl)Br 22a_100000741168_100000741628 [0,2,0,0,0,0|2,0,0]=4 8281 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Cl)Cl 22a_100000741168_100000185840 [0,2,0,0,0,0|2,0,0]=4 8282 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Cl)F 22a_100000741168_100000211397 [0,2,0,0,0,0|2,0,0]=4 8283 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Cl)I 22a_100000741168_100000751301 [0,2,0,0,0,0|2,0,0]=4 8284 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Cl)O 22a_100000741168_100000702456 [0,2,0,0,0,0|2,0,0]=4 8285 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1F)Br 22a_100000741168_100000214689 [0,2,0,0,0,0|2,0,0]=4 8286 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1F)Cl 22a_100000741168_100000212326 [0,2,0,0,0,0|2,0,0]=4 8287 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1F)F 22a_100000741168_100000211022 [0,2,0,0,0,0|2,0,0]=4 8288 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1F)I 22a_100000741168_100000037189 [0,2,0,0,0,0|2,0,0]=4 8289 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1F)O 22a_100000741168_100000689029 [0,2,0,0,0,0|2,0,0]=4 8290 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1I)Br 22a_100000741168_100000751167 [0,2,0,0,0,0|2,0,0]=4 8291 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1I)Cl 22a_100000741168_100000739380 [0,2,0,0,0,0|2,0,0]=4 8292 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1I)F 22a_100000741168_100000739341 [0,2,0,0,0,0|2,0,0]=4 8293 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1O)Br 22a_100000741168_100000744433 [0,2,0,0,0,0|2,0,0]=4 8294 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1O)Cl 22a_100000741168_100000188622 [0,2,0,0,0,0|2,0,0]=4 8295 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1O)F 22a_100000741168_100000746061 [0,2,0,0,0,0|2,0,0]=4 8296 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1O)I 22a_100000741168_100000091984 [0,2,0,0,0,0|2,0,0]=4 8297 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1O)O 22a_100000741168_100000212172 [0,2,0,0,0,0|2,0,0]=4 8298 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1Br)F 34a_100000212225_100012361341 [0,2,0,0,0,0|2,0,0]=4 8299 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1Cl)F 34a_100000212225_100012056422 [0,2,0,0,0,0|2,0,0]=4 8300 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1F)Br 34a_100000212225_200012361339 [0,2,0,0,0,0|2,0,0]=4 8301 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1F)Cl 34a_100000212225_100012351891 [0,2,0,0,0,0|2,0,0]=4 8302 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1F)F 34a_100000212225_100000229962 [0,2,0,0,0,0|2,0,0]=4 8303 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1O)F 34a_100000212225_100009817053 [0,2,0,0,0,0|2,0,0]=4 8304 B15R1.5822 CC(C)OCC(=O)c1ccc(cc1O)O 34a_100000212225_100009814262 [0,2,0,0,0,0|2,0,0]=4 8305 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1Br)F 62a_100012361341_100000210206 [0,2,0,0,0,0|2,0,0]=4 8306 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210206 [0,2,0,0,0,0|2,0,0]=4 8307 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1Cl)F 62a_100000210206_100012056422 [0,2,0,0,0,0|2,0,0]=4 8308 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100000210206 [0,2,0,0,0,0|2,0,0]=4 8309 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1F)Br 62a_200012361339_100000210206 [0,2,0,0,0,0|2,0,0]=4 8310 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1F)Cl 62a_100000210206_100012351891 [0,2,0,0,0,0|2,0,0]=4 8311 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210206 [0,2,0,0,0,0|2,0,0]=4 8312 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1F)F 62a_100000210206_100000229962 [0,2,0,0,0,0|2,0,0]=4 8313 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1F)F 62a_100000229962_100000210206 [0,2,0,0,0,0|2,0,0]=4 8314 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1O)F 62a_100000210206_100009817053 [0,2,0,0,0,0|2,0,0]=4 8315 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1O)F 62a_100009817053_100000210206 [0,2,0,0,0,0|2,0,0]=4 8316 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1O)O 62a_100000210206_100009814262 [0,2,0,0,0,0|2,0,0]=4 8317 B15R1.5822 CC(C)SCC(=O)c1ccc(cc1O)O 62a_100009814262_100000210206 [0,2,0,0,0,0|2,0,0]=4 8318 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100012276601 [0,2,0,0,0,0|2,0,0]=4 8319 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100012276601 [0,2,0,0,0,0|2,0,0]=4 8320 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100012276601 [0,2,0,0,0,0|2,0,0]=4 8321 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100012276601 [0,2,0,0,0,0|2,0,0]=4 8322 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100012276601 [0,2,0,0,0,0|2,0,0]=4 8323 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100012276601 [0,2,0,0,0,0|2,0,0]=4 8324 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100012276601 [0,2,0,0,0,0|2,0,0]=4 8325 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100012276601 [0,2,0,0,0,0|2,0,0]=4 8326 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100012276601 [0,2,0,0,0,0|2,0,0]=4 8327 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100012276601 [0,2,0,0,0,0|2,0,0]=4 8328 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100012276601 [0,2,0,0,0,0|2,0,0]=4 8329 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100012276601 [0,2,0,0,0,0|2,0,0]=4 8330 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100012276601 [0,2,0,0,0,0|2,0,0]=4 8331 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100012276601 [0,2,0,0,0,0|2,0,0]=4 8332 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100012276601 [0,2,0,0,0,0|2,0,0]=4 8333 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100012276601 [0,2,0,0,0,0|2,0,0]=4 8334 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100012276601 [0,2,0,0,0,0|2,0,0]=4 8335 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100012276601 [0,2,0,0,0,0|2,0,0]=4 8336 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100012276601 [0,2,0,0,0,0|2,0,0]=4 8337 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100012276601 [0,2,0,0,0,0|2,0,0]=4 8338 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100012276601 [0,2,0,0,0,0|2,0,0]=4 8339 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100012276601 [0,2,0,0,0,0|2,0,0]=4 8340 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100012276601 [0,2,0,0,0,0|2,0,0]=4 8341 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Br 11a_100000210904_100000762965 [0,2,0,0,0,0|2,0,0]=4 8342 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Br 240690a_100000210904_100000762965 [0,2,0,0,0,0|2,0,0]=4 8343 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Br 527a_100000210904_100000762965 [0,2,0,0,0,0|2,0,0]=4 8344 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Cl 11a_100000210904_100000766353 [0,2,0,0,0,0|2,0,0]=4 8345 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000210904_100000766353 [0,2,0,0,0,0|2,0,0]=4 8346 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Cl 527a_100000210904_100000766353 [0,2,0,0,0,0|2,0,0]=4 8347 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)F 11a_100000210904_100000212304 [0,2,0,0,0,0|2,0,0]=4 8348 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)F 240690a_100000210904_100000212304 [0,2,0,0,0,0|2,0,0]=4 8349 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)F 527a_100000210904_100000212304 [0,2,0,0,0,0|2,0,0]=4 8350 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)I 11a_100000210904_100012360512 [0,2,0,0,0,0|2,0,0]=4 8351 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)I 240690a_100000210904_100012360512 [0,2,0,0,0,0|2,0,0]=4 8352 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)I 527a_100000210904_100012360512 [0,2,0,0,0,0|2,0,0]=4 8353 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)O 240690a_100000210904_100012344906 [0,2,0,0,0,0|2,0,0]=4 8354 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)O 527a_100000210904_100012344906 [0,2,0,0,0,0|2,0,0]=4 8355 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Br 11a_100000210904_100000741628 [0,2,0,0,0,0|2,0,0]=4 8356 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Br 240690a_100000210904_100000741628 [0,2,0,0,0,0|2,0,0]=4 8357 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Br 527a_100000210904_100000741628 [0,2,0,0,0,0|2,0,0]=4 8358 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000210904_100000185840 [0,2,0,0,0,0|2,0,0]=4 8359 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000210904_100000185840 [0,2,0,0,0,0|2,0,0]=4 8360 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000210904_100000185840 [0,2,0,0,0,0|2,0,0]=4 8361 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)F 11a_100000210904_100000211397 [0,2,0,0,0,0|2,0,0]=4 8362 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)F 240690a_100000210904_100000211397 [0,2,0,0,0,0|2,0,0]=4 8363 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)F 527a_100000210904_100000211397 [0,2,0,0,0,0|2,0,0]=4 8364 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)I 11a_100000210904_100000751301 [0,2,0,0,0,0|2,0,0]=4 8365 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)I 240690a_100000210904_100000751301 [0,2,0,0,0,0|2,0,0]=4 8366 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)I 527a_100000210904_100000751301 [0,2,0,0,0,0|2,0,0]=4 8367 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)O 240690a_100000210904_100000702456 [0,2,0,0,0,0|2,0,0]=4 8368 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)O 527a_100000210904_100000702456 [0,2,0,0,0,0|2,0,0]=4 8369 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Br 11a_100000210904_100000214689 [0,2,0,0,0,0|2,0,0]=4 8370 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Br 240690a_100000210904_100000214689 [0,2,0,0,0,0|2,0,0]=4 8371 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Br 527a_100000210904_100000214689 [0,2,0,0,0,0|2,0,0]=4 8372 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Cl 11a_100000210904_100000212326 [0,2,0,0,0,0|2,0,0]=4 8373 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Cl 240690a_100000210904_100000212326 [0,2,0,0,0,0|2,0,0]=4 8374 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Cl 527a_100000210904_100000212326 [0,2,0,0,0,0|2,0,0]=4 8375 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)F 11a_100000210904_100000211022 [0,2,0,0,0,0|2,0,0]=4 8376 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)F 240690a_100000210904_100000211022 [0,2,0,0,0,0|2,0,0]=4 8377 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)F 527a_100000210904_100000211022 [0,2,0,0,0,0|2,0,0]=4 8378 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)I 11a_100000210904_100000037189 [0,2,0,0,0,0|2,0,0]=4 8379 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)I 240690a_100000210904_100000037189 [0,2,0,0,0,0|2,0,0]=4 8380 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)I 527a_100000210904_100000037189 [0,2,0,0,0,0|2,0,0]=4 8381 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)O 240690a_100000210904_100000689029 [0,2,0,0,0,0|2,0,0]=4 8382 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)O 527a_100000210904_100000689029 [0,2,0,0,0,0|2,0,0]=4 8383 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Br 11a_100000210904_100000751167 [0,2,0,0,0,0|2,0,0]=4 8384 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Br 240690a_100000210904_100000751167 [0,2,0,0,0,0|2,0,0]=4 8385 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Br 527a_100000210904_100000751167 [0,2,0,0,0,0|2,0,0]=4 8386 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Cl 11a_100000210904_100000739380 [0,2,0,0,0,0|2,0,0]=4 8387 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Cl 240690a_100000210904_100000739380 [0,2,0,0,0,0|2,0,0]=4 8388 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Cl 527a_100000210904_100000739380 [0,2,0,0,0,0|2,0,0]=4 8389 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)F 11a_100000210904_100000739341 [0,2,0,0,0,0|2,0,0]=4 8390 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)F 240690a_100000210904_100000739341 [0,2,0,0,0,0|2,0,0]=4 8391 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)F 527a_100000210904_100000739341 [0,2,0,0,0,0|2,0,0]=4 8392 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Br 240690a_100000210904_100000744433 [0,2,0,0,0,0|2,0,0]=4 8393 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Br 527a_100000210904_100000744433 [0,2,0,0,0,0|2,0,0]=4 8394 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 11a_100000210904_100000188622 [0,2,0,0,0,0|2,0,0]=4 8395 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 240690a_100000210904_100000188622 [0,2,0,0,0,0|2,0,0]=4 8396 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 527a_100000210904_100000188622 [0,2,0,0,0,0|2,0,0]=4 8397 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)F 240690a_100000210904_100000746061 [0,2,0,0,0,0|2,0,0]=4 8398 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)F 527a_100000210904_100000746061 [0,2,0,0,0,0|2,0,0]=4 8399 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)I 240690a_100000210904_100000091984 [0,2,0,0,0,0|2,0,0]=4 8400 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)I 527a_100000210904_100000091984 [0,2,0,0,0,0|2,0,0]=4 8401 B15R1.5822 CN(C)CCC(=O)c1ccc(cc1F)Br 2230a_100102631434_100010339771 [0,2,0,0,0,0|2,0,0]=4 8402 B15R1.5822 CN(C)CCC(=O)c1ccc(cc1F)Br 269982a_100102631434_100010339771 [0,2,0,0,0,0|2,0,0]=4 8403 B15R1.5822 CN(C)COC(=O)c1ccc(cc1Cl)Cl 2230a_100102631434_100010978946 [0,2,0,0,0,0|1,0,0]=3 8404 B15R1.5822 CN(C)COC(=O)c1ccc(cc1Cl)Cl 269982a_100102631434_100010978946 [0,2,0,0,0,0|1,0,0]=3 8405 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)Br 1458a_100000741311_100000210312 [0,2,0,0,0,0|1,0,0]=3 8406 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)Cl 1458a_100000688705_100000210312 [0,2,0,0,0,0|1,0,0]=3 8407 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)F 1458a_100000686989_100000210312 [0,2,0,0,0,0|1,0,0]=3 8408 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)I 1458a_100010189873_100000210312 [0,2,0,0,0,0|1,0,0]=3 8409 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)O 1458a_100000692822_100000210312 [0,2,0,0,0,0|1,0,0]=3 8410 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Br 1458a_100000741311_100012276601 [0,2,0,0,0,0|2,0,0]=4 8411 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Cl 1458a_100000688705_100012276601 [0,2,0,0,0,0|2,0,0]=4 8412 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)F 1458a_100000686989_100012276601 [0,2,0,0,0,0|2,0,0]=4 8413 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)I 1458a_100010189873_100012276601 [0,2,0,0,0,0|2,0,0]=4 8414 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)O 1458a_100000692822_100012276601 [0,2,0,0,0,0|2,0,0]=4 8415 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 11a_100000210953_100000741311 [0,2,0,0,0,0|1,0,0]=3 8416 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000741311 [0,2,0,0,0,0|1,0,0]=3 8417 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000741311 [0,2,0,0,0,0|1,0,0]=3 8418 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 527a_100000210953_100000741311 [0,2,0,0,0,0|1,0,0]=3 8419 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 11a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 8420 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 8421 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 8422 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 527a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 8423 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 11a_100000210953_100000686989 [0,2,0,0,0,0|1,0,0]=3 8424 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 1626a_100000210953_100000686989 [0,2,0,0,0,0|1,0,0]=3 8425 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 240690a_100000210953_100000686989 [0,2,0,0,0,0|1,0,0]=3 8426 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 527a_100000210953_100000686989 [0,2,0,0,0,0|1,0,0]=3 8427 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 11a_100000210953_100010189873 [0,2,0,0,0,0|1,0,0]=3 8428 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 1626a_100000210953_100010189873 [0,2,0,0,0,0|1,0,0]=3 8429 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 240690a_100000210953_100010189873 [0,2,0,0,0,0|1,0,0]=3 8430 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 527a_100000210953_100010189873 [0,2,0,0,0,0|1,0,0]=3 8431 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)O 240690a_100000210953_100000692822 [0,2,0,0,0,0|1,0,0]=3 8432 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)O 527a_100000210953_100000692822 [0,2,0,0,0,0|1,0,0]=3 8433 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 11a_100000210904_100000741311 [0,2,0,0,0,0|2,0,0]=4 8434 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000741311 [0,2,0,0,0,0|2,0,0]=4 8435 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 527a_100000210904_100000741311 [0,2,0,0,0,0|2,0,0]=4 8436 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 11a_100000210904_100000688705 [0,2,0,0,0,0|2,0,0]=4 8437 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000688705 [0,2,0,0,0,0|2,0,0]=4 8438 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 527a_100000210904_100000688705 [0,2,0,0,0,0|2,0,0]=4 8439 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 11a_100000210904_100000686989 [0,2,0,0,0,0|2,0,0]=4 8440 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 240690a_100000210904_100000686989 [0,2,0,0,0,0|2,0,0]=4 8441 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 527a_100000210904_100000686989 [0,2,0,0,0,0|2,0,0]=4 8442 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 11a_100000210904_100010189873 [0,2,0,0,0,0|2,0,0]=4 8443 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 240690a_100000210904_100010189873 [0,2,0,0,0,0|2,0,0]=4 8444 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 527a_100000210904_100010189873 [0,2,0,0,0,0|2,0,0]=4 8445 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)O 240690a_100000210904_100000692822 [0,2,0,0,0,0|2,0,0]=4 8446 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)O 527a_100000210904_100000692822 [0,2,0,0,0,0|2,0,0]=4 8447 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)Br 22a_100000741168_100000741311 [0,2,0,0,0,0|2,0,0]=4 8448 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)Cl 22a_100000741168_100000688705 [0,2,0,0,0,0|2,0,0]=4 8449 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)F 22a_100000741168_100000686989 [0,2,0,0,0,0|2,0,0]=4 8450 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)I 22a_100000741168_100010189873 [0,2,0,0,0,0|2,0,0]=4 8451 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)CCC(C)C 1458a_100000685072_100000210312 [0,2,0,0,0,0|1,0,0]=3 8452 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)CCC(C)O 1458a_100000685072_100012276601 [0,2,0,0,0,0|2,0,0]=4 8453 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 11a_100000210953_100000685072 [0,2,0,0,0,0|1,0,0]=3 8454 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 1626a_100000210953_100000685072 [0,2,0,0,0,0|1,0,0]=3 8455 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 240690a_100000210953_100000685072 [0,2,0,0,0,0|1,0,0]=3 8456 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 527a_100000210953_100000685072 [0,2,0,0,0,0|1,0,0]=3 8457 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)O 11a_100000210904_100000685072 [0,2,0,0,0,0|2,0,0]=4 8458 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)O 240690a_100000210904_100000685072 [0,2,0,0,0,0|2,0,0]=4 8459 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)O 527a_100000210904_100000685072 [0,2,0,0,0,0|2,0,0]=4 8460 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NNC(C)C 22a_100000741168_100000685072 [0,2,0,0,0,0|2,0,0]=4 8461 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CCC(C)C 1458a_100000211164_100000210312 [0,2,0,0,0,0|1,0,0]=3 8462 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CCC(C)O 1458a_100000211164_100012276601 [0,2,0,0,0,0|2,0,0]=4 8463 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CNC(C)C 2230a_100138425928_100000229959 [0,2,0,0,0,0|2,0,0]=4 8464 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CNC(C)C 34a_100138425928_100000229959 [0,2,0,0,0,0|2,0,0]=4 8465 B15R1.5822 Cc1ccc(c(c1)C)C(=O)COC(C)C 34a_100000212225_100000229959 [0,2,0,0,0,0|2,0,0]=4 8466 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CSC(C)C 62a_100000210206_100000229959 [0,2,0,0,0,0|2,0,0]=4 8467 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CSC(C)C 62a_100000229959_100000210206 [0,2,0,0,0,0|2,0,0]=4 8468 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 11a_100000210953_100000211164 [0,2,0,0,0,0|1,0,0]=3 8469 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 1626a_100000210953_100000211164 [0,2,0,0,0,0|1,0,0]=3 8470 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 240690a_100000210953_100000211164 [0,2,0,0,0,0|1,0,0]=3 8471 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 527a_100000210953_100000211164 [0,2,0,0,0,0|1,0,0]=3 8472 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 11a_100000210904_100000211164 [0,2,0,0,0,0|2,0,0]=4 8473 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 240690a_100000210904_100000211164 [0,2,0,0,0,0|2,0,0]=4 8474 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 527a_100000210904_100000211164 [0,2,0,0,0,0|2,0,0]=4 8475 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NNC(C)C 22a_100000741168_100000211164 [0,2,0,0,0,0|2,0,0]=4 8476 B15R1.5822 Cc1ccc(c(c1)C)C(C)OCC(C)C 34a_100000246504_100000210624 [0,2,0,0,0,0|1,0,1]=4 8477 B15R1.5822 Cc1ccc(c(c1)C)C(C)OCC(C)C 7a_100000246504_100000210760 [0,2,0,0,0,0|1,0,1]=4 8478 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)CCC(C)C 1458a_100000766932_100000210312 [0,2,0,0,0,0|1,0,0]=3 8479 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)CCC(C)O 1458a_100000766932_100012276601 [0,2,0,0,0,0|2,0,0]=4 8480 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 11a_100000210953_100000766932 [0,2,0,0,0,0|1,0,0]=3 8481 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 1626a_100000210953_100000766932 [0,2,0,0,0,0|1,0,0]=3 8482 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 240690a_100000210953_100000766932 [0,2,0,0,0,0|1,0,0]=3 8483 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 527a_100000210953_100000766932 [0,2,0,0,0,0|1,0,0]=3 8484 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)O 11a_100000210904_100000766932 [0,2,0,0,0,0|2,0,0]=4 8485 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)O 240690a_100000210904_100000766932 [0,2,0,0,0,0|2,0,0]=4 8486 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)O 527a_100000210904_100000766932 [0,2,0,0,0,0|2,0,0]=4 8487 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NNC(C)C 22a_100000741168_100000766932 [0,2,0,0,0,0|2,0,0]=4 8488 B15R1.5822 Cc1ccc(c(c1)F)C(=O)CCC(C)C 1458a_100000766033_100000210312 [0,2,0,0,0,0|1,0,0]=3 8489 B15R1.5822 Cc1ccc(c(c1)F)C(=O)CCC(C)O 1458a_100000766033_100012276601 [0,2,0,0,0,0|2,0,0]=4 8490 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 11a_100000210953_100000766033 [0,2,0,0,0,0|1,0,0]=3 8491 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 1626a_100000210953_100000766033 [0,2,0,0,0,0|1,0,0]=3 8492 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 240690a_100000210953_100000766033 [0,2,0,0,0,0|1,0,0]=3 8493 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 527a_100000210953_100000766033 [0,2,0,0,0,0|1,0,0]=3 8494 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)O 11a_100000210904_100000766033 [0,2,0,0,0,0|2,0,0]=4 8495 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)O 240690a_100000210904_100000766033 [0,2,0,0,0,0|2,0,0]=4 8496 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)O 527a_100000210904_100000766033 [0,2,0,0,0,0|2,0,0]=4 8497 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NNC(C)C 22a_100000741168_100000766033 [0,2,0,0,0,0|2,0,0]=4 8498 B15R1.5822 Cc1ccc(c(c1)I)C(=O)CCC(C)C 1458a_100009999607_100000210312 [0,2,0,0,0,0|1,0,0]=3 8499 B15R1.5822 Cc1ccc(c(c1)I)C(=O)CCC(C)O 1458a_100009999607_100012276601 [0,2,0,0,0,0|2,0,0]=4 8500 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 11a_100000210953_100009999607 [0,2,0,0,0,0|1,0,0]=3 8501 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 1626a_100000210953_100009999607 [0,2,0,0,0,0|1,0,0]=3 8502 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 240690a_100000210953_100009999607 [0,2,0,0,0,0|1,0,0]=3 8503 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 527a_100000210953_100009999607 [0,2,0,0,0,0|1,0,0]=3 8504 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)O 11a_100000210904_100009999607 [0,2,0,0,0,0|2,0,0]=4 8505 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)O 240690a_100000210904_100009999607 [0,2,0,0,0,0|2,0,0]=4 8506 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)O 527a_100000210904_100009999607 [0,2,0,0,0,0|2,0,0]=4 8507 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NNC(C)C 22a_100000741168_100009999607 [0,2,0,0,0,0|2,0,0]=4 8508 B15R1.5822 Cc1ccc(c(c1)O)C(=O)CCC(C)C 1458a_100000212137_100000210312 [0,2,0,0,0,0|1,0,0]=3 8509 B15R1.5822 Cc1ccc(c(c1)O)C(=O)CCC(C)O 1458a_100000212137_100012276601 [0,2,0,0,0,0|2,0,0]=4 8510 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 1626a_100000210953_100000212137 [0,2,0,0,0,0|1,0,0]=3 8511 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 240690a_100000210953_100000212137 [0,2,0,0,0,0|1,0,0]=3 8512 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 527a_100000210953_100000212137 [0,2,0,0,0,0|1,0,0]=3 8513 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)O 240690a_100000210904_100000212137 [0,2,0,0,0,0|2,0,0]=4 8514 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)O 527a_100000210904_100000212137 [0,2,0,0,0,0|2,0,0]=4 8515 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NNC(C)C 22a_100000741168_100000212137 [0,2,0,0,0,0|2,0,0]=4 8516 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000755188 [0,2,0,0,0,0|1,0,0]=3 8517 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000755188 [0,2,0,0,0,0|1,0,0]=3 8518 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000755188 [0,2,0,0,0,0|1,0,0]=3 8519 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000755188 [0,2,0,0,0,0|1,0,0]=3 8520 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000755188 [0,2,0,0,0,0|1,0,0]=3 8521 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000755188 [0,2,0,0,0,0|1,0,0]=3 8522 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 11a_100000743828_100000188424 [0,2,0,0,0,0|1,0,0]=3 8523 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 1626a_100000743828_100000188424 [0,2,0,0,0,0|1,0,0]=3 8524 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 240690a_100000743828_100000188424 [0,2,0,0,0,0|1,0,0]=3 8525 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 527a_100000743828_100000188424 [0,2,0,0,0,0|1,0,0]=3 8526 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 11a_100000743828_100000185844 [0,2,0,0,0,0|1,0,0]=3 8527 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 1626a_100000743828_100000185844 [0,2,0,0,0,0|1,0,0]=3 8528 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 240690a_100000743828_100000185844 [0,2,0,0,0,0|1,0,0]=3 8529 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 527a_100000743828_100000185844 [0,2,0,0,0,0|1,0,0]=3 8530 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 11a_100000743828_100000188656 [0,2,0,0,0,0|1,0,0]=3 8531 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 1626a_100000743828_100000188656 [0,2,0,0,0,0|1,0,0]=3 8532 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 240690a_100000743828_100000188656 [0,2,0,0,0,0|1,0,0]=3 8533 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 527a_100000743828_100000188656 [0,2,0,0,0,0|1,0,0]=3 8534 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 11a_100000743828_100000187884 [0,2,0,0,0,0|1,0,0]=3 8535 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 1626a_100000743828_100000187884 [0,2,0,0,0,0|1,0,0]=3 8536 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 240690a_100000743828_100000187884 [0,2,0,0,0,0|1,0,0]=3 8537 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 527a_100000743828_100000187884 [0,2,0,0,0,0|1,0,0]=3 8538 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1O 240690a_100000743828_100015234032 [0,2,0,0,0,0|1,0,0]=3 8539 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1[O-] 1626a_100000743828_100009911694 [0,2,0,0,0,0|1,0,0]=3 8540 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1[O-] 240690a_100000743828_100009911694 [0,2,0,0,0,0|1,0,0]=3 8541 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1[O-] 527a_100000743828_100009911694 [0,2,0,0,0,0|1,0,0]=3 8542 B15R1.8018 CC(C)(C)NNC(=O)c1ccccc1Br 22a_100000725372_100000188424 [0,2,0,0,0,0|2,0,0]=4 8543 B15R1.8018 CC(C)(C)NNC(=O)c1ccccc1Cl 22a_100000725372_100000185844 [0,2,0,0,0,0|2,0,0]=4 8544 B15R1.8018 CC(C)(C)NNC(=O)c1ccccc1F 22a_100000725372_100000188656 [0,2,0,0,0,0|2,0,0]=4 8545 B15R1.8018 CC(C)(C)NNC(=O)c1ccccc1I 22a_100000725372_100000187884 [0,2,0,0,0,0|2,0,0]=4 8546 B15R1.8018 CC(C)(C)NNC(=O)c1ccccc1O 22a_100000725372_100015234032 [0,2,0,0,0,0|2,0,0]=4 8547 B15R1.8018 CC(C)(C)NNC(=O)c1ccccc1[O-] 22a_100000725372_100009911694 [0,2,0,0,0,0|2,0,0]=4 8548 B15R1.8018 CC(C)(C)OCC(=O)c1ccccc1Br 34a_100015890283_100000199116 [0,2,0,0,0,0|2,0,0]=4 8549 B15R1.8018 CC(C)(C)OCC(=O)c1ccccc1Cl 34a_100015890283_100000211432 [0,2,0,0,0,0|2,0,0]=4 8550 B15R1.8018 CC(C)(C)OCC(=O)c1ccccc1F 34a_100015890283_100000204681 [0,2,0,0,0,0|2,0,0]=4 8551 B15R1.8018 CC(C)(C)OCC(=O)c1ccccc1F 7a_100015890283_100000204681 [0,2,0,0,0,0|2,0,0]=4 8552 B15R1.8018 CC(C)(C)OCC(=O)c1ccccc1O 7a_100015890283_100000188908 [0,2,0,0,0,0|2,0,0]=4 8553 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000211941 [0,2,0,0,0,0|2,0,0]=4 8554 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000211941 [0,2,0,0,0,0|2,0,0]=4 8555 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1Cl 62a_100000211941_100000211432 [0,2,0,0,0,0|2,0,0]=4 8556 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1F 62a_100000204681_100000211941 [0,2,0,0,0,0|2,0,0]=4 8557 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1F 62a_100000211941_100000204681 [0,2,0,0,0,0|2,0,0]=4 8558 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1O 62a_100000188908_100000211941 [0,2,0,0,0,0|2,0,0]=4 8559 B15R1.8018 CC(C)(C)SCC(=O)c1ccccc1O 62a_100000211941_100000188908 [0,2,0,0,0,0|2,0,0]=4 8560 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 11a_100020643315_100000188424 [0,2,0,0,0,0|1,0,0]=3 8561 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 1626a_100020643315_100000188424 [0,2,0,0,0,0|1,0,0]=3 8562 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 240690a_100020643315_100000188424 [0,2,0,0,0,0|1,0,0]=3 8563 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 527a_100020643315_100000188424 [0,2,0,0,0,0|1,0,0]=3 8564 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 11a_100020643315_100000185844 [0,2,0,0,0,0|1,0,0]=3 8565 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 1626a_100020643315_100000185844 [0,2,0,0,0,0|1,0,0]=3 8566 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 240690a_100020643315_100000185844 [0,2,0,0,0,0|1,0,0]=3 8567 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 527a_100020643315_100000185844 [0,2,0,0,0,0|1,0,0]=3 8568 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 11a_100020643315_100000188656 [0,2,0,0,0,0|1,0,0]=3 8569 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 1626a_100020643315_100000188656 [0,2,0,0,0,0|1,0,0]=3 8570 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 240690a_100020643315_100000188656 [0,2,0,0,0,0|1,0,0]=3 8571 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 527a_100020643315_100000188656 [0,2,0,0,0,0|1,0,0]=3 8572 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 11a_100020643315_100000187884 [0,2,0,0,0,0|1,0,0]=3 8573 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 1626a_100020643315_100000187884 [0,2,0,0,0,0|1,0,0]=3 8574 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 240690a_100020643315_100000187884 [0,2,0,0,0,0|1,0,0]=3 8575 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 527a_100020643315_100000187884 [0,2,0,0,0,0|1,0,0]=3 8576 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1O 240690a_100020643315_100015234032 [0,2,0,0,0,0|1,0,0]=3 8577 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1[O-] 1626a_100020643315_100009911694 [0,2,0,0,0,0|1,0,0]=3 8578 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1[O-] 240690a_100020643315_100009911694 [0,2,0,0,0,0|1,0,0]=3 8579 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1[O-] 527a_100020643315_100009911694 [0,2,0,0,0,0|1,0,0]=3 8580 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Br 1626a_100000751335_100000188424 [0,2,0,0,0,0|1,0,0]=3 8581 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Br 240690a_100000751335_100000188424 [0,2,0,0,0,0|1,0,0]=3 8582 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Br 527a_100000751335_100000188424 [0,2,0,0,0,0|1,0,0]=3 8583 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Cl 1626a_100000751335_100000185844 [0,2,0,0,0,0|1,0,0]=3 8584 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Cl 240690a_100000751335_100000185844 [0,2,0,0,0,0|1,0,0]=3 8585 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Cl 527a_100000751335_100000185844 [0,2,0,0,0,0|1,0,0]=3 8586 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1F 1626a_100000751335_100000188656 [0,2,0,0,0,0|1,0,0]=3 8587 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1F 240690a_100000751335_100000188656 [0,2,0,0,0,0|1,0,0]=3 8588 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1F 527a_100000751335_100000188656 [0,2,0,0,0,0|1,0,0]=3 8589 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1I 1626a_100000751335_100000187884 [0,2,0,0,0,0|1,0,0]=3 8590 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1I 240690a_100000751335_100000187884 [0,2,0,0,0,0|1,0,0]=3 8591 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1I 527a_100000751335_100000187884 [0,2,0,0,0,0|1,0,0]=3 8592 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1O 240690a_100000751335_100015234032 [0,2,0,0,0,0|1,0,0]=3 8593 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1[O-] 1626a_100000751335_100009911694 [0,2,0,0,0,0|1,0,0]=3 8594 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1[O-] 240690a_100000751335_100009911694 [0,2,0,0,0,0|1,0,0]=3 8595 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1[O-] 527a_100000751335_100009911694 [0,2,0,0,0,0|1,0,0]=3 8596 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Br 11a_100000731000_100000188424 [0,2,0,0,0,0|2,0,0]=4 8597 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Br 1626a_100000731000_100000188424 [0,2,0,0,0,0|2,0,0]=4 8598 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Br 240690a_100000731000_100000188424 [0,2,0,0,0,0|2,0,0]=4 8599 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Br 527a_100000731000_100000188424 [0,2,0,0,0,0|2,0,0]=4 8600 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Cl 11a_100000731000_100000185844 [0,2,0,0,0,0|2,0,0]=4 8601 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Cl 1626a_100000731000_100000185844 [0,2,0,0,0,0|2,0,0]=4 8602 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Cl 240690a_100000731000_100000185844 [0,2,0,0,0,0|2,0,0]=4 8603 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1Cl 527a_100000731000_100000185844 [0,2,0,0,0,0|2,0,0]=4 8604 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1F 11a_100000731000_100000188656 [0,2,0,0,0,0|2,0,0]=4 8605 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1F 1626a_100000731000_100000188656 [0,2,0,0,0,0|2,0,0]=4 8606 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1F 240690a_100000731000_100000188656 [0,2,0,0,0,0|2,0,0]=4 8607 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1F 527a_100000731000_100000188656 [0,2,0,0,0,0|2,0,0]=4 8608 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1I 11a_100000731000_100000187884 [0,2,0,0,0,0|2,0,0]=4 8609 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1I 1626a_100000731000_100000187884 [0,2,0,0,0,0|2,0,0]=4 8610 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1I 240690a_100000731000_100000187884 [0,2,0,0,0,0|2,0,0]=4 8611 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1I 527a_100000731000_100000187884 [0,2,0,0,0,0|2,0,0]=4 8612 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1O 240690a_100000731000_100015234032 [0,2,0,0,0,0|2,0,0]=4 8613 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1[O-] 1626a_100000731000_100009911694 [0,2,0,0,0,0|2,0,0]=4 8614 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1[O-] 240690a_100000731000_100009911694 [0,2,0,0,0,0|2,0,0]=4 8615 B15R1.8018 CC(F)(F)CNC(=O)c1ccccc1[O-] 527a_100000731000_100009911694 [0,2,0,0,0,0|2,0,0]=4 8616 B15R1.8018 CC(OCC(C)(C)C)c1ccccc1Br 34a_100000702211_100011219605 [0,2,0,0,0,0|1,0,1]=4 8617 B15R1.8018 CC(OCC(C)(C)C)c1ccccc1Cl 34a_100000740796_100011219605 [0,2,0,0,0,0|1,0,1]=4 8618 B15R1.8018 CC(OCC(C)(C)C)c1ccccc1F 34a_100000697922_100011219605 [0,2,0,0,0,0|1,0,1]=4 8619 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1Br 34a_100000702211_100011997219 [0,2,0,0,0,0|1,0,1]=4 8620 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1Cl 34a_100000740796_100011997219 [0,2,0,0,0,0|1,0,1]=4 8621 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1F 34a_100000697922_100011997219 [0,2,0,0,0,0|1,0,1]=4 8622 B15R1.8018 CC(OCC(C)(C)F)c1ccccc1F 34a_100000716592_200000741388 [0,2,0,0,0,0|1,0,1]=4 8623 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Br 34a_100000702211_100000764493 [0,2,0,0,0,0|1,0,1]=4 8624 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Br 7a_100000702211_100000764493 [0,2,0,0,0,0|1,0,1]=4 8625 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Cl 34a_100000740796_100000764493 [0,2,0,0,0,0|1,0,1]=4 8626 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1Cl 7a_100000740796_100000764493 [0,2,0,0,0,0|1,0,1]=4 8627 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1F 34a_100000697922_100000764493 [0,2,0,0,0,0|1,0,1]=4 8628 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1F 7a_100000697922_100000764493 [0,2,0,0,0,0|1,0,1]=4 8629 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1N 7a_100011405641_100000764493 [0,2,0,0,0,0|1,0,1]=4 8630 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000085578 [0,2,0,0,0,0|2,0,0]=4 8631 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000085578 [0,2,0,0,0,0|2,0,0]=4 8632 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000085578 [0,2,0,0,0,0|2,0,0]=4 8633 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000085578 [0,2,0,0,0,0|2,0,0]=4 8634 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000085578 [0,2,0,0,0,0|2,0,0]=4 8635 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000085578 [0,2,0,0,0,0|2,0,0]=4 8636 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1Br 1458a_100000188424_200000733723 [0,2,0,0,0,0|1,1,0]=4 8637 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_200000733723 [0,2,0,0,0,0|1,1,0]=4 8638 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1F 1458a_100000188656_200000733723 [0,2,0,0,0,0|1,1,0]=4 8639 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1I 1458a_100000187884_200000733723 [0,2,0,0,0,0|1,1,0]=4 8640 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_200000733723 [0,2,0,0,0,0|1,1,0]=4 8641 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_200000733723 [0,2,0,0,0,0|1,1,0]=4 8642 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Br 11a_102516607284_100000188424 [0,2,0,0,0,0|1,1,0]=4 8643 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Br 1626a_102516607284_100000188424 [0,2,0,0,0,0|1,1,0]=4 8644 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Br 240690a_102516607284_100000188424 [0,2,0,0,0,0|1,1,0]=4 8645 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Br 527a_102516607284_100000188424 [0,2,0,0,0,0|1,1,0]=4 8646 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Cl 11a_102516607284_100000185844 [0,2,0,0,0,0|1,1,0]=4 8647 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Cl 1626a_102516607284_100000185844 [0,2,0,0,0,0|1,1,0]=4 8648 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Cl 240690a_102516607284_100000185844 [0,2,0,0,0,0|1,1,0]=4 8649 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1Cl 527a_102516607284_100000185844 [0,2,0,0,0,0|1,1,0]=4 8650 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1F 11a_102516607284_100000188656 [0,2,0,0,0,0|1,1,0]=4 8651 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1F 1626a_102516607284_100000188656 [0,2,0,0,0,0|1,1,0]=4 8652 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1F 240690a_102516607284_100000188656 [0,2,0,0,0,0|1,1,0]=4 8653 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1F 527a_102516607284_100000188656 [0,2,0,0,0,0|1,1,0]=4 8654 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1I 11a_102516607284_100000187884 [0,2,0,0,0,0|1,1,0]=4 8655 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1I 1626a_102516607284_100000187884 [0,2,0,0,0,0|1,1,0]=4 8656 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1I 240690a_102516607284_100000187884 [0,2,0,0,0,0|1,1,0]=4 8657 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1I 527a_102516607284_100000187884 [0,2,0,0,0,0|1,1,0]=4 8658 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1O 240690a_102516607284_100015234032 [0,2,0,0,0,0|1,1,0]=4 8659 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1[O-] 1626a_102516607284_100009911694 [0,2,0,0,0,0|1,1,0]=4 8660 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1[O-] 240690a_102516607284_100009911694 [0,2,0,0,0,0|1,1,0]=4 8661 B15R1.8018 C[Si](C)(C)CNC(=O)c1ccccc1[O-] 527a_102516607284_100009911694 [0,2,0,0,0,0|1,1,0]=4 8662 B15R1.8018 Cc1ccccc1C(=O)CCC(C)(C)C 1458a_100000212026_100000755188 [0,2,0,0,0,0|1,0,0]=3 8663 B15R1.8018 Cc1ccccc1C(=O)CC[N+](C)(C)C 1458a_100000212026_100000085578 [0,2,0,0,0,0|2,0,0]=4 8664 B15R1.8018 Cc1ccccc1C(=O)CC[Si](C)(C)C 1458a_100000212026_200000733723 [0,2,0,0,0,0|1,1,0]=4 8665 B15R1.8018 Cc1ccccc1C(=O)CNC(C)(C)C 2230a_100000715429_100000741374 [0,2,0,0,0,0|2,0,0]=4 8666 B15R1.8018 Cc1ccccc1C(=O)COC(C)(C)C 34a_100015890283_100000741374 [0,2,0,0,0,0|2,0,0]=4 8667 B15R1.8018 Cc1ccccc1C(=O)COC(C)(C)C 7a_100015890283_100000741374 [0,2,0,0,0,0|2,0,0]=4 8668 B15R1.8018 Cc1ccccc1C(=O)CSC(C)(C)C 62a_100000211941_100000741374 [0,2,0,0,0,0|2,0,0]=4 8669 B15R1.8018 Cc1ccccc1C(=O)CSC(C)(C)C 62a_100000741374_100000211941 [0,2,0,0,0,0|2,0,0]=4 8670 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000212026 [0,2,0,0,0,0|1,0,0]=3 8671 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000212026 [0,2,0,0,0,0|1,0,0]=3 8672 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000212026 [0,2,0,0,0,0|1,0,0]=3 8673 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000212026 [0,2,0,0,0,0|1,0,0]=3 8674 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000212026 [0,2,0,0,0,0|1,0,0]=3 8675 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000212026 [0,2,0,0,0,0|1,0,0]=3 8676 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000212026 [0,2,0,0,0,0|1,0,0]=3 8677 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000212026 [0,2,0,0,0,0|1,0,0]=3 8678 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000212026 [0,2,0,0,0,0|1,0,0]=3 8679 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000212026 [0,2,0,0,0,0|1,0,0]=3 8680 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000212026 [0,2,0,0,0,0|1,0,0]=3 8681 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 11a_100000731000_100000212026 [0,2,0,0,0,0|2,0,0]=4 8682 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 1626a_100000731000_100000212026 [0,2,0,0,0,0|2,0,0]=4 8683 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 240690a_100000731000_100000212026 [0,2,0,0,0,0|2,0,0]=4 8684 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 527a_100000731000_100000212026 [0,2,0,0,0,0|2,0,0]=4 8685 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 11a_102516607284_100000212026 [0,2,0,0,0,0|1,1,0]=4 8686 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 1626a_102516607284_100000212026 [0,2,0,0,0,0|1,1,0]=4 8687 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 240690a_102516607284_100000212026 [0,2,0,0,0,0|1,1,0]=4 8688 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 527a_102516607284_100000212026 [0,2,0,0,0,0|1,1,0]=4 8689 B15R1.8018 Cc1ccccc1C(=O)NNC(C)(C)C 22a_100000725372_100000212026 [0,2,0,0,0,0|2,0,0]=4 8690 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)C 34a_100000742021_100011219605 [0,2,0,0,0,0|1,0,1]=4 8691 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)F 34a_100000742021_100011997219 [0,2,0,0,0,0|1,0,1]=4 8692 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)O 34a_100000742021_100000764493 [0,2,0,0,0,0|1,0,1]=4 8693 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)O 7a_100000742021_100000764493 [0,2,0,0,0,0|1,0,1]=4 8694 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1Br 270084a_100000210953_100000184729 [0,2,0,0,0,0|2,0,0]=4 8695 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1Br 274078a_100000210953_100000184729 [0,2,0,0,0,0|2,0,0]=4 8696 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1Br 40a_100000210953_100010380725 [0,2,0,0,0,0|2,0,0]=4 8697 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1Cl 270084a_100000210953_100000184199 [0,2,0,0,0,0|2,0,0]=4 8698 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1Cl 274078a_100000210953_100000184199 [0,2,0,0,0,0|2,0,0]=4 8699 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1F 270084a_100000210953_100000184916 [0,2,0,0,0,0|2,0,0]=4 8700 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1F 274078a_100000210953_100000184916 [0,2,0,0,0,0|2,0,0]=4 8701 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1I 270084a_100000210953_100011191325 [0,2,0,0,0,0|2,0,0]=4 8702 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1I 274078a_100000210953_100011191325 [0,2,0,0,0,0|2,0,0]=4 8703 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1N 40a_100000210953_100000703237 [0,2,0,0,0,0|2,0,0]=4 8704 B15R1.8020 CC(C)COC(C)(C)c1ccccc1Br 34a_100011346021_100000210624 [0,2,0,0,0,0|1,0,1]=4 8705 B15R1.8020 CC(C)COC(C)(C)c1ccccc1Br 7a_100011346021_100000210760 [0,2,0,0,0,0|1,0,1]=4 8706 B15R1.8020 CC(C)COC(C)(C)c1ccccc1Cl 34a_100000690508_100000210624 [0,2,0,0,0,0|1,0,1]=4 8707 B15R1.8020 CC(C)COC(C)(C)c1ccccc1Cl 7a_100000690508_100000210760 [0,2,0,0,0,0|1,0,1]=4 8708 B15R1.8020 CC(C)COC(C)(C)c1ccccc1F 34a_100011345963_100000210624 [0,2,0,0,0,0|1,0,1]=4 8709 B15R1.8020 CC(C)COC(C)(C)c1ccccc1F 7a_100011345963_100000210760 [0,2,0,0,0,0|1,0,1]=4 8710 B15R1.8020 CC(C)COC(C)(C)c1ccccc1I 34a_100010296449_100000210624 [0,2,0,0,0,0|1,0,1]=4 8711 B15R1.8020 CC(C)COC(C)(C)c1ccccc1I 7a_100010296449_100000210760 [0,2,0,0,0,0|1,0,1]=4 8712 B15R1.8020 CC(C)COC(C)(C)c1ccccc1N 7a_100000081495_100000210760 [0,2,0,0,0,0|1,0,1]=4 8713 B15R1.8020 CC(C)COC(F)(F)c1ccccc1F 34a_100000210257_100000070671 [0,2,0,0,0,0|1,0,1]=4 8714 B15R1.8020 Cc1ccccc1S(=O)(=O)NCC(C)C 270084a_100000210953_100000750907 [0,2,0,0,0,0|2,0,0]=4 8715 B15R1.8020 Cc1ccccc1S(=O)(=O)NCC(C)C 274078a_100000210953_100000750907 [0,2,0,0,0,0|2,0,0]=4 8716 B15R1.8020 Cc1ccccc1S(=O)(=O)NCC(C)C 40a_100000210953_100010269479 [0,2,0,0,0,0|2,0,0]=4 8717 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210312 [0,2,0,0,0,0|1,0,0]=3 8718 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210312 [0,2,0,0,0,0|1,0,0]=3 8719 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210312 [0,2,0,0,0,0|1,0,0]=3 8720 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210312 [0,2,0,0,0,0|1,0,0]=3 8721 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210312 [0,2,0,0,0,0|1,0,0]=3 8722 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210312 [0,2,0,0,0,0|1,0,0]=3 8723 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210312 [0,2,0,0,0,0|1,0,0]=3 8724 B15R1.8312 CC(C)CCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210312 [0,2,0,0,0,0|1,0,0]=3 8725 B15R1.8312 CC(C)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210312 [0,2,0,0,0,0|1,0,0]=3 8726 B15R1.8312 CC(C)CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210312 [0,2,0,0,0,0|1,0,0]=3 8727 B15R1.8312 CC(C)CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210312 [0,2,0,0,0,0|1,0,0]=3 8728 B15R1.8312 CC(C)CCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210312 [0,2,0,0,0,0|1,0,0]=3 8729 B15R1.8312 CC(C)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210312 [0,2,0,0,0,0|1,0,0]=3 8730 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 11a_100000210953_100000690891 [0,2,0,0,0,0|1,0,0]=3 8731 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 1626a_100000210953_100000690891 [0,2,0,0,0,0|1,0,0]=3 8732 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 240690a_100000210953_100000690891 [0,2,0,0,0,0|1,0,0]=3 8733 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 527a_100000210953_100000690891 [0,2,0,0,0,0|1,0,0]=3 8734 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 11a_100000210953_100011253703 [0,2,0,0,0,0|1,0,0]=3 8735 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 1626a_100000210953_100011253703 [0,2,0,0,0,0|1,0,0]=3 8736 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 240690a_100000210953_100011253703 [0,2,0,0,0,0|1,0,0]=3 8737 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 527a_100000210953_100011253703 [0,2,0,0,0,0|1,0,0]=3 8738 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 11a_100000210953_100000752694 [0,2,0,0,0,0|1,0,0]=3 8739 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 1626a_100000210953_100000752694 [0,2,0,0,0,0|1,0,0]=3 8740 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 240690a_100000210953_100000752694 [0,2,0,0,0,0|1,0,0]=3 8741 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 527a_100000210953_100000752694 [0,2,0,0,0,0|1,0,0]=3 8742 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)O 240690a_100000210953_100011935254 [0,2,0,0,0,0|1,0,0]=3 8743 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)O 527a_100000210953_100011935254 [0,2,0,0,0,0|1,0,0]=3 8744 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)Cl 11a_100000210953_100000210656 [0,2,0,0,0,0|1,0,0]=3 8745 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)Cl 1626a_100000210953_100000210656 [0,2,0,0,0,0|1,0,0]=3 8746 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)Cl 240690a_100000210953_100000210656 [0,2,0,0,0,0|1,0,0]=3 8747 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 11a_100000210953_100000210369 [0,2,0,0,0,0|1,0,0]=3 8748 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 1626a_100000210953_100000210369 [0,2,0,0,0,0|1,0,0]=3 8749 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 240690a_100000210953_100000210369 [0,2,0,0,0,0|1,0,0]=3 8750 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 527a_100000210953_100000210369 [0,2,0,0,0,0|1,0,0]=3 8751 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)O 240690a_100000210953_100000745519 [0,2,0,0,0,0|1,0,0]=3 8752 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)O 527a_100000210953_100000745519 [0,2,0,0,0,0|1,0,0]=3 8753 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 11a_100000210953_100000210804 [0,2,0,0,0,0|1,0,0]=3 8754 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 1626a_100000210953_100000210804 [0,2,0,0,0,0|1,0,0]=3 8755 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 240690a_100000210953_100000210804 [0,2,0,0,0,0|1,0,0]=3 8756 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 527a_100000210953_100000210804 [0,2,0,0,0,0|1,0,0]=3 8757 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)O 527a_100000210953_100000763259 [0,2,0,0,0,0|1,0,0]=3 8758 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 11a_100000210953_100010232521 [0,2,0,0,0,0|1,0,0]=3 8759 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 1626a_100000210953_100010232521 [0,2,0,0,0,0|1,0,0]=3 8760 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 240690a_100000210953_100010232521 [0,2,0,0,0,0|1,0,0]=3 8761 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 527a_100000210953_100010232521 [0,2,0,0,0,0|1,0,0]=3 8762 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 11a_100000210953_100000702859 [0,2,0,0,0,0|1,0,0]=3 8763 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 1626a_100000210953_100000702859 [0,2,0,0,0,0|1,0,0]=3 8764 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 240690a_100000210953_100000702859 [0,2,0,0,0,0|1,0,0]=3 8765 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 527a_100000210953_100000702859 [0,2,0,0,0,0|1,0,0]=3 8766 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)F 11a_100000210953_100000023732 [0,2,0,0,0,0|1,0,0]=3 8767 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)F 1626a_100000210953_100000023732 [0,2,0,0,0,0|1,0,0]=3 8768 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)F 240690a_100000210953_100000023732 [0,2,0,0,0,0|1,0,0]=3 8769 B15R1.8312 CC(C)CNC(=O)c1c(cccc1O)O 527a_100000210953_100000755285 [0,2,0,0,0,0|1,0,0]=3 8770 B15R1.8312 CC(C)COC(C)c1c(cccc1Br)F 34a_100013085324_100000210624 [0,2,0,0,0,0|1,0,1]=4 8771 B15R1.8312 CC(C)COC(C)c1c(cccc1Br)F 7a_100013085324_100000210760 [0,2,0,0,0,0|1,0,1]=4 8772 B15R1.8312 CC(C)COC(C)c1c(cccc1Cl)Cl 34a_100011215154_100000210624 [0,2,0,0,0,0|1,0,1]=4 8773 B15R1.8312 CC(C)COC(C)c1c(cccc1Cl)Cl 7a_100011215154_100000210760 [0,2,0,0,0,0|1,0,1]=4 8774 B15R1.8312 CC(C)COC(C)c1c(cccc1F)F 34a_100000742607_100000210624 [0,2,0,0,0,0|1,0,1]=4 8775 B15R1.8312 CC(C)COC(C)c1c(cccc1F)F 7a_100000742607_100000210760 [0,2,0,0,0,0|1,0,1]=4 8776 B15R1.8312 CC(C)CO[C@H](C)c1c(cccc1Cl)F 34a_200012136785_100000210624 [0,2,0,0,0,0|1,0,1]=4 8777 B15R1.8312 CC(C)CO[C@H](C)c1c(cccc1Cl)F 7a_200012136785_100000210760 [0,2,0,0,0,0|1,0,1]=4 8778 B15R1.8312 CC(C)NCC(=O)c1c(cccc1Cl)Cl 2230a_100138425928_100012340516 [0,2,0,0,0,0|2,0,0]=4 8779 B15R1.8312 CC(C)NCC(=O)c1c(cccc1Cl)Cl 34a_100138425928_100012340516 [0,2,0,0,0,0|2,0,0]=4 8780 B15R1.8312 CC(C)NCC(=O)c1c(cccc1Cl)F 2230a_100138425928_100011219195 [0,2,0,0,0,0|2,0,0]=4 8781 B15R1.8312 CC(C)NCC(=O)c1c(cccc1Cl)F 34a_100138425928_100011219195 [0,2,0,0,0,0|2,0,0]=4 8782 B15R1.8312 CC(C)NCC(=O)c1c(cccc1F)F 34a_100138425928_100000199083 [0,2,0,0,0,0|2,0,0]=4 8783 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Br)Br 22a_100000741168_100000690891 [0,2,0,0,0,0|2,0,0]=4 8784 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Br)Cl 22a_100000741168_100011253703 [0,2,0,0,0,0|2,0,0]=4 8785 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Br)F 22a_100000741168_100000752694 [0,2,0,0,0,0|2,0,0]=4 8786 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Br)O 22a_100000741168_100011935254 [0,2,0,0,0,0|2,0,0]=4 8787 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Cl)Cl 22a_100000741168_100000210656 [0,2,0,0,0,0|2,0,0]=4 8788 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Cl)F 22a_100000741168_100000210369 [0,2,0,0,0,0|2,0,0]=4 8789 B15R1.8312 CC(C)NNC(=O)c1c(cccc1Cl)O 22a_100000741168_100000745519 [0,2,0,0,0,0|2,0,0]=4 8790 B15R1.8312 CC(C)NNC(=O)c1c(cccc1F)F 22a_100000741168_100000210804 [0,2,0,0,0,0|2,0,0]=4 8791 B15R1.8312 CC(C)NNC(=O)c1c(cccc1F)O 22a_100000741168_100000763259 [0,2,0,0,0,0|2,0,0]=4 8792 B15R1.8312 CC(C)NNC(=O)c1c(cccc1I)Br 22a_100000741168_100010232521 [0,2,0,0,0,0|2,0,0]=4 8793 B15R1.8312 CC(C)NNC(=O)c1c(cccc1I)Cl 22a_100000741168_100000702859 [0,2,0,0,0,0|2,0,0]=4 8794 B15R1.8312 CC(C)NNC(=O)c1c(cccc1I)F 22a_100000741168_100000023732 [0,2,0,0,0,0|2,0,0]=4 8795 B15R1.8312 CC(C)OCC(=O)c1c(cccc1Cl)Cl 34a_100000212225_100012340516 [0,2,0,0,0,0|2,0,0]=4 8796 B15R1.8312 CC(C)OCC(=O)c1c(cccc1Cl)F 34a_100000212225_100011219195 [0,2,0,0,0,0|2,0,0]=4 8797 B15R1.8312 CC(C)OCC(=O)c1c(cccc1F)F 34a_100000212225_100000199083 [0,2,0,0,0,0|2,0,0]=4 8798 B15R1.8312 CC(C)SCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100000210206 [0,2,0,0,0,0|2,0,0]=4 8799 B15R1.8312 CC(C)SCC(=O)c1c(cccc1Cl)F 62a_100000210206_100011219195 [0,2,0,0,0,0|2,0,0]=4 8800 B15R1.8312 CC(C)SCC(=O)c1c(cccc1Cl)F 62a_100011219195_100000210206 [0,2,0,0,0,0|2,0,0]=4 8801 B15R1.8312 CC(C)SCC(=O)c1c(cccc1F)F 62a_100000199083_100000210206 [0,2,0,0,0,0|2,0,0]=4 8802 B15R1.8312 CC(C)SCC(=O)c1c(cccc1F)F 62a_100000210206_100000199083 [0,2,0,0,0,0|2,0,0]=4 8803 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100012276601 [0,2,0,0,0,0|2,0,0]=4 8804 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100012276601 [0,2,0,0,0,0|2,0,0]=4 8805 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100012276601 [0,2,0,0,0,0|2,0,0]=4 8806 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100012276601 [0,2,0,0,0,0|2,0,0]=4 8807 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100012276601 [0,2,0,0,0,0|2,0,0]=4 8808 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100012276601 [0,2,0,0,0,0|2,0,0]=4 8809 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100012276601 [0,2,0,0,0,0|2,0,0]=4 8810 B15R1.8312 CC(O)CCC(=O)c1c(cccc1F)F 1458a_100000210804_100012276601 [0,2,0,0,0,0|2,0,0]=4 8811 B15R1.8312 CC(O)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100012276601 [0,2,0,0,0,0|2,0,0]=4 8812 B15R1.8312 CC(O)CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100012276601 [0,2,0,0,0,0|2,0,0]=4 8813 B15R1.8312 CC(O)CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100012276601 [0,2,0,0,0,0|2,0,0]=4 8814 B15R1.8312 CC(O)CCC(=O)c1c(cccc1I)F 1458a_100000023732_100012276601 [0,2,0,0,0,0|2,0,0]=4 8815 B15R1.8312 CC(O)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100012276601 [0,2,0,0,0,0|2,0,0]=4 8816 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)Br 11a_100000210904_100000690891 [0,2,0,0,0,0|2,0,0]=4 8817 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)Br 240690a_100000210904_100000690891 [0,2,0,0,0,0|2,0,0]=4 8818 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)Br 527a_100000210904_100000690891 [0,2,0,0,0,0|2,0,0]=4 8819 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)Cl 11a_100000210904_100011253703 [0,2,0,0,0,0|2,0,0]=4 8820 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)Cl 240690a_100000210904_100011253703 [0,2,0,0,0,0|2,0,0]=4 8821 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)Cl 527a_100000210904_100011253703 [0,2,0,0,0,0|2,0,0]=4 8822 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)F 11a_100000210904_100000752694 [0,2,0,0,0,0|2,0,0]=4 8823 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)F 240690a_100000210904_100000752694 [0,2,0,0,0,0|2,0,0]=4 8824 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)F 527a_100000210904_100000752694 [0,2,0,0,0,0|2,0,0]=4 8825 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)O 240690a_100000210904_100011935254 [0,2,0,0,0,0|2,0,0]=4 8826 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)O 527a_100000210904_100011935254 [0,2,0,0,0,0|2,0,0]=4 8827 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)Cl 11a_100000210904_100000210656 [0,2,0,0,0,0|2,0,0]=4 8828 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)Cl 240690a_100000210904_100000210656 [0,2,0,0,0,0|2,0,0]=4 8829 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)F 11a_100000210904_100000210369 [0,2,0,0,0,0|2,0,0]=4 8830 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)F 240690a_100000210904_100000210369 [0,2,0,0,0,0|2,0,0]=4 8831 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)F 527a_100000210904_100000210369 [0,2,0,0,0,0|2,0,0]=4 8832 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)O 240690a_100000210904_100000745519 [0,2,0,0,0,0|2,0,0]=4 8833 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)O 527a_100000210904_100000745519 [0,2,0,0,0,0|2,0,0]=4 8834 B15R1.8312 CC(O)CNC(=O)c1c(cccc1F)F 11a_100000210904_100000210804 [0,2,0,0,0,0|2,0,0]=4 8835 B15R1.8312 CC(O)CNC(=O)c1c(cccc1F)F 240690a_100000210904_100000210804 [0,2,0,0,0,0|2,0,0]=4 8836 B15R1.8312 CC(O)CNC(=O)c1c(cccc1F)F 527a_100000210904_100000210804 [0,2,0,0,0,0|2,0,0]=4 8837 B15R1.8312 CC(O)CNC(=O)c1c(cccc1F)O 527a_100000210904_100000763259 [0,2,0,0,0,0|2,0,0]=4 8838 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)Br 11a_100000210904_100010232521 [0,2,0,0,0,0|2,0,0]=4 8839 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)Br 240690a_100000210904_100010232521 [0,2,0,0,0,0|2,0,0]=4 8840 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)Br 527a_100000210904_100010232521 [0,2,0,0,0,0|2,0,0]=4 8841 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)Cl 11a_100000210904_100000702859 [0,2,0,0,0,0|2,0,0]=4 8842 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)Cl 240690a_100000210904_100000702859 [0,2,0,0,0,0|2,0,0]=4 8843 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)Cl 527a_100000210904_100000702859 [0,2,0,0,0,0|2,0,0]=4 8844 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)F 11a_100000210904_100000023732 [0,2,0,0,0,0|2,0,0]=4 8845 B15R1.8312 CC(O)CNC(=O)c1c(cccc1I)F 240690a_100000210904_100000023732 [0,2,0,0,0,0|2,0,0]=4 8846 B15R1.8312 CC(O)CNC(=O)c1c(cccc1O)O 527a_100000210904_100000755285 [0,2,0,0,0,0|2,0,0]=4 8847 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)Br 1458a_100000701904_100000210312 [0,2,0,0,0,0|1,0,0]=3 8848 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)C 1458a_100000758298_100000210312 [0,2,0,0,0,0|1,0,0]=3 8849 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)Cl 1458a_100000692601_100000210312 [0,2,0,0,0,0|1,0,0]=3 8850 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)F 1458a_100000762013_100000210312 [0,2,0,0,0,0|1,0,0]=3 8851 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)I 1458a_100000688020_100000210312 [0,2,0,0,0,0|1,0,0]=3 8852 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)O 1458a_100011934116_100000210312 [0,2,0,0,0,0|1,0,0]=3 8853 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)Br 1458a_100000701904_100012276601 [0,2,0,0,0,0|2,0,0]=4 8854 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)C 1458a_100000758298_100012276601 [0,2,0,0,0,0|2,0,0]=4 8855 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)Cl 1458a_100000692601_100012276601 [0,2,0,0,0,0|2,0,0]=4 8856 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)F 1458a_100000762013_100012276601 [0,2,0,0,0,0|2,0,0]=4 8857 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)I 1458a_100000688020_100012276601 [0,2,0,0,0,0|2,0,0]=4 8858 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)O 1458a_100011934116_100012276601 [0,2,0,0,0,0|2,0,0]=4 8859 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 11a_100000210953_100000701904 [0,2,0,0,0,0|1,0,0]=3 8860 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 1626a_100000210953_100000701904 [0,2,0,0,0,0|1,0,0]=3 8861 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 240690a_100000210953_100000701904 [0,2,0,0,0,0|1,0,0]=3 8862 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 527a_100000210953_100000701904 [0,2,0,0,0,0|1,0,0]=3 8863 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 11a_100000210953_100000758298 [0,2,0,0,0,0|1,0,0]=3 8864 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 1626a_100000210953_100000758298 [0,2,0,0,0,0|1,0,0]=3 8865 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 240690a_100000210953_100000758298 [0,2,0,0,0,0|1,0,0]=3 8866 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Cl 11a_100000210953_100000692601 [0,2,0,0,0,0|1,0,0]=3 8867 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Cl 1626a_100000210953_100000692601 [0,2,0,0,0,0|1,0,0]=3 8868 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Cl 240690a_100000210953_100000692601 [0,2,0,0,0,0|1,0,0]=3 8869 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 11a_100000210953_100000762013 [0,2,0,0,0,0|1,0,0]=3 8870 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 1626a_100000210953_100000762013 [0,2,0,0,0,0|1,0,0]=3 8871 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 240690a_100000210953_100000762013 [0,2,0,0,0,0|1,0,0]=3 8872 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 527a_100000210953_100000762013 [0,2,0,0,0,0|1,0,0]=3 8873 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)I 11a_100000210953_100000688020 [0,2,0,0,0,0|1,0,0]=3 8874 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)I 1626a_100000210953_100000688020 [0,2,0,0,0,0|1,0,0]=3 8875 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)I 240690a_100000210953_100000688020 [0,2,0,0,0,0|1,0,0]=3 8876 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Br 11a_100000210904_100000701904 [0,2,0,0,0,0|2,0,0]=4 8877 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Br 240690a_100000210904_100000701904 [0,2,0,0,0,0|2,0,0]=4 8878 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Br 527a_100000210904_100000701904 [0,2,0,0,0,0|2,0,0]=4 8879 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)C 11a_100000210904_100000758298 [0,2,0,0,0,0|2,0,0]=4 8880 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)C 240690a_100000210904_100000758298 [0,2,0,0,0,0|2,0,0]=4 8881 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Cl 11a_100000210904_100000692601 [0,2,0,0,0,0|2,0,0]=4 8882 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Cl 240690a_100000210904_100000692601 [0,2,0,0,0,0|2,0,0]=4 8883 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)F 11a_100000210904_100000762013 [0,2,0,0,0,0|2,0,0]=4 8884 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)F 240690a_100000210904_100000762013 [0,2,0,0,0,0|2,0,0]=4 8885 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)F 527a_100000210904_100000762013 [0,2,0,0,0,0|2,0,0]=4 8886 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)I 11a_100000210904_100000688020 [0,2,0,0,0,0|2,0,0]=4 8887 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)I 240690a_100000210904_100000688020 [0,2,0,0,0,0|2,0,0]=4 8888 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)Br 22a_100000741168_100000701904 [0,2,0,0,0,0|2,0,0]=4 8889 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)C 22a_100000741168_100000758298 [0,2,0,0,0,0|2,0,0]=4 8890 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)Cl 22a_100000741168_100000692601 [0,2,0,0,0,0|2,0,0]=4 8891 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)F 22a_100000741168_100000762013 [0,2,0,0,0,0|2,0,0]=4 8892 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)I 22a_100000741168_100000688020 [0,2,0,0,0,0|2,0,0]=4 8893 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)O 22a_100000741168_100011934116 [0,2,0,0,0,0|2,0,0]=4 8894 B15R1.8312 Cc1cccc(c1C(C)OCC(C)C)C 34a_200000695261_100000210624 [0,2,0,0,0,0|1,0,1]=4 8895 B15R1.8312 Cc1cccc(c1C(C)OCC(C)C)C 7a_200000695261_100000210760 [0,2,0,0,0,0|1,0,1]=4 8896 B15R1.10019 CC(C)COC(C#N)c1ccccc1Cl 7a_200011294979_100000210760 [0,2,0,0,0,0|1,0,1]=4 8897 B15R1.10019 CC(C)COC(CN)c1ccccc1Br 34a_100011236429_100000210624 [0,2,0,0,0,0|1,0,1]=4 8898 B15R1.10019 CC(C)COC(CN)c1ccccc1Cl 34a_200000759403_100000210624 [0,2,0,0,0,0|1,0,1]=4 8899 B15R1.10019 CCC(OCC(C)C)c1ccccc1F 34a_200011689290_100000210624 [0,2,0,0,0,0|1,0,1]=4 8900 B15R1.10019 CCC(OCC(C)C)c1ccccc1F 7a_200011689290_100000210760 [0,2,0,0,0,0|1,0,1]=4 8901 B15R1.89 C#CCC(=O)COC(=O)c1ccccc1 1458a_100011220946_100000073877 [0,2,0,0,0,0|1,0,1]=4 8902 B15R1.89 C#CCC(C)OCC(=O)c1ccccc1 7a_100000685586_100000211460 [0,2,0,0,0,0|2,0,0]=4 8903 B15R1.89 C#CCN(C)CCC(=O)c1ccccc1 2230a_100000225692_100000750707 [0,2,0,0,0,0|2,0,0]=4 8904 B15R1.89 C=CCC(=O)COC(=O)c1ccccc1 1458a_100000210193_100000073877 [0,2,0,0,0,0|1,0,1]=4 8905 B15R1.89 C=CCC(C)COC(C)c1ccccc1 34a_100009832082_100000211855 [0,2,0,0,0,0|1,0,1]=4 8906 B15R1.89 C=CCC(C)COC(C)c1ccccc1 7a_100009832082_100000230085 [0,2,0,0,0,0|1,0,1]=4 8907 B15R1.89 C=CCN(C)CCC(=O)c1ccccc1 2230a_100000225617_100000750707 [0,2,0,0,0,0|2,0,0]=4 8908 B15R1.89 C=CCN(C)CCC(=O)c1ccccc1 269982a_100000225617_100000750707 [0,2,0,0,0,0|2,0,0]=4 8909 B15R1.89 C=CCN(C)COC(=O)c1ccccc1 269982a_100000225617_100000073877 [0,2,0,0,0,0|1,0,0]=3 8910 B15R1.89 C=CC[C@@H](C)OCC(=O)c1ccccc1 7a_100000731007_100000211460 [0,2,0,0,0,0|2,0,0]=4 8911 B15R1.89 CC#CC(=O)COC(=O)c1ccccc1 1458a_100000763181_100000073877 [0,2,0,0,0,0|1,0,1]=4 8912 B15R1.89 CC(CC#N)SCC(=O)c1ccccc1 62a_100000211460_100009813641 [0,2,0,0,0,0|2,0,0]=4 8913 B15R1.89 CC(CC#N)SCC(=O)c1ccccc1 62a_100009813641_100000211460 [0,2,0,0,0,0|2,0,0]=4 8914 B15R1.89 CC(CCC(=O)c1ccccc1)OCF 7a_200012571355_100015361967 [0,2,0,0,0,0|1,0,0]=3 8915 B15R1.89 CC(CCN)COC(C)c1ccccc1 34a_106354213184_100000211855 [0,2,0,0,0,0|1,0,1]=4 8916 B15R1.89 CC(CCO)SCC(=O)c1ccccc1 62a_100000211460_100009893172 [0,2,0,0,0,0|2,0,0]=4 8917 B15R1.89 CC(CCO)SCC(=O)c1ccccc1 62a_100009893172_100000211460 [0,2,0,0,0,0|2,0,0]=4 8918 B15R1.89 CC=CC(=O)COC(=O)c1ccccc1 1458a_100000210699_100000073877 [0,2,0,0,0,0|1,0,1]=4 8919 B15R1.89 CCCC(=O)COC(=O)c1ccccc1 1458a_100000211992_100000073877 [0,2,0,0,0,0|1,0,1]=4 8920 B15R1.89 CCCC(C)COC(C)c1ccccc1 34a_100000688023_100000211855 [0,2,0,0,0,0|1,0,1]=4 8921 B15R1.89 CCCC(C)COC(C)c1ccccc1 7a_100000688023_100000230085 [0,2,0,0,0,0|1,0,1]=4 8922 B15R1.89 CCCC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100011216630 [0,2,0,0,0,0|1,0,1]=4 8923 B15R1.89 CCCC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100011216630 [0,2,0,0,0,0|1,0,1]=4 8924 B15R1.89 CCCC(C)OCC(=O)c1ccccc1 7a_100000764384_100000211460 [0,2,0,0,0,0|2,0,0]=4 8925 B15R1.89 CCCC(C)SCC(=O)c1ccccc1 62a_100000211460_100000766640 [0,2,0,0,0,0|2,0,0]=4 8926 B15R1.89 CCCC(C)SCC(=O)c1ccccc1 62a_100000766640_100000211460 [0,2,0,0,0,0|2,0,0]=4 8927 B15R1.89 CCCN(C)CCC(=O)c1ccccc1 2230a_100000747261_100000750707 [0,2,0,0,0,0|2,0,0]=4 8928 B15R1.89 CCCN(C)CCC(=O)c1ccccc1 269982a_100000747261_100000750707 [0,2,0,0,0,0|2,0,0]=4 8929 B15R1.89 CCCN(C)COC(=O)c1ccccc1 269982a_100000747261_100000073877 [0,2,0,0,0,0|1,0,0]=3 8930 B15R1.89 CCNC(C)COC(=O)c1ccccc1 270004a_100015525214_100000000904 [0,2,0,0,0,0|0,0,0]=2 8931 B15R1.89 CCOC(C)CCC(=O)c1ccccc1 7a_200012571355_100000210202 [0,2,0,0,0,0|1,0,0]=3 8932 B15R1.89 CN(CC#N)CCC(=O)c1ccccc1 2230a_100000748184_100000750707 [0,2,0,0,0,0|2,0,0]=4 8933 B15R1.89 CN(CCO)CCC(=O)c1ccccc1 2230a_100000210263_100000750707 [0,2,0,0,0,0|2,0,0]=4 8934 B15R1.89 CN(CCO)CCC(=O)c1ccccc1 269982a_100000210263_100000750707 [0,2,0,0,0,0|2,0,0]=4 8935 B15R1.89 CN(CCO)COC(=O)c1ccccc1 269982a_100000210263_100000073877 [0,2,0,0,0,0|1,0,0]=3 8936 B15R1.89 COCC(=O)COC(=O)c1ccccc1 1458a_100000210968_100000073877 [0,2,0,0,0,0|1,0,1]=4 8937 B15R1.89 COCC(C)SCC(=O)c1ccccc1 62a_100000211460_100000765312 [0,2,0,0,0,0|2,0,0]=4 8938 B15R1.89 COCC(C)SCC(=O)c1ccccc1 62a_100000765312_100000211460 [0,2,0,0,0,0|2,0,0]=4 8939 B15R1.89 COCC(O)CNC(=O)c1ccccc1 240690a_100000756049_100000185807 [0,2,0,0,0,0|2,0,0]=4 8940 B15R1.89 COCC(O)CNC(=O)c1ccccc1 527a_100000756049_100000185807 [0,2,0,0,0,0|2,0,0]=4 8941 B15R1.89 CSCC(=O)COC(=O)c1ccccc1 1458a_100000184570_100000073877 [0,2,0,0,0,0|1,0,1]=4 8942 B15R1.89 N#CCC(=O)COC(=O)c1ccccc1 1458a_100051588842_100000073877 [0,2,0,0,0,0|1,0,1]=4 8943 B15R1.89 O=C(CCO)COC(=O)c1ccccc1 1458a_100011216618_100000073877 [0,2,0,0,0,0|1,0,1]=4 8944 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)Br 34a_100016041109_100000188085 [0,2,0,0,0,0|2,0,0]=4 8945 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)Br 7a_100016041109_100000188085 [0,2,0,0,0,0|2,0,0]=4 8946 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)Cl 7a_100016041109_100000211071 [0,2,0,0,0,0|2,0,0]=4 8947 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)F 7a_100016041109_100000211279 [0,2,0,0,0,0|2,0,0]=4 8948 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)I 34a_100016041109_100011216261 [0,2,0,0,0,0|2,0,0]=4 8949 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)I 7a_100016041109_100011216261 [0,2,0,0,0,0|2,0,0]=4 8950 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)O 34a_100016041109_100009814261 [0,2,0,0,0,0|2,0,0]=4 8951 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)O 7a_100016041109_100000018856 [0,2,0,0,0,0|2,0,0]=4 8952 B15R1.132 CC(CN)COC(C)c1ccc(cc1)Br 34a_100000744482_100000755118 [0,2,0,0,0,0|1,0,1]=4 8953 B15R1.132 CC(CN)COC(C)c1ccc(cc1)F 34a_100000744482_100000743420 [0,2,0,0,0,0|1,0,1]=4 8954 B15R1.132 CC(CN)OCC(=O)c1ccc(cc1)Br 34a_100000210904_100000188085 [0,2,0,0,0,0|2,0,0]=4 8955 B15R1.132 CC(CN)OCC(=O)c1ccc(cc1)I 34a_100000210904_100011216261 [0,2,0,0,0,0|2,0,0]=4 8956 B15R1.132 CC(CN)OCC(=O)c1ccc(cc1)O 34a_100000210904_100009814261 [0,2,0,0,0,0|2,0,0]=4 8957 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Br 240690a_100000744482_100000185839 [0,2,0,0,0,0|1,0,0]=3 8958 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Br 527a_100000744482_100000185839 [0,2,0,0,0,0|1,0,0]=3 8959 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Cl 240690a_100000744482_100000210187 [0,2,0,0,0,0|1,0,0]=3 8960 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Cl 527a_100000744482_100000210187 [0,2,0,0,0,0|1,0,0]=3 8961 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)F 240690a_100000744482_100000187176 [0,2,0,0,0,0|1,0,0]=3 8962 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)F 527a_100000744482_100000187176 [0,2,0,0,0,0|1,0,0]=3 8963 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)I 240690a_100000744482_100000187904 [0,2,0,0,0,0|1,0,0]=3 8964 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)I 527a_100000744482_100000187904 [0,2,0,0,0,0|1,0,0]=3 8965 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)O 240690a_100000744482_100000212099 [0,2,0,0,0,0|1,0,0]=3 8966 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)O 527a_100000744482_100000212099 [0,2,0,0,0,0|1,0,0]=3 8967 B15R1.132 CC(CO)OCC(=O)c1ccc(cc1)F 34a_100000246311_100012180447 [0,2,0,0,0,0|2,0,0]=4 8968 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)Cl 62a_100012180447_100000211071 [0,2,0,0,0,0|2,0,0]=4 8969 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)F 62a_100012180447_100000211279 [0,2,0,0,0,0|2,0,0]=4 8970 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)I 62a_100012180447_100011216261 [0,2,0,0,0,0|2,0,0]=4 8971 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)O 62a_100012180447_100009814261 [0,2,0,0,0,0|2,0,0]=4 8972 B15R1.132 CC(OC[C@@H](C)CO)c1ccc(cc1)Br 34a_100000745893_100000059175 [0,2,0,0,0,0|1,0,1]=4 8973 B15R1.132 CC(OC[C@@H](C)CO)c1ccc(cc1)Br 7a_100000745893_100000059175 [0,2,0,0,0,0|1,0,1]=4 8974 B15R1.132 CC(OC[C@@H](C)CO)c1ccc(cc1)F 34a_100000181323_100000059175 [0,2,0,0,0,0|1,0,1]=4 8975 B15R1.132 CC(OC[C@@H](C)CO)c1ccc(cc1)F 7a_100000181323_100000059175 [0,2,0,0,0,0|1,0,1]=4 8976 B15R1.132 CC(OC[C@@H](C)CO)c1ccc(cc1)N 34a_100011216399_100000059175 [0,2,0,0,0,0|1,0,1]=4 8977 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 11a_100020588543_100000185839 [0,2,0,0,0,0|1,0,0]=3 8978 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 1626a_100020588543_100000185839 [0,2,0,0,0,0|1,0,0]=3 8979 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 240690a_100020588543_100000185839 [0,2,0,0,0,0|1,0,0]=3 8980 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 527a_100020588543_100000185839 [0,2,0,0,0,0|1,0,0]=3 8981 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 11a_100020588543_100000188618 [0,2,0,0,0,0|1,0,0]=3 8982 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 1626a_100020588543_100000188618 [0,2,0,0,0,0|1,0,0]=3 8983 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 240690a_100020588543_100000188618 [0,2,0,0,0,0|1,0,0]=3 8984 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 527a_100020588543_100000188618 [0,2,0,0,0,0|1,0,0]=3 8985 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 11a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 8986 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 1626a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 8987 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 240690a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 8988 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 527a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 8989 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 11a_100020588543_100000187176 [0,2,0,0,0,0|1,0,0]=3 8990 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 1626a_100020588543_100000187176 [0,2,0,0,0,0|1,0,0]=3 8991 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 240690a_100020588543_100000187176 [0,2,0,0,0,0|1,0,0]=3 8992 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 527a_100020588543_100000187176 [0,2,0,0,0,0|1,0,0]=3 8993 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 11a_100020588543_100000187904 [0,2,0,0,0,0|1,0,0]=3 8994 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 1626a_100020588543_100000187904 [0,2,0,0,0,0|1,0,0]=3 8995 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 240690a_100020588543_100000187904 [0,2,0,0,0,0|1,0,0]=3 8996 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 527a_100020588543_100000187904 [0,2,0,0,0,0|1,0,0]=3 8997 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)O 240690a_100020588543_100000212099 [0,2,0,0,0,0|1,0,0]=3 8998 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)O 527a_100020588543_100000212099 [0,2,0,0,0,0|1,0,0]=3 8999 B15R1.132 CCC(C)COC(C)c1ccc(cc1)Br 34a_100000745893_100000748023 [0,2,0,0,0,0|1,0,1]=4 9000 B15R1.132 CCC(C)COC(C)c1ccc(cc1)Br 7a_100000745893_100000748023 [0,2,0,0,0,0|1,0,1]=4 9001 B15R1.132 CCC(C)COC(C)c1ccc(cc1)F 34a_100000181323_100000748023 [0,2,0,0,0,0|1,0,1]=4 9002 B15R1.132 CCC(C)COC(C)c1ccc(cc1)F 7a_100000181323_100000748023 [0,2,0,0,0,0|1,0,1]=4 9003 B15R1.132 CCC(C)COC(C)c1ccc(cc1)N 34a_100011216399_100000748023 [0,2,0,0,0,0|1,0,1]=4 9004 B15R1.132 CCC(C)CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000748023 [0,2,0,0,0,0|1,0,1]=4 9005 B15R1.132 CCC(C)CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000748023 [0,2,0,0,0,0|1,0,1]=4 9006 B15R1.132 CCC(C)CO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000748023 [0,2,0,0,0,0|1,0,1]=4 9007 B15R1.132 CCC(C)CO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000748023 [0,2,0,0,0,0|1,0,1]=4 9008 B15R1.132 CCC(C)NCC(=O)c1ccc(cc1)C 2230a_100000209981_100000211441 [0,2,0,0,0,0|2,0,0]=4 9009 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)Br 22a_100000718999_100000185839 [0,2,0,0,0,0|2,0,0]=4 9010 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)C 22a_100000718999_100000188618 [0,2,0,0,0,0|2,0,0]=4 9011 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)Cl 22a_100000718999_100000210187 [0,2,0,0,0,0|2,0,0]=4 9012 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)F 22a_100000718999_100000187176 [0,2,0,0,0,0|2,0,0]=4 9013 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)I 22a_100000718999_100000187904 [0,2,0,0,0,0|2,0,0]=4 9014 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)O 22a_100000718999_100000212099 [0,2,0,0,0,0|2,0,0]=4 9015 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)Br 7a_100000210228_100000188085 [0,2,0,0,0,0|2,0,0]=4 9016 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)C 7a_100000210228_100000211441 [0,2,0,0,0,0|2,0,0]=4 9017 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)Cl 7a_100000210228_100000211071 [0,2,0,0,0,0|2,0,0]=4 9018 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)F 34a_100000246311_100011215416 [0,2,0,0,0,0|2,0,0]=4 9019 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)F 7a_100000210228_100000211279 [0,2,0,0,0,0|2,0,0]=4 9020 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)I 7a_100000210228_100011216261 [0,2,0,0,0,0|2,0,0]=4 9021 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)O 7a_100000210228_100000018856 [0,2,0,0,0,0|2,0,0]=4 9022 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)Br 62a_100000188085_100000758301 [0,2,0,0,0,0|2,0,0]=4 9023 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)C 62a_100000211441_100000758301 [0,2,0,0,0,0|2,0,0]=4 9024 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)C 62a_100000758301_100000211441 [0,2,0,0,0,0|2,0,0]=4 9025 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000758301 [0,2,0,0,0,0|2,0,0]=4 9026 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000758301_100000211071 [0,2,0,0,0,0|2,0,0]=4 9027 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)F 62a_100000211279_100000758301 [0,2,0,0,0,0|2,0,0]=4 9028 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)F 62a_100000758301_100000211279 [0,2,0,0,0,0|2,0,0]=4 9029 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)I 62a_100000758301_100011216261 [0,2,0,0,0,0|2,0,0]=4 9030 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)I 62a_100011216261_100000758301 [0,2,0,0,0,0|2,0,0]=4 9031 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)O 62a_100000758301_100009814261 [0,2,0,0,0,0|2,0,0]=4 9032 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)O 62a_100009814261_100000758301 [0,2,0,0,0,0|2,0,0]=4 9033 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Br 11a_100011218483_100000185839 [0,2,0,0,0,0|2,0,0]=4 9034 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Br 240690a_100011218483_100000185839 [0,2,0,0,0,0|2,0,0]=4 9035 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Br 527a_100011218483_100000185839 [0,2,0,0,0,0|2,0,0]=4 9036 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)C 11a_100011218483_100000188618 [0,2,0,0,0,0|2,0,0]=4 9037 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)C 240690a_100011218483_100000188618 [0,2,0,0,0,0|2,0,0]=4 9038 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)C 527a_100011218483_100000188618 [0,2,0,0,0,0|2,0,0]=4 9039 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Cl 11a_100011218483_100000210187 [0,2,0,0,0,0|2,0,0]=4 9040 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Cl 240690a_100011218483_100000210187 [0,2,0,0,0,0|2,0,0]=4 9041 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Cl 527a_100011218483_100000210187 [0,2,0,0,0,0|2,0,0]=4 9042 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)F 11a_100011218483_100000187176 [0,2,0,0,0,0|2,0,0]=4 9043 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)F 240690a_100011218483_100000187176 [0,2,0,0,0,0|2,0,0]=4 9044 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)F 527a_100011218483_100000187176 [0,2,0,0,0,0|2,0,0]=4 9045 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)I 11a_100011218483_100000187904 [0,2,0,0,0,0|2,0,0]=4 9046 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)I 240690a_100011218483_100000187904 [0,2,0,0,0,0|2,0,0]=4 9047 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)I 527a_100011218483_100000187904 [0,2,0,0,0,0|2,0,0]=4 9048 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)O 240690a_100011218483_100000212099 [0,2,0,0,0,0|2,0,0]=4 9049 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)O 527a_100011218483_100000212099 [0,2,0,0,0,0|2,0,0]=4 9050 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)Br 269982a_100000225621_100011215963 [0,2,0,0,0,0|2,0,0]=4 9051 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)C 2230a_100000225621_100000701375 [0,2,0,0,0,0|2,0,0]=4 9052 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)C 269982a_100000225621_100000701375 [0,2,0,0,0,0|2,0,0]=4 9053 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)Cl 269982a_100000225621_100011216492 [0,2,0,0,0,0|2,0,0]=4 9054 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)F 2230a_100000225621_100000211231 [0,2,0,0,0,0|2,0,0]=4 9055 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)F 269982a_100000225621_100000211231 [0,2,0,0,0,0|2,0,0]=4 9056 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)O 2230a_100000225621_100009879949 [0,2,0,0,0,0|2,0,0]=4 9057 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)O 269982a_100000225621_100009879949 [0,2,0,0,0,0|2,0,0]=4 9058 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)Br 34a_100000745893_100009816398 [0,2,0,0,0,0|1,0,1]=4 9059 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)Br 7a_100000745893_100009816398 [0,2,0,0,0,0|1,0,1]=4 9060 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)C 7a_100009816381_100011261388 [0,2,0,0,0,0|1,0,1]=4 9061 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)Cl 7a_100009816381_100000684792 [0,2,0,0,0,0|1,0,1]=4 9062 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)F 34a_100000181323_100009816398 [0,2,0,0,0,0|1,0,1]=4 9063 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)F 7a_100000181323_100009816398 [0,2,0,0,0,0|1,0,1]=4 9064 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)F 7a_100009816381_100000743420 [0,2,0,0,0,0|1,0,1]=4 9065 B15R1.132 CC[C@H](C)COC(C)c1ccc(cc1)N 34a_100011216399_100009816398 [0,2,0,0,0,0|1,0,1]=4 9066 B15R1.132 CC[C@H](C)CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100009816398 [0,2,0,0,0,0|1,0,1]=4 9067 B15R1.132 CC[C@H](C)CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100009816398 [0,2,0,0,0,0|1,0,1]=4 9068 B15R1.132 CC[C@H](C)CO[C@H](C)c1ccc(cc1)C 34a_100000690690_100009816398 [0,2,0,0,0,0|1,0,1]=4 9069 B15R1.132 CC[C@H](C)CO[C@H](C)c1ccc(cc1)C 7a_100000690690_100009816398 [0,2,0,0,0,0|1,0,1]=4 9070 B15R1.132 CNC(C)COC(=O)c1ccc(cc1)Br 270004a_106832991635_200027936475 [0,2,0,0,0,0|0,0,0]=2 9071 B15R1.132 COC(C)COC(C)c1ccc(cc1)Br 34a_100000690652_100000755118 [0,2,0,0,0,0|1,0,1]=4 9072 B15R1.132 COC(C)COC(C)c1ccc(cc1)C 34a_100000690652_100011261388 [0,2,0,0,0,0|1,0,1]=4 9073 B15R1.132 COC(C)COC(C)c1ccc(cc1)F 34a_100000690652_100000743420 [0,2,0,0,0,0|1,0,1]=4 9074 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)Br 62a_100000188085_100009879195 [0,2,0,0,0,0|2,0,0]=4 9075 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)C 62a_100000211441_100009879195 [0,2,0,0,0,0|2,0,0]=4 9076 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)C 62a_100009879195_100000211441 [0,2,0,0,0,0|2,0,0]=4 9077 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100009879195 [0,2,0,0,0,0|2,0,0]=4 9078 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)Cl 62a_100009879195_100000211071 [0,2,0,0,0,0|2,0,0]=4 9079 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)F 62a_100000211279_100009879195 [0,2,0,0,0,0|2,0,0]=4 9080 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)F 62a_100009879195_100000211279 [0,2,0,0,0,0|2,0,0]=4 9081 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)I 62a_100009879195_100011216261 [0,2,0,0,0,0|2,0,0]=4 9082 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)I 62a_100011216261_100009879195 [0,2,0,0,0,0|2,0,0]=4 9083 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)O 62a_100009814261_100009879195 [0,2,0,0,0,0|2,0,0]=4 9084 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)O 62a_100009879195_100009814261 [0,2,0,0,0,0|2,0,0]=4 9085 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 11a_100020591295_100000185839 [0,2,0,0,0,0|1,0,0]=3 9086 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 1626a_100020591295_100000185839 [0,2,0,0,0,0|1,0,0]=3 9087 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 240690a_100020591295_100000185839 [0,2,0,0,0,0|1,0,0]=3 9088 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 527a_100020591295_100000185839 [0,2,0,0,0,0|1,0,0]=3 9089 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 11a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 9090 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 1626a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 9091 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 240690a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 9092 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 527a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 9093 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 11a_100020591295_100000210187 [0,2,0,0,0,0|1,0,0]=3 9094 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 1626a_100020591295_100000210187 [0,2,0,0,0,0|1,0,0]=3 9095 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 240690a_100020591295_100000210187 [0,2,0,0,0,0|1,0,0]=3 9096 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 527a_100020591295_100000210187 [0,2,0,0,0,0|1,0,0]=3 9097 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 11a_100020591295_100000187176 [0,2,0,0,0,0|1,0,0]=3 9098 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 1626a_100020591295_100000187176 [0,2,0,0,0,0|1,0,0]=3 9099 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 240690a_100020591295_100000187176 [0,2,0,0,0,0|1,0,0]=3 9100 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 527a_100020591295_100000187176 [0,2,0,0,0,0|1,0,0]=3 9101 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 11a_100020591295_100000187904 [0,2,0,0,0,0|1,0,0]=3 9102 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 1626a_100020591295_100000187904 [0,2,0,0,0,0|1,0,0]=3 9103 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 240690a_100020591295_100000187904 [0,2,0,0,0,0|1,0,0]=3 9104 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 527a_100020591295_100000187904 [0,2,0,0,0,0|1,0,0]=3 9105 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)O 240690a_100020591295_100000212099 [0,2,0,0,0,0|1,0,0]=3 9106 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)O 527a_100020591295_100000212099 [0,2,0,0,0,0|1,0,0]=3 9107 B15R1.132 C[C@@H](CO)CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000059175 [0,2,0,0,0,0|1,0,1]=4 9108 B15R1.132 C[C@@H](CO)CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000059175 [0,2,0,0,0,0|1,0,1]=4 9109 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)Br 62a_100000188085_100016084084 [0,2,0,0,0,0|2,0,0]=4 9110 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100016084084 [0,2,0,0,0,0|2,0,0]=4 9111 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)Cl 62a_100016084084_100000211071 [0,2,0,0,0,0|2,0,0]=4 9112 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)F 62a_100000211279_100016084084 [0,2,0,0,0,0|2,0,0]=4 9113 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)F 62a_100016084084_100000211279 [0,2,0,0,0,0|2,0,0]=4 9114 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)I 62a_100011216261_100016084084 [0,2,0,0,0,0|2,0,0]=4 9115 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)I 62a_100016084084_100011216261 [0,2,0,0,0,0|2,0,0]=4 9116 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)O 62a_100009814261_100016084084 [0,2,0,0,0,0|2,0,0]=4 9117 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)O 62a_100016084084_100009814261 [0,2,0,0,0,0|2,0,0]=4 9118 B15R1.132 Cc1ccc(cc1)C(=O)CN[C@H](C)CO 2230a_100000737577_100000211441 [0,2,0,0,0,0|2,0,0]=4 9119 B15R1.132 Cc1ccc(cc1)C(=O)COC(C)CF 34a_100016041109_100000211441 [0,2,0,0,0,0|2,0,0]=4 9120 B15R1.132 Cc1ccc(cc1)C(=O)COC(C)CF 7a_100016041109_100000211441 [0,2,0,0,0,0|2,0,0]=4 9121 B15R1.132 Cc1ccc(cc1)C(=O)COC(C)CN 34a_100000210904_100000211441 [0,2,0,0,0,0|2,0,0]=4 9122 B15R1.132 Cc1ccc(cc1)C(=O)CSC(C)CO 62a_100012180447_100000211441 [0,2,0,0,0,0|2,0,0]=4 9123 B15R1.132 Cc1ccc(cc1)C(=O)CS[C@H](C)CO 62a_100000211441_100016084084 [0,2,0,0,0,0|2,0,0]=4 9124 B15R1.132 Cc1ccc(cc1)C(=O)CS[C@H](C)CO 62a_100016084084_100000211441 [0,2,0,0,0,0|2,0,0]=4 9125 B15R1.132 Cc1ccc(cc1)C(=O)NCC(C)CO 240690a_100000744482_100000188618 [0,2,0,0,0,0|1,0,0]=3 9126 B15R1.132 Cc1ccc(cc1)C(=O)NCC(C)CO 527a_100000744482_100000188618 [0,2,0,0,0,0|1,0,0]=3 9127 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@@H](F)CO 240690a_100015665980_100000188618 [0,2,0,0,0,0|2,0,0]=4 9128 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@@H](F)CO 527a_100015665980_100000188618 [0,2,0,0,0,0|2,0,0]=4 9129 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@H](O)CO 240690a_100020644852_100000188618 [0,2,0,0,0,0|2,0,0]=4 9130 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@H](O)CO 527a_100020644852_100000188618 [0,2,0,0,0,0|2,0,0]=4 9131 B15R1.132 Cc1ccc(cc1)C(C)OCC(C)CN 34a_100000744482_100011261388 [0,2,0,0,0,0|1,0,1]=4 9132 B15R1.132 Cc1ccc(cc1)[C@@H](C)OC[C@@H](C)CO 34a_100000690690_100000059175 [0,2,0,0,0,0|1,0,1]=4 9133 B15R1.132 Cc1ccc(cc1)[C@@H](C)OC[C@@H](C)CO 7a_100000690690_100000059175 [0,2,0,0,0,0|1,0,1]=4 9134 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Br 240690a_100015665980_100000185839 [0,2,0,0,0,0|2,0,0]=4 9135 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Br 527a_100015665980_100000185839 [0,2,0,0,0,0|2,0,0]=4 9136 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Cl 240690a_100015665980_100000210187 [0,2,0,0,0,0|2,0,0]=4 9137 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Cl 527a_100015665980_100000210187 [0,2,0,0,0,0|2,0,0]=4 9138 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)F 240690a_100015665980_100000187176 [0,2,0,0,0,0|2,0,0]=4 9139 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)F 527a_100015665980_100000187176 [0,2,0,0,0,0|2,0,0]=4 9140 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)I 240690a_100015665980_100000187904 [0,2,0,0,0,0|2,0,0]=4 9141 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)I 527a_100015665980_100000187904 [0,2,0,0,0,0|2,0,0]=4 9142 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)O 240690a_100015665980_100000212099 [0,2,0,0,0,0|2,0,0]=4 9143 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)O 527a_100015665980_100000212099 [0,2,0,0,0,0|2,0,0]=4 9144 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Br 240690a_100020644852_100000185839 [0,2,0,0,0,0|2,0,0]=4 9145 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Br 527a_100020644852_100000185839 [0,2,0,0,0,0|2,0,0]=4 9146 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Cl 240690a_100020644852_100000210187 [0,2,0,0,0,0|2,0,0]=4 9147 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Cl 527a_100020644852_100000210187 [0,2,0,0,0,0|2,0,0]=4 9148 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)F 240690a_100020644852_100000187176 [0,2,0,0,0,0|2,0,0]=4 9149 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)F 527a_100020644852_100000187176 [0,2,0,0,0,0|2,0,0]=4 9150 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)I 240690a_100020644852_100000187904 [0,2,0,0,0,0|2,0,0]=4 9151 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)I 527a_100020644852_100000187904 [0,2,0,0,0,0|2,0,0]=4 9152 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)O 240690a_100020644852_100000212099 [0,2,0,0,0,0|2,0,0]=4 9153 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)O 527a_100020644852_100000212099 [0,2,0,0,0,0|2,0,0]=4 9154 B15R1.132 [2H]C(OCC(C)CC)c1ccc(cc1)F 34a_217856618577_100000748023 [0,2,0,0,0,0|1,0,1]=4 9155 B15R1.132 [2H]C(OCC(C)CC)c1ccc(cc1)F 7a_217856618577_100000748023 [0,2,0,0,0,0|1,0,1]=4 9156 B15R1.132 [2H]C(OC[C@@H](C)CC)c1ccc(cc1)F 34a_217856618577_100009816398 [0,2,0,0,0,0|1,0,1]=4 9157 B15R1.132 [2H]C(OC[C@@H](C)CC)c1ccc(cc1)F 7a_217856618577_100009816398 [0,2,0,0,0,0|1,0,1]=4 9158 B15R1.132 [2H]C(OC[C@@H](C)CO)c1ccc(cc1)F 34a_217856618577_100000059175 [0,2,0,0,0,0|1,0,1]=4 9159 B15R1.132 [2H]C(OC[C@@H](C)CO)c1ccc(cc1)F 7a_217856618577_100000059175 [0,2,0,0,0,0|1,0,1]=4 9160 B15R1.311 C#CC(C)(C)OCC(=O)c1ccccc1 7a_100000189450_100000211460 [0,2,0,0,0,0|2,0,0]=4 9161 B15R1.311 C#CC(C)(C)SCC(=O)c1ccccc1 62a_100000038118_100000211460 [0,2,0,0,0,0|2,0,0]=4 9162 B15R1.311 C#CC(C)(C)SCC(=O)c1ccccc1 62a_100000211460_100000038118 [0,2,0,0,0,0|2,0,0]=4 9163 B15R1.311 C=CC(C)(C)OCC(=O)c1ccccc1 7a_100011215311_100000211460 [0,2,0,0,0,0|2,0,0]=4 9164 B15R1.311 CC(C)(C#N)SCC(=O)c1ccccc1 62a_100000211460_100011162410 [0,2,0,0,0,0|2,0,0]=4 9165 B15R1.311 CC(C)(C#N)SCC(=O)c1ccccc1 62a_100011162410_100000211460 [0,2,0,0,0,0|2,0,0]=4 9166 B15R1.311 CC(C)(CCl)OCC(=O)c1ccccc1 7a_100000764493_100000211460 [0,2,0,0,0,0|2,0,0]=4 9167 B15R1.311 CC(C)(CO)CNC(=O)c1ccccc1 240690a_100020635058_100000185807 [0,2,0,0,0,0|1,0,0]=3 9168 B15R1.311 CC(C)(CO)CNC(=O)c1ccccc1 527a_100020635058_100000185807 [0,2,0,0,0,0|1,0,0]=3 9169 B15R1.311 CC(OCC(C)(C)CCl)c1ccccc1 7a_100011217199_100000230085 [0,2,0,0,0,0|1,0,1]=4 9170 B15R1.311 CCC(C)(C)COC(C)c1ccccc1 7a_100000765029_100000230085 [0,2,0,0,0,0|1,0,1]=4 9171 B15R1.311 CCC(C)(C)OCC(=O)c1ccccc1 7a_100000210230_100000211460 [0,2,0,0,0,0|2,0,0]=4 9172 B15R1.311 CCC(C)(C)SCC(=O)c1ccccc1 62a_100000032637_100000211460 [0,2,0,0,0,0|2,0,0]=4 9173 B15R1.311 CCC(C)(C)SCC(=O)c1ccccc1 62a_100000211460_100000032637 [0,2,0,0,0,0|2,0,0]=4 9174 B15R1.311 COC(C)(C)CNC(=O)c1ccccc1 11a_100000763424_100000185807 [0,2,0,0,0,0|1,0,0]=3 9175 B15R1.311 COC(C)(C)CNC(=O)c1ccccc1 1626a_100000763424_100000185807 [0,2,0,0,0,0|1,0,0]=3 9176 B15R1.311 COC(C)(C)CNC(=O)c1ccccc1 240690a_100000763424_100000185807 [0,2,0,0,0,0|1,0,0]=3 9177 B15R1.311 COC(C)(C)CNC(=O)c1ccccc1 527a_100000763424_100000185807 [0,2,0,0,0,0|1,0,0]=3 9178 B15R1.311 COC(C)(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000701081 [0,2,0,0,0,0|1,0,1]=4 9179 B15R1.311 C[C@@H](OCC(C)(C)CO)c1ccccc1 34a_100000761318_100009813988 [0,2,0,0,0,0|1,0,1]=4 9180 B15R1.311 C[C@@H](OCC(C)(C)CO)c1ccccc1 7a_100000761318_100009813988 [0,2,0,0,0,0|1,0,1]=4 9181 B15R1.311 O=C(NCC(F)(F)CO)c1ccccc1 240690a_100000703232_100000185807 [0,2,0,0,0,0|2,0,0]=4 9182 B15R1.311 O=C(NCC(F)(F)CO)c1ccccc1 527a_100000703232_100000185807 [0,2,0,0,0,0|2,0,0]=4 9183 B15R1.652 CCC(CC)CNC(=O)c1ccccc1 11a_100102946423_100000185807 [0,2,0,0,0,0|1,0,0]=3 9184 B15R1.652 CCC(CC)CNC(=O)c1ccccc1 1626a_100102946423_100000185807 [0,2,0,0,0,0|1,0,0]=3 9185 B15R1.652 CCC(CC)CNC(=O)c1ccccc1 240690a_100102946423_100000185807 [0,2,0,0,0,0|1,0,0]=3 9186 B15R1.652 CCC(CC)CNC(=O)c1ccccc1 527a_100102946423_100000185807 [0,2,0,0,0,0|1,0,0]=3 9187 B15R1.652 CCC(CC)COC(C)c1ccccc1 7a_100000703878_100000230085 [0,2,0,0,0,0|1,0,1]=4 9188 B15R1.652 CCC(CC)CO[C@H](C)c1ccccc1 34a_100000761318_100011215472 [0,2,0,0,0,0|1,0,1]=4 9189 B15R1.652 CCC(CC)CO[C@H](C)c1ccccc1 7a_100000761318_100011215472 [0,2,0,0,0,0|1,0,1]=4 9190 B15R1.652 CCC(CC)NNC(=O)c1ccccc1 22a_100000756293_100000185807 [0,2,0,0,0,0|2,0,0]=4 9191 B15R1.652 CCC(CC)OCC(=O)c1ccccc1 7a_100000688536_100000211460 [0,2,0,0,0,0|2,0,0]=4 9192 B15R1.652 CCC(CC)SCC(=O)c1ccccc1 62a_100000210505_100000211460 [0,2,0,0,0,0|2,0,0]=4 9193 B15R1.652 CCC(CC)SCC(=O)c1ccccc1 62a_100000211460_100000210505 [0,2,0,0,0,0|2,0,0]=4 9194 B15R1.652 CCC(CNC(=O)c1ccccc1)OC 11a_100000731041_100000185807 [0,2,0,0,0,0|1,0,0]=3 9195 B15R1.652 CCC(CNC(=O)c1ccccc1)OC 1626a_100000731041_100000185807 [0,2,0,0,0,0|1,0,0]=3 9196 B15R1.652 CCC(CNC(=O)c1ccccc1)OC 240690a_100000731041_100000185807 [0,2,0,0,0,0|1,0,0]=3 9197 B15R1.652 CCC(CNC(=O)c1ccccc1)OC 527a_100000731041_100000185807 [0,2,0,0,0,0|1,0,0]=3 9198 B15R1.652 CCC(COC(C)c1ccccc1)OC 34a_100011934954_100000211855 [0,2,0,0,0,0|1,0,1]=4 9199 B15R1.652 CCC(COC(C)c1ccccc1)OC 7a_100011934954_100000230085 [0,2,0,0,0,0|1,0,1]=4 9200 B15R1.652 CCN(CC)CCC(=O)c1ccccc1 1458a_100000185807_100000700428 [0,2,0,0,0,0|2,0,0]=4 9201 B15R1.652 CCN(CC)CCC(=O)c1ccccc1 2230a_100000724800_100000750707 [0,2,0,0,0,0|2,0,0]=4 9202 B15R1.652 CCN(CC)CCC(=O)c1ccccc1 269956a_100000042499_100000750707 [0,2,0,0,0,0|2,0,0]=4 9203 B15R1.652 CCN(CC)CCC(=O)c1ccccc1 269982a_100000724800_100000750707 [0,2,0,0,0,0|2,0,0]=4 9204 B15R1.652 CCN(CC)COC(=O)c1ccccc1 269956a_100000042499_100000073877 [0,2,0,0,0,0|1,0,0]=3 9205 B15R1.652 CCN(CC)COC(=O)c1ccccc1 269982a_100000724800_100000073877 [0,2,0,0,0,0|1,0,0]=3 9206 B15R1.652 COC(CCC(=O)c1ccccc1)OC 1458a_100000185807_100000139399 [0,2,0,0,0,0|1,0,0]=3 9207 B15R1.652 COC(CNC(=O)c1ccccc1)OC 11a_100000210479_100000185807 [0,2,0,0,0,0|1,0,0]=3 9208 B15R1.652 COC(CNC(=O)c1ccccc1)OC 1626a_100000210479_100000185807 [0,2,0,0,0,0|1,0,0]=3 9209 B15R1.652 COC(CNC(=O)c1ccccc1)OC 240690a_100000210479_100000185807 [0,2,0,0,0,0|1,0,0]=3 9210 B15R1.652 COC(CNC(=O)c1ccccc1)OC 527a_100000210479_100000185807 [0,2,0,0,0,0|1,0,0]=3 9211 B15R1.652 COC(COC(C)c1ccccc1)OC 34a_100011216393_100000211855 [0,2,0,0,0,0|1,0,1]=4 9212 B15R1.652 COC(CO[C@H](C)c1ccccc1)OC 34a_100000761318_100000211822 [0,2,0,0,0,0|1,0,1]=4 9213 B15R1.652 COC(CO[C@H](C)c1ccccc1)OC 7a_100000761318_100000751394 [0,2,0,0,0,0|1,0,1]=4 9214 B15R1.652 O=C(COC(CCl)CCl)c1ccccc1 7a_100000737055_100000211460 [0,2,0,0,0,0|2,0,0]=4 9215 B15R1.652 O=C(COC(CF)CF)c1ccccc1 7a_100000032261_100000211460 [0,2,0,0,0,0|2,0,0]=4 9216 B15R1.652 O=C(CO[C@@H](CF)CCl)c1ccccc1 7a_100015614560_100000211460 [0,2,0,0,0,0|2,0,0]=4 9217 B15R1.947 CC(CO)N(C)CC(=O)c1ccccc1 269982a_100000693034_100000211460 [0,2,0,0,0,0|2,0,0]=4 9218 B15R1.947 CCC(=O)[C@@H](C)OC(=O)c1ccccc1 1458a_200035542198_100000210202 [0,2,0,0,0,0|1,0,1]=4 9219 B15R1.947 CCC(C)C(=O)CC(=O)c1ccccc1 1458a_100011192722_100000211460 [0,2,0,0,0,0|1,0,1]=4 9220 B15R1.947 CCC(C)C(C)OC(C)c1ccccc1 7a_100011215189_100000230085 [0,2,0,0,0,0|1,0,1]=4 9221 B15R1.947 CCC(C)N(C)CC(=O)c1ccccc1 269982a_100000741768_100000211460 [0,2,0,0,0,0|2,0,0]=4 9222 B15R1.947 CNC(=O)[C@@H](C)OC(=O)c1ccccc1 11a_106832991635_200035542198 [0,2,0,0,0,0|1,0,1]=4 9223 B15R1.947 CNC(=O)[C@@H](C)OC(=O)c1ccccc1 1626a_100102657272_200035542198 [0,2,0,0,0,0|1,0,1]=4 9224 B15R1.947 CNC(=O)[C@@H](C)OC(=O)c1ccccc1 240690a_100102657272_200035542198 [0,2,0,0,0,0|1,0,1]=4 9225 B15R1.947 CNC(=O)[C@@H](C)OC(=O)c1ccccc1 527a_100102657272_200035542198 [0,2,0,0,0,0|1,0,1]=4 9226 B15R1.947 COC(C)C(=O)CC(=O)c1ccccc1 1458a_100000743197_100000211460 [0,2,0,0,0,0|1,0,1]=4 9227 B15R1.947 CSC(C)C(=O)CC(=O)c1ccccc1 1458a_100000149566_100000211460 [0,2,0,0,0,0|1,0,1]=4 9228 B15R1.947 C[C@@H](OC(=O)c1ccccc1)C(=O)CF 1458a_200035542198_100015361967 [0,2,0,0,0,0|1,0,1]=4 9229 B15R1.950 C=C(C(=O)CC(C)CC)c1ccccc1 1458a_100000065200_100000748023 [0,2,0,0,0,0|2,0,0]=4 9230 B15R1.950 C=C(C(=O)C[C@@H](C)CC)c1ccccc1 1458a_100000065200_100009816398 [0,2,0,0,0,0|2,0,0]=4 9231 B15R1.950 C=C(C(=O)C[C@@H](C)CO)c1ccccc1 1458a_100000065200_100000059175 [0,2,0,0,0,0|2,0,0]=4 9232 B15R1.950 CC(CF)OC(C)C(=O)c1ccccc1 7a_100016041109_100000239700 [0,2,0,0,0,0|2,0,0]=4 9233 B15R1.950 CC(CO)SC(C)C(=O)c1ccccc1 62a_100012180447_100000239700 [0,2,0,0,0,0|2,0,0]=4 9234 B15R1.950 CC(N[C@H](C)CO)C(=O)c1ccccc1 2230a_100000737577_100000239700 [0,2,0,0,0,0|2,0,0]=4 9235 B15R1.950 CC(S[C@H](C)CO)C(=O)c1ccccc1 62a_100000239700_100016084084 [0,2,0,0,0,0|2,0,0]=4 9236 B15R1.950 CC(S[C@H](C)CO)C(=O)c1ccccc1 62a_100016084084_100000239700 [0,2,0,0,0,0|2,0,0]=4 9237 B15R1.950 CCC(C)CN(C)C(=O)c1ccccc1 11a_100000753921_100000185807 [0,2,0,0,0,0|1,0,0]=3 9238 B15R1.950 CCC(C)CN(C)C(=O)c1ccccc1 1626a_100000753921_100000185807 [0,2,0,0,0,0|1,0,0]=3 9239 B15R1.950 CCC(C)CN(C)C(=O)c1ccccc1 240690a_100000753921_100000185807 [0,2,0,0,0,0|1,0,0]=3 9240 B15R1.950 CCC(C)CN(C)C(=O)c1ccccc1 527a_100000753921_100000185807 [0,2,0,0,0,0|1,0,0]=3 9241 B15R1.950 CCC(C)NC(C)C(=O)c1ccccc1 2230a_100000209981_100000239700 [0,2,0,0,0,0|2,0,0]=4 9242 B15R1.950 CCC(C)OC(C)C(=O)c1ccccc1 7a_100000210228_100000239700 [0,2,0,0,0,0|2,0,0]=4 9243 B15R1.950 CCC(C)SC(C)C(=O)c1ccccc1 62a_100000239700_100000758301 [0,2,0,0,0,0|2,0,0]=4 9244 B15R1.950 CCC(C)SC(C)C(=O)c1ccccc1 62a_100000758301_100000239700 [0,2,0,0,0,0|2,0,0]=4 9245 B15R1.950 CN(CC(O)CO)C(=O)c1ccccc1 240690a_100011216503_100000185807 [0,2,0,0,0,0|2,0,0]=4 9246 B15R1.950 CN(CC(O)CO)C(=O)c1ccccc1 527a_100011216503_100000185807 [0,2,0,0,0,0|2,0,0]=4 9247 B15R1.950 COC(C)SC(C)C(=O)c1ccccc1 62a_100000239700_100009879195 [0,2,0,0,0,0|2,0,0]=4 9248 B15R1.950 COC(C)SC(C)C(=O)c1ccccc1 62a_100009879195_100000239700 [0,2,0,0,0,0|2,0,0]=4 9249 B15R1.1094 CC(CNS(=O)(=O)c1ccccc1)O[13CH3] 34a_100000243461_200025704644 [0,2,0,0,0,0|2,0,0]=4 9250 B15R1.1094 CC(CO)CNS(=O)(=O)c1ccccc1 270084a_100000744482_100000210345 [0,2,0,0,0,0|2,0,0]=4 9251 B15R1.1094 CC(CO)CNS(=O)(=O)c1ccccc1 274078a_100000744482_100000210345 [0,2,0,0,0,0|2,0,0]=4 9252 B15R1.1094 CC(CO)CNS(=O)(=O)c1ccccc1 40a_100000744482_100000032697 [0,2,0,0,0,0|2,0,0]=4 9253 B15R1.1094 CCC(C)CNS(=O)(=O)c1ccccc1 270084a_100020588543_100000210345 [0,2,0,0,0,0|2,0,0]=4 9254 B15R1.1094 CCC(C)CNS(=O)(=O)c1ccccc1 274078a_100020588543_100000210345 [0,2,0,0,0,0|2,0,0]=4 9255 B15R1.1094 CCC(C)CNS(=O)(=O)c1ccccc1 40a_100020588543_100000032697 [0,2,0,0,0,0|2,0,0]=4 9256 B15R1.1094 CCC(C)COC(C)(C)c1ccccc1 7a_100000694644_100000748023 [0,2,0,0,0,0|1,0,1]=4 9257 B15R1.1094 CC[C@H](C)COC(C)(C)c1ccccc1 7a_100000694644_100009816398 [0,2,0,0,0,0|1,0,1]=4 9258 B15R1.1094 CC[C@H](C)COC(F)(F)c1ccccc1 7a_100009816381_100000036403 [0,2,0,0,0,0|1,0,1]=4 9259 B15R1.1094 COC(C)CNS(=O)(=O)c1ccccc1 34a_100000243461_200000210301 [0,2,0,0,0,0|2,0,0]=4 9260 B15R1.1094 CO[C@H](C)CNS(=O)(=O)c1ccccc1 270084a_100020591295_100000210345 [0,2,0,0,0,0|2,0,0]=4 9261 B15R1.1094 CO[C@H](C)CNS(=O)(=O)c1ccccc1 274078a_100020591295_100000210345 [0,2,0,0,0,0|2,0,0]=4 9262 B15R1.1094 CO[C@H](C)CNS(=O)(=O)c1ccccc1 40a_100020591295_100000032697 [0,2,0,0,0,0|2,0,0]=4 9263 B15R1.1094 C[C@@H](CO)COC(C)(C)c1ccccc1 7a_100000694644_100000059175 [0,2,0,0,0,0|1,0,1]=4 9264 B15R1.1097 C#CC(OCC(C)CC)c1ccccc1 34a_100011219616_100000748023 [0,2,0,0,0,0|1,0,1]=4 9265 B15R1.1097 C#CC(OCC(C)CC)c1ccccc1 7a_100011219616_100000748023 [0,2,0,0,0,0|1,0,1]=4 9266 B15R1.1097 C#CC(OC[C@@H](C)CC)c1ccccc1 34a_100011219616_100009816398 [0,2,0,0,0,0|1,0,1]=4 9267 B15R1.1097 C#CC(OC[C@@H](C)CC)c1ccccc1 7a_100011219616_100009816398 [0,2,0,0,0,0|1,0,1]=4 9268 B15R1.1097 C#CC(OC[C@@H](C)CO)c1ccccc1 34a_100011219616_100000059175 [0,2,0,0,0,0|1,0,1]=4 9269 B15R1.1097 C#CC(OC[C@@H](C)CO)c1ccccc1 7a_100011219616_100000059175 [0,2,0,0,0,0|1,0,1]=4 9270 B15R1.1097 C=CC(OCC(C)CC)c1ccccc1 34a_100011215659_100000748023 [0,2,0,0,0,0|1,0,1]=4 9271 B15R1.1097 C=CC(OCC(C)CC)c1ccccc1 7a_100011215659_100000748023 [0,2,0,0,0,0|1,0,1]=4 9272 B15R1.1097 C=CC(OC[C@@H](C)CC)c1ccccc1 34a_100011215659_100009816398 [0,2,0,0,0,0|1,0,1]=4 9273 B15R1.1097 C=CC(OC[C@@H](C)CC)c1ccccc1 7a_100011215659_100009816398 [0,2,0,0,0,0|1,0,1]=4 9274 B15R1.1097 C=CC(OC[C@@H](C)CO)c1ccccc1 34a_100011215659_100000059175 [0,2,0,0,0,0|1,0,1]=4 9275 B15R1.1097 C=CC(OC[C@@H](C)CO)c1ccccc1 7a_100011215659_100000059175 [0,2,0,0,0,0|1,0,1]=4 9276 B15R1.1097 CCC(C)COC(C#N)c1ccccc1 7a_100011217353_100000748023 [0,2,0,0,0,0|1,0,1]=4 9277 B15R1.1097 CCC(C)COC(CBr)c1ccccc1 7a_100000185958_100000748023 [0,2,0,0,0,0|1,0,1]=4 9278 B15R1.1097 CCC(C)COC(CC)c1ccccc1 34a_100000698172_100000748023 [0,2,0,0,0,0|1,0,1]=4 9279 B15R1.1097 CCC(C)COC(CC)c1ccccc1 7a_100000698172_100000748023 [0,2,0,0,0,0|1,0,1]=4 9280 B15R1.1097 CCC(C)COC(CN)c1ccccc1 34a_100000210709_100000748023 [0,2,0,0,0,0|1,0,1]=4 9281 B15R1.1097 CCC(C)CO[C@H](CCl)c1ccccc1 34a_100011933945_100000748023 [0,2,0,0,0,0|1,0,1]=4 9282 B15R1.1097 CCC(C)CO[C@H](CCl)c1ccccc1 7a_100011933945_100000748023 [0,2,0,0,0,0|1,0,1]=4 9283 B15R1.1097 CCC(OC[C@@H](C)CC)c1ccccc1 34a_100000698172_100009816398 [0,2,0,0,0,0|1,0,1]=4 9284 B15R1.1097 CCC(OC[C@@H](C)CC)c1ccccc1 7a_100000698172_100009816398 [0,2,0,0,0,0|1,0,1]=4 9285 B15R1.1097 CCC(OC[C@@H](C)CO)c1ccccc1 34a_100000698172_100000059175 [0,2,0,0,0,0|1,0,1]=4 9286 B15R1.1097 CCC(OC[C@@H](C)CO)c1ccccc1 7a_100000698172_100000059175 [0,2,0,0,0,0|1,0,1]=4 9287 B15R1.1097 CC[C@H](C)COC(C#N)c1ccccc1 7a_100011217353_100009816398 [0,2,0,0,0,0|1,0,1]=4 9288 B15R1.1097 CC[C@H](C)COC(CBr)c1ccccc1 7a_100000185958_100009816398 [0,2,0,0,0,0|1,0,1]=4 9289 B15R1.1097 CC[C@H](C)COC(CN)c1ccccc1 34a_100000210709_100009816398 [0,2,0,0,0,0|1,0,1]=4 9290 B15R1.1097 CC[C@H](C)CO[C@H](CCl)c1ccccc1 34a_100011933945_100009816398 [0,2,0,0,0,0|1,0,1]=4 9291 B15R1.1097 CC[C@H](C)CO[C@H](CCl)c1ccccc1 7a_100011933945_100009816398 [0,2,0,0,0,0|1,0,1]=4 9292 B15R1.1097 C[C@@H](CO)COC(C#N)c1ccccc1 7a_100011217353_100000059175 [0,2,0,0,0,0|1,0,1]=4 9293 B15R1.1097 C[C@@H](CO)COC(CBr)c1ccccc1 7a_100000185958_100000059175 [0,2,0,0,0,0|1,0,1]=4 9294 B15R1.1097 C[C@@H](CO)COC(CN)c1ccccc1 34a_100000210709_100000059175 [0,2,0,0,0,0|1,0,1]=4 9295 B15R1.1097 C[C@@H](CO)CO[C@H](CCl)c1ccccc1 34a_100011933945_100000059175 [0,2,0,0,0,0|1,0,1]=4 9296 B15R1.1097 C[C@@H](CO)CO[C@H](CCl)c1ccccc1 7a_100011933945_100000059175 [0,2,0,0,0,0|1,0,1]=4 9297 B15R1.502 CC(C)C(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100009893295 [0,2,0,0,0,0|1,0,1]=4 9298 B15R1.502 CC(C)C(=O)C(C)C(=O)c1ccccc1 1458a_100000210198_100000239700 [0,2,0,0,0,0|1,0,1]=4 9299 B15R1.502 CC(C)C(C)N(C)C(=O)c1ccccc1 11a_100000228512_100000185807 [0,2,0,0,0,0|1,0,0]=3 9300 B15R1.502 CC(C)C(C)N(C)C(=O)c1ccccc1 1626a_100000228512_100000185807 [0,2,0,0,0,0|1,0,0]=3 9301 B15R1.502 CC(C)C(C)N(C)C(=O)c1ccccc1 240690a_100000228512_100000185807 [0,2,0,0,0,0|1,0,0]=3 9302 B15R1.502 CC(C)C(C)N(C)C(=O)c1ccccc1 527a_100000228512_100000185807 [0,2,0,0,0,0|1,0,0]=3 9303 B15R1.502 CC(C)N(C)C(C)C(=O)c1ccccc1 269982a_200000211004_100000239700 [0,2,0,0,0,0|2,0,0]=4 9304 B15R1.524 C#CC(OC(C)c1ccccc1)C(C)C 34a_100011217124_100000211855 [0,2,0,0,0,0|1,0,1]=4 9305 B15R1.524 C#CC(OC(C)c1ccccc1)C(C)C 7a_100011217124_100000230085 [0,2,0,0,0,0|1,0,1]=4 9306 B15R1.524 C=CC(OC(C)c1ccccc1)C(C)C 34a_100000732651_100000211855 [0,2,0,0,0,0|1,0,1]=4 9307 B15R1.524 C=CC(OC(C)c1ccccc1)C(C)C 7a_100000732651_100000230085 [0,2,0,0,0,0|1,0,1]=4 9308 B15R1.524 CC(C)[C@H](CO)NC(=O)c1ccccc1 240690a_100011830312_100000185807 [0,2,0,0,0,0|1,0,0]=3 9309 B15R1.524 CC(C)[C@H](CO)NC(=O)c1ccccc1 527a_100011830312_100000185807 [0,2,0,0,0,0|1,0,0]=3 9310 B15R1.524 CC(OC(C#N)C(C)C)c1ccccc1 34a_100000748901_100000211855 [0,2,0,0,0,0|1,0,1]=4 9311 B15R1.524 CC(OC(C#N)C(C)C)c1ccccc1 7a_100000748901_100000230085 [0,2,0,0,0,0|1,0,1]=4 9312 B15R1.524 CC(OC(CN)C(C)C)c1ccccc1 34a_100000759067_100000211855 [0,2,0,0,0,0|1,0,1]=4 9313 B15R1.524 CCC(NC(=O)c1ccccc1)C(C)C 11a_100000745074_100000185807 [0,2,0,0,0,0|1,0,0]=3 9314 B15R1.524 CCC(NC(=O)c1ccccc1)C(C)C 1626a_100000745074_100000185807 [0,2,0,0,0,0|1,0,0]=3 9315 B15R1.524 CCC(NC(=O)c1ccccc1)C(C)C 240690a_100000745074_100000185807 [0,2,0,0,0,0|1,0,0]=3 9316 B15R1.524 CCC(NC(=O)c1ccccc1)C(C)C 527a_100000745074_100000185807 [0,2,0,0,0,0|1,0,0]=3 9317 B15R1.524 CCC(OC(C)c1ccccc1)C(C)C 34a_100011218073_100000211855 [0,2,0,0,0,0|1,0,1]=4 9318 B15R1.524 CCC(OC(C)c1ccccc1)C(C)C 7a_100011218073_100000230085 [0,2,0,0,0,0|1,0,1]=4 9319 B15R1.524 CCN(CC(=O)c1ccccc1)C(C)C 269982a_100000223864_100000211460 [0,2,0,0,0,0|2,0,0]=4 9320 B15R1.524 CC[C@H](NC(=O)c1ccccc1)[C@@H](C)O 11a_100161114882_100000185807 [0,2,0,0,0,0|2,0,0]=4 9321 B15R1.524 CC[C@H](NC(=O)c1ccccc1)[C@@H](C)O 1626a_100161114882_100000185807 [0,2,0,0,0,0|2,0,0]=4 9322 B15R1.524 CC[C@H](NC(=O)c1ccccc1)[C@@H](C)O 240690a_100161114882_100000185807 [0,2,0,0,0,0|2,0,0]=4 9323 B15R1.524 CC[C@H](NC(=O)c1ccccc1)[C@@H](C)O 527a_100161114882_100000185807 [0,2,0,0,0,0|2,0,0]=4 9324 B15R1.524 C[C@@H](O)[C@@H](CO)NC(=O)c1ccccc1 240690a_100015196842_100000185807 [0,2,0,0,0,0|2,0,0]=4 9325 B15R1.524 C[C@@H](O)[C@@H](CO)NC(=O)c1ccccc1 527a_100015196842_100000185807 [0,2,0,0,0,0|2,0,0]=4 9326 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000753385 [0,2,0,0,0,0|1,0,1]=4 9327 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)Br 1458a_100000210198_100000188085 [0,2,0,0,0,0|1,0,1]=4 9328 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000753385 [0,2,0,0,0,0|1,0,1]=4 9329 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210198_100000211071 [0,2,0,0,0,0|1,0,1]=4 9330 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000753385 [0,2,0,0,0,0|1,0,1]=4 9331 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)F 1458a_100000210198_100000211279 [0,2,0,0,0,0|1,0,1]=4 9332 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000753385 [0,2,0,0,0,0|1,0,1]=4 9333 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)I 1458a_100000210198_100011216261 [0,2,0,0,0,0|1,0,1]=4 9334 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)O 1458a_100000210198_100009814261 [0,2,0,0,0,0|1,0,1]=4 9335 B15R1.881 CC(C)C(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000753385 [0,2,0,0,0,0|1,0,1]=4 9336 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 11a_100000211541_100000185839 [0,2,0,0,0,0|1,0,0]=3 9337 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 1626a_100000211541_100000185839 [0,2,0,0,0,0|1,0,0]=3 9338 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 240690a_100000211541_100000185839 [0,2,0,0,0,0|1,0,0]=3 9339 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 527a_100000211541_100000185839 [0,2,0,0,0,0|1,0,0]=3 9340 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 11a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9341 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 1626a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9342 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 240690a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9343 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 527a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9344 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 11a_100000211541_100000187176 [0,2,0,0,0,0|1,0,0]=3 9345 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 1626a_100000211541_100000187176 [0,2,0,0,0,0|1,0,0]=3 9346 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 240690a_100000211541_100000187176 [0,2,0,0,0,0|1,0,0]=3 9347 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 527a_100000211541_100000187176 [0,2,0,0,0,0|1,0,0]=3 9348 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 11a_100000211541_100000187904 [0,2,0,0,0,0|1,0,0]=3 9349 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 1626a_100000211541_100000187904 [0,2,0,0,0,0|1,0,0]=3 9350 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 240690a_100000211541_100000187904 [0,2,0,0,0,0|1,0,0]=3 9351 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 527a_100000211541_100000187904 [0,2,0,0,0,0|1,0,0]=3 9352 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)O 240690a_100000211541_100000212099 [0,2,0,0,0,0|1,0,0]=3 9353 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)O 527a_100000211541_100000212099 [0,2,0,0,0,0|1,0,0]=3 9354 B15R1.881 CC(C)N(C)CC(=O)c1ccc(cc1)Br 269982a_200000211004_100000188085 [0,2,0,0,0,0|2,0,0]=4 9355 B15R1.881 CC(C)N(C)CC(=O)c1ccc(cc1)Cl 269982a_200000211004_100000211071 [0,2,0,0,0,0|2,0,0]=4 9356 B15R1.881 CC(C)N(C)CC(=O)c1ccc(cc1)F 269982a_200000211004_100000211279 [0,2,0,0,0,0|2,0,0]=4 9357 B15R1.881 CC(C)N(C)CC(=O)c1ccc(cc1)I 269982a_200000211004_100011216261 [0,2,0,0,0,0|2,0,0]=4 9358 B15R1.881 CC(C)N(C)CC(=O)c1ccc(cc1)O 269982a_200000211004_100009814261 [0,2,0,0,0,0|2,0,0]=4 9359 B15R1.881 CC(OC(C)C(C)C)c1ccc(cc1)Cl 7a_100000748068_100000684792 [0,2,0,0,0,0|1,0,1]=4 9360 B15R1.881 CC(OC(C)C(C)C)c1ccc(cc1)F 7a_100000748068_100000743420 [0,2,0,0,0,0|1,0,1]=4 9361 B15R1.881 Cc1ccc(cc1)C(=O)CC(=O)C(C)C 1458a_100000188618_100000753385 [0,2,0,0,0,0|1,0,1]=4 9362 B15R1.881 Cc1ccc(cc1)C(=O)CC(=O)C(C)C 1458a_100000210198_100000211441 [0,2,0,0,0,0|1,0,1]=4 9363 B15R1.881 Cc1ccc(cc1)C(=O)CN(C)C(C)C 269982a_200000211004_100000211441 [0,2,0,0,0,0|2,0,0]=4 9364 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 11a_100000211541_100000188618 [0,2,0,0,0,0|1,0,0]=3 9365 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 1626a_100000211541_100000188618 [0,2,0,0,0,0|1,0,0]=3 9366 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 240690a_100000211541_100000188618 [0,2,0,0,0,0|1,0,0]=3 9367 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 527a_100000211541_100000188618 [0,2,0,0,0,0|1,0,0]=3 9368 B15R1.881 Cc1ccc(cc1)C(C)OC(C)C(C)C 7a_100000748068_100011261388 [0,2,0,0,0,0|1,0,1]=4 9369 B15R1.3674 CC(C)C(C)NS(=O)(=O)c1ccccc1 270084a_100000211541_100000210345 [0,2,0,0,0,0|2,0,0]=4 9370 B15R1.3674 CC(C)C(C)NS(=O)(=O)c1ccccc1 274078a_100000211541_100000210345 [0,2,0,0,0,0|2,0,0]=4 9371 B15R1.3674 CC(C)C(C)NS(=O)(=O)c1ccccc1 40a_100000211541_100000032697 [0,2,0,0,0,0|2,0,0]=4 9372 B15R1.3674 CC(C)C(C)OC(F)(F)c1ccccc1 7a_100000748068_100000036403 [0,2,0,0,0,0|1,0,1]=4 9373 B15R1.5392 CC(C)(C)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100000210923 [0,2,0,0,0,0|1,0,1]=4 9374 B15R1.5392 CC(C)(C)C(=O)CC(=O)c1ccccc1 1458a_106744555173_100000211460 [0,2,0,0,0,0|1,0,1]=4 9375 B15R1.5392 CC(C)(F)C(=O)CC(=O)c1ccccc1 1458a_100000765255_100000211460 [0,2,0,0,0,0|1,0,1]=4 9376 B15R1.5392 CC(C)(O)C(=O)CC(=O)c1ccccc1 1458a_100000242741_100000211460 [0,2,0,0,0,0|1,0,1]=4 9377 B15R1.5392 CN(CC(=O)c1ccccc1)C(C)(C)C 269982a_100011215553_100000211460 [0,2,0,0,0,0|2,0,0]=4 9378 B15R1.5392 C[C@@H](NC(=O)c1ccccc1)C(C)(C)C 11a_100025703359_100000185807 [0,2,0,0,0,0|1,0,0]=3 9379 B15R1.5392 C[C@@H](NC(=O)c1ccccc1)C(C)(C)C 1626a_100025703359_100000185807 [0,2,0,0,0,0|1,0,0]=3 9380 B15R1.5392 C[C@@H](NC(=O)c1ccccc1)C(C)(C)C 240690a_100025703359_100000185807 [0,2,0,0,0,0|1,0,0]=3 9381 B15R1.5392 C[C@@H](NC(=O)c1ccccc1)C(C)(C)C 527a_100025703359_100000185807 [0,2,0,0,0,0|1,0,0]=3 9382 B15R1.5392 C[C@H](NC(=O)c1ccccc1)C(C)(C)O 11a_100025708725_100000185807 [0,2,0,0,0,0|1,0,0]=3 9383 B15R1.5392 C[C@H](NC(=O)c1ccccc1)C(C)(C)O 1626a_100025708725_100000185807 [0,2,0,0,0,0|1,0,0]=3 9384 B15R1.5392 C[C@H](NC(=O)c1ccccc1)C(C)(C)O 240690a_100025708725_100000185807 [0,2,0,0,0,0|1,0,0]=3 9385 B15R1.5392 C[C@H](NC(=O)c1ccccc1)C(C)(C)O 527a_100025708725_100000185807 [0,2,0,0,0,0|1,0,0]=3 9386 B15R1.9011 CC(=O)C(C)(C)OC(=O)c1ccccc1 1458a_200010271906_200000210301 [0,2,0,0,0,0|1,0,1]=4 9387 B15R1.9011 CC(C)(OC(=O)c1ccccc1)C(=O)[13CH3] 1458a_200010271906_200025704644 [0,2,0,0,0,0|1,0,1]=4 9388 B15R1.9011 CC(C)C(C)(C)NC(=O)c1ccccc1 11a_200160471154_100000185807 [0,2,0,0,0,0|1,0,0]=3 9389 B15R1.9011 CC(C)C(C)(C)NC(=O)c1ccccc1 1626a_200160471154_100000185807 [0,2,0,0,0,0|1,0,0]=3 9390 B15R1.9011 CC(C)C(C)(C)NC(=O)c1ccccc1 240690a_200160471154_100000185807 [0,2,0,0,0,0|1,0,0]=3 9391 B15R1.9011 CC(C)C(C)(C)NC(=O)c1ccccc1 527a_200160471154_100000185807 [0,2,0,0,0,0|1,0,0]=3 9392 B15R1.9011 CC(C)S(=O)(=O)NC(=O)c1ccccc1 2740a_100000746418_100000185807 [0,2,0,0,0,0|2,0,0]=4 9393 B15R1.9011 CC(OC(C)(C)C(C)C)c1ccccc1 7a_100011215261_100000230085 [0,2,0,0,0,0|1,0,1]=4 9394 B15R1.880 CC(C)CC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000731052 [0,2,0,0,0,0|1,0,0]=3 9395 B15R1.880 CC(C)CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000731052 [0,2,0,0,0,0|1,0,0]=3 9396 B15R1.880 CC(C)CC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000731052 [0,2,0,0,0,0|1,0,0]=3 9397 B15R1.880 CC(C)CC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000731052 [0,2,0,0,0,0|1,0,0]=3 9398 B15R1.880 CC(C)CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000731052 [0,2,0,0,0,0|1,0,0]=3 9399 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 11a_100000747067_100000185839 [0,2,0,0,0,0|1,0,0]=3 9400 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 1626a_100000747067_100000185839 [0,2,0,0,0,0|1,0,0]=3 9401 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 240690a_100000747067_100000185839 [0,2,0,0,0,0|1,0,0]=3 9402 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 527a_100000747067_100000185839 [0,2,0,0,0,0|1,0,0]=3 9403 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 11a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 9404 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 1626a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 9405 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 240690a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 9406 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 527a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 9407 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 11a_100000747067_100000187176 [0,2,0,0,0,0|1,0,0]=3 9408 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 1626a_100000747067_100000187176 [0,2,0,0,0,0|1,0,0]=3 9409 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 240690a_100000747067_100000187176 [0,2,0,0,0,0|1,0,0]=3 9410 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 527a_100000747067_100000187176 [0,2,0,0,0,0|1,0,0]=3 9411 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 11a_100000747067_100000187904 [0,2,0,0,0,0|1,0,0]=3 9412 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 1626a_100000747067_100000187904 [0,2,0,0,0,0|1,0,0]=3 9413 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 240690a_100000747067_100000187904 [0,2,0,0,0,0|1,0,0]=3 9414 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 527a_100000747067_100000187904 [0,2,0,0,0,0|1,0,0]=3 9415 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)O 240690a_100000747067_100000212099 [0,2,0,0,0,0|1,0,0]=3 9416 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)O 527a_100000747067_100000212099 [0,2,0,0,0,0|1,0,0]=3 9417 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)Br 2230a_100138425928_100000184162 [0,2,0,0,0,0|2,0,0]=4 9418 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)Br 34a_100138425928_100000184162 [0,2,0,0,0,0|2,0,0]=4 9419 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)Cl 2230a_100138425928_100000183210 [0,2,0,0,0,0|2,0,0]=4 9420 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)F 2230a_100138425928_100000229918 [0,2,0,0,0,0|2,0,0]=4 9421 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)F 34a_100138425928_100000229918 [0,2,0,0,0,0|2,0,0]=4 9422 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)O 2230a_100138425928_200010205864 [0,2,0,0,0,0|2,0,0]=4 9423 B15R1.880 CC(C)NC(C)C(=O)c1ccc(cc1)O 34a_100138425928_200010205864 [0,2,0,0,0,0|2,0,0]=4 9424 B15R1.880 CC(C)OC(C)C(=O)c1ccc(cc1)Br 34a_100000212225_100000184162 [0,2,0,0,0,0|2,0,0]=4 9425 B15R1.880 CC(C)OC(C)C(=O)c1ccc(cc1)F 34a_100000212225_100000229918 [0,2,0,0,0,0|2,0,0]=4 9426 B15R1.880 CC(C)OC(C)C(=O)c1ccc(cc1)O 34a_100000212225_200010205864 [0,2,0,0,0,0|2,0,0]=4 9427 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)Br 62a_100000184162_100000210206 [0,2,0,0,0,0|2,0,0]=4 9428 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)Br 62a_100000210206_100000184162 [0,2,0,0,0,0|2,0,0]=4 9429 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)Cl 62a_100000183210_100000210206 [0,2,0,0,0,0|2,0,0]=4 9430 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)Cl 62a_100000210206_100000183210 [0,2,0,0,0,0|2,0,0]=4 9431 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)F 62a_100000210206_100000229918 [0,2,0,0,0,0|2,0,0]=4 9432 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)F 62a_100000229918_100000210206 [0,2,0,0,0,0|2,0,0]=4 9433 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)O 62a_100000210206_200010205864 [0,2,0,0,0,0|2,0,0]=4 9434 B15R1.880 CC(C)SC(C)C(=O)c1ccc(cc1)O 62a_200010205864_100000210206 [0,2,0,0,0,0|2,0,0]=4 9435 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Br 240690a_100000227577_100000185839 [0,2,0,0,0,0|2,0,0]=4 9436 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Br 527a_100000227577_100000185839 [0,2,0,0,0,0|2,0,0]=4 9437 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Cl 240690a_100000227577_100000210187 [0,2,0,0,0,0|2,0,0]=4 9438 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Cl 527a_100000227577_100000210187 [0,2,0,0,0,0|2,0,0]=4 9439 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)F 240690a_100000227577_100000187176 [0,2,0,0,0,0|2,0,0]=4 9440 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)F 527a_100000227577_100000187176 [0,2,0,0,0,0|2,0,0]=4 9441 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)I 240690a_100000227577_100000187904 [0,2,0,0,0,0|2,0,0]=4 9442 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)I 527a_100000227577_100000187904 [0,2,0,0,0,0|2,0,0]=4 9443 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)O 240690a_100000227577_100000212099 [0,2,0,0,0,0|2,0,0]=4 9444 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)O 527a_100000227577_100000212099 [0,2,0,0,0,0|2,0,0]=4 9445 B15R1.880 Cc1ccc(cc1)C(=O)C(C)CC(C)C 1458a_100000188618_100000731052 [0,2,0,0,0,0|1,0,0]=3 9446 B15R1.880 Cc1ccc(cc1)C(=O)C(C)NC(C)C 2230a_100138425928_100000726416 [0,2,0,0,0,0|2,0,0]=4 9447 B15R1.880 Cc1ccc(cc1)C(=O)C(C)NC(C)C 34a_100138425928_100000726416 [0,2,0,0,0,0|2,0,0]=4 9448 B15R1.880 Cc1ccc(cc1)C(=O)C(C)OC(C)C 34a_100000212225_100000726416 [0,2,0,0,0,0|2,0,0]=4 9449 B15R1.880 Cc1ccc(cc1)C(=O)C(C)SC(C)C 62a_100000210206_100000726416 [0,2,0,0,0,0|2,0,0]=4 9450 B15R1.880 Cc1ccc(cc1)C(=O)C(C)SC(C)C 62a_100000726416_100000210206 [0,2,0,0,0,0|2,0,0]=4 9451 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 11a_100000747067_100000188618 [0,2,0,0,0,0|1,0,0]=3 9452 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 1626a_100000747067_100000188618 [0,2,0,0,0,0|1,0,0]=3 9453 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 240690a_100000747067_100000188618 [0,2,0,0,0,0|1,0,0]=3 9454 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 527a_100000747067_100000188618 [0,2,0,0,0,0|1,0,0]=3 9455 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)O 240690a_100000227577_100000188618 [0,2,0,0,0,0|2,0,0]=4 9456 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)O 527a_100000227577_100000188618 [0,2,0,0,0,0|2,0,0]=4 9457 B15R1.1357 CCN(CC(C)C)C(=O)c1ccccc1 11a_100000738554_100000185807 [0,2,0,0,0,0|1,0,0]=3 9458 B15R1.1357 CCN(CC(C)C)C(=O)c1ccccc1 1626a_100000738554_100000185807 [0,2,0,0,0,0|1,0,0]=3 9459 B15R1.1357 CCN(CC(C)C)C(=O)c1ccccc1 240690a_100000738554_100000185807 [0,2,0,0,0,0|1,0,0]=3 9460 B15R1.1357 CCN(CC(C)C)C(=O)c1ccccc1 527a_100000738554_100000185807 [0,2,0,0,0,0|1,0,0]=3 9461 B15R1.1357 CCN(C[C@H](C)O)C(=O)c1ccccc1 240690a_100000729506_100000185807 [0,2,0,0,0,0|2,0,0]=4 9462 B15R1.1357 CCN(C[C@H](C)O)C(=O)c1ccccc1 527a_100000729506_100000185807 [0,2,0,0,0,0|2,0,0]=4 9463 B15R1.3977 CC(NC(C)(C)C)C(=O)c1ccccc1 2230a_100000715429_100000239700 [0,2,0,0,0,0|2,0,0]=4 9464 B15R1.3977 CC(OC(C)(C)C)C(=O)c1ccccc1 7a_100015890283_100000239700 [0,2,0,0,0,0|2,0,0]=4 9465 B15R1.3977 CC(SC(C)(C)C)C(=O)c1ccccc1 62a_100000211941_100000239700 [0,2,0,0,0,0|2,0,0]=4 9466 B15R1.3977 CC(SC(C)(C)C)C(=O)c1ccccc1 62a_100000239700_100000211941 [0,2,0,0,0,0|2,0,0]=4 9467 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 11a_100000742839_100000185807 [0,2,0,0,0,0|1,0,0]=3 9468 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 1626a_100000742839_100000185807 [0,2,0,0,0,0|1,0,0]=3 9469 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 240690a_100000742839_100000185807 [0,2,0,0,0,0|1,0,0]=3 9470 B15R1.3977 CN(CC(C)(C)C)C(=O)c1ccccc1 527a_100000742839_100000185807 [0,2,0,0,0,0|1,0,0]=3 9471 B15R1.3977 CN(CC(C)(C)O)C(=O)c1ccccc1 1626a_100000755907_100000185807 [0,2,0,0,0,0|1,0,0]=3 9472 B15R1.3977 CN(CC(C)(C)O)C(=O)c1ccccc1 240690a_100000755907_100000185807 [0,2,0,0,0,0|1,0,0]=3 9473 B15R1.3977 CN(CC(C)(C)O)C(=O)c1ccccc1 527a_100000755907_100000185807 [0,2,0,0,0,0|1,0,0]=3 9474 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 11a_200020589227_100000185807 [0,2,0,0,0,0|1,1,0]=4 9475 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 1626a_200020589227_100000185807 [0,2,0,0,0,0|1,1,0]=4 9476 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 240690a_200020589227_100000185807 [0,2,0,0,0,0|1,1,0]=4 9477 B15R1.3977 CN(C[Si](C)(C)C)C(=O)c1ccccc1 527a_200020589227_100000185807 [0,2,0,0,0,0|1,1,0]=4 9478 B15R1.12173 CC(C)CN(C)S(=O)(=O)c1ccccc1 270084a_100000747067_100000210345 [0,2,0,0,0,0|2,0,0]=4 9479 B15R1.12173 CC(C)CN(C)S(=O)(=O)c1ccccc1 274078a_100000747067_100000210345 [0,2,0,0,0,0|2,0,0]=4 9480 B15R1.12173 CC(C)CN(C)S(=O)(=O)c1ccccc1 40a_100000747067_100000032697 [0,2,0,0,0,0|2,0,0]=4 9481 B15R1.12235 CC(C)NC(C)(C)C(=O)c1ccccc1 2230a_100138425928_200009813919 [0,2,0,0,0,0|2,0,0]=4 9482 B15R1.12235 CC(C)OC(C)(C)C(=O)c1ccccc1 34a_100011217161_100000210206 [0,2,0,0,0,0|2,0,0]=4 9483 B15R1.12235 CC(C)OC(C)(C)C(=O)c1ccccc1 7a_100011217161_100000210206 [0,2,0,0,0,0|2,0,0]=4 9484 B15R1.12235 CC(C)SC(C)(C)C(=O)c1ccccc1 62a_100000210206_200009813919 [0,2,0,0,0,0|2,0,0]=4 9485 B15R1.12235 CC(C)SC(C)(C)C(=O)c1ccccc1 62a_200009813919_100000210206 [0,2,0,0,0,0|2,0,0]=4 9486 B15R1.12235 CC(C)SC(F)(F)C(=O)c1ccccc1 62a_100000210206_100011214938 [0,2,0,0,0,0|2,0,0]=4 9487 B15R1.12235 CC(C)SC(F)(F)C(=O)c1ccccc1 62a_100011214938_100000210206 [0,2,0,0,0,0|2,0,0]=4 9488 B15R1.659 C#CC(OCC(C)C)c1ccc(cc1)Cl 34a_100011470666_100000210624 [0,2,0,0,0,0|1,0,1]=4 9489 B15R1.659 C#CC(OCC(C)C)c1ccc(cc1)Cl 7a_100011470666_100000210760 [0,2,0,0,0,0|1,0,1]=4 9490 B15R1.659 CC(C)COC(CCl)c1ccc(cc1)Cl 34a_200011996143_100000210624 [0,2,0,0,0,0|1,0,1]=4 9491 B15R1.659 CC(C)COC(CCl)c1ccc(cc1)Cl 7a_200011996143_100000210760 [0,2,0,0,0,0|1,0,1]=4 9492 B15R1.659 CC(C)COC(CN)c1ccc(cc1)Br 34a_100020626992_100000210624 [0,2,0,0,0,0|1,0,1]=4 9493 B15R1.659 CC(C)COC(CN)c1ccc(cc1)Cl 34a_100000736658_100000210624 [0,2,0,0,0,0|1,0,1]=4 9494 B15R1.659 CC(C)CO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_100000210624 [0,2,0,0,0,0|1,0,1]=4 9495 B15R1.659 CC(C)CO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_100000210760 [0,2,0,0,0,0|1,0,1]=4 9496 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)Br 34a_100000246506_100000210624 [0,2,0,0,0,0|1,0,1]=4 9497 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)Br 7a_100000246506_100000210760 [0,2,0,0,0,0|1,0,1]=4 9498 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)C 34a_100000246521_100000210624 [0,2,0,0,0,0|1,0,1]=4 9499 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)C 7a_100000246521_100000210760 [0,2,0,0,0,0|1,0,1]=4 9500 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)Cl 34a_100000246471_100000210624 [0,2,0,0,0,0|1,0,1]=4 9501 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)Cl 7a_100000246471_100000210760 [0,2,0,0,0,0|1,0,1]=4 9502 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)F 34a_100000246474_100000210624 [0,2,0,0,0,0|1,0,1]=4 9503 B15R1.659 CCC(OCC(C)C)c1ccc(cc1)F 7a_100000246474_100000210760 [0,2,0,0,0,0|1,0,1]=4 9504 B15R1.659 Cc1ccc(cc1)[C@H](C#N)OCC(C)C 34a_200009814964_100000210624 [0,2,0,0,0,0|1,0,1]=4 9505 B15R1.659 Cc1ccc(cc1)[C@H](C#N)OCC(C)C 7a_200009814964_100000210760 [0,2,0,0,0,0|1,0,1]=4 9506 B15R1.1299 C=CCC(OCC(C)C)c1ccccc1 34a_100000687291_100000210624 [0,2,0,0,0,0|1,0,1]=4 9507 B15R1.1299 C=CCC(OCC(C)C)c1ccccc1 7a_100000687291_100000210760 [0,2,0,0,0,0|1,0,1]=4 9508 B15R1.1299 CC(C)COC(CCN)c1ccccc1 34a_100000763605_100000210624 [0,2,0,0,0,0|1,0,1]=4 9509 B15R1.1299 CC(C)CO[C@H](CC#N)c1ccccc1 7a_100009817555_100000210760 [0,2,0,0,0,0|1,0,1]=4 9510 B15R1.1299 CC(C)CO[C@H](CCCl)c1ccccc1 34a_100000729684_100000210624 [0,2,0,0,0,0|1,0,1]=4 9511 B15R1.1299 CC(C)CO[C@H](CCCl)c1ccccc1 7a_100000729684_100000210760 [0,2,0,0,0,0|1,0,1]=4 9512 B15R1.1299 CCCC(OCC(C)C)c1ccccc1 34a_100000747916_100000210624 [0,2,0,0,0,0|1,0,1]=4 9513 B15R1.1299 CCCC(OCC(C)C)c1ccccc1 7a_100000747916_100000210760 [0,2,0,0,0,0|1,0,1]=4 9514 B15R1.5334 C#CC(OCC(C)(C)C)c1ccccc1 34a_100011219616_100011219605 [0,2,0,0,0,0|1,0,1]=4 9515 B15R1.5334 C#CC(OCC(C)(C)F)c1ccccc1 34a_100011219616_100011997219 [0,2,0,0,0,0|1,0,1]=4 9516 B15R1.5334 C#CC(OCC(C)(C)O)c1ccccc1 34a_100011219616_100000764493 [0,2,0,0,0,0|1,0,1]=4 9517 B15R1.5334 C#CC(OCC(C)(C)O)c1ccccc1 7a_100011219616_100000764493 [0,2,0,0,0,0|1,0,1]=4 9518 B15R1.5334 C=CC(OCC(C)(C)C)c1ccccc1 34a_100011215659_100011219605 [0,2,0,0,0,0|1,0,1]=4 9519 B15R1.5334 C=CC(OCC(C)(C)F)c1ccccc1 34a_100011215659_100011997219 [0,2,0,0,0,0|1,0,1]=4 9520 B15R1.5334 C=CC(OCC(C)(C)O)c1ccccc1 34a_100011215659_100000764493 [0,2,0,0,0,0|1,0,1]=4 9521 B15R1.5334 C=CC(OCC(C)(C)O)c1ccccc1 7a_100011215659_100000764493 [0,2,0,0,0,0|1,0,1]=4 9522 B15R1.5334 CC(C)(C)COC(CN)c1ccccc1 34a_100000210709_100011219605 [0,2,0,0,0,0|1,0,1]=4 9523 B15R1.5334 CC(C)(C)CO[C@H](CCl)c1ccccc1 34a_100011933945_100011219605 [0,2,0,0,0,0|1,0,1]=4 9524 B15R1.5334 CC(C)(F)COC(CN)c1ccccc1 34a_100000210709_100011997219 [0,2,0,0,0,0|1,0,1]=4 9525 B15R1.5334 CC(C)(F)CO[C@H](CCl)c1ccccc1 34a_100011933945_100011997219 [0,2,0,0,0,0|1,0,1]=4 9526 B15R1.5334 CC(C)(O)COC(C#N)c1ccccc1 7a_100011217353_100000764493 [0,2,0,0,0,0|1,0,1]=4 9527 B15R1.5334 CC(C)(O)COC(CBr)c1ccccc1 7a_100000185958_100000764493 [0,2,0,0,0,0|1,0,1]=4 9528 B15R1.5334 CC(C)(O)COC(CN)c1ccccc1 34a_100000210709_100000764493 [0,2,0,0,0,0|1,0,1]=4 9529 B15R1.5334 CC(C)(O)CO[C@H](CCl)c1ccccc1 34a_100011933945_100000764493 [0,2,0,0,0,0|1,0,1]=4 9530 B15R1.5334 CC(C)(O)CO[C@H](CCl)c1ccccc1 7a_100011933945_100000764493 [0,2,0,0,0,0|1,0,1]=4 9531 B15R1.5334 CCC(OCC(C)(C)C)c1ccccc1 34a_100000698172_100011219605 [0,2,0,0,0,0|1,0,1]=4 9532 B15R1.5334 CCC(OCC(C)(C)F)c1ccccc1 34a_100000698172_100011997219 [0,2,0,0,0,0|1,0,1]=4 9533 B15R1.5334 CCC(OCC(C)(C)O)c1ccccc1 34a_100000698172_100000764493 [0,2,0,0,0,0|1,0,1]=4 9534 B15R1.5334 CCC(OCC(C)(C)O)c1ccccc1 7a_100000698172_100000764493 [0,2,0,0,0,0|1,0,1]=4 9535 B15R1.12293 C=C(C)C(OCC(C)C)c1ccccc1 34a_200011216824_100000210624 [0,2,0,0,0,0|1,0,1]=4 9536 B15R1.12293 C=C(C)C(OCC(C)C)c1ccccc1 7a_200011216824_100000210760 [0,2,0,0,0,0|1,0,1]=4 9537 B15R1.12293 CC(=O)C(NCC(C)C)c1ccccc1 2230a_100000210953_100009888967 [0,2,0,0,0,0|1,0,1]=4 9538 B15R1.12293 CC(=O)C(SCC(C)C)c1ccccc1 62a_100000210624_100009888967 [0,2,0,0,0,0|0,1,1]=4 9539 B15R1.12293 CC(=O)C(SCC(C)C)c1ccccc1 62a_100009888967_100000210760 [0,2,0,0,0,0|0,1,1]=4 9540 B15R1.12293 CC(C)CNC(C(=O)N)c1ccccc1 2230a_100000210953_100000188848 [0,2,0,0,0,0|1,0,1]=4 9541 B15R1.12293 CC(C)CNC(C(=O)O)c1ccccc1 269956a_100000230147_100000210760 [0,2,0,0,0,0|1,0,1]=4 9542 B15R1.12293 CC(C)CN[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_100000210760 [0,2,0,0,0,0|1,0,1]=4 9543 B15R1.12293 CC(C)CN[C@@H](C(=O)N)c1ccccc1 270004a_100011423151_100000210432 [0,2,0,0,0,0|1,0,1]=4 9544 B15R1.12293 CC(C)COC(C(=O)N)c1ccccc1 34a_100011200849_100000210624 [0,2,0,0,0,0|0,0,1]=3 9545 B15R1.12293 CC(C)COC(C(=O)N)c1ccccc1 7a_100011200849_100000210760 [0,2,0,0,0,0|0,0,1]=3 9546 B15R1.12293 CC(C)COC(c1ccccc1)C(C)C 34a_200011217822_100000210624 [0,2,0,0,0,0|1,0,1]=4 9547 B15R1.12293 CC(C)COC(c1ccccc1)C(C)C 7a_200011217822_100000210760 [0,2,0,0,0,0|1,0,1]=4 9548 B15R1.12293 CC(C)CSC(C(=O)N)c1ccccc1 62a_100000188848_100000210760 [0,2,0,0,0,0|0,1,1]=4 9549 B15R1.12293 CC(C)CSC(C(=O)N)c1ccccc1 62a_100000210624_100000188848 [0,2,0,0,0,0|0,1,1]=4 9550 B15R1.12293 CC(O)COC(C(=O)N)c1ccccc1 34a_100011200849_100011218427 [0,2,0,0,0,0|1,0,1]=4 9551 B15R1.12293 CC(O)COC(C(=O)N)c1ccccc1 7a_100011200849_100011218427 [0,2,0,0,0,0|1,0,1]=4 9552 B15R1.12293 C[C@@H](O)COC(C(=O)N)c1ccccc1 34a_100011200849_100009817552 [0,2,0,0,0,0|1,0,1]=4 9553 B15R1.12293 C[C@@H](O)COC(C(=O)N)c1ccccc1 7a_100011200849_100009817552 [0,2,0,0,0,0|1,0,1]=4 9554 B15R1.13394 C#CC(C)(OCC(C)C)c1ccccc1 34a_100000198054_100000210624 [0,2,0,0,0,0|1,0,1]=4 9555 B15R1.13394 C#CC(C)(OCC(C)C)c1ccccc1 7a_100000198054_100000210760 [0,2,0,0,0,0|1,0,1]=4 9556 B15R1.13394 CCC(C)(OCC(C)C)c1ccccc1 7a_100000748282_100000210760 [0,2,0,0,0,0|1,0,1]=4 9557 B15R1.5 C#Cc1ccc(cc1)C(=O)CCC(C)C 1458a_100011217615_100000210312 [0,2,0,0,0,0|1,0,0]=3 9558 B15R1.5 C#Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100011217615_100012276601 [0,2,0,0,0,0|2,0,0]=4 9559 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100011217615 [0,2,0,0,0,0|1,0,0]=3 9560 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100011217615 [0,2,0,0,0,0|1,0,0]=3 9561 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100011217615 [0,2,0,0,0,0|1,0,0]=3 9562 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100011217615 [0,2,0,0,0,0|1,0,0]=3 9563 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100011217615 [0,2,0,0,0,0|2,0,0]=4 9564 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100011217615 [0,2,0,0,0,0|2,0,0]=4 9565 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100011217615 [0,2,0,0,0,0|2,0,0]=4 9566 B15R1.5 C#Cc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100011217615 [0,2,0,0,0,0|2,0,0]=4 9567 B15R1.5 C=Cc1ccc(cc1)C(=O)CCC(C)C 1458a_100000687532_100000210312 [0,2,0,0,0,0|1,0,0]=3 9568 B15R1.5 C=Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100000687532_100012276601 [0,2,0,0,0,0|2,0,0]=4 9569 B15R1.5 C=Cc1ccc(cc1)C(=O)CCN(C)C 271570a_100011290941_200102510076 [0,2,0,0,0,0|2,0,0]=4 9570 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000687532 [0,2,0,0,0,0|1,0,0]=3 9571 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000687532 [0,2,0,0,0,0|1,0,0]=3 9572 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000687532 [0,2,0,0,0,0|1,0,0]=3 9573 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 271570a_100011290941_200000155730 [0,2,0,0,0,0|1,0,0]=3 9574 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000687532 [0,2,0,0,0,0|1,0,0]=3 9575 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000687532 [0,2,0,0,0,0|2,0,0]=4 9576 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000687532 [0,2,0,0,0,0|2,0,0]=4 9577 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000687532 [0,2,0,0,0,0|2,0,0]=4 9578 B15R1.5 C=Cc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100000687532 [0,2,0,0,0,0|2,0,0]=4 9579 B15R1.5 C=Cc1ccc(cc1)C(=O)OCC(=O)C 271570a_100011290941_200027936475 [0,2,0,0,0,0|1,0,1]=4 9580 B15R1.5 CC(=O)COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_200027936475 [0,2,0,0,0,0|1,0,1]=4 9581 B15R1.5 CC(=O)COC(=O)c1ccc(cc1)S[13CH3] 62a_200027936475_200025704644 [0,2,0,0,0,0|1,0,1]=4 9582 B15R1.5 CC(C)CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210312 [0,2,0,0,0,0|1,0,0]=3 9583 B15R1.5 CC(C)CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210312 [0,2,0,0,0,0|1,0,0]=3 9584 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 11a_100000210953_100000210717 [0,2,0,0,0,0|1,0,0]=3 9585 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 1626a_100000210953_100000210717 [0,2,0,0,0,0|1,0,0]=3 9586 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 240690a_100000210953_100000210717 [0,2,0,0,0,0|1,0,0]=3 9587 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 527a_100000210953_100000210717 [0,2,0,0,0,0|1,0,0]=3 9588 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)CO 1626a_100000210953_100000183892 [0,2,0,0,0,0|1,0,0]=3 9589 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)CO 240690a_100000210953_100000183892 [0,2,0,0,0,0|1,0,0]=3 9590 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)S[13CH3] 62a_200000155730_200025704644 [0,2,0,0,0,0|1,0,0]=3 9591 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_200000155730 [0,2,0,0,0,0|1,0,0]=3 9592 B15R1.5 CC(C)COC(=O)c1ccc(cc1)O[13CH3] 34a_100000005784_200025704644 [0,2,0,0,0,0|0,0,0]=2 9593 B15R1.5 CC(C)COC(=O)c1ccc(cc1)O[13CH3] 7a_100000005784_200025704644 [0,2,0,0,0,0|0,0,0]=2 9594 B15R1.5 CC(C)COC(C)c1ccc(cc1)CN 34a_200000048501_100000210624 [0,2,0,0,0,0|1,0,1]=4 9595 B15R1.5 CC(C)CO[C@@H](C)c1ccc(cc1)C#N 34a_100011852132_100000210624 [0,2,0,0,0,0|1,0,1]=4 9596 B15R1.5 CC(C)CO[C@@H](C)c1ccc(cc1)C#N 7a_100011852132_100000210760 [0,2,0,0,0,0|1,0,1]=4 9597 B15R1.5 CC(C)NCC(=O)c1ccc(cc1)C#N 2230a_100138425928_100000212069 [0,2,0,0,0,0|2,0,0]=4 9598 B15R1.5 CC(C)NNC(=O)c1ccc(cc1)C#N 22a_100000741168_100000210717 [0,2,0,0,0,0|2,0,0]=4 9599 B15R1.5 CC(C)NNC(=O)c1ccc(cc1)CO 22a_100000741168_100000183892 [0,2,0,0,0,0|2,0,0]=4 9600 B15R1.5 CC(C)OCC(=O)c1ccc(cc1)C#N 34a_100011592799_100000210206 [0,2,0,0,0,0|2,0,0]=4 9601 B15R1.5 CC(C)SCC(=O)c1ccc(cc1)C#N 62a_100000210206_100000212069 [0,2,0,0,0,0|2,0,0]=4 9602 B15R1.5 CC(C)SCC(=O)c1ccc(cc1)C#N 62a_100000212069_100000210206 [0,2,0,0,0,0|2,0,0]=4 9603 B15R1.5 CC(O)CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100012276601 [0,2,0,0,0,0|2,0,0]=4 9604 B15R1.5 CC(O)CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100012276601 [0,2,0,0,0,0|2,0,0]=4 9605 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)C#N 11a_100000210904_100000210717 [0,2,0,0,0,0|2,0,0]=4 9606 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)C#N 240690a_100000210904_100000210717 [0,2,0,0,0,0|2,0,0]=4 9607 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)C#N 527a_100000210904_100000210717 [0,2,0,0,0,0|2,0,0]=4 9608 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)CO 240690a_100000210904_100000183892 [0,2,0,0,0,0|2,0,0]=4 9609 B15R1.5 CCc1ccc(cc1)C(=O)CCC(C)C 1458a_100000211226_100000210312 [0,2,0,0,0,0|1,0,0]=3 9610 B15R1.5 CCc1ccc(cc1)C(=O)CCC(C)O 1458a_100000211226_100012276601 [0,2,0,0,0,0|2,0,0]=4 9611 B15R1.5 CCc1ccc(cc1)C(=O)CNC(C)C 2230a_100138425928_100000689809 [0,2,0,0,0,0|2,0,0]=4 9612 B15R1.5 CCc1ccc(cc1)C(=O)CSC(C)C 62a_100000210206_100000689809 [0,2,0,0,0,0|2,0,0]=4 9613 B15R1.5 CCc1ccc(cc1)C(=O)CSC(C)C 62a_100000689809_100000210206 [0,2,0,0,0,0|2,0,0]=4 9614 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000211226 [0,2,0,0,0,0|1,0,0]=3 9615 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000211226 [0,2,0,0,0,0|1,0,0]=3 9616 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000211226 [0,2,0,0,0,0|1,0,0]=3 9617 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000211226 [0,2,0,0,0,0|1,0,0]=3 9618 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000211226 [0,2,0,0,0,0|2,0,0]=4 9619 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000211226 [0,2,0,0,0,0|2,0,0]=4 9620 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000211226 [0,2,0,0,0,0|2,0,0]=4 9621 B15R1.5 CCc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100000211226 [0,2,0,0,0,0|2,0,0]=4 9622 B15R1.5 CCc1ccc(cc1)C(C)OCC(C)C 34a_100011232672_100000210624 [0,2,0,0,0,0|1,0,1]=4 9623 B15R1.5 CCc1ccc(cc1)C(C)OCC(C)C 7a_100011232672_100000210760 [0,2,0,0,0,0|1,0,1]=4 9624 B15R1.5 CN(C)CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_200102510076 [0,2,0,0,0,0|2,0,0]=4 9625 B15R1.5 CN(C)CCC(=O)c1ccc(cc1)S[13CH3] 62a_200102510076_200025704644 [0,2,0,0,0,0|2,0,0]=4 9626 B15R1.5 CNc1ccc(cc1)C(=O)NCC(C)C 27a_100102657272_200000155730 [0,2,0,0,0,0|1,0,0]=3 9627 B15R1.5 COc1ccc(cc1)C(=O)CCC(C)C 1458a_100000184203_100000210312 [0,2,0,0,0,0|1,0,0]=3 9628 B15R1.5 COc1ccc(cc1)C(=O)CCC(C)O 1458a_100000184203_100012276601 [0,2,0,0,0,0|2,0,0]=4 9629 B15R1.5 COc1ccc(cc1)C(=O)CCN(C)C 2230a_100102631434_100000700936 [0,2,0,0,0,0|2,0,0]=4 9630 B15R1.5 COc1ccc(cc1)C(=O)CCN(C)C 269982a_100102631434_100000700936 [0,2,0,0,0,0|2,0,0]=4 9631 B15R1.5 COc1ccc(cc1)C(=O)CNC(C)C 2230a_100138425928_100000212054 [0,2,0,0,0,0|2,0,0]=4 9632 B15R1.5 COc1ccc(cc1)C(=O)CSC(C)C 62a_100000210206_100000212054 [0,2,0,0,0,0|2,0,0]=4 9633 B15R1.5 COc1ccc(cc1)C(=O)CSC(C)C 62a_100000212054_100000210206 [0,2,0,0,0,0|2,0,0]=4 9634 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000184203 [0,2,0,0,0,0|1,0,0]=3 9635 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000184203 [0,2,0,0,0,0|1,0,0]=3 9636 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000184203 [0,2,0,0,0,0|1,0,0]=3 9637 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000184203 [0,2,0,0,0,0|1,0,0]=3 9638 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000184203 [0,2,0,0,0,0|2,0,0]=4 9639 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000184203 [0,2,0,0,0,0|2,0,0]=4 9640 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000184203 [0,2,0,0,0,0|2,0,0]=4 9641 B15R1.5 COc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100000184203 [0,2,0,0,0,0|2,0,0]=4 9642 B15R1.5 COc1ccc(cc1)C(=O)OCC(C)C 34a_100000005784_200000210301 [0,2,0,0,0,0|0,0,0]=2 9643 B15R1.5 COc1ccc(cc1)C(=O)OCC(C)C 7a_100000005784_200000210301 [0,2,0,0,0,0|0,0,0]=2 9644 B15R1.5 COc1ccc(cc1)C(C)OCC(C)C 34a_100000742907_100000210624 [0,2,0,0,0,0|1,0,1]=4 9645 B15R1.5 COc1ccc(cc1)C(C)OCC(C)C 7a_100000742907_100000210760 [0,2,0,0,0,0|1,0,1]=4 9646 B15R1.5 CSc1ccc(cc1)C(=O)CCC(C)C 1458a_100000189692_100000210312 [0,2,0,0,0,0|1,0,0]=3 9647 B15R1.5 CSc1ccc(cc1)C(=O)CCC(C)O 1458a_100000189692_100012276601 [0,2,0,0,0,0|2,0,0]=4 9648 B15R1.5 CSc1ccc(cc1)C(=O)CCN(C)C 62a_200000210301_200102510076 [0,2,0,0,0,0|2,0,0]=4 9649 B15R1.5 CSc1ccc(cc1)C(=O)CCN(C)C 62a_200102510076_200000210301 [0,2,0,0,0,0|2,0,0]=4 9650 B15R1.5 CSc1ccc(cc1)C(=O)CNC(C)C 2230a_100138425928_100011216809 [0,2,0,0,0,0|2,0,0]=4 9651 B15R1.5 CSc1ccc(cc1)C(=O)CNC(C)C 34a_100138425928_100011216809 [0,2,0,0,0,0|2,0,0]=4 9652 B15R1.5 CSc1ccc(cc1)C(=O)COC(C)C 34a_100000212225_100011216809 [0,2,0,0,0,0|2,0,0]=4 9653 B15R1.5 CSc1ccc(cc1)C(=O)CSC(C)C 62a_100000210206_100011216809 [0,2,0,0,0,0|2,0,0]=4 9654 B15R1.5 CSc1ccc(cc1)C(=O)CSC(C)C 62a_100011216809_100000210206 [0,2,0,0,0,0|2,0,0]=4 9655 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000189692 [0,2,0,0,0,0|1,0,0]=3 9656 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000189692 [0,2,0,0,0,0|1,0,0]=3 9657 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000189692 [0,2,0,0,0,0|1,0,0]=3 9658 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000189692 [0,2,0,0,0,0|1,0,0]=3 9659 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 62a_200000155730_200000210301 [0,2,0,0,0,0|1,0,0]=3 9660 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 62a_200000210301_200000155730 [0,2,0,0,0,0|1,0,0]=3 9661 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000189692 [0,2,0,0,0,0|2,0,0]=4 9662 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000189692 [0,2,0,0,0,0|2,0,0]=4 9663 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000189692 [0,2,0,0,0,0|2,0,0]=4 9664 B15R1.5 CSc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100000189692 [0,2,0,0,0,0|2,0,0]=4 9665 B15R1.5 CSc1ccc(cc1)C(=O)OCC(=O)C 62a_200000210301_200027936475 [0,2,0,0,0,0|1,0,1]=4 9666 B15R1.5 CSc1ccc(cc1)C(=O)OCC(=O)C 62a_200027936475_200000210301 [0,2,0,0,0,0|1,0,1]=4 9667 B15R1.892 CC(C)(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000755188 [0,2,0,0,0,0|1,0,0]=3 9668 B15R1.892 CC(C)(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000755188 [0,2,0,0,0,0|1,0,0]=3 9669 B15R1.892 CC(C)(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000755188 [0,2,0,0,0,0|1,0,0]=3 9670 B15R1.892 CC(C)(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000755188 [0,2,0,0,0,0|1,0,0]=3 9671 B15R1.892 CC(C)(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000755188 [0,2,0,0,0,0|1,0,0]=3 9672 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 11a_100000743828_100000185839 [0,2,0,0,0,0|1,0,0]=3 9673 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 1626a_100000743828_100000185839 [0,2,0,0,0,0|1,0,0]=3 9674 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 240690a_100000743828_100000185839 [0,2,0,0,0,0|1,0,0]=3 9675 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 527a_100000743828_100000185839 [0,2,0,0,0,0|1,0,0]=3 9676 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 11a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 9677 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 1626a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 9678 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 240690a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 9679 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 527a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 9680 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 11a_100000743828_100000187176 [0,2,0,0,0,0|1,0,0]=3 9681 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 1626a_100000743828_100000187176 [0,2,0,0,0,0|1,0,0]=3 9682 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 240690a_100000743828_100000187176 [0,2,0,0,0,0|1,0,0]=3 9683 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 527a_100000743828_100000187176 [0,2,0,0,0,0|1,0,0]=3 9684 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 11a_100000743828_100000187904 [0,2,0,0,0,0|1,0,0]=3 9685 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 1626a_100000743828_100000187904 [0,2,0,0,0,0|1,0,0]=3 9686 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 240690a_100000743828_100000187904 [0,2,0,0,0,0|1,0,0]=3 9687 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 527a_100000743828_100000187904 [0,2,0,0,0,0|1,0,0]=3 9688 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)O 240690a_100000743828_100000212099 [0,2,0,0,0,0|1,0,0]=3 9689 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)O 527a_100000743828_100000212099 [0,2,0,0,0,0|1,0,0]=3 9690 B15R1.892 CC(C)(C)NNC(=O)c1ccc(cc1)Br 22a_100000725372_100000185839 [0,2,0,0,0,0|2,0,0]=4 9691 B15R1.892 CC(C)(C)NNC(=O)c1ccc(cc1)Cl 22a_100000725372_100000210187 [0,2,0,0,0,0|2,0,0]=4 9692 B15R1.892 CC(C)(C)NNC(=O)c1ccc(cc1)F 22a_100000725372_100000187176 [0,2,0,0,0,0|2,0,0]=4 9693 B15R1.892 CC(C)(C)NNC(=O)c1ccc(cc1)I 22a_100000725372_100000187904 [0,2,0,0,0,0|2,0,0]=4 9694 B15R1.892 CC(C)(C)NNC(=O)c1ccc(cc1)O 22a_100000725372_100000212099 [0,2,0,0,0,0|2,0,0]=4 9695 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)Br 34a_100015890283_100000188085 [0,2,0,0,0,0|2,0,0]=4 9696 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)Br 7a_100015890283_100000188085 [0,2,0,0,0,0|2,0,0]=4 9697 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)Cl 7a_100015890283_100000211071 [0,2,0,0,0,0|2,0,0]=4 9698 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)F 34a_100000246311_100000210625 [0,2,0,0,0,0|2,0,0]=4 9699 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)F 7a_100015890283_100000211279 [0,2,0,0,0,0|2,0,0]=4 9700 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)I 34a_100015890283_100011216261 [0,2,0,0,0,0|2,0,0]=4 9701 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)I 7a_100015890283_100011216261 [0,2,0,0,0,0|2,0,0]=4 9702 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)O 34a_100015890283_100009814261 [0,2,0,0,0,0|2,0,0]=4 9703 B15R1.892 CC(C)(C)OCC(=O)c1ccc(cc1)O 7a_100015890283_100000018856 [0,2,0,0,0,0|2,0,0]=4 9704 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)Br 62a_100000188085_100000211941 [0,2,0,0,0,0|2,0,0]=4 9705 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000211941 [0,2,0,0,0,0|2,0,0]=4 9706 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211941_100000211071 [0,2,0,0,0,0|2,0,0]=4 9707 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)F 62a_100000211279_100000211941 [0,2,0,0,0,0|2,0,0]=4 9708 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)F 62a_100000211941_100000211279 [0,2,0,0,0,0|2,0,0]=4 9709 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)I 62a_100000211941_100011216261 [0,2,0,0,0,0|2,0,0]=4 9710 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)I 62a_100011216261_100000211941 [0,2,0,0,0,0|2,0,0]=4 9711 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)O 62a_100000211941_100009814261 [0,2,0,0,0,0|2,0,0]=4 9712 B15R1.892 CC(C)(C)SCC(=O)c1ccc(cc1)O 62a_100009814261_100000211941 [0,2,0,0,0,0|2,0,0]=4 9713 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 11a_100020643315_100000185839 [0,2,0,0,0,0|1,0,0]=3 9714 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 1626a_100020643315_100000185839 [0,2,0,0,0,0|1,0,0]=3 9715 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 240690a_100020643315_100000185839 [0,2,0,0,0,0|1,0,0]=3 9716 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 527a_100020643315_100000185839 [0,2,0,0,0,0|1,0,0]=3 9717 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 11a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 9718 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 1626a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 9719 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 240690a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 9720 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 527a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 9721 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 11a_100020643315_100000187176 [0,2,0,0,0,0|1,0,0]=3 9722 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 1626a_100020643315_100000187176 [0,2,0,0,0,0|1,0,0]=3 9723 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 240690a_100020643315_100000187176 [0,2,0,0,0,0|1,0,0]=3 9724 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 527a_100020643315_100000187176 [0,2,0,0,0,0|1,0,0]=3 9725 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 11a_100020643315_100000187904 [0,2,0,0,0,0|1,0,0]=3 9726 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 1626a_100020643315_100000187904 [0,2,0,0,0,0|1,0,0]=3 9727 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 240690a_100020643315_100000187904 [0,2,0,0,0,0|1,0,0]=3 9728 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 527a_100020643315_100000187904 [0,2,0,0,0,0|1,0,0]=3 9729 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)O 240690a_100020643315_100000212099 [0,2,0,0,0,0|1,0,0]=3 9730 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)O 527a_100020643315_100000212099 [0,2,0,0,0,0|1,0,0]=3 9731 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Br 1626a_100000751335_100000185839 [0,2,0,0,0,0|1,0,0]=3 9732 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Br 240690a_100000751335_100000185839 [0,2,0,0,0,0|1,0,0]=3 9733 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Br 527a_100000751335_100000185839 [0,2,0,0,0,0|1,0,0]=3 9734 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Cl 1626a_100000751335_100000210187 [0,2,0,0,0,0|1,0,0]=3 9735 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Cl 240690a_100000751335_100000210187 [0,2,0,0,0,0|1,0,0]=3 9736 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Cl 527a_100000751335_100000210187 [0,2,0,0,0,0|1,0,0]=3 9737 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)F 1626a_100000751335_100000187176 [0,2,0,0,0,0|1,0,0]=3 9738 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)F 240690a_100000751335_100000187176 [0,2,0,0,0,0|1,0,0]=3 9739 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)F 527a_100000751335_100000187176 [0,2,0,0,0,0|1,0,0]=3 9740 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)I 1626a_100000751335_100000187904 [0,2,0,0,0,0|1,0,0]=3 9741 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)I 240690a_100000751335_100000187904 [0,2,0,0,0,0|1,0,0]=3 9742 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)I 527a_100000751335_100000187904 [0,2,0,0,0,0|1,0,0]=3 9743 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)O 240690a_100000751335_100000212099 [0,2,0,0,0,0|1,0,0]=3 9744 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)O 527a_100000751335_100000212099 [0,2,0,0,0,0|1,0,0]=3 9745 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 11a_100000731000_100000185839 [0,2,0,0,0,0|2,0,0]=4 9746 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 1626a_100000731000_100000185839 [0,2,0,0,0,0|2,0,0]=4 9747 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 240690a_100000731000_100000185839 [0,2,0,0,0,0|2,0,0]=4 9748 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 527a_100000731000_100000185839 [0,2,0,0,0,0|2,0,0]=4 9749 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 11a_100000731000_100000210187 [0,2,0,0,0,0|2,0,0]=4 9750 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 1626a_100000731000_100000210187 [0,2,0,0,0,0|2,0,0]=4 9751 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 240690a_100000731000_100000210187 [0,2,0,0,0,0|2,0,0]=4 9752 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 527a_100000731000_100000210187 [0,2,0,0,0,0|2,0,0]=4 9753 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 11a_100000731000_100000187176 [0,2,0,0,0,0|2,0,0]=4 9754 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 1626a_100000731000_100000187176 [0,2,0,0,0,0|2,0,0]=4 9755 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 240690a_100000731000_100000187176 [0,2,0,0,0,0|2,0,0]=4 9756 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 527a_100000731000_100000187176 [0,2,0,0,0,0|2,0,0]=4 9757 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 11a_100000731000_100000187904 [0,2,0,0,0,0|2,0,0]=4 9758 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 1626a_100000731000_100000187904 [0,2,0,0,0,0|2,0,0]=4 9759 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 240690a_100000731000_100000187904 [0,2,0,0,0,0|2,0,0]=4 9760 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 527a_100000731000_100000187904 [0,2,0,0,0,0|2,0,0]=4 9761 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)O 240690a_100000731000_100000212099 [0,2,0,0,0,0|2,0,0]=4 9762 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)O 527a_100000731000_100000212099 [0,2,0,0,0,0|2,0,0]=4 9763 B15R1.892 CC(OCC(C)(C)C)c1ccc(cc1)Br 34a_100000745893_100011219605 [0,2,0,0,0,0|1,0,1]=4 9764 B15R1.892 CC(OCC(C)(C)C)c1ccc(cc1)F 34a_100000181323_100011219605 [0,2,0,0,0,0|1,0,1]=4 9765 B15R1.892 CC(OCC(C)(C)C)c1ccc(cc1)N 34a_100011216399_100011219605 [0,2,0,0,0,0|1,0,1]=4 9766 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)Br 34a_100000716592_100000755118 [0,2,0,0,0,0|1,0,1]=4 9767 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)Br 34a_100000745893_100011997219 [0,2,0,0,0,0|1,0,1]=4 9768 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)F 34a_100000181323_100011997219 [0,2,0,0,0,0|1,0,1]=4 9769 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)F 34a_100000716592_100000743420 [0,2,0,0,0,0|1,0,1]=4 9770 B15R1.892 CC(OCC(C)(C)F)c1ccc(cc1)N 34a_100011216399_100011997219 [0,2,0,0,0,0|1,0,1]=4 9771 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)Br 34a_100000745893_100000764493 [0,2,0,0,0,0|1,0,1]=4 9772 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)Br 7a_100000745893_100000764493 [0,2,0,0,0,0|1,0,1]=4 9773 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)F 34a_100000181323_100000764493 [0,2,0,0,0,0|1,0,1]=4 9774 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)F 7a_100000181323_100000764493 [0,2,0,0,0,0|1,0,1]=4 9775 B15R1.892 CC(OCC(C)(C)O)c1ccc(cc1)N 34a_100011216399_100000764493 [0,2,0,0,0,0|1,0,1]=4 9776 B15R1.892 C[C@H](OCC(C)(C)C)c1ccc(cc1)Cl 34a_100011852131_100011219605 [0,2,0,0,0,0|1,0,1]=4 9777 B15R1.892 C[C@H](OCC(C)(C)F)c1ccc(cc1)Cl 34a_100011852131_100011997219 [0,2,0,0,0,0|1,0,1]=4 9778 B15R1.892 C[C@H](OCC(C)(C)O)c1ccc(cc1)Cl 34a_100011852131_100000764493 [0,2,0,0,0,0|1,0,1]=4 9779 B15R1.892 C[C@H](OCC(C)(C)O)c1ccc(cc1)Cl 7a_100011852131_100000764493 [0,2,0,0,0,0|1,0,1]=4 9780 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000085578 [0,2,0,0,0,0|2,0,0]=4 9781 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000085578 [0,2,0,0,0,0|2,0,0]=4 9782 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000085578 [0,2,0,0,0,0|2,0,0]=4 9783 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000085578 [0,2,0,0,0,0|2,0,0]=4 9784 B15R1.892 C[N+](C)(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000085578 [0,2,0,0,0,0|2,0,0]=4 9785 B15R1.892 C[Si](C)(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_200000733723 [0,2,0,0,0,0|1,1,0]=4 9786 B15R1.892 C[Si](C)(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000733723 [0,2,0,0,0,0|1,1,0]=4 9787 B15R1.892 C[Si](C)(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_200000733723 [0,2,0,0,0,0|1,1,0]=4 9788 B15R1.892 C[Si](C)(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_200000733723 [0,2,0,0,0,0|1,1,0]=4 9789 B15R1.892 C[Si](C)(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_200000733723 [0,2,0,0,0,0|1,1,0]=4 9790 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Br 11a_102516607284_100000185839 [0,2,0,0,0,0|1,1,0]=4 9791 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Br 1626a_102516607284_100000185839 [0,2,0,0,0,0|1,1,0]=4 9792 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Br 240690a_102516607284_100000185839 [0,2,0,0,0,0|1,1,0]=4 9793 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Br 527a_102516607284_100000185839 [0,2,0,0,0,0|1,1,0]=4 9794 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 11a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 9795 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 1626a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 9796 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 240690a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 9797 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 527a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 9798 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)F 11a_102516607284_100000187176 [0,2,0,0,0,0|1,1,0]=4 9799 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)F 1626a_102516607284_100000187176 [0,2,0,0,0,0|1,1,0]=4 9800 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)F 240690a_102516607284_100000187176 [0,2,0,0,0,0|1,1,0]=4 9801 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)F 527a_102516607284_100000187176 [0,2,0,0,0,0|1,1,0]=4 9802 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)I 11a_102516607284_100000187904 [0,2,0,0,0,0|1,1,0]=4 9803 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)I 1626a_102516607284_100000187904 [0,2,0,0,0,0|1,1,0]=4 9804 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)I 240690a_102516607284_100000187904 [0,2,0,0,0,0|1,1,0]=4 9805 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)I 527a_102516607284_100000187904 [0,2,0,0,0,0|1,1,0]=4 9806 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)O 240690a_102516607284_100000212099 [0,2,0,0,0,0|1,1,0]=4 9807 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)O 527a_102516607284_100000212099 [0,2,0,0,0,0|1,1,0]=4 9808 B15R1.892 Cc1ccc(cc1)C(=O)CCC(C)(C)C 1458a_100000188618_100000755188 [0,2,0,0,0,0|1,0,0]=3 9809 B15R1.892 Cc1ccc(cc1)C(=O)CC[N+](C)(C)C 1458a_100000188618_100000085578 [0,2,0,0,0,0|2,0,0]=4 9810 B15R1.892 Cc1ccc(cc1)C(=O)CC[Si](C)(C)C 1458a_100000188618_200000733723 [0,2,0,0,0,0|1,1,0]=4 9811 B15R1.892 Cc1ccc(cc1)C(=O)CNC(C)(C)C 2230a_100000715429_100000211441 [0,2,0,0,0,0|2,0,0]=4 9812 B15R1.892 Cc1ccc(cc1)C(=O)COC(C)(C)C 34a_100015890283_100000211441 [0,2,0,0,0,0|2,0,0]=4 9813 B15R1.892 Cc1ccc(cc1)C(=O)COC(C)(C)C 7a_100015890283_100000211441 [0,2,0,0,0,0|2,0,0]=4 9814 B15R1.892 Cc1ccc(cc1)C(=O)CSC(C)(C)C 62a_100000211441_100000211941 [0,2,0,0,0,0|2,0,0]=4 9815 B15R1.892 Cc1ccc(cc1)C(=O)CSC(C)(C)C 62a_100000211941_100000211441 [0,2,0,0,0,0|2,0,0]=4 9816 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 11a_100000743828_100000188618 [0,2,0,0,0,0|1,0,0]=3 9817 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 1626a_100000743828_100000188618 [0,2,0,0,0,0|1,0,0]=3 9818 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 240690a_100000743828_100000188618 [0,2,0,0,0,0|1,0,0]=3 9819 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 527a_100000743828_100000188618 [0,2,0,0,0,0|1,0,0]=3 9820 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 11a_100020643315_100000188618 [0,2,0,0,0,0|1,0,0]=3 9821 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 1626a_100020643315_100000188618 [0,2,0,0,0,0|1,0,0]=3 9822 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 240690a_100020643315_100000188618 [0,2,0,0,0,0|1,0,0]=3 9823 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 527a_100020643315_100000188618 [0,2,0,0,0,0|1,0,0]=3 9824 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)O 1626a_100000751335_100000188618 [0,2,0,0,0,0|1,0,0]=3 9825 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)O 240690a_100000751335_100000188618 [0,2,0,0,0,0|1,0,0]=3 9826 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)O 527a_100000751335_100000188618 [0,2,0,0,0,0|1,0,0]=3 9827 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 11a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 9828 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 1626a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 9829 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 240690a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 9830 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 527a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 9831 B15R1.892 Cc1ccc(cc1)C(=O)NC[Si](C)(C)C 11a_102516607284_100000188618 [0,2,0,0,0,0|1,1,0]=4 9832 B15R1.892 Cc1ccc(cc1)C(=O)NC[Si](C)(C)C 1626a_102516607284_100000188618 [0,2,0,0,0,0|1,1,0]=4 9833 B15R1.892 Cc1ccc(cc1)C(=O)NC[Si](C)(C)C 240690a_102516607284_100000188618 [0,2,0,0,0,0|1,1,0]=4 9834 B15R1.892 Cc1ccc(cc1)C(=O)NC[Si](C)(C)C 527a_102516607284_100000188618 [0,2,0,0,0,0|1,1,0]=4 9835 B15R1.892 Cc1ccc(cc1)C(=O)NNC(C)(C)C 22a_100000725372_100000188618 [0,2,0,0,0,0|2,0,0]=4 9836 B15R1.892 Cc1ccc(cc1)C(C)OCC(C)(C)F 34a_100000716592_100011261388 [0,2,0,0,0,0|1,0,1]=4 9837 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)C 34a_100000690690_100011219605 [0,2,0,0,0,0|1,0,1]=4 9838 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)F 34a_100000690690_100011997219 [0,2,0,0,0,0|1,0,1]=4 9839 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)O 34a_100000690690_100000764493 [0,2,0,0,0,0|1,0,1]=4 9840 B15R1.892 Cc1ccc(cc1)[C@@H](C)OCC(C)(C)O 7a_100000690690_100000764493 [0,2,0,0,0,0|1,0,1]=4 9841 B15R1.892 [2H]C(OCC(C)(C)C)c1ccc(cc1)F 34a_217856618577_100011219605 [0,2,0,0,0,0|1,0,1]=4 9842 B15R1.892 [2H]C(OCC(C)(C)F)c1ccc(cc1)F 34a_217856618577_100011997219 [0,2,0,0,0,0|1,0,1]=4 9843 B15R1.892 [2H]C(OCC(C)(C)O)c1ccc(cc1)F 34a_217856618577_100000764493 [0,2,0,0,0,0|1,0,1]=4 9844 B15R1.892 [2H]C(OCC(C)(C)O)c1ccc(cc1)F 7a_217856618577_100000764493 [0,2,0,0,0,0|1,0,1]=4 9845 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Br 270084a_100000210953_100000182491 [0,2,0,0,0,0|2,0,0]=4 9846 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Br 274078a_100000210953_100000182491 [0,2,0,0,0,0|2,0,0]=4 9847 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Br 40a_100000210953_100010306709 [0,2,0,0,0,0|2,0,0]=4 9848 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100000210953_100000209962 [0,2,0,0,0,0|2,0,0]=4 9849 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000210953_100000209962 [0,2,0,0,0,0|2,0,0]=4 9850 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Cl 40a_100000210953_100000077732 [0,2,0,0,0,0|2,0,0]=4 9851 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)F 270084a_100000210953_100000184267 [0,2,0,0,0,0|2,0,0]=4 9852 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)F 274078a_100000210953_100000184267 [0,2,0,0,0,0|2,0,0]=4 9853 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)F 40a_100000210953_100000081159 [0,2,0,0,0,0|2,0,0]=4 9854 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)I 270084a_100000210953_100011205396 [0,2,0,0,0,0|2,0,0]=4 9855 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)I 274078a_100000210953_100011205396 [0,2,0,0,0,0|2,0,0]=4 9856 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)N 40a_100000210953_100000054796 [0,2,0,0,0,0|2,0,0]=4 9857 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)O 270084a_100000210953_100020667864 [0,2,0,0,0,0|2,0,0]=4 9858 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)O 274078a_100000210953_100020667864 [0,2,0,0,0,0|2,0,0]=4 9859 B15R1.903 CC(C)COC(C)(C)c1ccc(cc1)Br 34a_100000753367_100000210624 [0,2,0,0,0,0|1,0,1]=4 9860 B15R1.903 CC(C)COC(C)(C)c1ccc(cc1)Br 7a_100000753367_100000210760 [0,2,0,0,0,0|1,0,1]=4 9861 B15R1.903 CC(C)COC(C)(C)c1ccc(cc1)Cl 34a_100000750429_100000210624 [0,2,0,0,0,0|1,0,1]=4 9862 B15R1.903 CC(C)COC(C)(C)c1ccc(cc1)Cl 7a_100000750429_100000210760 [0,2,0,0,0,0|1,0,1]=4 9863 B15R1.903 CC(C)COC(C)(C)c1ccc(cc1)F 34a_100011219992_100000210624 [0,2,0,0,0,0|1,0,1]=4 9864 B15R1.903 CC(C)COC(C)(C)c1ccc(cc1)F 7a_100011219992_100000210760 [0,2,0,0,0,0|1,0,1]=4 9865 B15R1.903 Cc1ccc(cc1)C(C)(C)OCC(C)C 34a_200011345916_100000210624 [0,2,0,0,0,0|1,0,1]=4 9866 B15R1.903 Cc1ccc(cc1)C(C)(C)OCC(C)C 7a_200011345916_100000210760 [0,2,0,0,0,0|1,0,1]=4 9867 B15R1.903 Cc1ccc(cc1)S(=O)(=O)NCC(C)C 270084a_100000210953_100000211267 [0,2,0,0,0,0|2,0,0]=4 9868 B15R1.903 Cc1ccc(cc1)S(=O)(=O)NCC(C)C 274078a_100000210953_100000211267 [0,2,0,0,0,0|2,0,0]=4 9869 B15R1.903 Cc1ccc(cc1)S(=O)(=O)NCC(C)C 40a_100000210953_100000039673 [0,2,0,0,0,0|2,0,0]=4 9870 B15R1.23261 CC(C)(C)CNS(=O)(=O)c1ccccc1 270084a_100000743828_100000210345 [0,2,0,0,0,0|2,0,0]=4 9871 B15R1.23261 CC(C)(C)CNS(=O)(=O)c1ccccc1 274078a_100000743828_100000210345 [0,2,0,0,0,0|2,0,0]=4 9872 B15R1.23261 CC(C)(C)CNS(=O)(=O)c1ccccc1 40a_100000743828_100000032697 [0,2,0,0,0,0|2,0,0]=4 9873 B15R1.23261 CC(C)(F)CNS(=O)(=O)c1ccccc1 270084a_100020643315_100000210345 [0,2,0,0,0,0|2,0,0]=4 9874 B15R1.23261 CC(C)(F)CNS(=O)(=O)c1ccccc1 274078a_100020643315_100000210345 [0,2,0,0,0,0|2,0,0]=4 9875 B15R1.23261 CC(C)(F)CNS(=O)(=O)c1ccccc1 40a_100020643315_100000032697 [0,2,0,0,0,0|2,0,0]=4 9876 B15R1.23261 CC(C)(O)CNS(=O)(=O)c1ccccc1 270084a_100000751335_100000210345 [0,2,0,0,0,0|2,0,0]=4 9877 B15R1.23261 CC(C)(O)CNS(=O)(=O)c1ccccc1 274078a_100000751335_100000210345 [0,2,0,0,0,0|2,0,0]=4 9878 B15R1.23261 CC(C)(O)CNS(=O)(=O)c1ccccc1 40a_100000751335_100000032697 [0,2,0,0,0,0|2,0,0]=4 9879 B15R1.23261 CC(C)(O)COC(C)(C)c1ccccc1 7a_100000694644_100000764493 [0,2,0,0,0,0|1,0,1]=4 9880 B13R1.90 C=Cc1ccccc1NCC(C)C 34a_100012022501_100000210624 [0,0,1,1,0,0|2,0,0]=4 9881 B13R1.90 C=Cc1ccccc1SCC(C)C 62a_100000210624_100011218376 [0,0,1,1,0,0|1,1,0]=4 9882 B13R1.90 C=Cc1ccccc1SCC(C)C 62a_100011218376_100000210760 [0,0,1,1,0,0|1,1,0]=4 9883 B13R1.280 CC(C)COc1cccccc1=O 34a_100000036025_100000210624 [0,0,1,1,0,0|2,0,0]=4 9884 B13R1.280 CC(C)COc1cccccc1=O 7a_100000036025_100000210760 [0,0,1,1,0,0|2,0,0]=4 9885 B13R1.643 C=Cc1cccc(c1)NCC(C)C 34a_100011827668_100000210624 [0,0,1,1,0,0|2,0,0]=4 9886 B13R1.643 C=Cc1cccc(c1)OCC(C)C 271570a_100011290941_200000170005 [0,0,1,1,0,0|1,0,0]=3 9887 B13R1.643 C=Cc1cccc(c1)OCC(C)C 34a_100011309434_100000210624 [0,0,1,1,0,0|1,0,0]=3 9888 B13R1.643 C=Cc1cccc(c1)OCC(C)C 7a_100011309434_100000210760 [0,0,1,1,0,0|1,0,0]=3 9889 B13R1.643 C=Cc1cccc(c1)OCC(C)O 34a_100011309434_100011218427 [0,0,1,1,0,0|2,0,0]=4 9890 B13R1.643 C=Cc1cccc(c1)OCC(C)O 7a_100011309434_100011218427 [0,0,1,1,0,0|2,0,0]=4 9891 B13R1.643 C=Cc1cccc(c1)OC[C@@H](C)O 34a_100011309434_100009817552 [0,0,1,1,0,0|2,0,0]=4 9892 B13R1.643 C=Cc1cccc(c1)OC[C@@H](C)O 7a_100011309434_100009817552 [0,0,1,1,0,0|2,0,0]=4 9893 B13R1.643 C=Cc1cccc(c1)SCC(C)C 62a_100000210624_100011215241 [0,0,1,1,0,0|1,1,0]=4 9894 B13R1.643 C=Cc1cccc(c1)SCC(C)C 62a_100011215241_100000210760 [0,0,1,1,0,0|1,1,0]=4 9895 B13R2.3 C1=C(CCCC1)c2ccccc2 271570a_100000062251_100000210277 [1,0,0,1,0,0|2,0,0]=4 9896 B13R2.3 C1=C(OCCC1)c2ccccc2 271570a_100010177797_100000210277 [1,0,0,1,0,0|1,0,0]=3 9897 B13R2.3 C1=C(OCCC1)c2ccccn2 271570a_100010177797_100011216584 [1,0,0,1,0,0|2,0,0]=4 9898 B13R2.3 C1=C(OCCC1)c2cccnc2 271570a_100010177797_100000752921 [1,0,0,1,0,0|2,0,0]=4 9899 B13R2.3 C1=C(OCCC1)c2ccncc2 271570a_100010177797_100000035832 [1,0,0,1,0,0|2,0,0]=4 9900 B13R2.690 C[C@@H](OC1CC1)c2ccccc2 34a_100000761318_100000211595 [1,0,0,1,0,0|1,0,1]=4 9901 B13R2.690 O=C(CC1CC1)c2ccccc2 1458a_100000185807_100000742324 [1,0,0,1,0,0|1,0,0]=3 9902 B13R2.690 O=C(CC1CO1)c2ccccc2 1458a_100000185807_100011216344 [1,0,0,1,0,0|2,0,0]=4 9903 B13R2.690 O=C(CC1CS1)c2ccccc2 1458a_100000185807_100000031435 [1,0,0,1,0,0|2,0,0]=4 9904 B13R2.690 O=C(C[C@@H]1CO1)c2ccccc2 1458a_100000185807_100000745022 [1,0,0,1,0,0|2,0,0]=4 9905 B13R2.690 O=C(NC1CC1)c2ccccc2 1626a_100000212008_100000185807 [1,0,0,1,0,0|1,0,0]=3 9906 B13R2.690 O=C(NC1CC1)c2ccccc2 240690a_100000212008_100000185807 [1,0,0,1,0,0|1,0,0]=3 9907 B13R2.690 O=C(NC1CC1)c2ccccc2 527a_100000212008_100000185807 [1,0,0,1,0,0|1,0,0]=3 9908 B13R2.2931 CNC1CC(=O)c2c1cccc2 2230a_106832991635_100010208147 [1,0,0,1,0,0|2,0,0]=4 9909 B13R2.2931 CNC1CC(=O)c2c1cccc2 7a_106832991635_100010208147 [1,0,0,1,0,0|2,0,0]=4 9910 B13R2.2931 CNC1OC(=O)c2c1cccc2 2230a_106832991635_100009813457 [1,0,0,1,0,0|1,0,0]=3 9911 B13R2.2931 CSC1CC(=O)c2c1cccc2 62a_100010208147_200000210301 [1,0,0,1,0,0|2,0,0]=4 9912 B13R2.2931 CSC1CC(=O)c2c1cccc2 62a_200000210301_100010208147 [1,0,0,1,0,0|2,0,0]=4 9913 B13R2.2931 CSC1OC(=O)c2c1cccc2 62a_200000210301_100009813457 [1,0,0,1,0,0|1,0,0]=3 9914 B13R2.2931 [13CH3]SC1CC(=O)c2c1cccc2 62a_100010208147_200025704644 [1,0,0,1,0,0|2,0,0]=4 9915 B13R2.2931 [13CH3]SC1CC(=O)c2c1cccc2 62a_200025704644_100010208147 [1,0,0,1,0,0|2,0,0]=4 9916 B13R2.2931 [13CH3]SC1OC(=O)c2c1cccc2 62a_200025704644_100009813457 [1,0,0,1,0,0|1,0,0]=3 9917 B13R2.8137 O=C(c1ccccc1)C2CCC2 1458a_100000185807_100000749161 [1,0,0,1,0,0|1,0,0]=3 9918 B13R2.8137 O=C(c1ccccc1)C2COC2 1458a_100000185807_100000687716 [1,0,0,1,0,0|2,0,0]=4 9919 B13R2.8137 O=C(c1ccccc1)N2CCC2 11a_100000754969_100000185807 [1,0,0,1,0,0|1,0,0]=3 9920 B13R2.8137 O=C(c1ccccc1)N2CCC2 240690a_100000754969_100000185807 [1,0,0,1,0,0|1,0,0]=3 9921 B13R2.8137 O=C(c1ccccc1)N2CCC2 527a_100000754969_100000185807 [1,0,0,1,0,0|1,0,0]=3 9922 B13R2.31 CC1CN(C1)Cc2ccccc2 2230a_100000702820_100015291786 [1,0,0,1,0,0|1,0,1]=4 9923 B13R2.31 CC1CN(C1)Cc2ccccc2 269982a_100000702820_100000211182 [1,0,0,1,0,0|1,0,1]=4 9924 B13R2.31 CC1CN(C1)Cc2ccccc2 270004a_100000702820_100015611070 [1,0,0,1,0,0|1,0,1]=4 9925 B13R2.31 CC1CN(C1)Cc2ccccc2 34a_100000702820_100015291786 [1,0,0,1,0,0|1,0,1]=4 9926 B13R2.2382 C(=NNC1CC1)c2ccccc2 4a_100000701032_100015611070 [1,0,0,1,0,0|2,0,0]=4 9927 B13R2.2382 c1ccc(cc1)CNCC2CC2 207a_100000735609_100015611070 [1,0,0,1,0,0|1,0,1]=4 9928 B13R2.2382 c1ccc(cc1)CNCC2CC2 2230a_100000735609_100015291786 [1,0,0,1,0,0|1,0,1]=4 9929 B13R2.2382 c1ccc(cc1)CNCC2CC2 2230a_100015324214_100000742324 [1,0,0,1,0,0|1,0,1]=4 9930 B13R2.2382 c1ccc(cc1)CNCC2CC2 269862a_100015324214_100000741477 [1,0,0,1,0,0|1,0,1]=4 9931 B13R2.2382 c1ccc(cc1)CNCC2CC2 270004a_100000735609_100015611070 [1,0,0,1,0,0|1,0,1]=4 9932 B13R2.2382 c1ccc(cc1)CNCC2CC2 34a_100000735609_100015291786 [1,0,0,1,0,0|1,0,1]=4 9933 B13R2.2382 c1ccc(cc1)CNCC2CC2 34a_100015324214_100000742324 [1,0,0,1,0,0|1,0,1]=4 9934 B13R2.2382 c1ccc(cc1)COCC2CC2 34a_100000210790_100000742324 [1,0,0,1,0,0|0,0,1]=3 9935 B13R2.2382 c1ccc(cc1)COCC2CC2 34a_100000211283_100015291786 [1,0,0,1,0,0|0,0,1]=3 9936 B13R2.2382 c1ccc(cc1)COCC2CC2 7a_100000210790_100000742324 [1,0,0,1,0,0|0,0,1]=3 9937 B13R2.2382 c1ccc(cc1)COCC2CO2 34a_100000210790_102125554688 [1,0,0,1,0,0|1,0,1]=4 9938 B13R2.2382 c1ccc(cc1)COCC2CO2 7a_100000210790_102125554688 [1,0,0,1,0,0|1,0,1]=4 9939 B13R2.2382 c1ccc(cc1)COCC2CS2 7a_100000210790_100000031435 [1,0,0,1,0,0|1,0,1]=4 9940 B13R2.2382 c1ccc(cc1)COC[C@@H]2CO2 34a_100000757423_100015291786 [1,0,0,1,0,0|1,0,1]=4 9941 B13R2.2382 c1ccc(cc1)COC[C@@H]2CO2 7a_100000210790_100000745022 [1,0,0,1,0,0|1,0,1]=4 9942 B13R2.2382 c1ccc(cc1)CSCC2CC2 62a_100000211182_100000742324 [1,0,0,1,0,0|0,1,1]=4 9943 B13R2.2382 c1ccc(cc1)CSCC2CC2 62a_100000756562_100015291786 [1,0,0,1,0,0|0,1,1]=4 9944 B13R2.2382 c1ccc(cc1)NCCC2CC2 34a_100000106764_100000694398 [1,0,0,1,0,0|2,0,0]=4 9945 B13R2.2382 c1ccc(cc1)OCCC2CC2 34a_100000210340_100000694398 [1,0,0,1,0,0|2,0,0]=4 9946 B13R2.2382 c1ccc(cc1)OCCC2CC2 7a_100000210340_100000764125 [1,0,0,1,0,0|2,0,0]=4 9947 B13R2.2382 c1ccc(cc1)SCCC2CC2 62a_100000719477_100000764125 [1,0,0,1,0,0|2,0,0]=4 9948 B13R2.2382 c1ccc(cc1)SCCC2CC2 62a_100000764125_100000041952 [1,0,0,1,0,0|2,0,0]=4 9949 B13R2.2382 c1ccc(nc1)COCC2CC2 34a_100000211283_100000721315 [1,0,0,1,0,0|1,0,1]=4 9950 B13R2.2382 c1cncc(c1)COCC2CC2 34a_100000211283_100000733263 [1,0,0,1,0,0|1,0,1]=4 9951 B15R2.59 CC(C)c1nc(no1)c2ccccc2 270196a_100000210280_100000210198 [0,0,0,1,0,1|1,0,1]=4 9952 B15R2.59 CC(C)c1noc(n1)c2ccccc2 270196a_100000210513_100000185807 [0,0,0,1,0,1|1,0,1]=4 9953 B15R2.297 C[C@@H]1CCN(C1)C(=O)c2ccccc2 11a_100016987628_100000185807 [0,0,0,1,0,1|1,0,0]=3 9954 B15R2.297 C[C@@H]1CCN(C1)C(=O)c2ccccc2 240690a_100016987628_100000185807 [0,0,0,1,0,1|1,0,0]=3 9955 B15R2.297 C[C@@H]1CCN(C1)C(=O)c2ccccc2 527a_100016987628_100000185807 [0,0,0,1,0,1|1,0,0]=3 9956 B15R2.297 O=C(c1ccccc1)N2CCC(C2)O 240690a_100011215560_100000185807 [0,0,0,1,0,1|2,0,0]=4 9957 B15R2.297 O=C(c1ccccc1)N2CCC(C2)O 527a_100011215560_100000185807 [0,0,0,1,0,1|2,0,0]=4 9958 B15R2.297 O=C(c1ccccc1)N2CC[C@@H](C2)F 11a_100015203821_100000185807 [0,0,0,1,0,1|2,0,0]=4 9959 B15R2.297 O=C(c1ccccc1)N2CC[C@@H](C2)F 1626a_100015203821_100000185807 [0,0,0,1,0,1|2,0,0]=4 9960 B15R2.297 O=C(c1ccccc1)N2CC[C@@H](C2)F 240690a_100015203821_100000185807 [0,0,0,1,0,1|2,0,0]=4 9961 B15R2.297 O=C(c1ccccc1)N2CC[C@@H](C2)F 527a_100015203821_100000185807 [0,0,0,1,0,1|2,0,0]=4 9962 B15R2.612 CC1CN(C1)CC(=O)c2ccccc2 269982a_100000702820_100000211460 [0,0,0,1,0,1|1,0,0]=3 9963 B15R2.612 CC1CN(C1)CC(=O)c2ccccn2 269982a_100000702820_100000027445 [0,0,0,1,0,1|2,0,0]=4 9964 B15R2.612 CC1CN(C1)CC(=O)c2ccccn2 34a_100000702820_100000027445 [0,0,0,1,0,1|2,0,0]=4 9965 B15R2.612 CC1CN(C1)CC(=O)c2cccnc2 269982a_100000702820_100000757877 [0,0,0,1,0,1|2,0,0]=4 9966 B15R2.612 CC1CN(C1)CC(=O)c2ccncc2 269982a_100000702820_100000027454 [0,0,0,1,0,1|2,0,0]=4 9967 B15R2.612 CC1CN(C1)CS(=O)c2ccccc2 269982a_100000702820_100000031784 [0,0,0,1,0,1|2,0,0]=4 9968 B15R2.612 CN1CC(C1)NC(=O)c2ccccc2 240690a_100015196640_100000185807 [0,0,0,1,0,1|2,0,0]=4 9969 B15R2.612 O=C(CN1CC(C1)F)c2ccccc2 269982a_100000690557_100000211460 [0,0,0,1,0,1|2,0,0]=4 9970 B15R2.612 O=C(CN1CC(C1)O)c2ccccc2 269982a_100000749847_100000211460 [0,0,0,1,0,1|2,0,0]=4 9971 B15R2.612 O=C(NC1CC(C1)F)c2ccccc2 11a_100016993743_100000185807 [0,0,0,1,0,1|2,0,0]=4 9972 B15R2.612 O=C(NC1CC(C1)F)c2ccccc2 1626a_100016993743_100000185807 [0,0,0,1,0,1|2,0,0]=4 9973 B15R2.612 O=C(NC1CC(C1)F)c2ccccc2 240690a_100016993743_100000185807 [0,0,0,1,0,1|2,0,0]=4 9974 B15R2.612 O=C(NC1CC(C1)F)c2ccccc2 527a_100016993743_100000185807 [0,0,0,1,0,1|2,0,0]=4 9975 B15R2.612 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2 11a_100020629032_100000185807 [0,0,0,1,0,1|2,0,0]=4 9976 B15R2.612 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2 1626a_100020629032_100000185807 [0,0,0,1,0,1|2,0,0]=4 9977 B15R2.612 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2 240690a_100020629032_100000185807 [0,0,0,1,0,1|2,0,0]=4 9978 B15R2.612 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2 527a_100020629032_100000185807 [0,0,0,1,0,1|2,0,0]=4 9979 B15R2.1040 CC(OCC1CC1C)c2ccccc2 34a_100000744939_100000211855 [0,0,0,1,0,1|1,0,1]=4 9980 B15R2.1040 CC(OCC1CC1C)c2ccccc2 7a_100000744939_100000230085 [0,0,0,1,0,1|1,0,1]=4 9981 B15R2.16442 CC(=NNCC1CC1)c2ccccc2 4a_100000736359_100000185851 [0,0,0,1,0,1|2,0,0]=4 9982 B15R2.16442 CC(COCC1CC1)c2ccccc2 34a_100000211283_100000756946 [0,0,0,1,0,1|1,0,1]=4 9983 B15R2.16442 CC(COCC1CC1)c2ccccc2 34a_100011215166_100000742324 [0,0,0,1,0,1|1,0,1]=4 9984 B15R2.16442 CC(COCC1CC1)c2ccccc2 7a_100011215166_100000742324 [0,0,0,1,0,1|1,0,1]=4 9985 B15R2.16442 CC(OCCC1CC1)c2ccccc2 34a_100000754188_100000211855 [0,0,0,1,0,1|1,0,1]=4 9986 B15R2.16442 CC(OCCC1CC1)c2ccccc2 7a_100000754188_100000230085 [0,0,0,1,0,1|1,0,1]=4 9987 B15R2.16442 C[C@@H](OCCC1CC1)c2ccccc2 34a_100000761318_100000694398 [0,0,0,1,0,1|1,0,1]=4 9988 B15R2.16442 C[C@@H](OCCC1CC1)c2ccccc2 7a_100000761318_100000764125 [0,0,0,1,0,1|1,0,1]=4 9989 B15R2.16442 N[C@H](COCC1CC1)c2ccccc2 34a_100000751927_100000742324 [0,0,0,1,0,1|1,0,1]=4 9990 B15R2.16442 O=C(CC#CC1CC1)c2ccccc2 1458a_100000185807_100009895102 [0,0,0,1,0,1|1,0,1]=4 9991 B15R2.16442 O=C(CCCC1CO1)c2ccccc2 1458a_100000185807_100000733510 [0,0,0,1,0,1|2,0,0]=4 9992 B15R2.16442 O=C(CCSC1CC1)c2ccccc2 62a_100000750707_100000211595 [0,0,0,1,0,1|1,0,0]=3 9993 B15R2.16442 O=C(CNCC1CC1)c2ccccn2 34a_100000735609_100000027445 [0,0,0,1,0,1|2,0,0]=4 9994 B15R2.16442 O=C(COCC1CC1)c2ccccn2 34a_100000211283_100000027445 [0,0,0,1,0,1|1,0,0]=3 9995 B15R2.16442 O=C(COC[C@@H]1CO1)c2ccccn2 34a_100000757423_100000027445 [0,0,0,1,0,1|2,0,0]=4 9996 B15R2.16442 O=C(CSCC1CC1)c2ccccc2 62a_100000211460_100000742324 [0,0,0,1,0,1|0,1,0]=3 9997 B15R2.16442 O=C(CSCC1CC1)c2ccccc2 62a_100000756562_100000211460 [0,0,0,1,0,1|0,1,0]=3 9998 B15R2.16442 O=C(CSCC1CC1)c2ccccn2 62a_100000027445_100000742324 [0,0,0,1,0,1|1,1,0]=4 9999 B15R2.16442 O=C(CSCC1CC1)c2ccccn2 62a_100000756562_100000027445 [0,0,0,1,0,1|1,1,0]=4 10000 B15R2.16442 O=C(CSCC1CC1)c2cccnc2 62a_100000756562_100000757877 [0,0,0,1,0,1|1,1,0]=4 10001 B15R2.16442 O=C(CSCC1CC1)c2cccnc2 62a_100000757877_100000742324 [0,0,0,1,0,1|1,1,0]=4 10002 B15R2.16442 O=C(CSCC1CC1)c2ccncc2 62a_100000027454_100000742324 [0,0,0,1,0,1|1,1,0]=4 10003 B15R2.16442 O=C(CSCC1CC1)c2ccncc2 62a_100000756562_100000027454 [0,0,0,1,0,1|1,1,0]=4 10004 B15R2.16442 O=C(CSCC1CO1)c2ccccc2 62a_100000211460_102125554688 [0,0,0,1,0,1|1,1,0]=4 10005 B15R2.16442 O=C(CSCC1CO1)c2ccccc2 62a_102125554688_100000211460 [0,0,0,1,0,1|1,1,0]=4 10006 B15R2.16442 O=C(CSCC1CS1)c2ccccc2 62a_100000031435_100000211460 [0,0,0,1,0,1|1,1,0]=4 10007 B15R2.16442 O=C(CSCC1CS1)c2ccccc2 62a_100000211460_100000031435 [0,0,0,1,0,1|1,1,0]=4 10008 B15R2.16442 O=C(CSC[C@@H]1CO1)c2ccccc2 62a_100000211460_100000745022 [0,0,0,1,0,1|1,1,0]=4 10009 B15R2.16442 O=C(CSC[C@@H]1CO1)c2ccccc2 62a_100000745022_100000211460 [0,0,0,1,0,1|1,1,0]=4 10010 B15R2.16442 O=C(NCCC1CC1)c2ccccc2 1626a_100000764129_100000185807 [0,0,0,1,0,1|1,0,0]=3 10011 B15R2.16442 O=C(NCCC1CC1)c2ccccc2 240690a_100000764129_100000185807 [0,0,0,1,0,1|1,0,0]=3 10012 B15R2.16442 O=C(NCCC1CC1)c2ccccc2 527a_100000764129_100000185807 [0,0,0,1,0,1|1,0,0]=3 10013 B15R2.16442 O=C(NN=CC1CC1)c2ccccc2 4a_100000184135_100000741477 [0,0,0,1,0,1|1,0,1]=4 10014 B15R2.16442 O=C(NNCC1CC1)c2ccccc2 22a_100000736359_100000185807 [0,0,0,1,0,1|1,0,0]=3 10015 B15R2.16442 O=C(OCSC1CC1)c2ccccc2 62a_100000073877_100000211595 [0,0,0,1,0,1|0,0,0]=2 10016 B15R2.16442 O=S(CSCC1CC1)c2ccccc2 62a_100000756562_100000031784 [0,0,0,1,0,1|1,1,0]=4 10017 B15R2.16442 OC(COCC1CC1)c2ccccc2 34a_100000211283_100000185958 [0,0,0,1,0,1|0,0,2]=4 10018 B15R2.16442 O[C@H](COCC1CC1)c2ccccc2 34a_100000211283_100011933945 [0,0,0,1,0,1|0,0,2]=4 10019 B15R2.53147 CC(=O)CC1OC(=O)c2c1cccc2 1458a_100000185305_200000210301 [0,0,0,1,0,1|1,0,1]=4 10020 B15R2.53147 CC(C)NC1CC(=O)c2c1cccc2 2230a_100138425928_100010208147 [0,0,0,1,0,1|1,0,0]=3 10021 B15R2.53147 CC(C)NC1OC(=O)c2c1cccc2 2230a_100138425928_100009813457 [0,0,0,1,0,1|0,0,0]=2 10022 B15R2.53147 CC(C)SC1CC(=O)c2c1cccc2 62a_100000210206_100010208147 [0,0,0,1,0,1|1,0,0]=3 10023 B15R2.53147 CC(C)SC1CC(=O)c2c1cccc2 62a_100010208147_100000210206 [0,0,0,1,0,1|1,0,0]=3 10024 B15R2.53147 CC(C)SC1OC(=O)c2c1cccc2 62a_100000210206_100009813457 [0,0,0,1,0,1|0,0,0]=2 10025 B15R2.53147 [13CH3]C(=O)CC1OC(=O)c2c1cccc2 1458a_100000185305_200025704644 [0,0,0,1,0,1|1,0,1]=4 10026 B15R2.68818 CC(C)CCOC1Cc2c1cccc2 7a_100000210254_100009813401 [0,0,0,1,0,1|1,0,1]=4 10027 B15R2.68818 CC(C)COCC1Cc2c1cccc2 34a_100012476685_100000210624 [0,0,0,1,0,1|1,0,1]=4 10028 B15R2.68818 CC(C)COCC1Cc2c1cccc2 7a_100012476685_100000210760 [0,0,0,1,0,1|1,0,1]=4 10029 B15R2.491 O=C(Nc1ccccc1)N[C@@H]2C[C@@H]2F 2430a_100000106764_100015190264 [0,0,0,1,0,1|2,0,0]=4 10030 B15R2.491 O=C(Nc1ccccc1)N[C@@H]2C[C@H]2F 2430a_100000106764_100025746932 [0,0,0,1,0,1|2,0,0]=4 10031 B15R2.596 CC1CC(C1)C(=O)Cc2ccccc2 1458a_100000686124_100015291786 [0,0,0,1,0,1|1,0,0]=3 10032 B15R2.596 CC1CC(C1)C(=O)Cc2ccccn2 1458a_100000686124_100000721315 [0,0,0,1,0,1|2,0,0]=4 10033 B15R2.596 CC1CC(C1)C(=O)Cc2cccnc2 1458a_100000686124_100000733263 [0,0,0,1,0,1|2,0,0]=4 10034 B15R2.596 CC1CC(C1)C(=O)Cc2ccncc2 1458a_100000686124_100000705612 [0,0,0,1,0,1|2,0,0]=4 10035 B15R2.596 CC1CC(C1)C(=O)Nc2ccccc2 11a_100000106764_100000686124 [0,0,0,1,0,1|1,0,0]=3 10036 B15R2.596 CC1CC(C1)C(=O)Nc2ccccc2 1626a_100000106764_100000686124 [0,0,0,1,0,1|1,0,0]=3 10037 B15R2.596 CC1CC(C1)C(=O)Nc2ccccc2 22a_100000106764_100000686124 [0,0,0,1,0,1|1,0,0]=3 10038 B15R2.596 CC1CC(C1)C(=O)Nc2ccccc2 527a_100000106764_100000686124 [0,0,0,1,0,1|1,0,0]=3 10039 B15R2.596 CC1CN(C1)C(=O)C[n+]2ccccc2 11a_100000702820_200000086051 [0,0,0,1,0,1|2,0,0]=4 10040 B15R2.596 CC1CN(C1)C(=O)C[n+]2ccccc2 240690a_100000702820_200000086051 [0,0,0,1,0,1|2,0,0]=4 10041 B15R2.596 CC1CN(C1)C(=O)C[n+]2ccccc2 527a_100000702820_200000086051 [0,0,0,1,0,1|2,0,0]=4 10042 B15R2.596 CC1CN(C1)C(=O)Cc2ccccn2 11a_100000702820_100000233486 [0,0,0,1,0,1|2,0,0]=4 10043 B15R2.596 CC1CN(C1)C(=O)Cc2cccnc2 11a_100000702820_100000737805 [0,0,0,1,0,1|2,0,0]=4 10044 B15R2.596 CC1CN(C1)C(=O)Cc2cccnc2 240690a_100000702820_100000737805 [0,0,0,1,0,1|2,0,0]=4 10045 B15R2.596 CC1CN(C1)C(=O)Cc2cccnc2 527a_100000702820_100000737805 [0,0,0,1,0,1|2,0,0]=4 10046 B15R2.596 CC1CN(C1)C(=O)Cc2ccncc2 11a_100000702820_100011201483 [0,0,0,1,0,1|2,0,0]=4 10047 B15R2.596 CC1CN(C1)C(=O)Cc2ccncc2 240690a_100000702820_100011201483 [0,0,0,1,0,1|2,0,0]=4 10048 B15R2.596 CC1CN(C1)C(=O)Nc2ccccc2 2430a_100000106764_100000702820 [0,0,0,1,0,1|1,0,0]=3 10049 B15R2.596 CN1CC(C1)C(=O)Cc2ccccc2 1458a_100012002723_100015291786 [0,0,0,1,0,1|2,0,0]=4 10050 B15R2.596 CN1CC(C1)C(=O)Nc2ccccc2 22a_100000106764_100012002723 [0,0,0,1,0,1|2,0,0]=4 10051 B15R2.596 O=C(Cc1ccccc1)C2CC(C2)F 1458a_100000062598_100015291786 [0,0,0,1,0,1|2,0,0]=4 10052 B15R2.596 O=C(Cc1ccccc1)[C@H]2C[C@H](C2)O 1458a_100015266633_100015291786 [0,0,0,1,0,1|2,0,0]=4 10053 B15R2.596 O=C(Nc1ccccc1)C2CC(C2)F 11a_100000106764_100000062598 [0,0,0,1,0,1|2,0,0]=4 10054 B15R2.596 O=C(Nc1ccccc1)C2CC(C2)F 1626a_100000106764_100000062598 [0,0,0,1,0,1|2,0,0]=4 10055 B15R2.596 O=C(Nc1ccccc1)C2CC(C2)F 22a_100000106764_100000062598 [0,0,0,1,0,1|2,0,0]=4 10056 B15R2.596 O=C(Nc1ccccc1)C2CC(C2)F 527a_100000106764_100000062598 [0,0,0,1,0,1|2,0,0]=4 10057 B15R2.596 O=C(Nc1ccccc1)N2CC(C2)F 2430a_100000106764_100000690557 [0,0,0,1,0,1|2,0,0]=4 10058 B15R2.596 O=C(Nc1ccccc1)N2CC(C2)O 2430a_100000106764_100000749847 [0,0,0,1,0,1|2,0,0]=4 10059 B15R2.596 O=C(Nc1ccccc1)[C@H]2C[C@H](C2)O 22a_100000106764_100015266633 [0,0,0,1,0,1|2,0,0]=4 10060 B15R2.596 O=C(Nc1ccccc1)[C@H]2C[C@H](C2)O 527a_100000106764_100015266633 [0,0,0,1,0,1|2,0,0]=4 10061 B15R2.993 CC(C)SC1C(=O)Nc2c1cccc2 62a_100000210206_200009996675 [0,0,0,1,0,1|2,0,0]=4 10062 B15R2.1256 CC(Cc1ccccc1)OCC2CC2 34a_100000211283_200011218536 [0,0,0,1,0,1|1,0,1]=4 10063 B15R2.1256 CC(Cc1ccccc1)OCC2CC2 34a_100000748627_100000742324 [0,0,0,1,0,1|1,0,1]=4 10064 B15R2.1256 CC(Cc1ccccc1)OCC2CC2 7a_100000748627_100000742324 [0,0,0,1,0,1|1,0,1]=4 10065 B15R2.1256 O=C(C=CC1CC1)Cc2ccccc2 1458a_100102529529_100015291786 [0,0,0,1,0,1|1,0,1]=4 10066 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 11a_100000106764_100102529529 [0,0,0,1,0,1|1,0,1]=4 10067 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 1626a_100000106764_100102529529 [0,0,0,1,0,1|1,0,1]=4 10068 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 22a_100000106764_100102529529 [0,0,0,1,0,1|1,0,1]=4 10069 B15R2.1256 O=C(CCC1CC1)C[n+]2ccccc2 1458a_200000086051_100000694398 [0,0,0,1,0,1|2,0,0]=4 10070 B15R2.1256 O=C(CCC1CC1)Cc2ccccc2 1458a_100000756386_100015291786 [0,0,0,1,0,1|1,0,0]=3 10071 B15R2.1256 O=C(CCC1CC1)Cc2ccccn2 1458a_100000233486_100000694398 [0,0,0,1,0,1|2,0,0]=4 10072 B15R2.1256 O=C(CCC1CC1)Cc2ccccn2 1458a_100000756386_100000721315 [0,0,0,1,0,1|2,0,0]=4 10073 B15R2.1256 O=C(CCC1CC1)Cc2cccnc2 1458a_100000737805_100000694398 [0,0,0,1,0,1|2,0,0]=4 10074 B15R2.1256 O=C(CCC1CC1)Cc2cccnc2 1458a_100000756386_100000733263 [0,0,0,1,0,1|2,0,0]=4 10075 B15R2.1256 O=C(CCC1CC1)Cc2ccncc2 1458a_100000756386_100000705612 [0,0,0,1,0,1|2,0,0]=4 10076 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 11a_100000106764_100000756386 [0,0,0,1,0,1|1,0,0]=3 10077 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 1626a_100000106764_100000756386 [0,0,0,1,0,1|1,0,0]=3 10078 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 22a_100000106764_100000756386 [0,0,0,1,0,1|1,0,0]=3 10079 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 527a_100000106764_100000756386 [0,0,0,1,0,1|1,0,0]=3 10080 B15R2.1256 O=C(CNC1CC1)Nc2ccccc2 34a_100000212008_100000182850 [0,0,0,1,0,1|2,0,0]=4 10081 B15R2.1256 O=C(CNC1CC1)Oc2ccccc2 34a_100000212008_100009813826 [0,0,0,1,0,1|2,0,0]=4 10082 B15R2.1256 O=C(COC1CC1)Nc2ccccc2 34a_100000246334_100000211595 [0,0,0,1,0,1|2,0,0]=4 10083 B15R2.1256 O=C(CSC1CC1)Cc2ccccc2 62a_100000233483_100000211595 [0,0,0,1,0,1|2,0,0]=4 10084 B15R2.1256 O=C(CSC1CC1)Nc2ccccc2 62a_100012148978_100000211595 [0,0,0,1,0,1|2,0,0]=4 10085 B15R2.1256 O=C(CSC1CC1)Oc2ccccc2 62a_100009813826_100000211595 [0,0,0,1,0,1|2,0,0]=4 10086 B15R2.1256 O=C(C[n+]1ccccc1)NCC2CC2 11a_100000735609_200000086051 [0,0,0,1,0,1|2,0,0]=4 10087 B15R2.1256 O=C(C[n+]1ccccc1)NCC2CC2 240690a_100000735609_200000086051 [0,0,0,1,0,1|2,0,0]=4 10088 B15R2.1256 O=C(C[n+]1ccccc1)NCC2CC2 527a_100000735609_200000086051 [0,0,0,1,0,1|2,0,0]=4 10089 B15R2.1256 O=C(Cc1ccccn1)NCC2CC2 11a_100000735609_100000233486 [0,0,0,1,0,1|2,0,0]=4 10090 B15R2.1256 O=C(Cc1cccnc1)NCC2CC2 11a_100000735609_100000737805 [0,0,0,1,0,1|2,0,0]=4 10091 B15R2.1256 O=C(Cc1cccnc1)NCC2CC2 240690a_100000735609_100000737805 [0,0,0,1,0,1|2,0,0]=4 10092 B15R2.1256 O=C(Cc1cccnc1)NCC2CC2 527a_100000735609_100000737805 [0,0,0,1,0,1|2,0,0]=4 10093 B15R2.1256 O=C(Cc1ccncc1)NCC2CC2 11a_100000735609_100011201483 [0,0,0,1,0,1|2,0,0]=4 10094 B15R2.1256 O=C(Cc1ccncc1)NCC2CC2 240690a_100000735609_100011201483 [0,0,0,1,0,1|2,0,0]=4 10095 B15R2.1256 O=C(NCC1CC1)Nc2ccccc2 2430a_100000106764_100000735609 [0,0,0,1,0,1|1,0,0]=3 10096 B15R2.1660 CC(C)CNc1nc2ccccc2[nH]1 27a_100000210953_100009814255 [0,0,0,1,0,1|2,0,0]=4 10097 B15R2.1660 CC(C)CNc1nc2ccccc2s1 27a_100000210953_100000751744 [0,0,0,1,0,1|1,1,0]=4 10098 B15R2.1660 CC(C)COC1Cc2ccccc2C1 34a_100000210257_100000753484 [0,0,0,1,0,1|1,0,1]=4 10099 B15R2.1660 CC(C)COC1Cc2ccccc2C1 34a_100011215286_100000210624 [0,0,0,1,0,1|1,0,1]=4 10100 B15R2.1660 CC(C)CSc1cc2ccccc2[nH]1 62a_100000210624_100010232065 [0,0,0,1,0,1|1,1,0]=4 10101 B15R2.1660 CC(C)CSc1cc2ccccc2o1 62a_100000210624_100010159458 [0,0,0,1,0,1|0,1,1]=4 10102 B15R2.1660 CC(C)CSc1cc2ccccc2s1 62a_100000210624_100009816949 [0,0,0,1,0,1|0,2,0]=4 10103 B15R2.1660 CC(C)CSc1nc2ccccc2[nH]1 62a_100000210624_100009814255 [0,0,0,1,0,1|1,1,0]=4 10104 B15R2.1660 CC(C)CSc1nc2ccccc2s1 62a_100000210624_100000751744 [0,0,0,1,0,1|0,2,0]=4 10105 B15R2.16445 CC1(C[C@@H]1C(=O)Cc2ccccc2)C 1458a_100000692687_100015291786 [0,0,0,1,0,1|1,0,0]=3 10106 B15R2.16445 CC1(C[C@@H]1C(=O)Cc2ccccn2)C 1458a_100000692687_100000721315 [0,0,0,1,0,1|2,0,0]=4 10107 B15R2.16445 CC1(C[C@@H]1C(=O)Cc2cccnc2)C 1458a_100000692687_100000733263 [0,0,0,1,0,1|2,0,0]=4 10108 B15R2.16445 CC1(C[C@@H]1C(=O)Cc2ccncc2)C 1458a_100000692687_100000705612 [0,0,0,1,0,1|2,0,0]=4 10109 B15R2.16445 CC1(C[C@@H]1C(=O)Nc2ccccc2)C 11a_100000106764_100000692687 [0,0,0,1,0,1|1,0,0]=3 10110 B15R2.16445 CC1(C[C@@H]1C(=O)Nc2ccccc2)C 1626a_100000106764_100000692687 [0,0,0,1,0,1|1,0,0]=3 10111 B15R2.16445 CC1(C[C@@H]1C(=O)Nc2ccccc2)C 22a_100000106764_100000692687 [0,0,0,1,0,1|1,0,0]=3 10112 B15R2.16445 CC1(C[C@@H]1C(=O)Nc2ccccc2)C 527a_100000106764_100000692687 [0,0,0,1,0,1|1,0,0]=3 10113 B15R2.28 CC1CC=C(CC1)c2cccc(c2)Br 271570a_100010240233_100000691529 [0,1,0,1,0,0|2,0,0]=4 10114 B15R2.28 CC1CC=C(CC1)c2cccc(c2)Cl 271570a_100010240233_100000699651 [0,1,0,1,0,0|2,0,0]=4 10115 B15R2.28 CC1CC=C(CC1)c2cccc(c2)F 271570a_100010240233_100000685547 [0,1,0,1,0,0|2,0,0]=4 10116 B15R2.28 CC1CC=C(CC1)c2cccc(c2)N 271570a_100010240233_100000210019 [0,1,0,1,0,0|2,0,0]=4 10117 B15R2.28 CC1CC=C(CC1)c2cccc(c2)O 271570a_100010240233_100000211634 [0,1,0,1,0,0|2,0,0]=4 10118 B15R2.28 CC1CC=C(CC1)c2cccc(c2)[S] 271570a_100010240233_114929384022 [0,1,0,1,0,0|2,0,0]=4 10119 B15R2.28 Cc1cccc(c1)C2=CCC(CC2)C 271570a_100010240233_100011215228 [0,1,0,1,0,0|2,0,0]=4 10120 B15R2.7152 CC(OCC1CC1)c2cccc(c2)Br 34a_100000246457_100000742324 [0,1,0,1,0,0|1,0,1]=4 10121 B15R2.7152 CC(OCC1CC1)c2cccc(c2)Br 7a_100000246457_100000742324 [0,1,0,1,0,0|1,0,1]=4 10122 B15R2.7152 CC(OCC1CC1)c2cccc(c2)F 34a_100000744526_100000742324 [0,1,0,1,0,0|1,0,1]=4 10123 B15R2.7152 CC(OCC1CC1)c2cccc(c2)F 7a_100000744526_100000742324 [0,1,0,1,0,0|1,0,1]=4 10124 B15R2.7152 CC(OCC1CC1)c2cccc(c2)I 34a_100013085317_100000742324 [0,1,0,1,0,0|1,0,1]=4 10125 B15R2.7152 CC(OCC1CC1)c2cccc(c2)I 7a_100013085317_100000742324 [0,1,0,1,0,0|1,0,1]=4 10126 B15R2.7152 CC(OCC1CC1)c2cccc(c2)N 34a_100011217120_100000742324 [0,1,0,1,0,0|1,0,1]=4 10127 B15R2.7152 CC(OCC1CC1)c2cccc(c2)N 7a_100011217120_100000742324 [0,1,0,1,0,0|1,0,1]=4 10128 B15R2.7152 C[C@@H](OCC1CC1)c2cccc(c2)Cl 34a_100000747380_100000742324 [0,1,0,1,0,0|1,0,1]=4 10129 B15R2.7152 C[C@@H](OCC1CC1)c2cccc(c2)Cl 7a_100000747380_100000742324 [0,1,0,1,0,0|1,0,1]=4 10130 B15R2.7152 Cc1cccc(c1)C(=O)CCC2CC2 1458a_100000189346_100000694398 [0,1,0,1,0,0|1,0,0]=3 10131 B15R2.7152 Cc1cccc(c1)C(=O)CCC2CO2 1458a_100000189346_100000732470 [0,1,0,1,0,0|2,0,0]=4 10132 B15R2.7152 Cc1cccc(c1)C(=O)CNC2CC2 34a_100000212008_100000739480 [0,1,0,1,0,0|2,0,0]=4 10133 B15R2.7152 Cc1cccc(c1)C(=O)CSC2CC2 62a_100000739480_100000211595 [0,1,0,1,0,0|2,0,0]=4 10134 B15R2.7152 Cc1cccc(c1)C(=O)NCC2CC2 11a_100000735609_100000189346 [0,1,0,1,0,0|1,0,0]=3 10135 B15R2.7152 Cc1cccc(c1)C(=O)NCC2CC2 1626a_100000735609_100000189346 [0,1,0,1,0,0|1,0,0]=3 10136 B15R2.7152 Cc1cccc(c1)C(=O)NCC2CC2 240690a_100000735609_100000189346 [0,1,0,1,0,0|1,0,0]=3 10137 B15R2.7152 Cc1cccc(c1)C(=O)NCC2CC2 527a_100000735609_100000189346 [0,1,0,1,0,0|1,0,0]=3 10138 B15R2.7152 Cc1cccc(c1)C(=O)NNC2CC2 22a_100000701032_100000189346 [0,1,0,1,0,0|2,0,0]=4 10139 B15R2.7152 Cc1cccc(c1)C(C)OCC2CC2 34a_100000757818_100000742324 [0,1,0,1,0,0|1,0,1]=4 10140 B15R2.7152 Cc1cccc(c1)C(C)OCC2CC2 7a_100000757818_100000742324 [0,1,0,1,0,0|1,0,1]=4 10141 B15R2.7152 O=C(CCC1CC1)c2cccc(c2)Br 1458a_100000210664_100000694398 [0,1,0,1,0,0|1,0,0]=3 10142 B15R2.7152 O=C(CCC1CC1)c2cccc(c2)Cl 1458a_100000210390_100000694398 [0,1,0,1,0,0|1,0,0]=3 10143 B15R2.7152 O=C(CCC1CC1)c2cccc(c2)F 1458a_100000210950_100000694398 [0,1,0,1,0,0|1,0,0]=3 10144 B15R2.7152 O=C(CCC1CC1)c2cccc(c2)I 1458a_100000184098_100000694398 [0,1,0,1,0,0|1,0,0]=3 10145 B15R2.7152 O=C(CCC1CC1)c2cccc(c2)O 1458a_100000183914_100000694398 [0,1,0,1,0,0|1,0,0]=3 10146 B15R2.7152 O=C(CCC1CO1)c2cccc(c2)Br 1458a_100000210664_100000732470 [0,1,0,1,0,0|2,0,0]=4 10147 B15R2.7152 O=C(CCC1CO1)c2cccc(c2)Cl 1458a_100000210390_100000732470 [0,1,0,1,0,0|2,0,0]=4 10148 B15R2.7152 O=C(CCC1CO1)c2cccc(c2)F 1458a_100000210950_100000732470 [0,1,0,1,0,0|2,0,0]=4 10149 B15R2.7152 O=C(CCC1CO1)c2cccc(c2)I 1458a_100000184098_100000732470 [0,1,0,1,0,0|2,0,0]=4 10150 B15R2.7152 O=C(CCC1CO1)c2cccc(c2)O 1458a_100000183914_100000732470 [0,1,0,1,0,0|2,0,0]=4 10151 B15R2.7152 O=C(CNC1CC1)c2cccc(c2)Br 34a_100000212008_100000212080 [0,1,0,1,0,0|2,0,0]=4 10152 B15R2.7152 O=C(CNC1CC1)c2cccc(c2)Cl 34a_100000212008_100000211444 [0,1,0,1,0,0|2,0,0]=4 10153 B15R2.7152 O=C(CNC1CC1)c2cccc(c2)F 34a_100000212008_100000215616 [0,1,0,1,0,0|2,0,0]=4 10154 B15R2.7152 O=C(CNC1CC1)c2cccc(c2)O 34a_100000212008_100009813753 [0,1,0,1,0,0|2,0,0]=4 10155 B15R2.7152 O=C(COC1CC1)c2cccc(c2)F 34a_100011592800_100000211595 [0,1,0,1,0,0|2,0,0]=4 10156 B15R2.7152 O=C(CSC1CC1)c2cccc(c2)Br 62a_100000212080_100000211595 [0,1,0,1,0,0|2,0,0]=4 10157 B15R2.7152 O=C(CSC1CC1)c2cccc(c2)Cl 62a_100000211444_100000211595 [0,1,0,1,0,0|2,0,0]=4 10158 B15R2.7152 O=C(CSC1CC1)c2cccc(c2)F 62a_100000215616_100000211595 [0,1,0,1,0,0|2,0,0]=4 10159 B15R2.7152 O=C(CSC1CC1)c2cccc(c2)O 62a_100009813753_100000211595 [0,1,0,1,0,0|2,0,0]=4 10160 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Br 11a_100000735609_100000210664 [0,1,0,1,0,0|1,0,0]=3 10161 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Br 1626a_100000735609_100000210664 [0,1,0,1,0,0|1,0,0]=3 10162 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Br 240690a_100000735609_100000210664 [0,1,0,1,0,0|1,0,0]=3 10163 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Br 527a_100000735609_100000210664 [0,1,0,1,0,0|1,0,0]=3 10164 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Cl 11a_100000735609_100000210390 [0,1,0,1,0,0|1,0,0]=3 10165 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Cl 1626a_100000735609_100000210390 [0,1,0,1,0,0|1,0,0]=3 10166 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Cl 240690a_100000735609_100000210390 [0,1,0,1,0,0|1,0,0]=3 10167 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)Cl 527a_100000735609_100000210390 [0,1,0,1,0,0|1,0,0]=3 10168 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)F 11a_100000735609_100000210950 [0,1,0,1,0,0|1,0,0]=3 10169 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)F 1626a_100000735609_100000210950 [0,1,0,1,0,0|1,0,0]=3 10170 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)F 240690a_100000735609_100000210950 [0,1,0,1,0,0|1,0,0]=3 10171 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)F 527a_100000735609_100000210950 [0,1,0,1,0,0|1,0,0]=3 10172 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)I 11a_100000735609_100000184098 [0,1,0,1,0,0|1,0,0]=3 10173 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)I 1626a_100000735609_100000184098 [0,1,0,1,0,0|1,0,0]=3 10174 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)I 240690a_100000735609_100000184098 [0,1,0,1,0,0|1,0,0]=3 10175 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)I 527a_100000735609_100000184098 [0,1,0,1,0,0|1,0,0]=3 10176 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)O 240690a_100000735609_100000183914 [0,1,0,1,0,0|1,0,0]=3 10177 B15R2.7152 O=C(NCC1CC1)c2cccc(c2)O 527a_100000735609_100000183914 [0,1,0,1,0,0|1,0,0]=3 10178 B15R2.7152 O=C(NNC1CC1)c2cccc(c2)Br 22a_100000701032_100000210664 [0,1,0,1,0,0|2,0,0]=4 10179 B15R2.7152 O=C(NNC1CC1)c2cccc(c2)Cl 22a_100000701032_100000210390 [0,1,0,1,0,0|2,0,0]=4 10180 B15R2.7152 O=C(NNC1CC1)c2cccc(c2)F 22a_100000701032_100000210950 [0,1,0,1,0,0|2,0,0]=4 10181 B15R2.7152 O=C(NNC1CC1)c2cccc(c2)I 22a_100000701032_100000184098 [0,1,0,1,0,0|2,0,0]=4 10182 B15R2.7152 O=C(NNC1CC1)c2cccc(c2)O 22a_100000701032_100000183914 [0,1,0,1,0,0|2,0,0]=4 10183 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)Br 11a_100000702820_100000210664 [0,1,0,1,0,0|1,0,0]=3 10184 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)Br 240690a_100000702820_100000210664 [0,1,0,1,0,0|1,0,0]=3 10185 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)Br 527a_100000702820_100000210664 [0,1,0,1,0,0|1,0,0]=3 10186 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)Cl 11a_100000702820_100000210390 [0,1,0,1,0,0|1,0,0]=3 10187 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)Cl 240690a_100000702820_100000210390 [0,1,0,1,0,0|1,0,0]=3 10188 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)Cl 527a_100000702820_100000210390 [0,1,0,1,0,0|1,0,0]=3 10189 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)F 11a_100000702820_100000210950 [0,1,0,1,0,0|1,0,0]=3 10190 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)F 240690a_100000702820_100000210950 [0,1,0,1,0,0|1,0,0]=3 10191 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)F 527a_100000702820_100000210950 [0,1,0,1,0,0|1,0,0]=3 10192 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)I 11a_100000702820_100000184098 [0,1,0,1,0,0|1,0,0]=3 10193 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)I 240690a_100000702820_100000184098 [0,1,0,1,0,0|1,0,0]=3 10194 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)I 527a_100000702820_100000184098 [0,1,0,1,0,0|1,0,0]=3 10195 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)O 240690a_100000702820_100000183914 [0,1,0,1,0,0|1,0,0]=3 10196 B15R2.15379 CC1CN(C1)C(=O)c2cccc(c2)O 527a_100000702820_100000183914 [0,1,0,1,0,0|1,0,0]=3 10197 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)C 11a_100000702820_100000189346 [0,1,0,1,0,0|1,0,0]=3 10198 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)C 240690a_100000702820_100000189346 [0,1,0,1,0,0|1,0,0]=3 10199 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)C 527a_100000702820_100000189346 [0,1,0,1,0,0|1,0,0]=3 10200 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)F 11a_100000690557_100000189346 [0,1,0,1,0,0|2,0,0]=4 10201 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)F 240690a_100000690557_100000189346 [0,1,0,1,0,0|2,0,0]=4 10202 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)F 527a_100000690557_100000189346 [0,1,0,1,0,0|2,0,0]=4 10203 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)O 11a_100000749847_100000189346 [0,1,0,1,0,0|2,0,0]=4 10204 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)O 240690a_100000749847_100000189346 [0,1,0,1,0,0|2,0,0]=4 10205 B15R2.15379 Cc1cccc(c1)C(=O)N2CC(C2)O 527a_100000749847_100000189346 [0,1,0,1,0,0|2,0,0]=4 10206 B15R2.15379 O=C(c1cccc(c1)Br)N2CC(C2)F 11a_100000690557_100000210664 [0,1,0,1,0,0|2,0,0]=4 10207 B15R2.15379 O=C(c1cccc(c1)Br)N2CC(C2)F 240690a_100000690557_100000210664 [0,1,0,1,0,0|2,0,0]=4 10208 B15R2.15379 O=C(c1cccc(c1)Br)N2CC(C2)F 527a_100000690557_100000210664 [0,1,0,1,0,0|2,0,0]=4 10209 B15R2.15379 O=C(c1cccc(c1)Br)N2CC(C2)O 11a_100000749847_100000210664 [0,1,0,1,0,0|2,0,0]=4 10210 B15R2.15379 O=C(c1cccc(c1)Br)N2CC(C2)O 240690a_100000749847_100000210664 [0,1,0,1,0,0|2,0,0]=4 10211 B15R2.15379 O=C(c1cccc(c1)Br)N2CC(C2)O 527a_100000749847_100000210664 [0,1,0,1,0,0|2,0,0]=4 10212 B15R2.15379 O=C(c1cccc(c1)Cl)N2CC(C2)F 11a_100000690557_100000210390 [0,1,0,1,0,0|2,0,0]=4 10213 B15R2.15379 O=C(c1cccc(c1)Cl)N2CC(C2)F 240690a_100000690557_100000210390 [0,1,0,1,0,0|2,0,0]=4 10214 B15R2.15379 O=C(c1cccc(c1)Cl)N2CC(C2)F 527a_100000690557_100000210390 [0,1,0,1,0,0|2,0,0]=4 10215 B15R2.15379 O=C(c1cccc(c1)Cl)N2CC(C2)O 11a_100000749847_100000210390 [0,1,0,1,0,0|2,0,0]=4 10216 B15R2.15379 O=C(c1cccc(c1)Cl)N2CC(C2)O 240690a_100000749847_100000210390 [0,1,0,1,0,0|2,0,0]=4 10217 B15R2.15379 O=C(c1cccc(c1)Cl)N2CC(C2)O 527a_100000749847_100000210390 [0,1,0,1,0,0|2,0,0]=4 10218 B15R2.15379 O=C(c1cccc(c1)F)N2CC(C2)F 11a_100000690557_100000210950 [0,1,0,1,0,0|2,0,0]=4 10219 B15R2.15379 O=C(c1cccc(c1)F)N2CC(C2)F 240690a_100000690557_100000210950 [0,1,0,1,0,0|2,0,0]=4 10220 B15R2.15379 O=C(c1cccc(c1)F)N2CC(C2)F 527a_100000690557_100000210950 [0,1,0,1,0,0|2,0,0]=4 10221 B15R2.15379 O=C(c1cccc(c1)F)N2CC(C2)O 11a_100000749847_100000210950 [0,1,0,1,0,0|2,0,0]=4 10222 B15R2.15379 O=C(c1cccc(c1)F)N2CC(C2)O 240690a_100000749847_100000210950 [0,1,0,1,0,0|2,0,0]=4 10223 B15R2.15379 O=C(c1cccc(c1)F)N2CC(C2)O 527a_100000749847_100000210950 [0,1,0,1,0,0|2,0,0]=4 10224 B15R2.15379 O=C(c1cccc(c1)I)N2CC(C2)F 11a_100000690557_100000184098 [0,1,0,1,0,0|2,0,0]=4 10225 B15R2.15379 O=C(c1cccc(c1)I)N2CC(C2)F 240690a_100000690557_100000184098 [0,1,0,1,0,0|2,0,0]=4 10226 B15R2.15379 O=C(c1cccc(c1)I)N2CC(C2)F 527a_100000690557_100000184098 [0,1,0,1,0,0|2,0,0]=4 10227 B15R2.15379 O=C(c1cccc(c1)I)N2CC(C2)O 11a_100000749847_100000184098 [0,1,0,1,0,0|2,0,0]=4 10228 B15R2.15379 O=C(c1cccc(c1)I)N2CC(C2)O 240690a_100000749847_100000184098 [0,1,0,1,0,0|2,0,0]=4 10229 B15R2.15379 O=C(c1cccc(c1)I)N2CC(C2)O 527a_100000749847_100000184098 [0,1,0,1,0,0|2,0,0]=4 10230 B15R2.15379 O=C(c1cccc(c1)O)N2CC(C2)F 240690a_100000690557_100000183914 [0,1,0,1,0,0|2,0,0]=4 10231 B15R2.15379 O=C(c1cccc(c1)O)N2CC(C2)F 527a_100000690557_100000183914 [0,1,0,1,0,0|2,0,0]=4 10232 B15R2.15379 O=C(c1cccc(c1)O)N2CC(C2)O 240690a_100000749847_100000183914 [0,1,0,1,0,0|2,0,0]=4 10233 B15R2.15379 O=C(c1cccc(c1)O)N2CC(C2)O 527a_100000749847_100000183914 [0,1,0,1,0,0|2,0,0]=4 10234 B15R2.15386 Cc1cccc(c1)C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000189346 [0,1,0,1,0,0|2,0,0]=4 10235 B15R2.15386 Cc1cccc(c1)C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000189346 [0,1,0,1,0,0|2,0,0]=4 10236 B15R2.15386 Cc1cccc(c1)C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000189346 [0,1,0,1,0,0|2,0,0]=4 10237 B15R2.15386 Cc1cccc(c1)C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000189346 [0,1,0,1,0,0|2,0,0]=4 10238 B15R2.15386 Cc1cccc(c1)C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000189346 [0,1,0,1,0,0|2,0,0]=4 10239 B15R2.15386 Cc1cccc(c1)C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000189346 [0,1,0,1,0,0|2,0,0]=4 10240 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)Br 240690a_100015190264_100000210664 [0,1,0,1,0,0|2,0,0]=4 10241 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)Br 527a_100015190264_100000210664 [0,1,0,1,0,0|2,0,0]=4 10242 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)Cl 240690a_100015190264_100000210390 [0,1,0,1,0,0|2,0,0]=4 10243 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)Cl 527a_100015190264_100000210390 [0,1,0,1,0,0|2,0,0]=4 10244 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)F 240690a_100015190264_100000210950 [0,1,0,1,0,0|2,0,0]=4 10245 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)F 527a_100015190264_100000210950 [0,1,0,1,0,0|2,0,0]=4 10246 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)I 240690a_100015190264_100000184098 [0,1,0,1,0,0|2,0,0]=4 10247 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)I 527a_100015190264_100000184098 [0,1,0,1,0,0|2,0,0]=4 10248 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)O 240690a_100015190264_100000183914 [0,1,0,1,0,0|2,0,0]=4 10249 B15R2.15386 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2)O 527a_100015190264_100000183914 [0,1,0,1,0,0|2,0,0]=4 10250 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Br 11a_100025746932_100000210664 [0,1,0,1,0,0|2,0,0]=4 10251 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Br 1626a_100025746932_100000210664 [0,1,0,1,0,0|2,0,0]=4 10252 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Br 240690a_100025746932_100000210664 [0,1,0,1,0,0|2,0,0]=4 10253 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Br 527a_100025746932_100000210664 [0,1,0,1,0,0|2,0,0]=4 10254 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Cl 11a_100025746932_100000210390 [0,1,0,1,0,0|2,0,0]=4 10255 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Cl 1626a_100025746932_100000210390 [0,1,0,1,0,0|2,0,0]=4 10256 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Cl 240690a_100025746932_100000210390 [0,1,0,1,0,0|2,0,0]=4 10257 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)Cl 527a_100025746932_100000210390 [0,1,0,1,0,0|2,0,0]=4 10258 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)F 11a_100025746932_100000210950 [0,1,0,1,0,0|2,0,0]=4 10259 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)F 1626a_100025746932_100000210950 [0,1,0,1,0,0|2,0,0]=4 10260 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)F 240690a_100025746932_100000210950 [0,1,0,1,0,0|2,0,0]=4 10261 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)F 527a_100025746932_100000210950 [0,1,0,1,0,0|2,0,0]=4 10262 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)I 11a_100025746932_100000184098 [0,1,0,1,0,0|2,0,0]=4 10263 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)I 1626a_100025746932_100000184098 [0,1,0,1,0,0|2,0,0]=4 10264 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)I 240690a_100025746932_100000184098 [0,1,0,1,0,0|2,0,0]=4 10265 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)I 527a_100025746932_100000184098 [0,1,0,1,0,0|2,0,0]=4 10266 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)O 240690a_100025746932_100000183914 [0,1,0,1,0,0|2,0,0]=4 10267 B15R2.15386 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2)O 527a_100025746932_100000183914 [0,1,0,1,0,0|2,0,0]=4 10268 B15R2.65026 CC1(COC(=N1)c2cc(ccn2)O)C 271570a_203496583355_106256037380 [0,1,0,1,0,0|2,0,0]=4 10269 B15R2.65026 CC1(COC(=N1)c2cccc(c2)O)C 271570a_203496583355_100010002488 [0,1,0,1,0,0|1,0,0]=3 10270 B15R2.6 CC(C)COC1CCc2c1cccc2 34a_100000212247_100000210624 [0,1,0,1,0,0|1,0,1]=4 10271 B15R2.6 CC(C)COC1CCc2c1cccc2 7a_100000212247_100000210760 [0,1,0,1,0,0|1,0,1]=4 10272 B15R2.6 CC(C)COc1csc2c1cccc2 34a_100000077758_100000210624 [0,1,0,1,0,0|0,1,0]=3 10273 B15R2.6 CC(C)COc1csc2c1cccc2 7a_100000077758_100000210760 [0,1,0,1,0,0|0,1,0]=3 10274 B15R2.6 CC(C)CSc1coc2c1cccc2 62a_100000210624_100009812202 [0,1,0,1,0,0|0,1,1]=4 10275 B15R2.6 CC(C)CSc1csc2c1cccc2 62a_100000210624_100009813928 [0,1,0,1,0,0|0,2,0]=4 10276 B15R2.6 CC(C)CSc1n[nH]c2c1cccc2 62a_100000210624_100000050141 [0,1,0,1,0,0|1,1,0]=4 10277 B15R2.6 CC(C)CSc1noc2c1cccc2 62a_100000210624_200000703156 [0,1,0,1,0,0|0,1,1]=4 10278 B15R2.6 CC(C)CSc1noc2c1cccc2 62a_200000703156_100000210760 [0,1,0,1,0,0|0,1,1]=4 10279 B15R2.6 CC(O)COc1csc2c1cccc2 34a_100000077758_100011218427 [0,1,0,1,0,0|1,1,0]=4 10280 B15R2.6 CC(O)COc1csc2c1cccc2 7a_100000077758_100011218427 [0,1,0,1,0,0|1,1,0]=4 10281 B15R2.6 C[C@@H](O)COc1csc2c1cccc2 34a_100000077758_100009817552 [0,1,0,1,0,0|1,1,0]=4 10282 B15R2.6 C[C@@H](O)COc1csc2c1cccc2 7a_100000077758_100009817552 [0,1,0,1,0,0|1,1,0]=4 10283 B15R2.308 CC1CC=C(CC1)c2ccccc2Br 271570a_100010240233_100000695589 [0,1,0,1,0,0|2,0,0]=4 10284 B15R2.308 CC1CC=C(CC1)c2ccccc2Cl 271570a_100010240233_100000764095 [0,1,0,1,0,0|2,0,0]=4 10285 B15R2.308 CC1CC=C(CC1)c2ccccc2F 271570a_100010240233_100011215700 [0,1,0,1,0,0|2,0,0]=4 10286 B15R2.308 CC1CC=C(CC1)c2ccccc2N 271570a_100010240233_100000210017 [0,1,0,1,0,0|2,0,0]=4 10287 B15R2.308 CC1CC=C(CC1)c2ccccc2O 271570a_100010240233_100000739446 [0,1,0,1,0,0|2,0,0]=4 10288 B15R2.308 Cc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100000210755 [0,1,0,1,0,0|2,0,0]=4 10289 B15R2.629 CC(C)SC1Cc2ccccc2C1=O 62a_100000210206_100011218503 [0,1,0,1,0,0|2,0,0]=4 10290 B15R2.629 CC(C)SC1Cc2ccccc2C1=O 62a_100011218503_100000210206 [0,1,0,1,0,0|2,0,0]=4 10291 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Br 11a_100000702820_100000188424 [0,1,0,1,0,0|1,0,0]=3 10292 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Br 240690a_100000702820_100000188424 [0,1,0,1,0,0|1,0,0]=3 10293 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Br 527a_100000702820_100000188424 [0,1,0,1,0,0|1,0,0]=3 10294 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Cl 11a_100000702820_100000185844 [0,1,0,1,0,0|1,0,0]=3 10295 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Cl 240690a_100000702820_100000185844 [0,1,0,1,0,0|1,0,0]=3 10296 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Cl 527a_100000702820_100000185844 [0,1,0,1,0,0|1,0,0]=3 10297 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2F 11a_100000702820_100000188656 [0,1,0,1,0,0|1,0,0]=3 10298 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2F 240690a_100000702820_100000188656 [0,1,0,1,0,0|1,0,0]=3 10299 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2F 527a_100000702820_100000188656 [0,1,0,1,0,0|1,0,0]=3 10300 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2I 11a_100000702820_100000187884 [0,1,0,1,0,0|1,0,0]=3 10301 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2I 240690a_100000702820_100000187884 [0,1,0,1,0,0|1,0,0]=3 10302 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2I 527a_100000702820_100000187884 [0,1,0,1,0,0|1,0,0]=3 10303 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2O 240690a_100000702820_100015234032 [0,1,0,1,0,0|1,0,0]=3 10304 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2[O-] 240690a_100000702820_100009911694 [0,1,0,1,0,0|1,0,0]=3 10305 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2[O-] 527a_100000702820_100009911694 [0,1,0,1,0,0|1,0,0]=3 10306 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000212026 [0,1,0,1,0,0|1,0,0]=3 10307 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000212026 [0,1,0,1,0,0|1,0,0]=3 10308 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000212026 [0,1,0,1,0,0|1,0,0]=3 10309 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)F 11a_100000690557_100000212026 [0,1,0,1,0,0|2,0,0]=4 10310 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)F 240690a_100000690557_100000212026 [0,1,0,1,0,0|2,0,0]=4 10311 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)F 527a_100000690557_100000212026 [0,1,0,1,0,0|2,0,0]=4 10312 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)O 11a_100000749847_100000212026 [0,1,0,1,0,0|2,0,0]=4 10313 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)O 240690a_100000749847_100000212026 [0,1,0,1,0,0|2,0,0]=4 10314 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)O 527a_100000749847_100000212026 [0,1,0,1,0,0|2,0,0]=4 10315 B15R2.7432 O=C(c1ccccc1Br)N2CC(C2)F 11a_100000690557_100000188424 [0,1,0,1,0,0|2,0,0]=4 10316 B15R2.7432 O=C(c1ccccc1Br)N2CC(C2)F 240690a_100000690557_100000188424 [0,1,0,1,0,0|2,0,0]=4 10317 B15R2.7432 O=C(c1ccccc1Br)N2CC(C2)F 527a_100000690557_100000188424 [0,1,0,1,0,0|2,0,0]=4 10318 B15R2.7432 O=C(c1ccccc1Br)N2CC(C2)O 11a_100000749847_100000188424 [0,1,0,1,0,0|2,0,0]=4 10319 B15R2.7432 O=C(c1ccccc1Br)N2CC(C2)O 240690a_100000749847_100000188424 [0,1,0,1,0,0|2,0,0]=4 10320 B15R2.7432 O=C(c1ccccc1Br)N2CC(C2)O 527a_100000749847_100000188424 [0,1,0,1,0,0|2,0,0]=4 10321 B15R2.7432 O=C(c1ccccc1Cl)N2CC(C2)F 11a_100000690557_100000185844 [0,1,0,1,0,0|2,0,0]=4 10322 B15R2.7432 O=C(c1ccccc1Cl)N2CC(C2)F 240690a_100000690557_100000185844 [0,1,0,1,0,0|2,0,0]=4 10323 B15R2.7432 O=C(c1ccccc1Cl)N2CC(C2)F 527a_100000690557_100000185844 [0,1,0,1,0,0|2,0,0]=4 10324 B15R2.7432 O=C(c1ccccc1Cl)N2CC(C2)O 11a_100000749847_100000185844 [0,1,0,1,0,0|2,0,0]=4 10325 B15R2.7432 O=C(c1ccccc1Cl)N2CC(C2)O 240690a_100000749847_100000185844 [0,1,0,1,0,0|2,0,0]=4 10326 B15R2.7432 O=C(c1ccccc1Cl)N2CC(C2)O 527a_100000749847_100000185844 [0,1,0,1,0,0|2,0,0]=4 10327 B15R2.7432 O=C(c1ccccc1F)N2CC(C2)F 11a_100000690557_100000188656 [0,1,0,1,0,0|2,0,0]=4 10328 B15R2.7432 O=C(c1ccccc1F)N2CC(C2)F 240690a_100000690557_100000188656 [0,1,0,1,0,0|2,0,0]=4 10329 B15R2.7432 O=C(c1ccccc1F)N2CC(C2)F 527a_100000690557_100000188656 [0,1,0,1,0,0|2,0,0]=4 10330 B15R2.7432 O=C(c1ccccc1F)N2CC(C2)O 11a_100000749847_100000188656 [0,1,0,1,0,0|2,0,0]=4 10331 B15R2.7432 O=C(c1ccccc1F)N2CC(C2)O 240690a_100000749847_100000188656 [0,1,0,1,0,0|2,0,0]=4 10332 B15R2.7432 O=C(c1ccccc1F)N2CC(C2)O 527a_100000749847_100000188656 [0,1,0,1,0,0|2,0,0]=4 10333 B15R2.7432 O=C(c1ccccc1I)N2CC(C2)F 11a_100000690557_100000187884 [0,1,0,1,0,0|2,0,0]=4 10334 B15R2.7432 O=C(c1ccccc1I)N2CC(C2)F 240690a_100000690557_100000187884 [0,1,0,1,0,0|2,0,0]=4 10335 B15R2.7432 O=C(c1ccccc1I)N2CC(C2)F 527a_100000690557_100000187884 [0,1,0,1,0,0|2,0,0]=4 10336 B15R2.7432 O=C(c1ccccc1I)N2CC(C2)O 11a_100000749847_100000187884 [0,1,0,1,0,0|2,0,0]=4 10337 B15R2.7432 O=C(c1ccccc1I)N2CC(C2)O 240690a_100000749847_100000187884 [0,1,0,1,0,0|2,0,0]=4 10338 B15R2.7432 O=C(c1ccccc1I)N2CC(C2)O 527a_100000749847_100000187884 [0,1,0,1,0,0|2,0,0]=4 10339 B15R2.7432 O=C(c1ccccc1O)N2CC(C2)F 240690a_100000690557_100015234032 [0,1,0,1,0,0|2,0,0]=4 10340 B15R2.7432 O=C(c1ccccc1O)N2CC(C2)O 240690a_100000749847_100015234032 [0,1,0,1,0,0|2,0,0]=4 10341 B15R2.7432 O=C(c1ccccc1[O-])N2CC(C2)F 240690a_100000690557_100009911694 [0,1,0,1,0,0|2,0,0]=4 10342 B15R2.7432 O=C(c1ccccc1[O-])N2CC(C2)F 527a_100000690557_100009911694 [0,1,0,1,0,0|2,0,0]=4 10343 B15R2.7432 O=C(c1ccccc1[O-])N2CC(C2)O 240690a_100000749847_100009911694 [0,1,0,1,0,0|2,0,0]=4 10344 B15R2.7432 O=C(c1ccccc1[O-])N2CC(C2)O 527a_100000749847_100009911694 [0,1,0,1,0,0|2,0,0]=4 10345 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212026 [0,1,0,1,0,0|2,0,0]=4 10346 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212026 [0,1,0,1,0,0|2,0,0]=4 10347 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000212026 [0,1,0,1,0,0|2,0,0]=4 10348 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000212026 [0,1,0,1,0,0|2,0,0]=4 10349 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212026 [0,1,0,1,0,0|2,0,0]=4 10350 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000212026 [0,1,0,1,0,0|2,0,0]=4 10351 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Br 240690a_100015190264_100000188424 [0,1,0,1,0,0|2,0,0]=4 10352 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Br 527a_100015190264_100000188424 [0,1,0,1,0,0|2,0,0]=4 10353 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Cl 240690a_100015190264_100000185844 [0,1,0,1,0,0|2,0,0]=4 10354 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Cl 527a_100015190264_100000185844 [0,1,0,1,0,0|2,0,0]=4 10355 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2F 240690a_100015190264_100000188656 [0,1,0,1,0,0|2,0,0]=4 10356 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2F 527a_100015190264_100000188656 [0,1,0,1,0,0|2,0,0]=4 10357 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2I 240690a_100015190264_100000187884 [0,1,0,1,0,0|2,0,0]=4 10358 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2I 527a_100015190264_100000187884 [0,1,0,1,0,0|2,0,0]=4 10359 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2O 240690a_100015190264_100015234032 [0,1,0,1,0,0|2,0,0]=4 10360 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2[O-] 240690a_100015190264_100009911694 [0,1,0,1,0,0|2,0,0]=4 10361 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2[O-] 527a_100015190264_100009911694 [0,1,0,1,0,0|2,0,0]=4 10362 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 11a_100025746932_100000188424 [0,1,0,1,0,0|2,0,0]=4 10363 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 1626a_100025746932_100000188424 [0,1,0,1,0,0|2,0,0]=4 10364 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 240690a_100025746932_100000188424 [0,1,0,1,0,0|2,0,0]=4 10365 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 527a_100025746932_100000188424 [0,1,0,1,0,0|2,0,0]=4 10366 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 11a_100025746932_100000185844 [0,1,0,1,0,0|2,0,0]=4 10367 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 1626a_100025746932_100000185844 [0,1,0,1,0,0|2,0,0]=4 10368 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 240690a_100025746932_100000185844 [0,1,0,1,0,0|2,0,0]=4 10369 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 527a_100025746932_100000185844 [0,1,0,1,0,0|2,0,0]=4 10370 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 11a_100025746932_100000188656 [0,1,0,1,0,0|2,0,0]=4 10371 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 1626a_100025746932_100000188656 [0,1,0,1,0,0|2,0,0]=4 10372 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 240690a_100025746932_100000188656 [0,1,0,1,0,0|2,0,0]=4 10373 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 527a_100025746932_100000188656 [0,1,0,1,0,0|2,0,0]=4 10374 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 11a_100025746932_100000187884 [0,1,0,1,0,0|2,0,0]=4 10375 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 1626a_100025746932_100000187884 [0,1,0,1,0,0|2,0,0]=4 10376 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 240690a_100025746932_100000187884 [0,1,0,1,0,0|2,0,0]=4 10377 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 527a_100025746932_100000187884 [0,1,0,1,0,0|2,0,0]=4 10378 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2O 240690a_100025746932_100015234032 [0,1,0,1,0,0|2,0,0]=4 10379 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2[O-] 1626a_100025746932_100009911694 [0,1,0,1,0,0|2,0,0]=4 10380 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2[O-] 240690a_100025746932_100009911694 [0,1,0,1,0,0|2,0,0]=4 10381 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2[O-] 527a_100025746932_100009911694 [0,1,0,1,0,0|2,0,0]=4 10382 B15R2.7474 CC1(COC(=N1)c2ccccc2O)C 271570a_203496583355_100000695370 [0,1,0,1,0,0|1,0,0]=3 10383 B15R2.8805 CC(OCC1CC1)c2ccccc2Br 34a_100000702211_100000742324 [0,1,0,1,0,0|1,0,1]=4 10384 B15R2.8805 CC(OCC1CC1)c2ccccc2Br 7a_100000702211_100000742324 [0,1,0,1,0,0|1,0,1]=4 10385 B15R2.8805 CC(OCC1CC1)c2ccccc2Cl 34a_100000740796_100000742324 [0,1,0,1,0,0|1,0,1]=4 10386 B15R2.8805 CC(OCC1CC1)c2ccccc2Cl 7a_100000740796_100000742324 [0,1,0,1,0,0|1,0,1]=4 10387 B15R2.8805 CC(OCC1CC1)c2ccccc2F 34a_100000211283_200000741388 [0,1,0,1,0,0|1,0,1]=4 10388 B15R2.8805 CC(OCC1CC1)c2ccccc2F 34a_100000697922_100000742324 [0,1,0,1,0,0|1,0,1]=4 10389 B15R2.8805 CC(OCC1CC1)c2ccccc2F 7a_100000697922_100000742324 [0,1,0,1,0,0|1,0,1]=4 10390 B15R2.8805 CC(OCC1CC1)c2ccccc2N 7a_100011405641_100000742324 [0,1,0,1,0,0|1,0,1]=4 10391 B15R2.8805 Cc1ccccc1C(=O)CCC2CC2 1458a_100000212026_100000694398 [0,1,0,1,0,0|1,0,0]=3 10392 B15R2.8805 Cc1ccccc1C(=O)CCC2CO2 1458a_100000212026_100000732470 [0,1,0,1,0,0|2,0,0]=4 10393 B15R2.8805 Cc1ccccc1C(=O)CNC2CC2 34a_100000212008_100000741374 [0,1,0,1,0,0|2,0,0]=4 10394 B15R2.8805 Cc1ccccc1C(=O)CSC2CC2 62a_100000741374_100000211595 [0,1,0,1,0,0|2,0,0]=4 10395 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000212026 [0,1,0,1,0,0|1,0,0]=3 10396 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000212026 [0,1,0,1,0,0|1,0,0]=3 10397 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000212026 [0,1,0,1,0,0|1,0,0]=3 10398 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000212026 [0,1,0,1,0,0|1,0,0]=3 10399 B15R2.8805 Cc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000212026 [0,1,0,1,0,0|2,0,0]=4 10400 B15R2.8805 Cc1ccccc1C(C)OCC2CC2 34a_100000742021_100000742324 [0,1,0,1,0,0|1,0,1]=4 10401 B15R2.8805 Cc1ccccc1C(C)OCC2CC2 7a_100000742021_100000742324 [0,1,0,1,0,0|1,0,1]=4 10402 B15R2.8805 O=C(CCC1CC1)c2ccccc2Br 1458a_100000188424_100000694398 [0,1,0,1,0,0|1,0,0]=3 10403 B15R2.8805 O=C(CCC1CC1)c2ccccc2Cl 1458a_100000185844_100000694398 [0,1,0,1,0,0|1,0,0]=3 10404 B15R2.8805 O=C(CCC1CC1)c2ccccc2F 1458a_100000188656_100000694398 [0,1,0,1,0,0|1,0,0]=3 10405 B15R2.8805 O=C(CCC1CC1)c2ccccc2I 1458a_100000187884_100000694398 [0,1,0,1,0,0|1,0,0]=3 10406 B15R2.8805 O=C(CCC1CC1)c2ccccc2O 1458a_100015234032_100000694398 [0,1,0,1,0,0|1,0,0]=3 10407 B15R2.8805 O=C(CCC1CC1)c2ccccc2[O-] 1458a_100009911694_100000694398 [0,1,0,1,0,0|1,0,0]=3 10408 B15R2.8805 O=C(CCC1CO1)c2ccccc2Br 1458a_100000188424_100000732470 [0,1,0,1,0,0|2,0,0]=4 10409 B15R2.8805 O=C(CCC1CO1)c2ccccc2Cl 1458a_100000185844_100000732470 [0,1,0,1,0,0|2,0,0]=4 10410 B15R2.8805 O=C(CCC1CO1)c2ccccc2F 1458a_100000188656_100000732470 [0,1,0,1,0,0|2,0,0]=4 10411 B15R2.8805 O=C(CCC1CO1)c2ccccc2I 1458a_100000187884_100000732470 [0,1,0,1,0,0|2,0,0]=4 10412 B15R2.8805 O=C(CCC1CO1)c2ccccc2O 1458a_100015234032_100000732470 [0,1,0,1,0,0|2,0,0]=4 10413 B15R2.8805 O=C(CCC1CO1)c2ccccc2[O-] 1458a_100009911694_100000732470 [0,1,0,1,0,0|2,0,0]=4 10414 B15R2.8805 O=C(CNC1CC1)c2ccccc2Br 34a_100000212008_100000199116 [0,1,0,1,0,0|2,0,0]=4 10415 B15R2.8805 O=C(CNC1CC1)c2ccccc2Cl 34a_100000212008_100000211432 [0,1,0,1,0,0|2,0,0]=4 10416 B15R2.8805 O=C(CNC1CC1)c2ccccc2F 34a_100000212008_100000204681 [0,1,0,1,0,0|2,0,0]=4 10417 B15R2.8805 O=C(CSC1CC1)c2ccccc2Br 62a_100000199116_100000211595 [0,1,0,1,0,0|2,0,0]=4 10418 B15R2.8805 O=C(CSC1CC1)c2ccccc2Cl 62a_100000211432_100000211595 [0,1,0,1,0,0|2,0,0]=4 10419 B15R2.8805 O=C(CSC1CC1)c2ccccc2F 62a_100000204681_100000211595 [0,1,0,1,0,0|2,0,0]=4 10420 B15R2.8805 O=C(CSC1CC1)c2ccccc2O 62a_100000188908_100000211595 [0,1,0,1,0,0|2,0,0]=4 10421 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 11a_100000735609_100000188424 [0,1,0,1,0,0|1,0,0]=3 10422 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 1626a_100000735609_100000188424 [0,1,0,1,0,0|1,0,0]=3 10423 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 240690a_100000735609_100000188424 [0,1,0,1,0,0|1,0,0]=3 10424 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 527a_100000735609_100000188424 [0,1,0,1,0,0|1,0,0]=3 10425 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 11a_100000735609_100000185844 [0,1,0,1,0,0|1,0,0]=3 10426 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 1626a_100000735609_100000185844 [0,1,0,1,0,0|1,0,0]=3 10427 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 240690a_100000735609_100000185844 [0,1,0,1,0,0|1,0,0]=3 10428 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 527a_100000735609_100000185844 [0,1,0,1,0,0|1,0,0]=3 10429 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 11a_100000735609_100000188656 [0,1,0,1,0,0|1,0,0]=3 10430 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 1626a_100000735609_100000188656 [0,1,0,1,0,0|1,0,0]=3 10431 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 240690a_100000735609_100000188656 [0,1,0,1,0,0|1,0,0]=3 10432 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 527a_100000735609_100000188656 [0,1,0,1,0,0|1,0,0]=3 10433 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 11a_100000735609_100000187884 [0,1,0,1,0,0|1,0,0]=3 10434 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 1626a_100000735609_100000187884 [0,1,0,1,0,0|1,0,0]=3 10435 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 240690a_100000735609_100000187884 [0,1,0,1,0,0|1,0,0]=3 10436 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 527a_100000735609_100000187884 [0,1,0,1,0,0|1,0,0]=3 10437 B15R2.8805 O=C(NCC1CC1)c2ccccc2O 240690a_100000735609_100015234032 [0,1,0,1,0,0|1,0,0]=3 10438 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 1626a_100000735609_100009911694 [0,1,0,1,0,0|1,0,0]=3 10439 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 240690a_100000735609_100009911694 [0,1,0,1,0,0|1,0,0]=3 10440 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 527a_100000735609_100009911694 [0,1,0,1,0,0|1,0,0]=3 10441 B15R2.8805 O=C(NNC1CC1)c2ccccc2Br 22a_100000701032_100000188424 [0,1,0,1,0,0|2,0,0]=4 10442 B15R2.8805 O=C(NNC1CC1)c2ccccc2Cl 22a_100000701032_100000185844 [0,1,0,1,0,0|2,0,0]=4 10443 B15R2.8805 O=C(NNC1CC1)c2ccccc2F 22a_100000701032_100000188656 [0,1,0,1,0,0|2,0,0]=4 10444 B15R2.8805 O=C(NNC1CC1)c2ccccc2I 22a_100000701032_100000187884 [0,1,0,1,0,0|2,0,0]=4 10445 B15R2.8805 O=C(NNC1CC1)c2ccccc2O 22a_100000701032_100015234032 [0,1,0,1,0,0|2,0,0]=4 10446 B15R2.8805 O=C(NNC1CC1)c2ccccc2[O-] 22a_100000701032_100009911694 [0,1,0,1,0,0|2,0,0]=4 10447 B15R2.1 CCC1CC=C(CC1)c2ccccc2 271570a_200010144120_100000210277 [0,1,0,1,0,0|2,0,0]=4 10448 B15R2.1 COC1CC=C(CC1)c2ccccc2 271570a_100010144119_100000210277 [0,1,0,1,0,0|2,0,0]=4 10449 B15R2.1 CO[C@H]1CO[C@H](OC1)c2ccccc2 34a_100015291175_200000210301 [0,1,0,1,0,0|0,0,2]=4 10450 B15R2.1 CO[C@H]1CO[C@H](OC1)c2ccccc2 7a_100015291175_200000210301 [0,1,0,1,0,0|0,0,2]=4 10451 B15R2.1 [13CH3]O[C@H]1CO[C@H](OC1)c2ccccc2 34a_100015291175_200025704644 [0,1,0,1,0,0|0,0,2]=4 10452 B15R2.1 [13CH3]O[C@H]1CO[C@H](OC1)c2ccccc2 7a_100015291175_200025704644 [0,1,0,1,0,0|0,0,2]=4 10453 B15R2.620 C[C@H]1[C@H](CN1C(=O)c2ccccc2)O 11a_206633788156_100000185807 [0,1,0,1,0,0|2,0,0]=4 10454 B15R2.620 C[C@H]1[C@H](CN1C(=O)c2ccccc2)O 240690a_206633788156_100000185807 [0,1,0,1,0,0|2,0,0]=4 10455 B15R2.620 C[C@H]1[C@H](CN1C(=O)c2ccccc2)O 527a_206633788156_100000185807 [0,1,0,1,0,0|2,0,0]=4 10456 B15R2.1130 CC1CCN1CC(=O)c2ccccc2 269982a_100000755817_100000211460 [0,1,0,1,0,0|2,0,0]=4 10457 B15R2.2013 CCC1CN(C1)C(=O)c2ccccc2 11a_100015205115_100000185807 [0,1,0,1,0,0|1,0,0]=3 10458 B15R2.2013 CCC1CN(C1)C(=O)c2ccccc2 1626a_100015205115_100000185807 [0,1,0,1,0,0|1,0,0]=3 10459 B15R2.2013 CCC1CN(C1)C(=O)c2ccccc2 240690a_100015205115_100000185807 [0,1,0,1,0,0|1,0,0]=3 10460 B15R2.2013 CCC1CN(C1)C(=O)c2ccccc2 527a_100015205115_100000185807 [0,1,0,1,0,0|1,0,0]=3 10461 B15R2.2013 COC1CN(C1)C(=O)c2ccccc2 11a_100000755009_100000185807 [0,1,0,1,0,0|1,0,0]=3 10462 B15R2.2013 COC1CN(C1)C(=O)c2ccccc2 1626a_100000755009_100000185807 [0,1,0,1,0,0|1,0,0]=3 10463 B15R2.2013 COC1CN(C1)C(=O)c2ccccc2 240690a_100000755009_100000185807 [0,1,0,1,0,0|1,0,0]=3 10464 B15R2.2013 COC1CN(C1)C(=O)c2ccccc2 527a_100000755009_100000185807 [0,1,0,1,0,0|1,0,0]=3 10465 B15R2.2013 CSC1CN(C1)C(=O)c2ccccc2 11a_100016990038_100000185807 [0,1,0,1,0,0|1,0,0]=3 10466 B15R2.2013 CSC1CN(C1)C(=O)c2ccccc2 1626a_100016990038_100000185807 [0,1,0,1,0,0|1,0,0]=3 10467 B15R2.2013 CSC1CN(C1)C(=O)c2ccccc2 240690a_100016990038_100000185807 [0,1,0,1,0,0|1,0,0]=3 10468 B15R2.2013 CSC1CN(C1)C(=O)c2ccccc2 527a_100016990038_100000185807 [0,1,0,1,0,0|1,0,0]=3 10469 B15R2.2013 N#CC1CN(C1)C(=O)c2ccccc2 11a_100015195279_100000185807 [0,1,0,1,0,0|1,0,1]=4 10470 B15R2.2013 N#CC1CN(C1)C(=O)c2ccccc2 527a_100015195279_100000185807 [0,1,0,1,0,0|1,0,1]=4 10471 B15R2.2013 O=C(c1ccccc1)N2CC(C2)CF 11a_100010363649_100000185807 [0,1,0,1,0,0|1,0,0]=3 10472 B15R2.2013 O=C(c1ccccc1)N2CC(C2)CF 240690a_100010363649_100000185807 [0,1,0,1,0,0|1,0,0]=3 10473 B15R2.2013 O=C(c1ccccc1)N2CC(C2)CF 527a_100010363649_100000185807 [0,1,0,1,0,0|1,0,0]=3 10474 B15R2.2013 O=C(c1ccccc1)N2CC(C2)CO 240690a_100016987283_100000185807 [0,1,0,1,0,0|1,0,0]=3 10475 B15R2.2013 O=C(c1ccccc1)N2CC(C2)CO 527a_100016987283_100000185807 [0,1,0,1,0,0|1,0,0]=3 10476 B15R2.16439 CC(OCC1CCC1)c2ccccc2 34a_100000760304_100000211855 [0,1,0,1,0,0|1,0,1]=4 10477 B15R2.16439 CC(OCC1CCO1)c2ccccc2 34a_100000039022_100000211855 [0,1,0,1,0,0|1,0,1]=4 10478 B15R2.16439 CC(OCC1CNC1)c2ccccc2 34a_100016987283_100000211855 [0,1,0,1,0,0|1,0,1]=4 10479 B15R2.16439 CC(OCC1COC1)c2ccccc2 34a_100000060846_100000211855 [0,1,0,1,0,0|1,0,1]=4 10480 B15R2.16439 C[C@@H](OCC1CCC1)c2ccccc2 34a_100000761318_100000763275 [0,1,0,1,0,0|1,0,1]=4 10481 B15R2.16439 C[C@@H](OCC1CCC1)c2ccccc2 7a_100000761318_100000763275 [0,1,0,1,0,0|1,0,1]=4 10482 B15R2.16439 C[C@@H](OCC1CCO1)c2ccccc2 34a_100000761318_100000103362 [0,1,0,1,0,0|1,0,1]=4 10483 B15R2.16439 C[C@@H](OCC1CCO1)c2ccccc2 7a_100000761318_100000103362 [0,1,0,1,0,0|1,0,1]=4 10484 B15R2.16439 C[C@@H](OCC1COC1)c2ccccc2 34a_100000761318_100010264016 [0,1,0,1,0,0|1,0,1]=4 10485 B15R2.16439 C[C@@H](OCC1COC1)c2ccccc2 7a_100000761318_100010264016 [0,1,0,1,0,0|1,0,1]=4 10486 B15R2.16439 O=C(CCN1CCC1)c2ccccc2 269982a_100000754969_100000750707 [0,1,0,1,0,0|2,0,0]=4 10487 B15R2.16439 O=C(COC1CSC1)c2ccccc2 7a_100000072292_100000211460 [0,1,0,1,0,0|2,0,0]=4 10488 B15R2.16439 O=C(CSC1CCC1)c2ccccc2 62a_100000211460_100000749161 [0,1,0,1,0,0|2,0,0]=4 10489 B15R2.16439 O=C(CSC1COC1)c2ccccc2 62a_100000211460_100009818527 [0,1,0,1,0,0|2,0,0]=4 10490 B15R2.16439 O=C(NCC1CCC1)c2ccccc2 11a_100000738700_100000185807 [0,1,0,1,0,0|1,0,0]=3 10491 B15R2.16439 O=C(NCC1CCC1)c2ccccc2 1626a_100000738700_100000185807 [0,1,0,1,0,0|1,0,0]=3 10492 B15R2.16439 O=C(NCC1CCC1)c2ccccc2 240690a_100000738700_100000185807 [0,1,0,1,0,0|1,0,0]=3 10493 B15R2.16439 O=C(NCC1CCC1)c2ccccc2 527a_100000738700_100000185807 [0,1,0,1,0,0|1,0,0]=3 10494 B15R2.16439 O=C(NCC1COC1)c2ccccc2 11a_100015281925_100000185807 [0,1,0,1,0,0|1,0,0]=3 10495 B15R2.16439 O=C(NCC1COC1)c2ccccc2 1626a_100015281925_100000185807 [0,1,0,1,0,0|1,0,0]=3 10496 B15R2.16439 O=C(NCC1COC1)c2ccccc2 240690a_100015281925_100000185807 [0,1,0,1,0,0|1,0,0]=3 10497 B15R2.16439 O=C(NCC1COC1)c2ccccc2 527a_100015281925_100000185807 [0,1,0,1,0,0|1,0,0]=3 10498 B15R2.16439 O=C(NC[C@@H]1CCO1)c2ccccc2 11a_100020831831_100000185807 [0,1,0,1,0,0|1,0,0]=3 10499 B15R2.16439 O=C(NC[C@@H]1CCO1)c2ccccc2 1626a_100020831831_100000185807 [0,1,0,1,0,0|1,0,0]=3 10500 B15R2.16439 O=C(NC[C@@H]1CCO1)c2ccccc2 240690a_100020831831_100000185807 [0,1,0,1,0,0|1,0,0]=3 10501 B15R2.16439 O=C(NC[C@@H]1CCO1)c2ccccc2 527a_100020831831_100000185807 [0,1,0,1,0,0|1,0,0]=3 10502 B15R2.16439 O=C(NNC1CCC1)c2ccccc2 22a_100000736358_100000185807 [0,1,0,1,0,0|2,0,0]=4 10503 B15R2.16439 O=C(NNC1COC1)c2ccccc2 22a_100015188821_100000185807 [0,1,0,1,0,0|2,0,0]=4 10504 B15R2.16439 O=C(OCN1CCC1)c2ccccc2 269982a_100000754969_100000073877 [0,1,0,1,0,0|1,0,0]=3 10505 B15R2.23388 CCN(C)C1CC(=O)c2c1cccc2 2230a_100000225621_100010208147 [0,1,0,1,0,0|2,0,0]=4 10506 B15R2.23388 CCN(C)C1CC(=O)c2c1cccc2 269982a_100000225621_100010208147 [0,1,0,1,0,0|2,0,0]=4 10507 B15R2.23388 CCN(C)C1OC(=O)c2c1cccc2 2230a_100000225621_100009813457 [0,1,0,1,0,0|1,0,0]=3 10508 B15R2.23388 CCN(C)C1OC(=O)c2c1cccc2 269982a_100000225621_100009813457 [0,1,0,1,0,0|1,0,0]=3 10509 B15R2.24496 CC(OCC1(CC1)C)c2ccccc2 7a_100000698024_100000230085 [0,1,0,1,0,0|1,0,1]=4 10510 B15R2.24496 CC(OCC1(CC1)F)c2ccccc2 34a_200000703853_100000211855 [0,1,0,1,0,0|1,0,1]=4 10511 B15R2.24496 CC(OCC1(CC1)F)c2ccccc2 7a_200000703853_100000230085 [0,1,0,1,0,0|1,0,1]=4 10512 B15R2.24496 CC1(CC1)CNC(=O)c2ccccc2 11a_100000766693_100000185807 [0,1,0,1,0,0|1,0,0]=3 10513 B15R2.24496 CC1(CC1)CNC(=O)c2ccccc2 1626a_100000766693_100000185807 [0,1,0,1,0,0|1,0,0]=3 10514 B15R2.24496 CC1(CC1)CNC(=O)c2ccccc2 240690a_100000766693_100000185807 [0,1,0,1,0,0|1,0,0]=3 10515 B15R2.24496 CC1(CC1)CNC(=O)c2ccccc2 527a_100000766693_100000185807 [0,1,0,1,0,0|1,0,0]=3 10516 B15R2.24496 CC1(CC1)OCC(=O)c2ccccc2 7a_100011725673_100000211460 [0,1,0,1,0,0|2,0,0]=4 10517 B15R2.24496 C[C@@H](OCC1(CO1)C)c2ccccc2 34a_100000761318_100000760498 [0,1,0,1,0,0|1,0,1]=4 10518 B15R2.24496 O=C(NCC1(CC1)O)c2ccccc2 11a_100011936951_100000185807 [0,1,0,1,0,0|1,0,0]=3 10519 B15R2.24496 O=C(NCC1(CC1)O)c2ccccc2 240690a_100011936951_100000185807 [0,1,0,1,0,0|1,0,0]=3 10520 B15R2.24496 O=C(NCC1(CC1)O)c2ccccc2 527a_100011936951_100000185807 [0,1,0,1,0,0|1,0,0]=3 10521 B15R2.79185 CC[C@H](C)COC1Cc2c1cccc2 7a_100009816381_100009813401 [0,1,0,1,0,0|1,0,1]=4 10522 B15R2.41154 CC(NC(=O)c1ccccc1)C2CC2 11a_100000700016_100000185807 [0,1,0,1,0,0|1,0,0]=3 10523 B15R2.41154 CC(NC(=O)c1ccccc1)C2CC2 1626a_100000700016_100000185807 [0,1,0,1,0,0|1,0,0]=3 10524 B15R2.41154 CC(NC(=O)c1ccccc1)C2CC2 240690a_100000700016_100000185807 [0,1,0,1,0,0|1,0,0]=3 10525 B15R2.41154 CC(NC(=O)c1ccccc1)C2CC2 527a_100000700016_100000185807 [0,1,0,1,0,0|1,0,0]=3 10526 B15R2.41154 CC(OC(C)C1CC1)c2ccccc2 34a_100000744524_100000211855 [0,1,0,1,0,0|1,0,1]=4 10527 B15R2.41154 CC(OC(C)C1CC1)c2ccccc2 7a_100000744524_100000230085 [0,1,0,1,0,0|1,0,1]=4 10528 B15R2.41154 CN(CC(=O)c1ccccc1)C2CC2 269982a_100000226674_100000211460 [0,1,0,1,0,0|2,0,0]=4 10529 B15R2.41154 O=C(CC(=O)C1CC1)c2ccccc2 1458a_100000185807_100000746382 [0,1,0,1,0,0|1,0,1]=4 10530 B15R2.41154 O=C(CC(=O)C1CC1)c2ccccc2 1458a_100000210395_100000211460 [0,1,0,1,0,0|1,0,1]=4 10531 B15R2.107888 CC(C)C(C)OC1Cc2c1cccc2 7a_100000748068_100009813401 [0,1,0,1,0,0|1,0,1]=4 10532 B15R2.16431 C=C(C(=O)CC1CC1)c2ccccc2 1458a_100000065200_100000742324 [0,1,0,1,0,0|2,0,0]=4 10533 B15R2.16431 CC(SC1CC1)C(=O)c2ccccc2 62a_100000239700_100000211595 [0,1,0,1,0,0|2,0,0]=4 10534 B15R2.16431 CN(CC1CC1)C(=O)c2ccccc2 11a_100000741881_100000185807 [0,1,0,1,0,0|1,0,0]=3 10535 B15R2.16431 CN(CC1CC1)C(=O)c2ccccc2 1626a_100000741881_100000185807 [0,1,0,1,0,0|1,0,0]=3 10536 B15R2.16431 CN(CC1CC1)C(=O)c2ccccc2 240690a_100000741881_100000185807 [0,1,0,1,0,0|1,0,0]=3 10537 B15R2.16431 CN(CC1CC1)C(=O)c2ccccc2 527a_100000741881_100000185807 [0,1,0,1,0,0|1,0,0]=3 10538 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)C 11a_100000753659_100000185807 [0,1,0,1,0,0|1,0,0]=3 10539 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)C 1626a_100000753659_100000185807 [0,1,0,1,0,0|1,0,0]=3 10540 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)C 240690a_100000753659_100000185807 [0,1,0,1,0,0|1,0,0]=3 10541 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)C 527a_100000753659_100000185807 [0,1,0,1,0,0|1,0,0]=3 10542 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)F 11a_100000696199_100000185807 [0,1,0,1,0,0|1,0,0]=3 10543 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)F 1626a_100000696199_100000185807 [0,1,0,1,0,0|1,0,0]=3 10544 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)F 240690a_100000696199_100000185807 [0,1,0,1,0,0|1,0,0]=3 10545 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)F 527a_100000696199_100000185807 [0,1,0,1,0,0|1,0,0]=3 10546 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)O 11a_100000718560_100000185807 [0,1,0,1,0,0|1,0,0]=3 10547 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)O 240690a_100000718560_100000185807 [0,1,0,1,0,0|1,0,0]=3 10548 B15R2.29383 CC1(CN(C1)C(=O)c2ccccc2)O 527a_100000718560_100000185807 [0,1,0,1,0,0|1,0,0]=3 10549 B15R2.29383 O=C(c1ccccc1)C2CC(C2)(F)F 1458a_100000185807_100010741680 [0,1,0,1,0,0|2,0,0]=4 10550 B15R2.29383 O=C(c1ccccc1)N2CC(C2)(F)F 1626a_100000684464_100000185807 [0,1,0,1,0,0|2,0,0]=4 10551 B15R2.29383 O=C(c1ccccc1)N2CC(C2)(F)F 240690a_100000684464_100000185807 [0,1,0,1,0,0|2,0,0]=4 10552 B15R2.29383 O=C(c1ccccc1)N2CC(C2)(F)F 527a_100000684464_100000185807 [0,1,0,1,0,0|2,0,0]=4 10553 B15R2.467 CC1(CC=C(CC1)c2ccccc2)C 271570a_100000069032_100000210277 [0,1,0,1,0,0|2,0,0]=4 10554 B15R2.1327 BrCC(OCC1CC1)c2ccccc2 7a_100000185958_100000742324 [0,1,0,1,0,0|1,0,1]=4 10555 B15R2.1327 C#CC(OCC1CC1)c2ccccc2 34a_100011219616_100000742324 [0,1,0,1,0,0|1,0,1]=4 10556 B15R2.1327 C#CC(OCC1CC1)c2ccccc2 7a_100011219616_100000742324 [0,1,0,1,0,0|1,0,1]=4 10557 B15R2.1327 C=CC(OCC1CC1)c2ccccc2 34a_100011215659_100000742324 [0,1,0,1,0,0|1,0,1]=4 10558 B15R2.1327 C=CC(OCC1CC1)c2ccccc2 7a_100011215659_100000742324 [0,1,0,1,0,0|1,0,1]=4 10559 B15R2.1327 CCC(OCC1CC1)c2ccccc2 34a_100000698172_100000742324 [0,1,0,1,0,0|1,0,1]=4 10560 B15R2.1327 CCC(OCC1CC1)c2ccccc2 7a_100000698172_100000742324 [0,1,0,1,0,0|1,0,1]=4 10561 B15R2.1327 ClC[C@@H](OCC1CC1)c2ccccc2 34a_100011933945_100000742324 [0,1,0,1,0,0|1,0,1]=4 10562 B15R2.1327 ClC[C@@H](OCC1CC1)c2ccccc2 7a_100011933945_100000742324 [0,1,0,1,0,0|1,0,1]=4 10563 B15R2.1327 N#CC(OCC1CC1)c2ccccc2 7a_100011217353_100000742324 [0,1,0,1,0,0|1,0,1]=4 10564 B15R2.1327 NCC(OCC1CC1)c2ccccc2 34a_100000210709_100000742324 [0,1,0,1,0,0|1,0,1]=4 10565 B15R2.3 CC1CC=C(CC1)c2ccc(cc2)Br 271570a_100010240233_100000752885 [0,1,0,1,0,0|2,0,0]=4 10566 B15R2.3 CC1CC=C(CC1)c2ccc(cc2)Cl 271570a_100010240233_100000755918 [0,1,0,1,0,0|2,0,0]=4 10567 B15R2.3 CC1CC=C(CC1)c2ccc(cc2)F 271570a_100010240233_100000211213 [0,1,0,1,0,0|2,0,0]=4 10568 B15R2.3 CC1CC=C(CC1)c2ccc(cc2)N 271570a_100010240233_100000185761 [0,1,0,1,0,0|2,0,0]=4 10569 B15R2.3 CC1CC=C(CC1)c2ccc(cc2)O 271570a_100010240233_100000185759 [0,1,0,1,0,0|2,0,0]=4 10570 B15R2.3 Cc1ccc(cc1)C2=CCC(CC2)C 271570a_100010240233_100000186775 [0,1,0,1,0,0|2,0,0]=4 10571 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Br 11a_100000702820_100000185839 [0,1,0,1,0,0|1,0,0]=3 10572 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Br 240690a_100000702820_100000185839 [0,1,0,1,0,0|1,0,0]=3 10573 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Br 527a_100000702820_100000185839 [0,1,0,1,0,0|1,0,0]=3 10574 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Cl 11a_100000702820_100000210187 [0,1,0,1,0,0|1,0,0]=3 10575 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Cl 240690a_100000702820_100000210187 [0,1,0,1,0,0|1,0,0]=3 10576 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Cl 527a_100000702820_100000210187 [0,1,0,1,0,0|1,0,0]=3 10577 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)F 11a_100000702820_100000187176 [0,1,0,1,0,0|1,0,0]=3 10578 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)F 240690a_100000702820_100000187176 [0,1,0,1,0,0|1,0,0]=3 10579 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)F 527a_100000702820_100000187176 [0,1,0,1,0,0|1,0,0]=3 10580 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)I 11a_100000702820_100000187904 [0,1,0,1,0,0|1,0,0]=3 10581 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)I 240690a_100000702820_100000187904 [0,1,0,1,0,0|1,0,0]=3 10582 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)I 527a_100000702820_100000187904 [0,1,0,1,0,0|1,0,0]=3 10583 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)O 240690a_100000702820_100000212099 [0,1,0,1,0,0|1,0,0]=3 10584 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)O 527a_100000702820_100000212099 [0,1,0,1,0,0|1,0,0]=3 10585 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)C 11a_100000702820_100000188618 [0,1,0,1,0,0|1,0,0]=3 10586 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)C 240690a_100000702820_100000188618 [0,1,0,1,0,0|1,0,0]=3 10587 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)C 527a_100000702820_100000188618 [0,1,0,1,0,0|1,0,0]=3 10588 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)F 11a_100000690557_100000188618 [0,1,0,1,0,0|2,0,0]=4 10589 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)F 240690a_100000690557_100000188618 [0,1,0,1,0,0|2,0,0]=4 10590 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)F 527a_100000690557_100000188618 [0,1,0,1,0,0|2,0,0]=4 10591 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)O 11a_100000749847_100000188618 [0,1,0,1,0,0|2,0,0]=4 10592 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)O 240690a_100000749847_100000188618 [0,1,0,1,0,0|2,0,0]=4 10593 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)O 527a_100000749847_100000188618 [0,1,0,1,0,0|2,0,0]=4 10594 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)F 11a_100000690557_100000185839 [0,1,0,1,0,0|2,0,0]=4 10595 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)F 240690a_100000690557_100000185839 [0,1,0,1,0,0|2,0,0]=4 10596 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)F 527a_100000690557_100000185839 [0,1,0,1,0,0|2,0,0]=4 10597 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)O 11a_100000749847_100000185839 [0,1,0,1,0,0|2,0,0]=4 10598 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)O 240690a_100000749847_100000185839 [0,1,0,1,0,0|2,0,0]=4 10599 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)O 527a_100000749847_100000185839 [0,1,0,1,0,0|2,0,0]=4 10600 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)F 11a_100000690557_100000210187 [0,1,0,1,0,0|2,0,0]=4 10601 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)F 240690a_100000690557_100000210187 [0,1,0,1,0,0|2,0,0]=4 10602 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)F 527a_100000690557_100000210187 [0,1,0,1,0,0|2,0,0]=4 10603 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)O 11a_100000749847_100000210187 [0,1,0,1,0,0|2,0,0]=4 10604 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)O 240690a_100000749847_100000210187 [0,1,0,1,0,0|2,0,0]=4 10605 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)O 527a_100000749847_100000210187 [0,1,0,1,0,0|2,0,0]=4 10606 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)F 11a_100000690557_100000187176 [0,1,0,1,0,0|2,0,0]=4 10607 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)F 240690a_100000690557_100000187176 [0,1,0,1,0,0|2,0,0]=4 10608 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)F 527a_100000690557_100000187176 [0,1,0,1,0,0|2,0,0]=4 10609 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)O 11a_100000749847_100000187176 [0,1,0,1,0,0|2,0,0]=4 10610 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)O 240690a_100000749847_100000187176 [0,1,0,1,0,0|2,0,0]=4 10611 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)O 527a_100000749847_100000187176 [0,1,0,1,0,0|2,0,0]=4 10612 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)F 11a_100000690557_100000187904 [0,1,0,1,0,0|2,0,0]=4 10613 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)F 240690a_100000690557_100000187904 [0,1,0,1,0,0|2,0,0]=4 10614 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)F 527a_100000690557_100000187904 [0,1,0,1,0,0|2,0,0]=4 10615 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)O 11a_100000749847_100000187904 [0,1,0,1,0,0|2,0,0]=4 10616 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)O 240690a_100000749847_100000187904 [0,1,0,1,0,0|2,0,0]=4 10617 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)O 527a_100000749847_100000187904 [0,1,0,1,0,0|2,0,0]=4 10618 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)F 240690a_100000690557_100000212099 [0,1,0,1,0,0|2,0,0]=4 10619 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)F 527a_100000690557_100000212099 [0,1,0,1,0,0|2,0,0]=4 10620 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)O 240690a_100000749847_100000212099 [0,1,0,1,0,0|2,0,0]=4 10621 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)O 527a_100000749847_100000212099 [0,1,0,1,0,0|2,0,0]=4 10622 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000188618 [0,1,0,1,0,0|2,0,0]=4 10623 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000188618 [0,1,0,1,0,0|2,0,0]=4 10624 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 10625 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 10626 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 10627 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 10628 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Br 240690a_100015190264_100000185839 [0,1,0,1,0,0|2,0,0]=4 10629 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Br 527a_100015190264_100000185839 [0,1,0,1,0,0|2,0,0]=4 10630 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Cl 240690a_100015190264_100000210187 [0,1,0,1,0,0|2,0,0]=4 10631 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Cl 527a_100015190264_100000210187 [0,1,0,1,0,0|2,0,0]=4 10632 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)F 240690a_100015190264_100000187176 [0,1,0,1,0,0|2,0,0]=4 10633 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)F 527a_100015190264_100000187176 [0,1,0,1,0,0|2,0,0]=4 10634 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)I 240690a_100015190264_100000187904 [0,1,0,1,0,0|2,0,0]=4 10635 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)I 527a_100015190264_100000187904 [0,1,0,1,0,0|2,0,0]=4 10636 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)O 240690a_100015190264_100000212099 [0,1,0,1,0,0|2,0,0]=4 10637 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)O 527a_100015190264_100000212099 [0,1,0,1,0,0|2,0,0]=4 10638 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 11a_100025746932_100000185839 [0,1,0,1,0,0|2,0,0]=4 10639 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 1626a_100025746932_100000185839 [0,1,0,1,0,0|2,0,0]=4 10640 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 240690a_100025746932_100000185839 [0,1,0,1,0,0|2,0,0]=4 10641 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 527a_100025746932_100000185839 [0,1,0,1,0,0|2,0,0]=4 10642 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 11a_100025746932_100000210187 [0,1,0,1,0,0|2,0,0]=4 10643 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 1626a_100025746932_100000210187 [0,1,0,1,0,0|2,0,0]=4 10644 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 240690a_100025746932_100000210187 [0,1,0,1,0,0|2,0,0]=4 10645 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 527a_100025746932_100000210187 [0,1,0,1,0,0|2,0,0]=4 10646 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 11a_100025746932_100000187176 [0,1,0,1,0,0|2,0,0]=4 10647 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 1626a_100025746932_100000187176 [0,1,0,1,0,0|2,0,0]=4 10648 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 240690a_100025746932_100000187176 [0,1,0,1,0,0|2,0,0]=4 10649 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 527a_100025746932_100000187176 [0,1,0,1,0,0|2,0,0]=4 10650 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 11a_100025746932_100000187904 [0,1,0,1,0,0|2,0,0]=4 10651 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 1626a_100025746932_100000187904 [0,1,0,1,0,0|2,0,0]=4 10652 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 240690a_100025746932_100000187904 [0,1,0,1,0,0|2,0,0]=4 10653 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 527a_100025746932_100000187904 [0,1,0,1,0,0|2,0,0]=4 10654 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)O 240690a_100025746932_100000212099 [0,1,0,1,0,0|2,0,0]=4 10655 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)O 527a_100025746932_100000212099 [0,1,0,1,0,0|2,0,0]=4 10656 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)Br 34a_100000211283_100000755118 [0,1,0,1,0,0|1,0,1]=4 10657 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)Br 34a_100000745893_100000742324 [0,1,0,1,0,0|1,0,1]=4 10658 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)Br 7a_100000745893_100000742324 [0,1,0,1,0,0|1,0,1]=4 10659 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)F 34a_100000181323_100000742324 [0,1,0,1,0,0|1,0,1]=4 10660 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)F 34a_100000211283_100000743420 [0,1,0,1,0,0|1,0,1]=4 10661 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)F 7a_100000181323_100000742324 [0,1,0,1,0,0|1,0,1]=4 10662 B15R2.6983 CC(OCC1CC1)c2ccc(cc2)N 34a_100011216399_100000742324 [0,1,0,1,0,0|1,0,1]=4 10663 B15R2.6983 C[C@H](OCC1CC1)c2ccc(cc2)Cl 34a_100011852131_100000742324 [0,1,0,1,0,0|1,0,1]=4 10664 B15R2.6983 C[C@H](OCC1CC1)c2ccc(cc2)Cl 7a_100011852131_100000742324 [0,1,0,1,0,0|1,0,1]=4 10665 B15R2.6983 Cc1ccc(cc1)C(=O)CCC2CC2 1458a_100000188618_100000694398 [0,1,0,1,0,0|1,0,0]=3 10666 B15R2.6983 Cc1ccc(cc1)C(=O)CCC2CO2 1458a_100000188618_100000732470 [0,1,0,1,0,0|2,0,0]=4 10667 B15R2.6983 Cc1ccc(cc1)C(=O)CNC2CC2 34a_100000212008_100000211441 [0,1,0,1,0,0|2,0,0]=4 10668 B15R2.6983 Cc1ccc(cc1)C(=O)CSC2CC2 62a_100000211441_100000211595 [0,1,0,1,0,0|2,0,0]=4 10669 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 11a_100000735609_100000188618 [0,1,0,1,0,0|1,0,0]=3 10670 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 1626a_100000735609_100000188618 [0,1,0,1,0,0|1,0,0]=3 10671 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 240690a_100000735609_100000188618 [0,1,0,1,0,0|1,0,0]=3 10672 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 527a_100000735609_100000188618 [0,1,0,1,0,0|1,0,0]=3 10673 B15R2.6983 Cc1ccc(cc1)C(=O)NNC2CC2 22a_100000701032_100000188618 [0,1,0,1,0,0|2,0,0]=4 10674 B15R2.6983 Cc1ccc(cc1)C(C)OCC2CC2 34a_100000211283_100011261388 [0,1,0,1,0,0|1,0,1]=4 10675 B15R2.6983 Cc1ccc(cc1)[C@@H](C)OCC2CC2 34a_100000690690_100000742324 [0,1,0,1,0,0|1,0,1]=4 10676 B15R2.6983 Cc1ccc(cc1)[C@@H](C)OCC2CC2 7a_100000690690_100000742324 [0,1,0,1,0,0|1,0,1]=4 10677 B15R2.6983 O=C(CCC1CC1)c2ccc(cc2)Br 1458a_100000185839_100000694398 [0,1,0,1,0,0|1,0,0]=3 10678 B15R2.6983 O=C(CCC1CC1)c2ccc(cc2)Cl 1458a_100000210187_100000694398 [0,1,0,1,0,0|1,0,0]=3 10679 B15R2.6983 O=C(CCC1CC1)c2ccc(cc2)F 1458a_100000187176_100000694398 [0,1,0,1,0,0|1,0,0]=3 10680 B15R2.6983 O=C(CCC1CC1)c2ccc(cc2)I 1458a_100000187904_100000694398 [0,1,0,1,0,0|1,0,0]=3 10681 B15R2.6983 O=C(CCC1CC1)c2ccc(cc2)O 1458a_100000212099_100000694398 [0,1,0,1,0,0|1,0,0]=3 10682 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)Br 1458a_100000185839_100000732470 [0,1,0,1,0,0|2,0,0]=4 10683 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)Cl 1458a_100000210187_100000732470 [0,1,0,1,0,0|2,0,0]=4 10684 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)F 1458a_100000187176_100000732470 [0,1,0,1,0,0|2,0,0]=4 10685 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)I 1458a_100000187904_100000732470 [0,1,0,1,0,0|2,0,0]=4 10686 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)O 1458a_100000212099_100000732470 [0,1,0,1,0,0|2,0,0]=4 10687 B15R2.6983 O=C(CNC1CC1)c2ccc(cc2)Br 34a_100000212008_100000188085 [0,1,0,1,0,0|2,0,0]=4 10688 B15R2.6983 O=C(CNC1CC1)c2ccc(cc2)I 34a_100000212008_100011216261 [0,1,0,1,0,0|2,0,0]=4 10689 B15R2.6983 O=C(CNC1CC1)c2ccc(cc2)O 34a_100000212008_100009814261 [0,1,0,1,0,0|2,0,0]=4 10690 B15R2.6983 O=C(COC1CC1)c2ccc(cc2)F 34a_100000246311_100000211595 [0,1,0,1,0,0|2,0,0]=4 10691 B15R2.6983 O=C(CSC1CC1)c2ccc(cc2)Br 62a_100000188085_100000211595 [0,1,0,1,0,0|2,0,0]=4 10692 B15R2.6983 O=C(CSC1CC1)c2ccc(cc2)Cl 62a_100000211071_100000211595 [0,1,0,1,0,0|2,0,0]=4 10693 B15R2.6983 O=C(CSC1CC1)c2ccc(cc2)F 62a_100000211279_100000211595 [0,1,0,1,0,0|2,0,0]=4 10694 B15R2.6983 O=C(CSC1CC1)c2ccc(cc2)I 62a_100011216261_100000211595 [0,1,0,1,0,0|2,0,0]=4 10695 B15R2.6983 O=C(CSC1CC1)c2ccc(cc2)O 62a_100009814261_100000211595 [0,1,0,1,0,0|2,0,0]=4 10696 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 11a_100000735609_100000185839 [0,1,0,1,0,0|1,0,0]=3 10697 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 1626a_100000735609_100000185839 [0,1,0,1,0,0|1,0,0]=3 10698 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 240690a_100000735609_100000185839 [0,1,0,1,0,0|1,0,0]=3 10699 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 527a_100000735609_100000185839 [0,1,0,1,0,0|1,0,0]=3 10700 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 11a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 10701 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 1626a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 10702 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 240690a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 10703 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 527a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 10704 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 11a_100000735609_100000187176 [0,1,0,1,0,0|1,0,0]=3 10705 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 1626a_100000735609_100000187176 [0,1,0,1,0,0|1,0,0]=3 10706 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 240690a_100000735609_100000187176 [0,1,0,1,0,0|1,0,0]=3 10707 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 527a_100000735609_100000187176 [0,1,0,1,0,0|1,0,0]=3 10708 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 11a_100000735609_100000187904 [0,1,0,1,0,0|1,0,0]=3 10709 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 1626a_100000735609_100000187904 [0,1,0,1,0,0|1,0,0]=3 10710 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 240690a_100000735609_100000187904 [0,1,0,1,0,0|1,0,0]=3 10711 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 527a_100000735609_100000187904 [0,1,0,1,0,0|1,0,0]=3 10712 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)O 240690a_100000735609_100000212099 [0,1,0,1,0,0|1,0,0]=3 10713 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)O 527a_100000735609_100000212099 [0,1,0,1,0,0|1,0,0]=3 10714 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)Br 22a_100000701032_100000185839 [0,1,0,1,0,0|2,0,0]=4 10715 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)Cl 22a_100000701032_100000210187 [0,1,0,1,0,0|2,0,0]=4 10716 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)F 22a_100000701032_100000187176 [0,1,0,1,0,0|2,0,0]=4 10717 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)I 22a_100000701032_100000187904 [0,1,0,1,0,0|2,0,0]=4 10718 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)O 22a_100000701032_100000212099 [0,1,0,1,0,0|2,0,0]=4 10719 B15R2.6983 [2H]C(OCC1CC1)c2ccc(cc2)F 34a_217856618577_100000742324 [0,1,0,1,0,0|1,0,1]=4 10720 B15R2.6983 [2H]C(OCC1CC1)c2ccc(cc2)F 7a_217856618577_100000742324 [0,1,0,1,0,0|1,0,1]=4 10721 B15R2.18934 CC1(COC(=N1)c2ccc(cc2)O)C 271570a_203496583355_100009998103 [0,1,0,1,0,0|1,0,0]=3 10722 B15R2.608 CC1CN(C1)S(=O)(=O)c2ccccc2 270084a_100000702820_100000210345 [0,1,0,1,0,0|2,0,0]=4 10723 B15R2.608 CC1CN(C1)S(=O)(=O)c2ccccc2 274078a_100000702820_100000210345 [0,1,0,1,0,0|2,0,0]=4 10724 B15R2.608 CC1CN(C1)S(=O)(=O)c2ccccc2 40a_100000702820_100000032697 [0,1,0,1,0,0|2,0,0]=4 10725 B15R2.42976 CC(C)(OCC1CC1)c2ccccc2 7a_100000694644_100000742324 [0,1,0,1,0,0|1,0,1]=4 10726 B15R2.42976 O=S(=O)(NCC1CC1)c2ccccc2 270084a_100000735609_100000210345 [0,1,0,1,0,0|2,0,0]=4 10727 B15R2.42976 O=S(=O)(NCC1CC1)c2ccccc2 274078a_100000735609_100000210345 [0,1,0,1,0,0|2,0,0]=4 10728 B15R2.42976 O=S(=O)(NCC1CC1)c2ccccc2 40a_100000735609_100000032697 [0,1,0,1,0,0|2,0,0]=4 10729 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [1,0,0,0,1,0|0,0,2]=4 10730 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [1,0,0,0,1,0|0,0,2]=4 10731 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [1,0,0,0,1,0|1,0,1]=4 10732 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [1,0,0,0,1,0|0,0,1]=3 10733 B11R1.91 CC(C)C=Cc1ccccn1 271570a_100016257149_100011216584 [1,0,0,0,1,0|1,0,1]=4 10734 B11R1.91 CC(C)C=Cc1cccnc1 271570a_100016257149_100000752921 [1,0,0,0,1,0|1,0,1]=4 10735 B11R1.91 CC(C)C=Cc1ccncc1 271570a_100016257149_100000035832 [1,0,0,0,1,0|1,0,1]=4 10736 B11R1.91 CC(C)CNc1ccccc1 34a_100000106764_100000210624 [1,0,0,0,1,0|1,0,0]=3 10737 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [1,0,0,0,1,0|0,0,0]=2 10738 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [1,0,0,0,1,0|0,0,0]=2 10739 B11R1.91 CC(C)COc1cccnc1 34a_100000210849_100000210624 [1,0,0,0,1,0|1,0,0]=3 10740 B11R1.91 CC(C)COc1cccnc1 7a_100000210849_100000210760 [1,0,0,0,1,0|1,0,0]=3 10741 B11R1.91 CC(C)COc1ccncc1 34a_100000212176_100000210624 [1,0,0,0,1,0|1,0,0]=3 10742 B11R1.91 CC(C)COc1ccnnc1 34a_100015204005_100000210624 [1,0,0,0,1,0|2,0,0]=4 10743 B11R1.91 CC(C)COc1cncnc1 7a_100000754086_100000210760 [1,0,0,0,1,0|2,0,0]=4 10744 B11R1.91 CC(C)CSc1ccccc1 62a_100000210624_100000041952 [1,0,0,0,1,0|0,1,0]=3 10745 B11R1.91 CC(C)CSc1ccccc1 62a_100000719477_100000210760 [1,0,0,0,1,0|0,1,0]=3 10746 B11R1.91 CC(C)CSc1ccccn1 62a_100000210624_100011216584 [1,0,0,0,1,0|1,1,0]=4 10747 B11R1.91 CC(C)CSc1ccccn1 62a_100011216584_100000210760 [1,0,0,0,1,0|1,1,0]=4 10748 B11R1.91 CC(C)CSc1cccnc1 62a_100000210063_100000210760 [1,0,0,0,1,0|1,1,0]=4 10749 B11R1.91 CC(C)CSc1cccnc1 62a_100000210624_100000210063 [1,0,0,0,1,0|1,1,0]=4 10750 B11R1.91 CC(C)CSc1ccncc1 62a_100000210624_100000728582 [1,0,0,0,1,0|1,1,0]=4 10751 B11R1.91 CC(C)CSc1ccncc1 62a_100000728582_100000210760 [1,0,0,0,1,0|1,1,0]=4 10752 B11R1.91 CC(C)NCc1ccccc1 207a_100138425928_100015611070 [1,0,0,0,1,0|1,0,1]=4 10753 B11R1.91 CC(C)NCc1ccccc1 2230a_100015324214_100000210206 [1,0,0,0,1,0|1,0,1]=4 10754 B11R1.91 CC(C)NCc1ccccc1 2230a_100138425928_100015291786 [1,0,0,0,1,0|1,0,1]=4 10755 B11R1.91 CC(C)NCc1ccccc1 34a_100015324214_100000210206 [1,0,0,0,1,0|1,0,1]=4 10756 B11R1.91 CC(C)NCc1ccccc1 34a_100138425928_100015291786 [1,0,0,0,1,0|1,0,1]=4 10757 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [1,0,0,0,1,0|0,0,1]=3 10758 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [1,0,0,0,1,0|0,0,1]=3 10759 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [1,0,0,0,1,0|0,0,1]=3 10760 B11R1.91 CC(C)OCc1ccccn1 34a_100000212225_100000721315 [1,0,0,0,1,0|1,0,1]=4 10761 B11R1.91 CC(C)OCc1cccnc1 34a_100000212225_100000733263 [1,0,0,0,1,0|1,0,1]=4 10762 B11R1.91 CC(C)SCc1ccccc1 62a_100000210206_100015291786 [1,0,0,0,1,0|0,1,1]=4 10763 B11R1.91 CC(C)SCc1ccccc1 62a_100000211182_100000210206 [1,0,0,0,1,0|0,1,1]=4 10764 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [1,0,0,0,1,0|1,0,1]=4 10765 B11R1.91 CC(O)CNc1ccccc1 34a_100000106764_100011218427 [1,0,0,0,1,0|2,0,0]=4 10766 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [1,0,0,0,1,0|1,0,0]=3 10767 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [1,0,0,0,1,0|1,0,0]=3 10768 B11R1.91 CC(O)COc1cccnc1 34a_100000210849_100011218427 [1,0,0,0,1,0|2,0,0]=4 10769 B11R1.91 CC(O)COc1cccnc1 7a_100000210849_100011218427 [1,0,0,0,1,0|2,0,0]=4 10770 B11R1.91 CC(O)COc1ccncc1 34a_100000212176_100011218427 [1,0,0,0,1,0|2,0,0]=4 10771 B11R1.91 CC(O)CSc1ccccc1 62a_100000719477_100011218427 [1,0,0,0,1,0|1,1,0]=4 10772 B11R1.91 CC(O)CSc1ccccc1 62a_100011218427_100000041952 [1,0,0,0,1,0|1,1,0]=4 10773 B11R1.91 CN(C)CCc1ccccc1 2230a_100000207497_200000210301 [1,0,0,0,1,0|1,0,1]=4 10774 B11R1.91 CN(C)CCc1ccccc1 2230a_100102631434_100000765856 [1,0,0,0,1,0|1,0,1]=4 10775 B11R1.91 CN(C)CCc1ccccc1 269982a_100000207497_200000210301 [1,0,0,0,1,0|1,0,1]=4 10776 B11R1.91 CN(C)CCc1ccccc1 269982a_100102631434_100000765856 [1,0,0,0,1,0|1,0,1]=4 10777 B11R1.91 CN(C)CSc1ccccc1 2230a_100102631434_100011218342 [1,0,0,0,1,0|1,1,0]=4 10778 B11R1.91 CN(C)CSc1ccccc1 269982a_100102631434_100011218342 [1,0,0,0,1,0|1,1,0]=4 10779 B11R1.91 CN([13CH3])CCc1ccccc1 2230a_100000207497_200025704644 [1,0,0,0,1,0|1,0,1]=4 10780 B11R1.91 CN([13CH3])CCc1ccccc1 269982a_100000207497_200025704644 [1,0,0,0,1,0|1,0,1]=4 10781 B11R1.91 C[C@@H](O)CNc1ccccc1 34a_100000106764_100009817552 [1,0,0,0,1,0|2,0,0]=4 10782 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [1,0,0,0,1,0|1,0,0]=3 10783 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [1,0,0,0,1,0|1,0,0]=3 10784 B11R1.91 C[C@@H](O)COc1cccnc1 34a_100000210849_100009817552 [1,0,0,0,1,0|2,0,0]=4 10785 B11R1.91 C[C@@H](O)COc1cccnc1 7a_100000210849_100009817552 [1,0,0,0,1,0|2,0,0]=4 10786 B11R1.91 C[C@@H](O)COc1ccncc1 34a_100000212176_100009817552 [1,0,0,0,1,0|2,0,0]=4 10787 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100000719477_100009817552 [1,0,0,0,1,0|1,1,0]=4 10788 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100009817552_100000041952 [1,0,0,0,1,0|1,1,0]=4 10789 B11R1.91 FC(F)COc1ccccc1 34a_100000210340_100011934356 [1,0,0,0,1,0|2,0,0]=4 10790 B11R1.91 FC(F)COc1ccccc1 7a_100000210340_100011934356 [1,0,0,0,1,0|2,0,0]=4 10791 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [1,0,0,0,1,0|1,0,1]=4 10792 B11R1.172 CC(C)CC=Cc1ccco1 271570a_100016259101_100009814098 [1,0,0,0,1,0|2,0,0]=4 10793 B11R1.172 CC(C)CC=Cc1cccs1 271570a_100016259101_100011215356 [1,0,0,0,1,0|2,0,0]=4 10794 B11R1.172 CC(C)CC=Cc1ccoc1 271570a_100016259101_100011215275 [1,0,0,0,1,0|2,0,0]=4 10795 B11R1.172 CC(C)CC=Cc1ccsc1 271570a_100016259101_100000738268 [1,0,0,0,1,0|2,0,0]=4 10796 B11R1.172 CC(C)COCc1ccco1 34a_100000210059_100000210624 [1,0,0,0,1,0|1,0,1]=4 10797 B11R1.172 CC(C)COCc1cccs1 34a_100000211240_100000210624 [1,0,0,0,1,0|1,0,1]=4 10798 B11R1.172 CC(C)COCc1ccoc1 34a_100011215357_100000210624 [1,0,0,0,1,0|1,0,1]=4 10799 B11R1.172 CC(C)COCc1ccsc1 34a_100000210257_100011261437 [1,0,0,0,1,0|1,0,1]=4 10800 B11R1.172 CC(C)COCc1ccsc1 34a_100011215551_100000210624 [1,0,0,0,1,0|1,0,1]=4 10801 B11R1.77 CN(C)CC(=O)c1ccc[nH]1 269982a_100102631434_200011262396 [0,0,0,0,2,0|2,0,0]=4 10802 B11R1.77 CN(C)CC(=O)c1ccco1 269982a_100102631434_100000211439 [0,0,0,0,2,0|2,0,0]=4 10803 B11R1.77 CN(C)CC(=O)c1cccs1 2230a_100102631434_100000211436 [0,0,0,0,2,0|2,0,0]=4 10804 B11R1.77 CN(C)CC(=O)c1cccs1 269982a_100102631434_100000211436 [0,0,0,0,2,0|2,0,0]=4 10805 B11R1.77 CN(C)CC(=O)c1ccsc1 2230a_100102631434_100011219462 [0,0,0,0,2,0|2,0,0]=4 10806 B11R1.77 CN(C)CC(=O)c1ccsc1 269982a_100102631434_100011219462 [0,0,0,0,2,0|2,0,0]=4 10807 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [0,0,0,0,2,0|1,0,1]=4 10808 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [0,0,0,0,2,0|0,0,0]=2 10809 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [0,0,0,0,2,0|2,0,0]=4 10810 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [0,0,0,0,2,0|2,0,0]=4 10811 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [0,0,0,0,2,0|2,0,0]=4 10812 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [0,0,0,0,2,0|2,0,0]=4 10813 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [0,0,0,0,2,0|2,0,0]=4 10814 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [0,0,0,0,2,0|2,0,0]=4 10815 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [0,0,0,0,2,0|2,0,0]=4 10816 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [0,0,0,0,2,0|2,0,0]=4 10817 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [0,0,0,0,2,0|2,0,0]=4 10818 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [0,0,0,0,2,0|2,0,0]=4 10819 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [0,0,0,0,2,0|2,0,0]=4 10820 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [0,0,0,0,2,0|1,0,0]=3 10821 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [0,0,0,0,2,0|1,0,0]=3 10822 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [0,0,0,0,2,0|1,0,0]=3 10823 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [0,0,0,0,2,0|1,0,0]=3 10824 B13R1.44 CCC#CC(=O)Cc1ccccc1 1458a_100011827653_100015291786 [1,0,0,0,0,1|1,0,1]=4 10825 B13R1.44 CCC#CC(=O)Nc1ccccc1 22a_100000106764_100011827653 [1,0,0,0,0,1|1,0,1]=4 10826 B13R1.44 CCC=CC(=O)Cc1ccccc1 1458a_100000212282_100015291786 [1,0,0,0,0,1|1,0,1]=4 10827 B13R1.44 CCC=CC(=O)Nc1ccccc1 11a_100000106764_100000212282 [1,0,0,0,0,1|1,0,1]=4 10828 B13R1.44 CCC=CC(=O)Nc1ccccc1 1626a_100000106764_100000212282 [1,0,0,0,0,1|1,0,1]=4 10829 B13R1.44 CCC=CC(=O)Nc1ccccc1 22a_100000106764_100000212282 [1,0,0,0,0,1|1,0,1]=4 10830 B13R1.44 CCCCC(=Cc1ccccc1)Br 271570a_206741709834_100000210277 [1,0,0,0,0,1|2,0,0]=4 10831 B13R1.44 CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210211 [1,0,0,0,0,1|2,0,0]=4 10832 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [1,0,0,0,0,1|1,0,0]=3 10833 B13R1.44 CCCCC(=O)Cc1ccccn1 1458a_100000210183_100000721315 [1,0,0,0,0,1|2,0,0]=4 10834 B13R1.44 CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210211 [1,0,0,0,0,1|2,0,0]=4 10835 B13R1.44 CCCCC(=O)Cc1cccnc1 1458a_100000210183_100000733263 [1,0,0,0,0,1|2,0,0]=4 10836 B13R1.44 CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210211 [1,0,0,0,0,1|2,0,0]=4 10837 B13R1.44 CCCCC(=O)Cc1ccncc1 1458a_100000210183_100000705612 [1,0,0,0,0,1|2,0,0]=4 10838 B13R1.44 CCCCC(=O)Nc1ccccc1 11a_100000106764_100000210183 [1,0,0,0,0,1|1,0,0]=3 10839 B13R1.44 CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000210183 [1,0,0,0,0,1|1,0,0]=3 10840 B13R1.44 CCCCC(=O)Nc1ccccc1 22a_100000106764_100000210183 [1,0,0,0,0,1|1,0,0]=3 10841 B13R1.44 CCCCC(=O)Nc1ccccc1 527a_100000106764_100000210183 [1,0,0,0,0,1|1,0,0]=3 10842 B13R1.44 CCCNC(=O)C[n+]1ccccc1 11a_100020643023_200000086051 [1,0,0,0,0,1|2,0,0]=4 10843 B13R1.44 CCCNC(=O)C[n+]1ccccc1 240690a_100020643023_200000086051 [1,0,0,0,0,1|2,0,0]=4 10844 B13R1.44 CCCNC(=O)C[n+]1ccccc1 527a_100020643023_200000086051 [1,0,0,0,0,1|2,0,0]=4 10845 B13R1.44 CCCNC(=O)Cc1ccccn1 11a_100020643023_100000233486 [1,0,0,0,0,1|2,0,0]=4 10846 B13R1.44 CCCNC(=O)Cc1cccnc1 11a_100020643023_100000737805 [1,0,0,0,0,1|2,0,0]=4 10847 B13R1.44 CCCNC(=O)Cc1cccnc1 240690a_100020643023_100000737805 [1,0,0,0,0,1|2,0,0]=4 10848 B13R1.44 CCCNC(=O)Cc1cccnc1 527a_100020643023_100000737805 [1,0,0,0,0,1|2,0,0]=4 10849 B13R1.44 CCCNC(=O)Cc1ccncc1 11a_100020643023_100011201483 [1,0,0,0,0,1|2,0,0]=4 10850 B13R1.44 CCCNC(=O)Cc1ccncc1 240690a_100020643023_100011201483 [1,0,0,0,0,1|2,0,0]=4 10851 B13R1.44 CCCNC(=O)Nc1ccccc1 2430a_100000106764_100020643023 [1,0,0,0,0,1|1,0,0]=3 10852 B13R1.44 CCCOC(C)Cc1ccccc1 34a_100000210258_200011218536 [1,0,0,0,0,1|1,0,1]=4 10853 B13R1.44 CCCOC(C)Cc1ccccc1 34a_100000748627_100000210303 [1,0,0,0,0,1|1,0,1]=4 10854 B13R1.44 CCCOC(C)Cc1ccccc1 7a_100000748627_100000210303 [1,0,0,0,0,1|1,0,1]=4 10855 B13R1.44 CCNCC(=O)Cc1ccccc1 2230a_100015525214_100000233483 [1,0,0,0,0,1|2,0,0]=4 10856 B13R1.44 CCNCC(=O)Nc1ccccc1 2230a_100015525214_100000182850 [1,0,0,0,0,1|2,0,0]=4 10857 B13R1.44 CCNCC(=O)Oc1ccccc1 2230a_100015525214_100009813826 [1,0,0,0,0,1|2,0,0]=4 10858 B13R1.44 CCOCC(=O)Cc1ccccc1 1458a_100000211967_100015291786 [1,0,0,0,0,1|2,0,0]=4 10859 B13R1.44 CCOCC(=O)Nc1ccccc1 11a_100000106764_100000211967 [1,0,0,0,0,1|2,0,0]=4 10860 B13R1.44 CCOCC(=O)Nc1ccccc1 1626a_100000106764_100000211967 [1,0,0,0,0,1|2,0,0]=4 10861 B13R1.44 CCOCC(=O)Nc1ccccc1 22a_100000106764_100000211967 [1,0,0,0,0,1|2,0,0]=4 10862 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100000246334_100000210202 [1,0,0,0,0,1|2,0,0]=4 10863 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100121572206_100000182850 [1,0,0,0,0,1|2,0,0]=4 10864 B13R1.44 CCOCC(=O)Nc1ccccc1 527a_100000106764_100000211967 [1,0,0,0,0,1|2,0,0]=4 10865 B13R1.44 CCOCC(=O)Oc1ccccc1 34a_100121572206_100009813826 [1,0,0,0,0,1|2,0,0]=4 10866 B13R1.44 CCSCC(=O)Cc1ccccc1 1458a_100000230394_100015291786 [1,0,0,0,0,1|2,0,0]=4 10867 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000210202_100000233483 [1,0,0,0,0,1|2,0,0]=4 10868 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210202 [1,0,0,0,0,1|2,0,0]=4 10869 B13R1.44 CCSCC(=O)Nc1ccccc1 11a_100000106764_100000230394 [1,0,0,0,0,1|2,0,0]=4 10870 B13R1.44 CCSCC(=O)Nc1ccccc1 1626a_100000106764_100000230394 [1,0,0,0,0,1|2,0,0]=4 10871 B13R1.44 CCSCC(=O)Nc1ccccc1 22a_100000106764_100000230394 [1,0,0,0,0,1|2,0,0]=4 10872 B13R1.44 CCSCC(=O)Nc1ccccc1 527a_100000106764_100000230394 [1,0,0,0,0,1|2,0,0]=4 10873 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100000210202_100000182850 [1,0,0,0,0,1|2,0,0]=4 10874 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100012148978_100000210202 [1,0,0,0,0,1|2,0,0]=4 10875 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100000210202_100009813826 [1,0,0,0,0,1|2,0,0]=4 10876 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100009813826_100000210202 [1,0,0,0,0,1|2,0,0]=4 10877 B13R1.44 CNCCC(=O)Nc1ccccc1 2230a_106832991635_100000242058 [1,0,0,0,0,1|2,0,0]=4 10878 B13R1.44 CNCCC(=O)Nc1ccccc1 34a_100102657272_100000242058 [1,0,0,0,0,1|2,0,0]=4 10879 B13R1.44 CNCCC(=O)Nc1ccccc1 7a_106832991635_100000242058 [1,0,0,0,0,1|2,0,0]=4 10880 B13R1.44 CNCCC(=O)Oc1ccccc1 2230a_106832991635_200000035796 [1,0,0,0,0,1|2,0,0]=4 10881 B13R1.44 CNCCC(=O)Oc1ccccc1 7a_106832991635_200000035796 [1,0,0,0,0,1|2,0,0]=4 10882 B13R1.44 COCCC(=O)Cc1ccccc1 1458a_100000749529_100015291786 [1,0,0,0,0,1|2,0,0]=4 10883 B13R1.44 COCCC(=O)Nc1ccccc1 11a_100000106764_100000749529 [1,0,0,0,0,1|2,0,0]=4 10884 B13R1.44 COCCC(=O)Nc1ccccc1 1626a_100000106764_100000749529 [1,0,0,0,0,1|2,0,0]=4 10885 B13R1.44 COCCC(=O)Nc1ccccc1 22a_100000106764_100000749529 [1,0,0,0,0,1|2,0,0]=4 10886 B13R1.44 COCCC(=O)Nc1ccccc1 34a_100138415774_100000242058 [1,0,0,0,0,1|2,0,0]=4 10887 B13R1.44 COCCC(=O)Nc1ccccc1 527a_100000106764_100000749529 [1,0,0,0,0,1|2,0,0]=4 10888 B13R1.44 CSCCC(=O)Cc1ccccc1 1458a_100000174002_100015291786 [1,0,0,0,0,1|2,0,0]=4 10889 B13R1.44 CSCCC(=O)Nc1ccccc1 11a_100000106764_100000174002 [1,0,0,0,0,1|2,0,0]=4 10890 B13R1.44 CSCCC(=O)Nc1ccccc1 1626a_100000106764_100000174002 [1,0,0,0,0,1|2,0,0]=4 10891 B13R1.44 CSCCC(=O)Nc1ccccc1 22a_100000106764_100000174002 [1,0,0,0,0,1|2,0,0]=4 10892 B13R1.44 CSCCC(=O)Nc1ccccc1 527a_100000106764_100000174002 [1,0,0,0,0,1|2,0,0]=4 10893 B13R1.44 CSCCC(=O)Nc1ccccc1 62a_200000210301_100000242058 [1,0,0,0,0,1|2,0,0]=4 10894 B13R1.44 CSCCC(=O)Oc1ccccc1 62a_200000210301_200000035796 [1,0,0,0,0,1|2,0,0]=4 10895 B13R1.44 O=C(NCCF)Nc1ccccc1 2430a_100000106764_100000724931 [1,0,0,0,0,1|2,0,0]=4 10896 B13R1.44 O=C(NCCO)Nc1ccccc1 2430a_100000106764_100000210304 [1,0,0,0,0,1|2,0,0]=4 10897 B13R1.44 [13CH3]SCCC(=O)Nc1ccccc1 62a_200025704644_100000242058 [1,0,0,0,0,1|2,0,0]=4 10898 B13R1.44 [13CH3]SCCC(=O)Oc1ccccc1 62a_200025704644_200000035796 [1,0,0,0,0,1|2,0,0]=4 10899 B13R1.337 CC(=CCOCc1ccccc1)C 34a_100000210790_100000761012 [1,0,0,0,0,1|0,0,2]=4 10900 B13R1.337 CC(=CCOCc1ccccc1)C 34a_100000753907_100015291786 [1,0,0,0,0,1|0,0,2]=4 10901 B13R1.337 CC(=CCOCc1ccccc1)C 7a_100000210790_100000761012 [1,0,0,0,0,1|0,0,2]=4 10902 B13R1.337 CC(Br)CCOCc1ccccc1 34a_100009893172_100015291786 [1,0,0,0,0,1|1,0,1]=4 10903 B13R1.337 CC(Br)COCCc1ccccc1 34a_100012180447_100000765856 [1,0,0,0,0,1|1,0,1]=4 10904 B13R1.337 CC(C)CC=NNc1ccccc1 4a_100015195140_100000185833 [1,0,0,0,0,1|2,0,0]=4 10905 B13R1.337 CC(C)CCCNc1ccccc1 34a_100000106764_100011214892 [1,0,0,0,0,1|1,0,1]=4 10906 B13R1.337 CC(C)CCCOc1ccccc1 34a_100000210340_100011214892 [1,0,0,0,0,1|1,0,1]=4 10907 B13R1.337 CC(C)CCCOc1ccccc1 7a_100000210340_100011214892 [1,0,0,0,0,1|1,0,1]=4 10908 B13R1.337 CC(C)CCCSc1ccccc1 62a_100000719477_100011214892 [1,0,0,0,0,1|1,0,1]=4 10909 B13R1.337 CC(C)CCCSc1ccccc1 62a_100011214892_100000041952 [1,0,0,0,0,1|1,0,1]=4 10910 B13R1.337 CC(C)CCNCc1ccccc1 207a_100000210545_100015611070 [1,0,0,0,0,1|1,0,1]=4 10911 B13R1.337 CC(C)CCNCc1ccccc1 2230a_100015324214_100000210312 [1,0,0,0,0,1|1,0,1]=4 10912 B13R1.337 CC(C)CCNCc1ccccc1 269862a_100015324214_100000185833 [1,0,0,0,0,1|1,0,1]=4 10913 B13R1.337 CC(C)CCNCc1ccccc1 270004a_100000210545_100015611070 [1,0,0,0,0,1|1,0,1]=4 10914 B13R1.337 CC(C)CCNCc1ccccc1 34a_100015324214_100000210312 [1,0,0,0,0,1|1,0,1]=4 10915 B13R1.337 CC(C)CCOCc1ccccc1 34a_100000210254_100015291786 [1,0,0,0,0,1|0,0,1]=3 10916 B13R1.337 CC(C)CCOCc1ccccc1 34a_100000210790_100000210312 [1,0,0,0,0,1|0,0,1]=3 10917 B13R1.337 CC(C)CCOCc1ccccc1 7a_100000210254_100000211182 [1,0,0,0,0,1|0,0,1]=3 10918 B13R1.337 CC(C)CCOCc1ccccc1 7a_100000210790_100000210626 [1,0,0,0,0,1|0,0,1]=3 10919 B13R1.337 CC(C)CCOCc1ccccn1 34a_100000210254_100000721315 [1,0,0,0,0,1|1,0,1]=4 10920 B13R1.337 CC(C)CCOCc1ccccn1 7a_100000210254_100000721315 [1,0,0,0,0,1|1,0,1]=4 10921 B13R1.337 CC(C)CCOCc1cccnc1 34a_100000210254_100000733263 [1,0,0,0,0,1|1,0,1]=4 10922 B13R1.337 CC(C)CCOCc1cccnc1 7a_100000210254_100000741622 [1,0,0,0,0,1|1,0,1]=4 10923 B13R1.337 CC(C)CCOCc1ccncc1 7a_100000210254_100015193705 [1,0,0,0,0,1|1,0,1]=4 10924 B13R1.337 CC(C)CCSCc1ccccc1 62a_100000210312_100015291786 [1,0,0,0,0,1|0,1,1]=4 10925 B13R1.337 CC(C)CCSCc1ccccc1 62a_100000211182_100000210312 [1,0,0,0,0,1|0,1,1]=4 10926 B13R1.337 CC(C)CNCCc1ccccc1 2230a_100000106460_100000210760 [1,0,0,0,0,1|1,0,1]=4 10927 B13R1.337 CC(C)CNCCc1ccccc1 2230a_100000210953_100000765856 [1,0,0,0,0,1|1,0,1]=4 10928 B13R1.337 CC(C)CNCCc1ccccc1 270004a_100000106460_100000210432 [1,0,0,0,0,1|1,0,1]=4 10929 B13R1.337 CC(C)CNCCc1ccccc1 34a_100000106460_100000210624 [1,0,0,0,0,1|1,0,1]=4 10930 B13R1.337 CC(C)CNCCc1ccccc1 34a_100000210953_100000765856 [1,0,0,0,0,1|1,0,1]=4 10931 B13R1.337 CC(C)CNCSc1ccccc1 2230a_100000210953_100011218342 [1,0,0,0,0,1|1,0,1]=4 10932 B13R1.337 CC(C)COCCc1ccccc1 34a_100000210257_100000765856 [1,0,0,0,0,1|0,0,1]=3 10933 B13R1.337 CC(C)COCCc1ccccc1 34a_100000210268_100000210624 [1,0,0,0,0,1|0,0,1]=3 10934 B13R1.337 CC(C)COCCc1ccccc1 7a_100000210268_100000210760 [1,0,0,0,0,1|0,0,1]=3 10935 B13R1.337 CC(C)COCCc1ccccn1 34a_100000210271_100000210624 [1,0,0,0,0,1|1,0,1]=4 10936 B13R1.337 CC(C)COCCc1cccnc1 34a_100011217484_100000210624 [1,0,0,0,0,1|1,0,1]=4 10937 B13R1.337 CC(C)COCCc1ccncc1 34a_100011216225_100000210624 [1,0,0,0,0,1|1,0,1]=4 10938 B13R1.337 CC(C)CSCCc1ccccc1 62a_100000210624_100011218657 [1,0,0,0,0,1|0,1,1]=4 10939 B13R1.337 CC(C)CSCCc1ccccc1 62a_100000765856_100000210760 [1,0,0,0,0,1|0,1,1]=4 10940 B13R1.337 CC(C)CSCSc1ccccc1 62a_100000210624_100011218342 [1,0,0,0,0,1|0,1,1]=4 10941 B13R1.337 CC(C)CSCSc1ccccc1 62a_100011218342_100000210760 [1,0,0,0,0,1|0,1,1]=4 10942 B13R1.337 CC(C)NC/C=C/c1ccccc1 2230a_100020603302_100000210206 [1,0,0,0,0,1|1,0,0]=3 10943 B13R1.337 CC(C)NC/C=C/c1ccccc1 2230a_100138425928_100016265936 [1,0,0,0,0,1|1,0,0]=3 10944 B13R1.337 CC(C)NC/C=C/c1ccccc1 34a_100020603302_100000210206 [1,0,0,0,0,1|1,0,0]=3 10945 B13R1.337 CC(C)NC/C=C/c1ccccc1 34a_100138425928_100016265936 [1,0,0,0,0,1|1,0,0]=3 10946 B13R1.337 CC(C)NCC#Cc1ccccc1 2230a_100138425928_100011352542 [1,0,0,0,0,1|1,0,1]=4 10947 B13R1.337 CC(C)NCC#Cc1ccccc1 34a_100000735379_100000210206 [1,0,0,0,0,1|1,0,1]=4 10948 B13R1.337 CC(C)NCC#Cc1ccccc1 34a_100138425928_100011352542 [1,0,0,0,0,1|1,0,1]=4 10949 B13R1.337 CC(C)NCCCc1ccccc1 2230a_100000211184_100000210206 [1,0,0,0,0,1|1,0,1]=4 10950 B13R1.337 CC(C)NCCCc1ccccc1 2230a_100138425928_100000211621 [1,0,0,0,0,1|1,0,1]=4 10951 B13R1.337 CC(C)NCCCc1ccccc1 34a_100000211184_100000210206 [1,0,0,0,0,1|1,0,1]=4 10952 B13R1.337 CC(C)NCCCc1ccccc1 34a_100138425928_100000211621 [1,0,0,0,0,1|1,0,1]=4 10953 B13R1.337 CC(C)NCCOc1ccccc1 2230a_100000174943_100000210206 [1,0,0,0,0,1|2,0,0]=4 10954 B13R1.337 CC(C)NCCOc1ccccc1 2230a_100138425928_100000184471 [1,0,0,0,0,1|2,0,0]=4 10955 B13R1.337 CC(C)NCCOc1ccccc1 34a_100000174943_100000210206 [1,0,0,0,0,1|2,0,0]=4 10956 B13R1.337 CC(C)NCCOc1ccccc1 34a_100138425928_100000184471 [1,0,0,0,0,1|2,0,0]=4 10957 B13R1.337 CC(C)NCCSc1ccccc1 2230a_100000189519_100000210206 [1,0,0,0,0,1|2,0,0]=4 10958 B13R1.337 CC(C)NCCSc1ccccc1 2230a_100138425928_100000246102 [1,0,0,0,0,1|2,0,0]=4 10959 B13R1.337 CC(C)NCCSc1ccccc1 34a_100138425928_100000246102 [1,0,0,0,0,1|2,0,0]=4 10960 B13R1.337 CC(C)NCOCc1ccccc1 2230a_100138425928_100000763385 [1,0,0,0,0,1|0,0,1]=3 10961 B13R1.337 CC(C)NCOCc1ccccc1 34a_100138425928_100000763385 [1,0,0,0,0,1|0,0,1]=3 10962 B13R1.337 CC(C)NCSCc1ccccc1 2230a_100138425928_200011217039 [1,0,0,0,0,1|0,1,1]=4 10963 B13R1.337 CC(C)NCSCc1ccccc1 34a_100138425928_200011217039 [1,0,0,0,0,1|0,1,1]=4 10964 B13R1.337 CC(C)NN=CCc1ccccc1 4a_100000741168_100000209964 [1,0,0,0,0,1|2,0,0]=4 10965 B13R1.337 CC(C)OC/C=C/c1ccccc1 34a_100000210256_100000210206 [1,0,0,0,0,1|1,0,0]=3 10966 B13R1.337 CC(C)OC/C=C/c1ccccc1 34a_100000212225_100016265936 [1,0,0,0,0,1|1,0,0]=3 10967 B13R1.337 CC(C)OC/C=C/c1cccnc1 34a_200102594124_100000210206 [1,0,0,0,0,1|2,0,0]=4 10968 B13R1.337 CC(C)OCC#Cc1ccccc1 34a_100000212225_100011352542 [1,0,0,0,0,1|1,0,1]=4 10969 B13R1.337 CC(C)OCC#Cc1ccccc1 34a_100011217464_100000210206 [1,0,0,0,0,1|1,0,1]=4 10970 B13R1.337 CC(C)OCC#Cc1ccccc1 7a_100011217464_100000210206 [1,0,0,0,0,1|1,0,1]=4 10971 B13R1.337 CC(C)OCCCc1ccccc1 34a_100000210828_100000210206 [1,0,0,0,0,1|1,0,1]=4 10972 B13R1.337 CC(C)OCCCc1ccccc1 34a_100000212225_100000211621 [1,0,0,0,0,1|1,0,1]=4 10973 B13R1.337 CC(C)OCCCc1ccccc1 7a_100000210828_100000210206 [1,0,0,0,0,1|1,0,1]=4 10974 B13R1.337 CC(C)OCCNc1ccccc1 34a_100000106764_100000211751 [1,0,0,0,0,1|2,0,0]=4 10975 B13R1.337 CC(C)OCCNc1ccccc1 34a_100000211345_100000210206 [1,0,0,0,0,1|2,0,0]=4 10976 B13R1.337 CC(C)OCCOc1ccccc1 34a_100000210260_100000210206 [1,0,0,0,0,1|2,0,0]=4 10977 B13R1.337 CC(C)OCCOc1ccccc1 34a_100000210340_100000211751 [1,0,0,0,0,1|2,0,0]=4 10978 B13R1.337 CC(C)OCCOc1ccccc1 34a_100000212225_100000184471 [1,0,0,0,0,1|2,0,0]=4 10979 B13R1.337 CC(C)OCCOc1ccccc1 7a_100000210260_100000210206 [1,0,0,0,0,1|2,0,0]=4 10980 B13R1.337 CC(C)OCCOc1ccccc1 7a_100000210340_100000211751 [1,0,0,0,0,1|2,0,0]=4 10981 B13R1.337 CC(C)OCCSc1ccccc1 34a_100000212225_100000246102 [1,0,0,0,0,1|2,0,0]=4 10982 B13R1.337 CC(C)OCCSc1ccccc1 62a_100000211751_100000041952 [1,0,0,0,0,1|2,0,0]=4 10983 B13R1.337 CC(C)OCCSc1ccccc1 62a_100000719477_100000211751 [1,0,0,0,0,1|2,0,0]=4 10984 B13R1.337 CC(C)OCCSc1ccccc1 7a_100000230494_100000210206 [1,0,0,0,0,1|2,0,0]=4 10985 B13R1.337 CC(C)OCNCc1ccccc1 2230a_100015324214_100000709892 [1,0,0,0,0,1|1,0,1]=4 10986 B13R1.337 CC(C)OCNCc1ccccc1 34a_100015324214_100000709892 [1,0,0,0,0,1|1,0,1]=4 10987 B13R1.337 CC(C)OCOCc1ccccc1 34a_100000210790_100000709892 [1,0,0,0,0,1|0,0,1]=3 10988 B13R1.337 CC(C)OCOCc1ccccc1 34a_100000212225_100000763385 [1,0,0,0,0,1|0,0,1]=3 10989 B13R1.337 CC(C)OCSCc1ccccc1 34a_100000212225_200011217039 [1,0,0,0,0,1|0,1,1]=4 10990 B13R1.337 CC(C)OCSCc1ccccc1 62a_100000211182_100000709892 [1,0,0,0,0,1|0,1,1]=4 10991 B13R1.337 CC(C)OCSCc1ccccc1 62a_100000709892_100015291786 [1,0,0,0,0,1|0,1,1]=4 10992 B13R1.337 CC(C)SC/C=C/c1ccccc1 62a_100000210206_100016265936 [1,0,0,0,0,1|1,0,0]=3 10993 B13R1.337 CC(C)SC/C=C/c1ccccc1 62a_100016265936_100000210206 [1,0,0,0,0,1|1,0,0]=3 10994 B13R1.337 CC(C)SCC#Cc1ccccc1 62a_100000210206_100011352542 [1,0,0,0,0,1|1,0,1]=4 10995 B13R1.337 CC(C)SCCCc1ccccc1 62a_100000210206_100000211621 [1,0,0,0,0,1|1,0,1]=4 10996 B13R1.337 CC(C)SCCCc1ccccc1 62a_100000211621_100000210206 [1,0,0,0,0,1|1,0,1]=4 10997 B13R1.337 CC(C)SCCNc1ccccc1 34a_100000106764_100000730970 [1,0,0,0,0,1|2,0,0]=4 10998 B13R1.337 CC(C)SCCOc1ccccc1 34a_100000210340_100000730970 [1,0,0,0,0,1|2,0,0]=4 10999 B13R1.337 CC(C)SCCOc1ccccc1 62a_100000184471_100000210206 [1,0,0,0,0,1|2,0,0]=4 11000 B13R1.337 CC(C)SCCOc1ccccc1 62a_100000210206_100000184471 [1,0,0,0,0,1|2,0,0]=4 11001 B13R1.337 CC(C)SCCOc1ccccc1 7a_100000210340_100000730970 [1,0,0,0,0,1|2,0,0]=4 11002 B13R1.337 CC(C)SCCSc1ccccc1 62a_100000210206_100000246102 [1,0,0,0,0,1|2,0,0]=4 11003 B13R1.337 CC(C)SCCSc1ccccc1 62a_100000246102_100000210206 [1,0,0,0,0,1|2,0,0]=4 11004 B13R1.337 CC(C)SCCSc1ccccc1 62a_100000719477_100000730970 [1,0,0,0,0,1|2,0,0]=4 11005 B13R1.337 CC(C)SCCSc1ccccc1 62a_100000730970_100000041952 [1,0,0,0,0,1|2,0,0]=4 11006 B13R1.337 CC(C)SCOCc1ccccc1 62a_100000210206_100000763385 [1,0,0,0,0,1|0,0,1]=3 11007 B13R1.337 CC(C)SCOCc1ccccc1 62a_100000763385_100000210206 [1,0,0,0,0,1|0,0,1]=3 11008 B13R1.337 CC(C)SCSCc1ccccc1 62a_100000210206_200011217039 [1,0,0,0,0,1|0,1,1]=4 11009 B13R1.337 CC(C)SCSCc1ccccc1 62a_200011217039_100000210206 [1,0,0,0,0,1|0,1,1]=4 11010 B13R1.337 CC(F)COCCc1ccccc1 34a_100015925927_100000765856 [1,0,0,0,0,1|1,0,1]=4 11011 B13R1.337 CC(O)CCOCc1ccccc1 34a_100000210790_100012276601 [1,0,0,0,0,1|1,0,1]=4 11012 B13R1.337 CC(O)CCOCc1ccccc1 7a_100000210790_100012276601 [1,0,0,0,0,1|1,0,1]=4 11013 B13R1.337 CC(O)CNN=Cc1ccccc1 4a_200000730056_100015611070 [1,0,0,0,0,1|2,0,0]=4 11014 B13R1.337 CC(O)COCCc1ccccc1 34a_100000210268_100011218427 [1,0,0,0,0,1|1,0,1]=4 11015 B13R1.337 CC(O)COCCc1ccccc1 7a_100000210268_100011218427 [1,0,0,0,0,1|1,0,1]=4 11016 B13R1.337 CN(C)CCOCc1ccccc1 2230a_100000687121_200000210301 [1,0,0,0,0,1|1,0,1]=4 11017 B13R1.337 CN(C)CCOCc1ccccc1 2230a_100102631434_100000234347 [1,0,0,0,0,1|1,0,1]=4 11018 B13R1.337 CN(C)CCOCc1ccccc1 269982a_100000687121_200000210301 [1,0,0,0,0,1|1,0,1]=4 11019 B13R1.337 CN(C)CCOCc1ccccc1 269982a_100102631434_100000234347 [1,0,0,0,0,1|1,0,1]=4 11020 B13R1.337 CN(C)CCOCc1ccccc1 7a_100000210790_100000755713 [1,0,0,0,0,1|1,0,1]=4 11021 B13R1.337 CN([13CH3])CCOCc1ccccc1 2230a_100000687121_200025704644 [1,0,0,0,0,1|1,0,1]=4 11022 B13R1.337 CN([13CH3])CCOCc1ccccc1 269982a_100000687121_200025704644 [1,0,0,0,0,1|1,0,1]=4 11023 B13R1.337 C[C@@H](Cl)COCCc1ccccc1 34a_100016084084_100000765856 [1,0,0,0,0,1|1,0,1]=4 11024 B13R1.337 C[C@@H](N)CCOCc1ccccc1 34a_100000706166_100015291786 [1,0,0,0,0,1|1,0,1]=4 11025 B13R1.337 C[C@@H](N)COCCc1ccccc1 34a_100000737577_100000765856 [1,0,0,0,0,1|1,0,1]=4 11026 B13R1.337 C[C@@H](O)COCCc1ccccc1 34a_100000210268_100009817552 [1,0,0,0,0,1|1,0,1]=4 11027 B13R1.337 C[C@@H](O)COCCc1ccccc1 7a_100000210268_100009817552 [1,0,0,0,0,1|1,0,1]=4 11028 B13R1.342 CC(Br)COCC(=O)c1ccsc1 34a_100012180447_100011219462 [0,0,0,0,1,1|2,0,0]=4 11029 B13R1.342 CC(C)CNCC(=O)c1cccs1 2230a_100000210953_100000211436 [0,0,0,0,1,1|2,0,0]=4 11030 B13R1.342 CC(C)CNCC(=O)c1ccsc1 2230a_100000210953_100011219462 [0,0,0,0,1,1|2,0,0]=4 11031 B13R1.342 CC(C)CNCC(=O)c1ccsc1 34a_100000210953_100011219462 [0,0,0,0,1,1|2,0,0]=4 11032 B13R1.342 CC(C)COCC(=O)c1ccsc1 34a_100000210257_100011219462 [0,0,0,0,1,1|1,0,0]=3 11033 B13R1.342 CC(C)CSCC(=O)c1ccc[nH]1 62a_100000210624_200011262396 [0,0,0,0,1,1|1,1,0]=4 11034 B13R1.342 CC(C)CSCC(=O)c1ccc[nH]1 62a_200011262396_100000210760 [0,0,0,0,1,1|1,1,0]=4 11035 B13R1.342 CC(C)CSCC(=O)c1ccco1 62a_100000210624_100000211439 [0,0,0,0,1,1|1,1,0]=4 11036 B13R1.342 CC(C)CSCC(=O)c1ccco1 62a_100000211439_100000210760 [0,0,0,0,1,1|1,1,0]=4 11037 B13R1.342 CC(C)CSCC(=O)c1cccs1 62a_100000210624_100000211436 [0,0,0,0,1,1|1,1,0]=4 11038 B13R1.342 CC(C)CSCC(=O)c1cccs1 62a_100000211436_100000210760 [0,0,0,0,1,1|1,1,0]=4 11039 B13R1.342 CC(C)CSCC(=O)c1ccsc1 62a_100000210624_100011219462 [0,0,0,0,1,1|1,1,0]=4 11040 B13R1.342 CC(C)CSCC(=O)c1ccsc1 62a_100011219462_100000210760 [0,0,0,0,1,1|1,1,0]=4 11041 B13R1.342 CC(C)NCCC(=O)c1cccs1 2230a_100138425928_100011290775 [0,0,0,0,1,1|2,0,0]=4 11042 B13R1.342 CC(C)SCCC(=O)c1cccs1 62a_100000210206_100011290775 [0,0,0,0,1,1|2,0,0]=4 11043 B13R1.342 CC(C)SCCC(=O)c1cccs1 62a_100011290775_100000210206 [0,0,0,0,1,1|2,0,0]=4 11044 B13R1.342 CC(F)COCC(=O)c1ccsc1 34a_100015925927_100011219462 [0,0,0,0,1,1|2,0,0]=4 11045 B13R1.342 C[C@@H](Cl)COCC(=O)c1ccsc1 34a_100016084084_100011219462 [0,0,0,0,1,1|2,0,0]=4 11046 B13R1.342 C[C@@H](N)COCC(=O)c1ccsc1 34a_100000737577_100011219462 [0,0,0,0,1,1|2,0,0]=4 11047 B15R1.497 C=C(C)CSCOC(=O)c1ccccc1 62a_100000073877_100000211660 [0,0,0,0,0,2|0,0,2]=4 11048 B15R1.497 C=C(C)CSCOC(=O)c1ccccc1 62a_100000748629_100000073877 [0,0,0,0,0,2|0,0,2]=4 11049 B15R1.497 CC(=CCOCC(=O)c1ccccn1)C 34a_100000753907_100000027445 [0,0,0,0,0,2|1,0,1]=4 11050 B15R1.497 CC(=CCSCC(=O)c1ccccc1)C 62a_100000211460_100000761012 [0,0,0,0,0,2|0,1,1]=4 11051 B15R1.497 CC(=CCSCC(=O)c1ccccc1)C 62a_100000761012_100000211460 [0,0,0,0,0,2|0,1,1]=4 11052 B15R1.497 CC(=O)CCCOC(=O)c1ccccc1 1458a_100000070787_200009892979 [0,0,0,0,0,2|1,0,1]=4 11053 B15R1.497 CC(=O)CCOCC(=O)c1ccccc1 7a_100000759926_100000211460 [0,0,0,0,0,2|1,0,1]=4 11054 B15R1.497 CC(Br)CCOCC(=O)c1ccccn1 34a_100009893172_100000027445 [0,0,0,0,0,2|2,0,0]=4 11055 B15R1.497 CC(C)CC=NNC(=O)c1ccccc1 4a_100000184135_100000185833 [0,0,0,0,0,2|1,0,0]=3 11056 B15R1.497 CC(C)CC=NNC(=O)c1ccccn1 4a_100000184044_100000185833 [0,0,0,0,0,2|2,0,0]=4 11057 B15R1.497 CC(C)CC=NNC(=O)c1cccnc1 4a_100000189771_100000185833 [0,0,0,0,0,2|2,0,0]=4 11058 B15R1.497 CC(C)CC=NNC(=O)c1ccncc1 4a_100000189768_100000185833 [0,0,0,0,0,2|2,0,0]=4 11059 B15R1.497 CC(C)CCCCC(=O)c1ccccc1 1458a_100000185807_100011216152 [0,0,0,0,0,2|1,0,0]=3 11060 B15R1.497 CC(C)CCCNC(=O)c1ccccc1 11a_200000737386_100000185807 [0,0,0,0,0,2|1,0,0]=3 11061 B15R1.497 CC(C)CCCNC(=O)c1ccccc1 1626a_200000737386_100000185807 [0,0,0,0,0,2|1,0,0]=3 11062 B15R1.497 CC(C)CCCNC(=O)c1ccccc1 240690a_200000737386_100000185807 [0,0,0,0,0,2|1,0,0]=3 11063 B15R1.497 CC(C)CCCNC(=O)c1ccccc1 527a_200000737386_100000185807 [0,0,0,0,0,2|1,0,0]=3 11064 B15R1.497 CC(C)CCCOC(C)c1ccccc1 34a_100000210774_100000211855 [0,0,0,0,0,2|1,0,1]=4 11065 B15R1.497 CC(C)CCCOC(C)c1ccccc1 7a_100000210774_100000230085 [0,0,0,0,0,2|1,0,1]=4 11066 B15R1.497 CC(C)CCCO[C@H](C)c1ccccc1 34a_100000761318_100011214892 [0,0,0,0,0,2|1,0,1]=4 11067 B15R1.497 CC(C)CCCO[C@H](C)c1ccccc1 7a_100000761318_100011214892 [0,0,0,0,0,2|1,0,1]=4 11068 B15R1.497 CC(C)CCOCC(=O)c1ccccc1 7a_100000210254_100000211460 [0,0,0,0,0,2|0,0,0]=2 11069 B15R1.497 CC(C)CCOCC(=O)c1ccccn1 34a_100000210254_100000027445 [0,0,0,0,0,2|1,0,0]=3 11070 B15R1.497 CC(C)CCOCC(=O)c1ccccn1 7a_100000210254_100000027445 [0,0,0,0,0,2|1,0,0]=3 11071 B15R1.497 CC(C)CCOCC(=O)c1ccncc1 7a_100000210254_100015248511 [0,0,0,0,0,2|1,0,0]=3 11072 B15R1.497 CC(C)CCOCC(C)c1ccccc1 34a_100000210254_100000756946 [0,0,0,0,0,2|1,0,1]=4 11073 B15R1.497 CC(C)CCOCC(C)c1ccccc1 34a_100011215166_100000210312 [0,0,0,0,0,2|1,0,1]=4 11074 B15R1.497 CC(C)CCOCC(C)c1ccccc1 7a_100000210254_100000756946 [0,0,0,0,0,2|1,0,1]=4 11075 B15R1.497 CC(C)CCOCC(C)c1ccccc1 7a_100011215166_100000210626 [0,0,0,0,0,2|1,0,1]=4 11076 B15R1.497 CC(C)CCOCC(O)c1ccccc1 34a_100000210254_100000185958 [0,0,0,0,0,2|0,0,2]=4 11077 B15R1.497 CC(C)CCOCC(O)c1ccccc1 7a_100000210254_100000185958 [0,0,0,0,0,2|0,0,2]=4 11078 B15R1.497 CC(C)CCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210312 [0,0,0,0,0,2|1,0,1]=4 11079 B15R1.497 CC(C)CCOC[C@@H](O)c1ccccc1 34a_100000210254_100011933945 [0,0,0,0,0,2|0,0,2]=4 11080 B15R1.497 CC(C)CCOC[C@@H](O)c1ccccc1 7a_100000210254_100011933945 [0,0,0,0,0,2|0,0,2]=4 11081 B15R1.497 CC(C)CCSCC(=O)c1ccccc1 62a_100000210312_100000211460 [0,0,0,0,0,2|0,1,0]=3 11082 B15R1.497 CC(C)CCSCC(=O)c1ccccc1 62a_100000211460_100000210312 [0,0,0,0,0,2|0,1,0]=3 11083 B15R1.497 CC(C)CCSCC(=O)c1ccccn1 62a_100000027445_100000210312 [0,0,0,0,0,2|1,1,0]=4 11084 B15R1.497 CC(C)CCSCC(=O)c1ccccn1 62a_100000210312_100000027445 [0,0,0,0,0,2|1,1,0]=4 11085 B15R1.497 CC(C)CCSCC(=O)c1cccnc1 62a_100000210312_100000757877 [0,0,0,0,0,2|1,1,0]=4 11086 B15R1.497 CC(C)CCSCC(=O)c1cccnc1 62a_100000757877_100000210312 [0,0,0,0,0,2|1,1,0]=4 11087 B15R1.497 CC(C)CCSCC(=O)c1ccncc1 62a_100000027454_100000210312 [0,0,0,0,0,2|1,1,0]=4 11088 B15R1.497 CC(C)CCSCC(=O)c1ccncc1 62a_100000210312_100000027454 [0,0,0,0,0,2|1,1,0]=4 11089 B15R1.497 CC(C)CCSCS(=O)c1ccccc1 62a_100000210312_100000031784 [0,0,0,0,0,2|1,1,0]=4 11090 B15R1.497 CC(C)CNCCC(=O)c1ccccc1 2230a_100000210953_100000750707 [0,0,0,0,0,2|1,0,0]=3 11091 B15R1.497 CC(C)CNCCS(=O)c1ccccc1 2230a_100000210953_100000740319 [0,0,0,0,0,2|2,0,0]=4 11092 B15R1.497 CC(C)COCC[C@@H](O)c1ccccc1 34a_100000210257_100000729684 [0,0,0,0,0,2|0,0,2]=4 11093 B15R1.497 CC(C)COCC[C@H](N)c1ccccc1 34a_100025705951_100000210624 [0,0,0,0,0,2|1,0,1]=4 11094 B15R1.497 CC(C)CSCCC(=O)c1ccccc1 62a_100000210624_100000750707 [0,0,0,0,0,2|0,1,0]=3 11095 B15R1.497 CC(C)CSCCC(=O)c1ccccc1 62a_100000750707_100000210760 [0,0,0,0,0,2|0,1,0]=3 11096 B15R1.497 CC(C)CSCCS(=O)c1ccccc1 62a_100000210624_100000740319 [0,0,0,0,0,2|1,1,0]=4 11097 B15R1.497 CC(C)CSCOC(=O)c1ccccc1 62a_100000073877_100000210760 [0,0,0,0,0,2|0,0,0]=2 11098 B15R1.497 CC(C)CSCOC(=O)c1ccccc1 62a_100000210624_100000073877 [0,0,0,0,0,2|0,0,0]=2 11099 B15R1.497 CC(C)NCCCC(=O)c1ccccc1 2230a_100138425928_100000211006 [0,0,0,0,0,2|1,0,0]=3 11100 B15R1.497 CC(C)NCCNC(=O)c1ccccc1 2230a_100000736134_100000210206 [0,0,0,0,0,2|1,0,0]=3 11101 B15R1.497 CC(C)NCCNC(=O)c1ccncc1 2230a_200011198449_100000210206 [0,0,0,0,0,2|2,0,0]=4 11102 B15R1.497 CC(C)NCCOC(=O)c1ccccc1 34a_100138425928_100009812718 [0,0,0,0,0,2|0,0,0]=2 11103 B15R1.497 CC(C)NCCOC(C)c1ccccc1 34a_100000224655_100000211855 [0,0,0,0,0,2|1,0,1]=4 11104 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 11a_100000701111_100000185807 [0,0,0,0,0,2|1,0,0]=3 11105 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 1626a_100000701111_100000185807 [0,0,0,0,0,2|1,0,0]=3 11106 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 240690a_100000701111_100000185807 [0,0,0,0,0,2|1,0,0]=3 11107 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 34a_200000158897_100000210206 [0,0,0,0,0,2|1,0,0]=3 11108 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 527a_100000701111_100000185807 [0,0,0,0,0,2|1,0,0]=3 11109 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 7a_200000158897_100000210206 [0,0,0,0,0,2|1,0,0]=3 11110 B15R1.497 CC(C)OCCOC(=O)c1ccccc1 34a_100000212225_100009812718 [0,0,0,0,0,2|0,0,0]=2 11111 B15R1.497 CC(C)OCCOC(=O)c1ccccc1 7a_100000025465_100000210206 [0,0,0,0,0,2|0,0,0]=2 11112 B15R1.497 CC(C)OCCOC(C)c1ccccc1 34a_100000211219_100000211855 [0,0,0,0,0,2|1,0,1]=4 11113 B15R1.497 CC(C)OCCOC(C)c1ccccc1 7a_100000211219_100000230085 [0,0,0,0,0,2|1,0,1]=4 11114 B15R1.497 CC(C)OCCO[C@H](C)c1ccccc1 34a_100000761318_100000211751 [0,0,0,0,0,2|1,0,1]=4 11115 B15R1.497 CC(C)OCCO[C@H](C)c1ccccc1 7a_100000761318_100000211751 [0,0,0,0,0,2|1,0,1]=4 11116 B15R1.497 CC(C)OCOCC(C)c1ccccc1 34a_100011215166_100000709892 [0,0,0,0,0,2|1,0,1]=4 11117 B15R1.497 CC(C)OCOC[C@@H](N)c1ccccc1 34a_100000751927_100000709892 [0,0,0,0,0,2|1,0,1]=4 11118 B15R1.497 CC(C)OCSCC(=O)c1ccccc1 62a_100000211460_100000709892 [0,0,0,0,0,2|0,1,0]=3 11119 B15R1.497 CC(C)OCSCC(=O)c1ccccc1 62a_100000709892_100000211460 [0,0,0,0,0,2|0,1,0]=3 11120 B15R1.497 CC(C)OCSCC(=O)c1ccccn1 62a_100000027445_100000709892 [0,0,0,0,0,2|1,1,0]=4 11121 B15R1.497 CC(C)OCSCC(=O)c1ccccn1 62a_100000709892_100000027445 [0,0,0,0,0,2|1,1,0]=4 11122 B15R1.497 CC(C)OCSCC(=O)c1cccnc1 62a_100000709892_100000757877 [0,0,0,0,0,2|1,1,0]=4 11123 B15R1.497 CC(C)OCSCC(=O)c1cccnc1 62a_100000757877_100000709892 [0,0,0,0,0,2|1,1,0]=4 11124 B15R1.497 CC(C)OCSCC(=O)c1ccncc1 62a_100000027454_100000709892 [0,0,0,0,0,2|1,1,0]=4 11125 B15R1.497 CC(C)OCSCC(=O)c1ccncc1 62a_100000709892_100000027454 [0,0,0,0,0,2|1,1,0]=4 11126 B15R1.497 CC(C)OCSCS(=O)c1ccccc1 62a_100000709892_100000031784 [0,0,0,0,0,2|1,1,0]=4 11127 B15R1.497 CC(C)SCCCC(=O)c1ccccc1 62a_100000210206_100000211006 [0,0,0,0,0,2|1,0,0]=3 11128 B15R1.497 CC(C)SCCCC(=O)c1ccccc1 62a_100000211006_100000210206 [0,0,0,0,0,2|1,0,0]=3 11129 B15R1.497 CC(C)SCCNC(=O)c1ccccc1 11a_100000731138_100000185807 [0,0,0,0,0,2|1,0,0]=3 11130 B15R1.497 CC(C)SCCNC(=O)c1ccccc1 1626a_100000731138_100000185807 [0,0,0,0,0,2|1,0,0]=3 11131 B15R1.497 CC(C)SCCNC(=O)c1ccccc1 240690a_100000731138_100000185807 [0,0,0,0,0,2|1,0,0]=3 11132 B15R1.497 CC(C)SCCNC(=O)c1ccccc1 527a_100000731138_100000185807 [0,0,0,0,0,2|1,0,0]=3 11133 B15R1.497 CC(C)SCCNC(=O)c1ccccc1 62a_100000210206_200011215302 [0,0,0,0,0,2|1,0,0]=3 11134 B15R1.497 CC(C)SCCNC(=O)c1ccccc1 62a_200011215302_100000210206 [0,0,0,0,0,2|1,0,0]=3 11135 B15R1.497 CC(C)SCCOC(=O)c1ccccc1 62a_100000210206_100009812718 [0,0,0,0,0,2|0,0,0]=2 11136 B15R1.497 CC(C)SCCOC(=O)c1ccccc1 62a_100009812718_100000210206 [0,0,0,0,0,2|0,0,0]=2 11137 B15R1.497 CC(C)SCCOC(C)c1ccccc1 34a_200011212901_100000211855 [0,0,0,0,0,2|1,0,1]=4 11138 B15R1.497 CC(C)SCCOC(C)c1ccccc1 7a_200011212901_100000230085 [0,0,0,0,0,2|1,0,1]=4 11139 B15R1.497 CC(C)SCCO[C@H](C)c1ccccc1 34a_100000761318_100000730970 [0,0,0,0,0,2|1,0,1]=4 11140 B15R1.497 CC(C)SCCO[C@H](C)c1ccccc1 7a_100000761318_100000730970 [0,0,0,0,0,2|1,0,1]=4 11141 B15R1.497 CC(O)CCSCC(=O)c1ccccc1 62a_100000211460_100012276601 [0,0,0,0,0,2|1,1,0]=4 11142 B15R1.497 CC(O)CCSCC(=O)c1ccccc1 62a_100012276601_100000211460 [0,0,0,0,0,2|1,1,0]=4 11143 B15R1.497 CC(O)CNCCC(=O)c1ccccc1 2230a_100000210904_100000750707 [0,0,0,0,0,2|2,0,0]=4 11144 B15R1.497 CC(O)CSCCC(=O)c1ccccc1 62a_100000750707_100011218427 [0,0,0,0,0,2|1,1,0]=4 11145 B15R1.497 CC(O)CSCCC(=O)c1ccccc1 62a_100011218427_100000750707 [0,0,0,0,0,2|1,1,0]=4 11146 B15R1.497 CC(O)CSCOC(=O)c1ccccc1 62a_100000073877_100011218427 [0,0,0,0,0,2|1,0,0]=3 11147 B15R1.497 CC(O)CSCOC(=O)c1ccccc1 62a_100011218427_100000073877 [0,0,0,0,0,2|1,0,0]=3 11148 B15R1.497 CN(C)CCCNC(=O)c1ccccc1 240690a_102531767803_100000185807 [0,0,0,0,0,2|2,0,0]=4 11149 B15R1.497 CN(C)CCCNC(=O)c1ccccc1 527a_102531767803_100000185807 [0,0,0,0,0,2|2,0,0]=4 11150 B15R1.497 CN(C)CCCOC(=O)c1ccccc1 269982a_100102631434_200009892979 [0,0,0,0,0,2|1,0,0]=3 11151 B15R1.497 CN(C)CCNNC(=O)c1ccccc1 22a_100000738145_100000185807 [0,0,0,0,0,2|2,0,0]=4 11152 B15R1.497 CN(C)CCSCC(=O)c1ccccc1 62a_100000211460_100000755713 [0,0,0,0,0,2|1,1,0]=4 11153 B15R1.497 C[C@@H](N)CCOCC(=O)c1ccccn1 34a_100000706166_100000027445 [0,0,0,0,0,2|2,0,0]=4 11154 B15R1.497 C[C@@H](O)CSCCC(=O)c1ccccc1 62a_100000750707_100009817552 [0,0,0,0,0,2|1,1,0]=4 11155 B15R1.497 C[C@@H](O)CSCCC(=O)c1ccccc1 62a_100009817552_100000750707 [0,0,0,0,0,2|1,1,0]=4 11156 B15R1.497 C[C@@H](O)CSCOC(=O)c1ccccc1 62a_100000073877_100009817552 [0,0,0,0,0,2|1,0,0]=3 11157 B15R1.497 C[C@@H](O)CSCOC(=O)c1ccccc1 62a_100009817552_100000073877 [0,0,0,0,0,2|1,0,0]=3 11158 B15R1.497 O=C(CCOCC(F)F)c1ccccc1 1458a_100000185807_200012177212 [0,0,0,0,0,2|2,0,0]=4 11159 B15R1.497 O=C(OCSCC(F)F)c1ccccc1 62a_100000073877_100011934356 [0,0,0,0,0,2|2,0,0]=4 11160 B15R1.497 O=C(OCSCC(F)F)c1ccccc1 62a_100011934356_100000073877 [0,0,0,0,0,2|2,0,0]=4 11161 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)C 34a_200025717232_100000210624 [0,0,0,0,0,2|1,0,0]=3 11162 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)C 7a_200025717232_100000210760 [0,0,0,0,0,2|1,0,0]=3 11163 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)O 34a_200025717232_100011218427 [0,0,0,0,0,2|2,0,0]=4 11164 B15R1.1081 C/C(=C\c1ccccc1)/COCC(C)O 7a_200025717232_100011218427 [0,0,0,0,0,2|2,0,0]=4 11165 B15R1.1081 C/C(=C\c1ccccc1)/COC[C@@H](C)O 34a_200025717232_100009817552 [0,0,0,0,0,2|2,0,0]=4 11166 B15R1.1081 C/C(=C\c1ccccc1)/COC[C@@H](C)O 7a_200025717232_100009817552 [0,0,0,0,0,2|2,0,0]=4 11167 B15R1.1081 C=C(C)COCC(=O)Nc1ccccc1 34a_100000210245_100000182850 [0,0,0,0,0,2|0,0,2]=4 11168 B15R1.1081 C=C(C)COCC(=O)Nc1ccccc1 34a_100000246334_100000748629 [0,0,0,0,0,2|0,0,2]=4 11169 B15R1.1081 C=C(C)COCC(=O)Oc1ccccc1 34a_100000210245_100009813826 [0,0,0,0,0,2|0,0,2]=4 11170 B15R1.1081 CC(=CCNC(=O)Nc1ccccc1)C 2430a_100000106764_100000718196 [0,0,0,0,0,2|1,0,1]=4 11171 B15R1.1081 CC(=O)COCC(=O)Nc1ccccc1 1458a_200000199795_200000210301 [0,0,0,0,0,2|1,0,1]=4 11172 B15R1.1081 CC(=O)COCC(=O)Nc1ccccc1 34a_100000211253_100000182850 [0,0,0,0,0,2|1,0,1]=4 11173 B15R1.1081 CC(=O)COCC(=O)Oc1ccccc1 34a_100000211253_100009813826 [0,0,0,0,0,2|1,0,1]=4 11174 B15R1.1081 CC(Br)COCC(=O)Nc1ccccc1 34a_100012180447_100000182850 [0,0,0,0,0,2|1,0,0]=3 11175 B15R1.1081 CC(Br)COCC(=O)Oc1ccccc1 34a_100012180447_100009813826 [0,0,0,0,0,2|1,0,0]=3 11176 B15R1.1081 CC(C)/C=C/CC(=O)Cc1ccccc1 1458a_100016292215_100015291786 [0,0,0,0,0,2|1,0,1]=4 11177 B15R1.1081 CC(C)/C=C/CC(=O)Nc1ccccc1 11a_100000106764_100016292215 [0,0,0,0,0,2|1,0,1]=4 11178 B15R1.1081 CC(C)/C=C/CC(=O)Nc1ccccc1 1626a_100000106764_100016292215 [0,0,0,0,0,2|1,0,1]=4 11179 B15R1.1081 CC(C)/C=C/CC(=O)Nc1ccccc1 22a_100000106764_100016292215 [0,0,0,0,0,2|1,0,1]=4 11180 B15R1.1081 CC(C)C=NNC(=O)Cc1ccccc1 4a_100000182964_100000210432 [0,0,0,0,0,2|1,0,1]=4 11181 B15R1.1081 CC(C)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011214892 [0,0,0,0,0,2|2,0,0]=4 11182 B15R1.1081 CC(C)CCCC(=O)Cc1ccccc1 1458a_100011216857_100015291786 [0,0,0,0,0,2|1,0,0]=3 11183 B15R1.1081 CC(C)CCCC(=O)Cc1ccccn1 1458a_100000233486_100011214892 [0,0,0,0,0,2|2,0,0]=4 11184 B15R1.1081 CC(C)CCCC(=O)Cc1ccccn1 1458a_100011216857_100000721315 [0,0,0,0,0,2|2,0,0]=4 11185 B15R1.1081 CC(C)CCCC(=O)Cc1cccnc1 1458a_100000737805_100011214892 [0,0,0,0,0,2|2,0,0]=4 11186 B15R1.1081 CC(C)CCCC(=O)Cc1cccnc1 1458a_100011216857_100000733263 [0,0,0,0,0,2|2,0,0]=4 11187 B15R1.1081 CC(C)CCCC(=O)Cc1ccncc1 1458a_100011216857_100000705612 [0,0,0,0,0,2|2,0,0]=4 11188 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 11a_100000106764_100011216857 [0,0,0,0,0,2|1,0,0]=3 11189 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 1626a_100000106764_100011216857 [0,0,0,0,0,2|1,0,0]=3 11190 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 22a_100000106764_100011216857 [0,0,0,0,0,2|1,0,0]=3 11191 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 527a_100000106764_100011216857 [0,0,0,0,0,2|1,0,0]=3 11192 B15R1.1081 CC(C)CCNC(=O)C[n+]1ccccc1 11a_100000210545_200000086051 [0,0,0,0,0,2|2,0,0]=4 11193 B15R1.1081 CC(C)CCNC(=O)C[n+]1ccccc1 240690a_100000210545_200000086051 [0,0,0,0,0,2|2,0,0]=4 11194 B15R1.1081 CC(C)CCNC(=O)C[n+]1ccccc1 527a_100000210545_200000086051 [0,0,0,0,0,2|2,0,0]=4 11195 B15R1.1081 CC(C)CCNC(=O)Cc1ccccn1 11a_100000210545_100000233486 [0,0,0,0,0,2|2,0,0]=4 11196 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 11a_100000210545_100000737805 [0,0,0,0,0,2|2,0,0]=4 11197 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 240690a_100000210545_100000737805 [0,0,0,0,0,2|2,0,0]=4 11198 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 527a_100000210545_100000737805 [0,0,0,0,0,2|2,0,0]=4 11199 B15R1.1081 CC(C)CCNC(=O)Cc1ccncc1 11a_100000210545_100011201483 [0,0,0,0,0,2|2,0,0]=4 11200 B15R1.1081 CC(C)CCNC(=O)Cc1ccncc1 240690a_100000210545_100011201483 [0,0,0,0,0,2|2,0,0]=4 11201 B15R1.1081 CC(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000210545 [0,0,0,0,0,2|1,0,0]=3 11202 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 34a_100000210254_200011218536 [0,0,0,0,0,2|1,0,1]=4 11203 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 34a_100000748627_100000210312 [0,0,0,0,0,2|1,0,1]=4 11204 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 7a_100000210254_200011218536 [0,0,0,0,0,2|1,0,1]=4 11205 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 7a_100000748627_100000210626 [0,0,0,0,0,2|1,0,1]=4 11206 B15R1.1081 CC(C)CNCC(=O)Cc1ccccc1 2230a_100000210953_100000233483 [0,0,0,0,0,2|1,0,0]=3 11207 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 2230a_100000210953_100000182850 [0,0,0,0,0,2|1,0,0]=3 11208 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 270004a_100000742222_100000210432 [0,0,0,0,0,2|1,0,0]=3 11209 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 34a_100000210953_100000182850 [0,0,0,0,0,2|1,0,0]=3 11210 B15R1.1081 CC(C)CNCC(=O)Nc1ccccn1 2230a_100000210953_100020662008 [0,0,0,0,0,2|2,0,0]=4 11211 B15R1.1081 CC(C)CNCC(=O)Nc1ccncc1 2230a_100000210953_100000754145 [0,0,0,0,0,2|2,0,0]=4 11212 B15R1.1081 CC(C)CNCC(=O)Oc1ccccc1 2230a_100000210953_100009813826 [0,0,0,0,0,2|1,0,0]=3 11213 B15R1.1081 CC(C)CNCC(=O)Oc1ccccc1 34a_100000210953_100009813826 [0,0,0,0,0,2|1,0,0]=3 11214 B15R1.1081 CC(C)CNNC(=O)C[n+]1ccccc1 22a_100000696102_200000086051 [0,0,0,0,0,2|2,0,0]=4 11215 B15R1.1081 CC(C)CNNC(=O)Cc1ccccn1 22a_100000696102_100000233486 [0,0,0,0,0,2|2,0,0]=4 11216 B15R1.1081 CC(C)CNNC(=O)Cc1cccnc1 22a_100000696102_100000737805 [0,0,0,0,0,2|2,0,0]=4 11217 B15R1.1081 CC(C)CNNC(=O)Cc1ccncc1 22a_100000696102_100011201483 [0,0,0,0,0,2|2,0,0]=4 11218 B15R1.1081 CC(C)COCC(=O)Cc1ccccc1 1458a_100011223364_100015291786 [0,0,0,0,0,2|0,0,0]=2 11219 B15R1.1081 CC(C)COCC(=O)Cc1ccccn1 1458a_100011223364_100000721315 [0,0,0,0,0,2|1,0,0]=3 11220 B15R1.1081 CC(C)COCC(=O)Cc1cccnc1 1458a_100011223364_100000733263 [0,0,0,0,0,2|1,0,0]=3 11221 B15R1.1081 CC(C)COCC(=O)Cc1cccnn1 1458a_100011223364_100016990269 [0,0,0,0,0,2|2,0,0]=4 11222 B15R1.1081 CC(C)COCC(=O)Cc1ccncc1 1458a_100011223364_100000705612 [0,0,0,0,0,2|1,0,0]=3 11223 B15R1.1081 CC(C)COCC(=O)Cc1cnccn1 1458a_100011223364_100016995436 [0,0,0,0,0,2|2,0,0]=4 11224 B15R1.1081 CC(C)COCC(=O)Cc1cncnc1 1458a_100011223364_100015196519 [0,0,0,0,0,2|2,0,0]=4 11225 B15R1.1081 CC(C)COCC(=O)Cc1ncccn1 1458a_100011223364_100000703007 [0,0,0,0,0,2|2,0,0]=4 11226 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 11a_100000106764_100011223364 [0,0,0,0,0,2|0,0,0]=2 11227 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 1626a_100000106764_100011223364 [0,0,0,0,0,2|0,0,0]=2 11228 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 22a_100000106764_100011223364 [0,0,0,0,0,2|0,0,0]=2 11229 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 34a_100000210257_100000182850 [0,0,0,0,0,2|0,0,0]=2 11230 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 34a_100000246334_100000210624 [0,0,0,0,0,2|0,0,0]=2 11231 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 527a_100000106764_100011223364 [0,0,0,0,0,2|0,0,0]=2 11232 B15R1.1081 CC(C)COCC(=O)Oc1ccccc1 34a_100000210257_100009813826 [0,0,0,0,0,2|0,0,0]=2 11233 B15R1.1081 CC(C)COCC(C)Cc1ccccc1 34a_100012125295_100000210624 [0,0,0,0,0,2|1,0,1]=4 11234 B15R1.1081 CC(C)COCC(C)Cc1ccccc1 7a_100012125295_100000210760 [0,0,0,0,0,2|1,0,1]=4 11235 B15R1.1081 CC(C)COCC(C)Oc1ccccc1 34a_200000036796_100000210624 [0,0,0,0,0,2|1,0,1]=4 11236 B15R1.1081 CC(C)COCC(C)Oc1ccccc1 7a_200000036796_100000210760 [0,0,0,0,0,2|1,0,1]=4 11237 B15R1.1081 CC(C)COCC(N)Cc1ccccc1 34a_100000739027_100000210624 [0,0,0,0,0,2|1,0,1]=4 11238 B15R1.1081 CC(C)COC[C@@H](O)Cc1ccccc1 34a_100000210257_100000729385 [0,0,0,0,0,2|0,0,2]=4 11239 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 62a_100000210624_100000233483 [0,0,0,0,0,2|0,1,0]=3 11240 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 62a_100000233483_100000210760 [0,0,0,0,0,2|0,1,0]=3 11241 B15R1.1081 CC(C)CSCC(=O)Nc1ccccc1 62a_100000210624_100000182850 [0,0,0,0,0,2|0,1,0]=3 11242 B15R1.1081 CC(C)CSCC(=O)Nc1ccccc1 62a_100012148978_100000210760 [0,0,0,0,0,2|0,1,0]=3 11243 B15R1.1081 CC(C)CSCC(=O)Nc1ccccn1 62a_100000210624_100020662008 [0,0,0,0,0,2|1,1,0]=4 11244 B15R1.1081 CC(C)CSCC(=O)Nc1ccccn1 62a_100020662008_100000210760 [0,0,0,0,0,2|1,1,0]=4 11245 B15R1.1081 CC(C)CSCC(=O)Nc1ccncc1 62a_100000210624_100000754145 [0,0,0,0,0,2|1,1,0]=4 11246 B15R1.1081 CC(C)CSCC(=O)Oc1ccccc1 62a_100000210624_100009813826 [0,0,0,0,0,2|0,1,0]=3 11247 B15R1.1081 CC(C)CSCC(=O)Oc1ccccc1 62a_100009813826_100000210760 [0,0,0,0,0,2|0,1,0]=3 11248 B15R1.1081 CC(C)NCCC(=O)Nc1ccccc1 2230a_100138425928_100000242058 [0,0,0,0,0,2|1,0,0]=3 11249 B15R1.1081 CC(C)NCCC(=O)Nc1ccccc1 34a_100138425928_100000242058 [0,0,0,0,0,2|1,0,0]=3 11250 B15R1.1081 CC(C)NCCC(=O)Nc1cccnc1 2230a_100138425928_200015187043 [0,0,0,0,0,2|2,0,0]=4 11251 B15R1.1081 CC(C)NCCC(=O)Nc1cccnc1 34a_100000748795_100000210206 [0,0,0,0,0,2|2,0,0]=4 11252 B15R1.1081 CC(C)NCCC(=O)Oc1ccccc1 2230a_100138425928_200000035796 [0,0,0,0,0,2|1,0,0]=3 11253 B15R1.1081 CC(C)OCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000211751 [0,0,0,0,0,2|2,0,0]=4 11254 B15R1.1081 CC(C)OCCC(=O)Cc1ccccn1 1458a_100000233486_100000211751 [0,0,0,0,0,2|2,0,0]=4 11255 B15R1.1081 CC(C)OCCC(=O)Cc1cccnc1 1458a_100000737805_100000211751 [0,0,0,0,0,2|2,0,0]=4 11256 B15R1.1081 CC(C)OCCC(=O)Nc1ccccc1 34a_100000212225_100000242058 [0,0,0,0,0,2|1,0,0]=3 11257 B15R1.1081 CC(C)OCOC(C)Cc1ccccc1 34a_100000748627_100000709892 [0,0,0,0,0,2|1,0,1]=4 11258 B15R1.1081 CC(C)SCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000730970 [0,0,0,0,0,2|2,0,0]=4 11259 B15R1.1081 CC(C)SCCC(=O)Cc1ccccn1 1458a_100000233486_100000730970 [0,0,0,0,0,2|2,0,0]=4 11260 B15R1.1081 CC(C)SCCC(=O)Cc1cccnc1 1458a_100000737805_100000730970 [0,0,0,0,0,2|2,0,0]=4 11261 B15R1.1081 CC(C)SCCC(=O)Nc1ccccc1 62a_100000210206_100000242058 [0,0,0,0,0,2|1,0,0]=3 11262 B15R1.1081 CC(C)SCCC(=O)Nc1cccnc1 62a_100000210206_200015187043 [0,0,0,0,0,2|2,0,0]=4 11263 B15R1.1081 CC(C)SCCC(=O)Oc1ccccc1 62a_100000210206_200000035796 [0,0,0,0,0,2|1,0,0]=3 11264 B15R1.1081 CC(F)COCC(=O)Nc1ccccc1 34a_100015925927_100000182850 [0,0,0,0,0,2|1,0,0]=3 11265 B15R1.1081 CC(F)COCC(=O)Oc1ccccc1 34a_100015925927_100009813826 [0,0,0,0,0,2|1,0,0]=3 11266 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 1626a_100000106764_100000761597 [0,0,0,0,0,2|2,0,0]=4 11267 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 22a_100000106764_100000761597 [0,0,0,0,0,2|2,0,0]=4 11268 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 527a_100000106764_100000761597 [0,0,0,0,0,2|2,0,0]=4 11269 B15R1.1081 CC(O)CCNC(=O)Nc1ccccc1 2430a_100000106764_200000755665 [0,0,0,0,0,2|2,0,0]=4 11270 B15R1.1081 CC(O)CNCC(=O)Cc1ccccc1 2230a_100000210904_100000233483 [0,0,0,0,0,2|2,0,0]=4 11271 B15R1.1081 CC(O)CNCC(=O)Nc1ccccc1 2230a_100000210904_100000182850 [0,0,0,0,0,2|2,0,0]=4 11272 B15R1.1081 CC(O)CNCC(=O)Nc1ccccc1 34a_100000210904_100000182850 [0,0,0,0,0,2|2,0,0]=4 11273 B15R1.1081 CC(O)CNCC(=O)Oc1ccccc1 2230a_100000210904_100009813826 [0,0,0,0,0,2|2,0,0]=4 11274 B15R1.1081 CC(O)CNCC(=O)Oc1ccccc1 34a_100000210904_100009813826 [0,0,0,0,0,2|2,0,0]=4 11275 B15R1.1081 CC(O)COCC(=O)Nc1ccccc1 34a_100000246334_100011218427 [0,0,0,0,0,2|1,0,0]=3 11276 B15R1.1081 CC(O)CSCC(=O)Cc1ccccc1 62a_100000233483_100011218427 [0,0,0,0,0,2|1,1,0]=4 11277 B15R1.1081 CC(O)CSCC(=O)Cc1ccccc1 62a_100011218427_100000233483 [0,0,0,0,0,2|1,1,0]=4 11278 B15R1.1081 CC(O)CSCC(=O)Nc1ccccc1 62a_100011218427_100000182850 [0,0,0,0,0,2|1,1,0]=4 11279 B15R1.1081 CC(O)CSCC(=O)Nc1ccccc1 62a_100012148978_100011218427 [0,0,0,0,0,2|1,1,0]=4 11280 B15R1.1081 CC(O)CSCC(=O)Oc1ccccc1 62a_100009813826_100011218427 [0,0,0,0,0,2|1,1,0]=4 11281 B15R1.1081 CC(O)CSCC(=O)Oc1ccccc1 62a_100011218427_100009813826 [0,0,0,0,0,2|1,1,0]=4 11282 B15R1.1081 CN(C)CC=CC(=O)Cc1ccccc1 1458a_100000754359_100015291786 [0,0,0,0,0,2|2,0,0]=4 11283 B15R1.1081 CN(C)CC=CC(=O)Nc1ccccc1 22a_100000106764_100000754359 [0,0,0,0,0,2|2,0,0]=4 11284 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 11a_100000106764_100000740757 [0,0,0,0,0,2|2,0,0]=4 11285 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 2230a_100102631434_100011194425 [0,0,0,0,0,2|2,0,0]=4 11286 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 22a_100000106764_100000740757 [0,0,0,0,0,2|2,0,0]=4 11287 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 269982a_100102631434_100011194425 [0,0,0,0,0,2|2,0,0]=4 11288 B15R1.1081 CN(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000210585 [0,0,0,0,0,2|2,0,0]=4 11289 B15R1.1081 C[C@@H](Cl)COCC(=O)Nc1ccccc1 34a_100016084084_100000182850 [0,0,0,0,0,2|1,0,0]=3 11290 B15R1.1081 C[C@@H](Cl)COCC(=O)Oc1ccccc1 34a_100016084084_100009813826 [0,0,0,0,0,2|1,0,0]=3 11291 B15R1.1081 C[C@@H](N)COCC(=O)Nc1ccccc1 34a_100000737577_100000182850 [0,0,0,0,0,2|1,0,0]=3 11292 B15R1.1081 C[C@@H](N)COCC(=O)Oc1ccccc1 34a_100000737577_100009813826 [0,0,0,0,0,2|1,0,0]=3 11293 B15R1.1081 C[C@@H](O)COCC(=O)Nc1ccccc1 34a_100000246334_100009817552 [0,0,0,0,0,2|1,0,0]=3 11294 B15R1.1081 C[C@@H](O)CSCC(=O)Cc1ccccc1 62a_100000233483_100009817552 [0,0,0,0,0,2|1,1,0]=4 11295 B15R1.1081 C[C@@H](O)CSCC(=O)Cc1ccccc1 62a_100009817552_100000233483 [0,0,0,0,0,2|1,1,0]=4 11296 B15R1.1081 C[C@@H](O)CSCC(=O)Nc1ccccc1 62a_100009817552_100000182850 [0,0,0,0,0,2|1,1,0]=4 11297 B15R1.1081 C[C@@H](O)CSCC(=O)Nc1ccccc1 62a_100012148978_100009817552 [0,0,0,0,0,2|1,1,0]=4 11298 B15R1.1081 C[C@@H](O)CSCC(=O)Oc1ccccc1 62a_100009813826_100009817552 [0,0,0,0,0,2|1,1,0]=4 11299 B15R1.1081 C[C@@H](O)CSCC(=O)Oc1ccccc1 62a_100009817552_100009813826 [0,0,0,0,0,2|1,1,0]=4 11300 B15R1.1081 O=C(COCC(F)F)Nc1ccccc1 34a_100000246334_100011934356 [0,0,0,0,0,2|2,0,0]=4 11301 B15R1.1081 O=C(COCC(F)F)Nc1ccccc1 34a_100000743014_100000182850 [0,0,0,0,0,2|2,0,0]=4 11302 B15R1.1081 O=C(COCC(F)F)Oc1ccccc1 34a_100000743014_100009813826 [0,0,0,0,0,2|2,0,0]=4 11303 B15R1.1081 [13CH3]C(=O)COCC(=O)Nc1ccccc1 1458a_200000199795_200025704644 [0,0,0,0,0,2|1,0,1]=4 11304 B15R1.5919 CC(=NNc1ccccc1)CCC(C)C 4a_100015195140_100000210476 [0,0,0,0,0,2|2,0,0]=4 11305 B15R1.5919 CC(C)C=CC(=O)CCc1ccccc1 1458a_100016268746_100000765856 [0,0,0,0,0,2|1,0,1]=4 11306 B15R1.5919 CC(C)C=CC(=O)NCc1ccccc1 11a_100015324214_100016268746 [0,0,0,0,0,2|1,0,1]=4 11307 B15R1.5919 CC(C)C=CC(=O)NCc1ccccc1 1626a_100015324214_100016268746 [0,0,0,0,0,2|1,0,1]=4 11308 B15R1.5919 CC(C)C=CC(=O)NCc1ccccc1 240690a_100015324214_100016268746 [0,0,0,0,0,2|1,0,1]=4 11309 B15R1.5919 CC(C)C=CC(=O)NNc1ccccc1 22a_100015195140_100016268746 [0,0,0,0,0,2|1,0,1]=4 11310 B15R1.5919 CC(C)CCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210312 [0,0,0,0,0,2|1,0,0]=3 11311 B15R1.5919 CC(C)CCC(=O)C#Cc1ccccn1 1458a_102125277312_100000210312 [0,0,0,0,0,2|2,0,0]=4 11312 B15R1.5919 CC(C)CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210312 [0,0,0,0,0,2|1,0,0]=3 11313 B15R1.5919 CC(C)CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210312 [0,0,0,0,0,2|2,0,0]=4 11314 B15R1.5919 CC(C)CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210312 [0,0,0,0,0,2|2,0,0]=4 11315 B15R1.5919 CC(C)CCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210312 [0,0,0,0,0,2|2,0,0]=4 11316 B15R1.5919 CC(C)CCC(=O)CCc1ccccc1 1458a_100000181311_100000765856 [0,0,0,0,0,2|1,0,0]=3 11317 B15R1.5919 CC(C)CCC(=O)CCc1ccccc1 1458a_100000185753_100000210312 [0,0,0,0,0,2|1,0,0]=3 11318 B15R1.5919 CC(C)CCC(=O)CCc1ccccn1 1458a_100000181311_100015183660 [0,0,0,0,0,2|2,0,0]=4 11319 B15R1.5919 CC(C)CCC(=O)CCc1ccccn1 1458a_100015195070_100000210312 [0,0,0,0,0,2|2,0,0]=4 11320 B15R1.5919 CC(C)CCC(=O)CCc1cccnc1 1458a_100000181311_200011713674 [0,0,0,0,0,2|2,0,0]=4 11321 B15R1.5919 CC(C)CCC(=O)CCc1cccnc1 1458a_100000198484_100000210312 [0,0,0,0,0,2|2,0,0]=4 11322 B15R1.5919 CC(C)CCC(=O)CCc1ccncc1 1458a_100000181311_100000723409 [0,0,0,0,0,2|2,0,0]=4 11323 B15R1.5919 CC(C)CCC(=O)CCc1ccncc1 1458a_100011225043_100000210312 [0,0,0,0,0,2|2,0,0]=4 11324 B15R1.5919 CC(C)CCC(=O)COc1ccccc1 1458a_100000186222_100000210312 [0,0,0,0,0,2|1,0,0]=3 11325 B15R1.5919 CC(C)CCC(=O)COc1ccccn1 1458a_100102699861_100000210312 [0,0,0,0,0,2|2,0,0]=4 11326 B15R1.5919 CC(C)CCC(=O)COc1cccnc1 1458a_100015207166_100000210312 [0,0,0,0,0,2|2,0,0]=4 11327 B15R1.5919 CC(C)CCC(=O)CSc1ccccc1 1458a_100000211596_100000210312 [0,0,0,0,0,2|1,0,0]=3 11328 B15R1.5919 CC(C)CCC(=O)CSc1ccccn1 1458a_100000156281_100000210312 [0,0,0,0,0,2|2,0,0]=4 11329 B15R1.5919 CC(C)CCC(=O)CSc1ccncc1 1458a_100000211328_100000210312 [0,0,0,0,0,2|2,0,0]=4 11330 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 11a_100015324214_100000181311 [0,0,0,0,0,2|1,0,0]=3 11331 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 1626a_100015324214_100000181311 [0,0,0,0,0,2|1,0,0]=3 11332 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 240690a_100015324214_100000181311 [0,0,0,0,0,2|1,0,0]=3 11333 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 527a_100015324214_100000181311 [0,0,0,0,0,2|1,0,0]=3 11334 B15R1.5919 CC(C)CCC(=O)NCc1ccccn1 11a_100000210449_100000181311 [0,0,0,0,0,2|2,0,0]=4 11335 B15R1.5919 CC(C)CCC(=O)NCc1ccccn1 1626a_100000210449_100000181311 [0,0,0,0,0,2|2,0,0]=4 11336 B15R1.5919 CC(C)CCC(=O)NCc1ccccn1 240690a_100000210449_100000181311 [0,0,0,0,0,2|2,0,0]=4 11337 B15R1.5919 CC(C)CCC(=O)NCc1ccccn1 527a_100000210449_100000181311 [0,0,0,0,0,2|2,0,0]=4 11338 B15R1.5919 CC(C)CCC(=O)NCc1cccnc1 11a_100000210453_100000181311 [0,0,0,0,0,2|2,0,0]=4 11339 B15R1.5919 CC(C)CCC(=O)NCc1cccnc1 240690a_100000210453_100000181311 [0,0,0,0,0,2|2,0,0]=4 11340 B15R1.5919 CC(C)CCC(=O)NCc1cccnc1 527a_100000210453_100000181311 [0,0,0,0,0,2|2,0,0]=4 11341 B15R1.5919 CC(C)CCC(=O)NCc1ccncc1 11a_100000210450_100000181311 [0,0,0,0,0,2|2,0,0]=4 11342 B15R1.5919 CC(C)CCC(=O)NCc1ccncc1 1626a_100000210450_100000181311 [0,0,0,0,0,2|2,0,0]=4 11343 B15R1.5919 CC(C)CCC(=O)NCc1ccncc1 240690a_100000210450_100000181311 [0,0,0,0,0,2|2,0,0]=4 11344 B15R1.5919 CC(C)CCC(=O)NCc1ccncc1 527a_100000210450_100000181311 [0,0,0,0,0,2|2,0,0]=4 11345 B15R1.5919 CC(C)CCC(=O)NNc1ccccc1 22a_100015195140_100000181311 [0,0,0,0,0,2|1,0,0]=3 11346 B15R1.5919 CC(C)CCC(=O)NNc1ccccn1 22a_100000183288_100000181311 [0,0,0,0,0,2|2,0,0]=4 11347 B15R1.5919 CC(C)CCC(=O)NNc1cccnc1 22a_100000728903_100000181311 [0,0,0,0,0,2|2,0,0]=4 11348 B15R1.5919 CC(C)CCC(=O)NNc1ccncc1 22a_100000698918_100000181311 [0,0,0,0,0,2|2,0,0]=4 11349 B15R1.5919 CC(C)CNC(=O)C#Cc1ccccc1 240690a_100000210953_100000736102 [0,0,0,0,0,2|1,0,0]=3 11350 B15R1.5919 CC(C)CNC(=O)C=Cc1ccccc1 11a_100000210953_100000210462 [0,0,0,0,0,2|1,0,0]=3 11351 B15R1.5919 CC(C)CNC(=O)C=Cc1ccccc1 1626a_100000210953_100000210462 [0,0,0,0,0,2|1,0,0]=3 11352 B15R1.5919 CC(C)CNC(=O)C=Cc1ccccn1 11a_100000210953_100000740811 [0,0,0,0,0,2|2,0,0]=4 11353 B15R1.5919 CC(C)CNC(=O)C=Cc1ccccn1 240690a_100000210953_100000740811 [0,0,0,0,0,2|2,0,0]=4 11354 B15R1.5919 CC(C)CNC(=O)C=Cc1cccnc1 11a_100000210953_100000735890 [0,0,0,0,0,2|2,0,0]=4 11355 B15R1.5919 CC(C)CNC(=O)C=Cc1cccnc1 240690a_100000210953_100000735890 [0,0,0,0,0,2|2,0,0]=4 11356 B15R1.5919 CC(C)CNC(=O)C=Cc1ccncc1 240690a_100000210953_100000682801 [0,0,0,0,0,2|2,0,0]=4 11357 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 11a_100000210953_100000185753 [0,0,0,0,0,2|1,0,0]=3 11358 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 1626a_100000210953_100000185753 [0,0,0,0,0,2|1,0,0]=3 11359 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 240690a_100000210953_100000185753 [0,0,0,0,0,2|1,0,0]=3 11360 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 527a_100000210953_100000185753 [0,0,0,0,0,2|1,0,0]=3 11361 B15R1.5919 CC(C)CNC(=O)CCc1ccccn1 11a_100000210953_100015195070 [0,0,0,0,0,2|2,0,0]=4 11362 B15R1.5919 CC(C)CNC(=O)CCc1ccccn1 240690a_100000210953_100015195070 [0,0,0,0,0,2|2,0,0]=4 11363 B15R1.5919 CC(C)CNC(=O)CCc1ccccn1 527a_100000210953_100015195070 [0,0,0,0,0,2|2,0,0]=4 11364 B15R1.5919 CC(C)CNC(=O)CCc1cccnc1 11a_100000210953_100000198484 [0,0,0,0,0,2|2,0,0]=4 11365 B15R1.5919 CC(C)CNC(=O)CCc1cccnc1 1626a_100000210953_100000198484 [0,0,0,0,0,2|2,0,0]=4 11366 B15R1.5919 CC(C)CNC(=O)CCc1cccnc1 240690a_100000210953_100000198484 [0,0,0,0,0,2|2,0,0]=4 11367 B15R1.5919 CC(C)CNC(=O)CCc1cccnc1 527a_100000210953_100000198484 [0,0,0,0,0,2|2,0,0]=4 11368 B15R1.5919 CC(C)CNC(=O)CCc1ccncc1 11a_100000210953_100011225043 [0,0,0,0,0,2|2,0,0]=4 11369 B15R1.5919 CC(C)CNC(=O)CCc1ccncc1 240690a_100000210953_100011225043 [0,0,0,0,0,2|2,0,0]=4 11370 B15R1.5919 CC(C)CNC(=O)CCc1ccncc1 527a_100000210953_100011225043 [0,0,0,0,0,2|2,0,0]=4 11371 B15R1.5919 CC(C)CNC(=O)CNc1ccccc1 34a_100000106764_100000183291 [0,0,0,0,0,2|1,0,0]=3 11372 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 11a_100000210953_100000186222 [0,0,0,0,0,2|1,0,0]=3 11373 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 1626a_100000210953_100000186222 [0,0,0,0,0,2|1,0,0]=3 11374 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 240690a_100000210953_100000186222 [0,0,0,0,0,2|1,0,0]=3 11375 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 34a_100000210340_100000183291 [0,0,0,0,0,2|1,0,0]=3 11376 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 527a_100000210953_100000186222 [0,0,0,0,0,2|1,0,0]=3 11377 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 7a_100000210340_100000183291 [0,0,0,0,0,2|1,0,0]=3 11378 B15R1.5919 CC(C)CNC(=O)COc1ccccn1 1626a_100000210953_100102699861 [0,0,0,0,0,2|2,0,0]=4 11379 B15R1.5919 CC(C)CNC(=O)COc1ccccn1 240690a_100000210953_100102699861 [0,0,0,0,0,2|2,0,0]=4 11380 B15R1.5919 CC(C)CNC(=O)COc1ccccn1 527a_100000210953_100102699861 [0,0,0,0,0,2|2,0,0]=4 11381 B15R1.5919 CC(C)CNC(=O)COc1cccnc1 11a_100000210953_100015207166 [0,0,0,0,0,2|2,0,0]=4 11382 B15R1.5919 CC(C)CNC(=O)COc1cccnc1 1626a_100000210953_100015207166 [0,0,0,0,0,2|2,0,0]=4 11383 B15R1.5919 CC(C)CNC(=O)COc1cccnc1 240690a_100000210953_100015207166 [0,0,0,0,0,2|2,0,0]=4 11384 B15R1.5919 CC(C)CNC(=O)COc1cccnc1 34a_100000210849_100000183291 [0,0,0,0,0,2|2,0,0]=4 11385 B15R1.5919 CC(C)CNC(=O)COc1cccnc1 527a_100000210953_100015207166 [0,0,0,0,0,2|2,0,0]=4 11386 B15R1.5919 CC(C)CNC(=O)COc1cccnc1 7a_100000210849_100000183291 [0,0,0,0,0,2|2,0,0]=4 11387 B15R1.5919 CC(C)CNC(=O)COc1ccncc1 34a_100000212176_100000183291 [0,0,0,0,0,2|2,0,0]=4 11388 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 11a_100000210953_100000211596 [0,0,0,0,0,2|1,0,0]=3 11389 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 1626a_100000210953_100000211596 [0,0,0,0,0,2|1,0,0]=3 11390 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 240690a_100000210953_100000211596 [0,0,0,0,0,2|1,0,0]=3 11391 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 527a_100000210953_100000211596 [0,0,0,0,0,2|1,0,0]=3 11392 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 62a_100000183291_100000041952 [0,0,0,0,0,2|1,0,0]=3 11393 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 62a_100000719477_100000183291 [0,0,0,0,0,2|1,0,0]=3 11394 B15R1.5919 CC(C)CNC(=O)CSc1ccccn1 11a_100000210953_100000156281 [0,0,0,0,0,2|2,0,0]=4 11395 B15R1.5919 CC(C)CNC(=O)CSc1ccccn1 240690a_100000210953_100000156281 [0,0,0,0,0,2|2,0,0]=4 11396 B15R1.5919 CC(C)CNC(=O)CSc1ccccn1 527a_100000210953_100000156281 [0,0,0,0,0,2|2,0,0]=4 11397 B15R1.5919 CC(C)CNC(=O)CSc1ccccn1 62a_100000183291_100011216584 [0,0,0,0,0,2|2,0,0]=4 11398 B15R1.5919 CC(C)CNC(=O)CSc1ccccn1 62a_100011216584_100000183291 [0,0,0,0,0,2|2,0,0]=4 11399 B15R1.5919 CC(C)CNC(=O)CSc1cccnc1 62a_100000183291_100000210063 [0,0,0,0,0,2|2,0,0]=4 11400 B15R1.5919 CC(C)CNC(=O)CSc1cccnc1 62a_100000210063_100000183291 [0,0,0,0,0,2|2,0,0]=4 11401 B15R1.5919 CC(C)CNC(=O)CSc1ccncc1 11a_100000210953_100000211328 [0,0,0,0,0,2|2,0,0]=4 11402 B15R1.5919 CC(C)CNC(=O)CSc1ccncc1 1626a_100000210953_100000211328 [0,0,0,0,0,2|2,0,0]=4 11403 B15R1.5919 CC(C)CNC(=O)CSc1ccncc1 240690a_100000210953_100000211328 [0,0,0,0,0,2|2,0,0]=4 11404 B15R1.5919 CC(C)CNC(=O)CSc1ccncc1 527a_100000210953_100000211328 [0,0,0,0,0,2|2,0,0]=4 11405 B15R1.5919 CC(C)CNC(=O)CSc1ccncc1 62a_100000183291_100000728582 [0,0,0,0,0,2|2,0,0]=4 11406 B15R1.5919 CC(C)CNC(=O)CSc1ccncc1 62a_100000728582_100000183291 [0,0,0,0,0,2|2,0,0]=4 11407 B15R1.5919 CC(C)CNC(=O)NCc1ccccc1 2708a_100000210953_100015324214 [0,0,0,0,0,2|1,0,0]=3 11408 B15R1.5919 CC(C)CNC(=O)NCc1ccccc1 2708a_100015324214_100000210953 [0,0,0,0,0,2|1,0,0]=3 11409 B15R1.5919 CC(C)CNC(=O)NCc1ccccc1 273464a_100000210953_100015324214 [0,0,0,0,0,2|1,0,0]=3 11410 B15R1.5919 CC(C)CNC(=O)NCc1ccccc1 273464a_100015324214_100000210953 [0,0,0,0,0,2|1,0,0]=3 11411 B15R1.5919 CC(C)CNC(=O)NCc1ccccc1 512a_100000210953_100015324214 [0,0,0,0,0,2|1,0,0]=3 11412 B15R1.5919 CC(C)CNC(=O)NCc1ccccc1 512a_100015324214_100000210953 [0,0,0,0,0,2|1,0,0]=3 11413 B15R1.5919 CC(C)CNC(=O)NCc1ccccn1 2708a_100000210449_100000210953 [0,0,0,0,0,2|2,0,0]=4 11414 B15R1.5919 CC(C)CNC(=O)NCc1ccccn1 2708a_100000210953_100000210449 [0,0,0,0,0,2|2,0,0]=4 11415 B15R1.5919 CC(C)CNC(=O)NCc1ccccn1 273464a_100000210449_100000210953 [0,0,0,0,0,2|2,0,0]=4 11416 B15R1.5919 CC(C)CNC(=O)NCc1ccccn1 273464a_100000210953_100000210449 [0,0,0,0,0,2|2,0,0]=4 11417 B15R1.5919 CC(C)CNC(=O)NCc1ccccn1 512a_100000210953_100000210449 [0,0,0,0,0,2|2,0,0]=4 11418 B15R1.5919 CC(C)CNC(=O)NCc1cccnc1 2708a_100000210453_100000210953 [0,0,0,0,0,2|2,0,0]=4 11419 B15R1.5919 CC(C)CNC(=O)NCc1cccnc1 2708a_100000210953_100000210453 [0,0,0,0,0,2|2,0,0]=4 11420 B15R1.5919 CC(C)CNC(=O)NCc1cccnc1 273464a_100000210453_100000210953 [0,0,0,0,0,2|2,0,0]=4 11421 B15R1.5919 CC(C)CNC(=O)NCc1cccnc1 273464a_100000210953_100000210453 [0,0,0,0,0,2|2,0,0]=4 11422 B15R1.5919 CC(C)CNC(=O)NCc1cccnc1 512a_100000210453_100000210953 [0,0,0,0,0,2|2,0,0]=4 11423 B15R1.5919 CC(C)CNC(=O)NCc1cccnc1 512a_100000210953_100000210453 [0,0,0,0,0,2|2,0,0]=4 11424 B15R1.5919 CC(C)CNC(=O)NCc1ccncc1 2708a_100000210450_100000210953 [0,0,0,0,0,2|2,0,0]=4 11425 B15R1.5919 CC(C)CNC(=O)NCc1ccncc1 2708a_100000210953_100000210450 [0,0,0,0,0,2|2,0,0]=4 11426 B15R1.5919 CC(C)CNC(=O)NCc1ccncc1 273464a_100000210450_100000210953 [0,0,0,0,0,2|2,0,0]=4 11427 B15R1.5919 CC(C)CNC(=O)NCc1ccncc1 273464a_100000210953_100000210450 [0,0,0,0,0,2|2,0,0]=4 11428 B15R1.5919 CC(C)CNC(=O)NCc1ccncc1 512a_100000210953_100000210450 [0,0,0,0,0,2|2,0,0]=4 11429 B15R1.5919 CC(C)CNC(=O)NNc1ccccc1 273464a_100000210953_100015195140 [0,0,0,0,0,2|1,0,0]=3 11430 B15R1.5919 CC(C)CNC(=O)NNc1ccccc1 512a_100000210953_100015195140 [0,0,0,0,0,2|1,0,0]=3 11431 B15R1.5919 CC(C)CNC(=O)NNc1ccccn1 273464a_100000210953_100000183288 [0,0,0,0,0,2|2,0,0]=4 11432 B15R1.5919 CC(C)CNC(=O)NNc1ccccn1 512a_100000210953_100000183288 [0,0,0,0,0,2|2,0,0]=4 11433 B15R1.5919 CC(C)CNC(=O)NNc1cccnc1 273464a_100000210953_100000728903 [0,0,0,0,0,2|2,0,0]=4 11434 B15R1.5919 CC(C)CNC(=O)NNc1cccnc1 512a_100000210953_100000728903 [0,0,0,0,0,2|2,0,0]=4 11435 B15R1.5919 CC(C)CNC(=O)NNc1ccncc1 273464a_100000210953_100000698918 [0,0,0,0,0,2|2,0,0]=4 11436 B15R1.5919 CC(C)CNC(=O)NNc1ccncc1 512a_100000210953_100000698918 [0,0,0,0,0,2|2,0,0]=4 11437 B15R1.5919 CC(C)COC(C)C#Cc1ccccc1 34a_200000065209_100000210624 [0,0,0,0,0,2|1,0,1]=4 11438 B15R1.5919 CC(C)COC(C)C#Cc1ccccc1 7a_200000065209_100000210760 [0,0,0,0,0,2|1,0,1]=4 11439 B15R1.5919 CC(C)COC(C)COc1ccccc1 34a_100000210911_100000210624 [0,0,0,0,0,2|1,0,1]=4 11440 B15R1.5919 CC(C)COC(C)COc1ccccc1 7a_100000210911_100000210760 [0,0,0,0,0,2|1,0,1]=4 11441 B15R1.5919 CC(C)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100000210624 [0,0,0,0,0,2|1,0,1]=4 11442 B15R1.5919 CC(C)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100000210760 [0,0,0,0,0,2|1,0,1]=4 11443 B15R1.5919 CC(C)NCC(=O)CCc1ccccc1 2230a_100138425928_100012361361 [0,0,0,0,0,2|2,0,0]=4 11444 B15R1.5919 CC(C)NCC(=O)CCc1ccccc1 34a_100138425928_100012361361 [0,0,0,0,0,2|2,0,0]=4 11445 B15R1.5919 CC(C)NCC(=O)NCc1ccccc1 2230a_100000739245_100000210206 [0,0,0,0,0,2|2,0,0]=4 11446 B15R1.5919 CC(C)NCC(=O)NCc1ccccc1 2230a_100138425928_100000183539 [0,0,0,0,0,2|2,0,0]=4 11447 B15R1.5919 CC(C)NCC(=O)NCc1ccccc1 34a_100138425928_100000183539 [0,0,0,0,0,2|2,0,0]=4 11448 B15R1.5919 CC(C)NCC(=O)OCc1ccccc1 2230a_100138425928_100000753625 [0,0,0,0,0,2|2,0,0]=4 11449 B15R1.5919 CC(C)NCC(=O)OCc1ccccc1 34a_100138425928_100000753625 [0,0,0,0,0,2|2,0,0]=4 11450 B15R1.5919 CC(C)NNC(=O)C#Cc1ccccc1 22a_100000741168_100000736102 [0,0,0,0,0,2|2,0,0]=4 11451 B15R1.5919 CC(C)NNC(=O)C=Cc1ccccc1 22a_100000741168_100000210462 [0,0,0,0,0,2|2,0,0]=4 11452 B15R1.5919 CC(C)NNC(=O)CCc1ccccc1 22a_100000741168_100000185753 [0,0,0,0,0,2|2,0,0]=4 11453 B15R1.5919 CC(C)NNC(=O)COc1ccccc1 22a_100000741168_100000186222 [0,0,0,0,0,2|2,0,0]=4 11454 B15R1.5919 CC(C)NNC(=O)CSc1ccccc1 22a_100000741168_100000211596 [0,0,0,0,0,2|2,0,0]=4 11455 B15R1.5919 CC(C)NNC(=O)NCc1ccccc1 273464a_100015324214_100000741168 [0,0,0,0,0,2|2,0,0]=4 11456 B15R1.5919 CC(C)NNC(=O)NCc1ccccc1 512a_100000741168_100015324214 [0,0,0,0,0,2|2,0,0]=4 11457 B15R1.5919 CC(C)NNC(=O)NCc1ccccc1 512a_100015324214_100000741168 [0,0,0,0,0,2|2,0,0]=4 11458 B15R1.5919 CC(C)NNC(=O)NNc1ccccc1 512a_100000741168_100015195140 [0,0,0,0,0,2|2,0,0]=4 11459 B15R1.5919 CC(C)OCC(=O)CCc1ccccc1 1458a_100000745533_100000765856 [0,0,0,0,0,2|2,0,0]=4 11460 B15R1.5919 CC(C)OCC(=O)CCc1ccccc1 34a_100000212225_100012361361 [0,0,0,0,0,2|2,0,0]=4 11461 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 11a_100015324214_100000745533 [0,0,0,0,0,2|2,0,0]=4 11462 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 1626a_100015324214_100000745533 [0,0,0,0,0,2|2,0,0]=4 11463 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 240690a_100015324214_100000745533 [0,0,0,0,0,2|2,0,0]=4 11464 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 34a_100000212225_100000183539 [0,0,0,0,0,2|2,0,0]=4 11465 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 527a_100015324214_100000745533 [0,0,0,0,0,2|2,0,0]=4 11466 B15R1.5919 CC(C)OCC(=O)NNc1ccccc1 22a_100015195140_100000745533 [0,0,0,0,0,2|2,0,0]=4 11467 B15R1.5919 CC(C)OCC(=O)OCc1ccccc1 34a_100000212225_100000753625 [0,0,0,0,0,2|2,0,0]=4 11468 B15R1.5919 CC(C)SCC(=O)CCc1ccccc1 1458a_100000241585_100000765856 [0,0,0,0,0,2|2,0,0]=4 11469 B15R1.5919 CC(C)SCC(=O)CCc1ccccc1 62a_100000210206_100012361361 [0,0,0,0,0,2|2,0,0]=4 11470 B15R1.5919 CC(C)SCC(=O)CCc1ccccc1 62a_100012361361_100000210206 [0,0,0,0,0,2|2,0,0]=4 11471 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 11a_100015324214_100000241585 [0,0,0,0,0,2|2,0,0]=4 11472 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 1626a_100015324214_100000241585 [0,0,0,0,0,2|2,0,0]=4 11473 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 240690a_100015324214_100000241585 [0,0,0,0,0,2|2,0,0]=4 11474 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 527a_100015324214_100000241585 [0,0,0,0,0,2|2,0,0]=4 11475 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 62a_100000183539_100000210206 [0,0,0,0,0,2|2,0,0]=4 11476 B15R1.5919 CC(C)SCC(=O)NCc1ccccc1 62a_100000210206_100000183539 [0,0,0,0,0,2|2,0,0]=4 11477 B15R1.5919 CC(C)SCC(=O)NNc1ccccc1 22a_100015195140_100000241585 [0,0,0,0,0,2|2,0,0]=4 11478 B15R1.5919 CC(C)SCC(=O)OCc1ccccc1 62a_100000210206_100000753625 [0,0,0,0,0,2|2,0,0]=4 11479 B15R1.5919 CC(C)SCC(=O)OCc1ccccc1 62a_100000753625_100000210206 [0,0,0,0,0,2|2,0,0]=4 11480 B15R1.5919 CC(O)CCC(=O)C#Cc1ccccc1 1458a_100000736102_100012276601 [0,0,0,0,0,2|2,0,0]=4 11481 B15R1.5919 CC(O)CCC(=O)C=Cc1ccccc1 1458a_100000210462_100012276601 [0,0,0,0,0,2|2,0,0]=4 11482 B15R1.5919 CC(O)CCC(=O)CCc1ccccc1 1458a_100000185753_100012276601 [0,0,0,0,0,2|2,0,0]=4 11483 B15R1.5919 CC(O)CCC(=O)COc1ccccc1 1458a_100000186222_100012276601 [0,0,0,0,0,2|2,0,0]=4 11484 B15R1.5919 CC(O)CCC(=O)CSc1ccccc1 1458a_100000211596_100012276601 [0,0,0,0,0,2|2,0,0]=4 11485 B15R1.5919 CC(O)CCC(=O)NCc1ccccc1 1626a_100015324214_100000718519 [0,0,0,0,0,2|2,0,0]=4 11486 B15R1.5919 CC(O)CNC(=O)C#Cc1ccccc1 240690a_100000210904_100000736102 [0,0,0,0,0,2|2,0,0]=4 11487 B15R1.5919 CC(O)CNC(=O)C=Cc1ccccc1 11a_100000210904_100000210462 [0,0,0,0,0,2|2,0,0]=4 11488 B15R1.5919 CC(O)CNC(=O)CCc1ccccc1 11a_100000210904_100000185753 [0,0,0,0,0,2|2,0,0]=4 11489 B15R1.5919 CC(O)CNC(=O)CCc1ccccc1 240690a_100000210904_100000185753 [0,0,0,0,0,2|2,0,0]=4 11490 B15R1.5919 CC(O)CNC(=O)CCc1ccccc1 527a_100000210904_100000185753 [0,0,0,0,0,2|2,0,0]=4 11491 B15R1.5919 CC(O)CNC(=O)COc1ccccc1 11a_100000210904_100000186222 [0,0,0,0,0,2|2,0,0]=4 11492 B15R1.5919 CC(O)CNC(=O)COc1ccccc1 240690a_100000210904_100000186222 [0,0,0,0,0,2|2,0,0]=4 11493 B15R1.5919 CC(O)CNC(=O)COc1ccccc1 527a_100000210904_100000186222 [0,0,0,0,0,2|2,0,0]=4 11494 B15R1.5919 CC(O)CNC(=O)CSc1ccccc1 11a_100000210904_100000211596 [0,0,0,0,0,2|2,0,0]=4 11495 B15R1.5919 CC(O)CNC(=O)CSc1ccccc1 240690a_100000210904_100000211596 [0,0,0,0,0,2|2,0,0]=4 11496 B15R1.5919 CC(O)CNC(=O)CSc1ccccc1 527a_100000210904_100000211596 [0,0,0,0,0,2|2,0,0]=4 11497 B15R1.5919 CC(O)CNC(=O)NCc1ccccc1 2708a_100015324214_100000210904 [0,0,0,0,0,2|2,0,0]=4 11498 B15R1.5919 CC(O)CNC(=O)NCc1ccccc1 273464a_100000210904_100015324214 [0,0,0,0,0,2|2,0,0]=4 11499 B15R1.5919 CC(O)CNC(=O)NCc1ccccc1 273464a_100015324214_100000210904 [0,0,0,0,0,2|2,0,0]=4 11500 B15R1.5919 CC(O)CNC(=O)NCc1ccccc1 512a_100000210904_100015324214 [0,0,0,0,0,2|2,0,0]=4 11501 B15R1.5919 CC(O)CNC(=O)NCc1ccccc1 512a_100015324214_100000210904 [0,0,0,0,0,2|2,0,0]=4 11502 B15R1.5919 CC(O)CNC(=O)NNc1ccccc1 273464a_100000210904_100015195140 [0,0,0,0,0,2|2,0,0]=4 11503 B15R1.5919 CC(O)CNC(=O)NNc1ccccc1 512a_100000210904_100015195140 [0,0,0,0,0,2|2,0,0]=4 11504 B15R1.5919 CN(C)CCC(=O)NCc1ccccc1 11a_100015324214_100000689311 [0,0,0,0,0,2|2,0,0]=4 11505 B15R1.5919 CN(C)CCC(=O)NCc1ccccc1 240690a_100015324214_100000689311 [0,0,0,0,0,2|2,0,0]=4 11506 B15R1.5919 CN(C)CCC(=O)NCc1ccccc1 527a_100015324214_100000689311 [0,0,0,0,0,2|2,0,0]=4 11507 B15R1.5919 CN(C)CCC(=O)NNc1ccccc1 22a_100015195140_100000689311 [0,0,0,0,0,2|2,0,0]=4 11508 B15R1.5919 CN(C)CCC(=O)OCc1ccccc1 2230a_100102631434_100009813219 [0,0,0,0,0,2|2,0,0]=4 11509 B15R1.5919 CN(C)CCC(=O)OCc1ccccc1 269982a_100102631434_100009813219 [0,0,0,0,0,2|2,0,0]=4 11510 B15R1.5919 C[S+](C)CCC(=O)CCc1ccccc1 1458a_100009452791_100000765856 [0,0,0,0,0,2|2,0,0]=4 11511 B15R1.5919 C[S+](C)CCC(=O)NCc1ccccc1 11a_100015324214_100009452791 [0,0,0,0,0,2|2,0,0]=4 11512 B15R1.5919 C[S+](C)CCC(=O)NCc1ccccc1 1626a_100015324214_100009452791 [0,0,0,0,0,2|2,0,0]=4 11513 B15R1.5919 C[S+](C)CCC(=O)NCc1ccccc1 240690a_100015324214_100009452791 [0,0,0,0,0,2|2,0,0]=4 11514 B15R1.5919 C[S+](C)CCC(=O)NNc1ccccc1 22a_100015195140_100009452791 [0,0,0,0,0,2|2,0,0]=4