0 B17R2.1057 C#Cc1ccccc1NCC2CNC(=O)O2 34a_100011470550_100000181169 [0,0,0,0,0,0|2,0,1]=3 1 B17R2.1057 C#Cc1ccccc1NCC2COC(=O)O2 34a_100011470550_100000073702 [0,0,0,0,0,0|3,0,1]=4 2 B17R2.1057 C#Cc1ccccc1OCC2CNC(=O)O2 34a_200011470546_100000181169 [0,0,0,0,0,0|1,0,1]=2 3 B17R2.1057 C#Cc1ccccc1OCC2CNC(=O)O2 7a_200011470546_100000181169 [0,0,0,0,0,0|1,0,1]=2 4 B17R2.1057 C#Cc1ccccc1OCC2COC(=O)O2 34a_200011470546_100000073702 [0,0,0,0,0,0|2,0,1]=3 5 B17R2.1057 C#Cc1ccccc1OC[C@@H]2CCC(=O)N2 7a_200011470546_100015189358 [0,0,0,0,0,0|3,0,1]=4 6 B17R2.1057 C#Cc1ccccc1OC[C@H]2COC(=O)N2 34a_200011470546_100015307671 [0,0,0,0,0,0|3,0,1]=4 7 B17R2.1057 C#Cc1ccccc1OC[C@H]2COC(=O)N2 7a_200011470546_100015307671 [0,0,0,0,0,0|3,0,1]=4 8 B17R2.1057 C=Cc1ccccc1NCC2CNC(=O)O2 34a_100012022501_100000181169 [0,0,0,0,0,0|2,0,1]=3 9 B17R2.1057 C=Cc1ccccc1NCC2COC(=O)O2 34a_100012022501_100000073702 [0,0,0,0,0,0|3,0,1]=4 10 B17R2.1057 C=Cc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011218376 [0,0,0,0,0,0|1,1,1]=3 11 B17R2.1057 C=Cc1ccccc1SCC2CNC(=O)O2 62a_100011218376_100000181169 [0,0,0,0,0,0|1,1,1]=3 12 B17R2.1057 C=Cc1ccccc1SCC2COC(=O)O2 62a_100000073702_100011218376 [0,0,0,0,0,0|2,1,1]=4 13 B17R2.1057 C=Cc1ccccc1SCC2COC(=O)O2 62a_100011218376_100000073702 [0,0,0,0,0,0|2,1,1]=4 14 B17R2.1057 CCc1ccccc1CNC2CNC(=O)C2 207a_100000697751_100011219594 [0,0,0,0,0,0|4,0,0]=4 15 B17R2.1057 CCc1ccccc1COC2COC(=O)O2 34a_100011663872_100000032252 [0,0,0,0,0,0|4,0,0]=4 16 B17R2.1057 CCc1ccccc1NCC2CNC(=O)O2 2230a_100000212081_100000181169 [0,0,0,0,0,0|2,0,0]=2 17 B17R2.1057 CCc1ccccc1NCC2CNC(=O)O2 34a_100000212081_100000181169 [0,0,0,0,0,0|2,0,0]=2 18 B17R2.1057 CCc1ccccc1NCC2CNC(=O)O2 7a_100000212081_100000181169 [0,0,0,0,0,0|2,0,0]=2 19 B17R2.1057 CCc1ccccc1NCC2COC(=O)O2 34a_100000212081_100000073702 [0,0,0,0,0,0|3,0,0]=3 20 B17R2.1057 CCc1ccccc1NC[C@@H]2CCC(=O)N2 2230a_100000212081_100015189358 [0,0,0,0,0,0|4,0,0]=4 21 B17R2.1057 CCc1ccccc1NC[C@@H]2CCC(=O)N2 7a_100000212081_100015189358 [0,0,0,0,0,0|4,0,0]=4 22 B17R2.1057 CCc1ccccc1NC[C@H]2COC(=O)N2 2230a_100000212081_100015307671 [0,0,0,0,0,0|4,0,0]=4 23 B17R2.1057 CCc1ccccc1NC[C@H]2COC(=O)N2 34a_100000212081_100015307671 [0,0,0,0,0,0|4,0,0]=4 24 B17R2.1057 CCc1ccccc1NC[C@H]2COC(=O)N2 7a_100000212081_100015307671 [0,0,0,0,0,0|4,0,0]=4 25 B17R2.1057 CCc1ccccc1OCC2=CC(=O)OC2 34a_100000210936_100000716558 [0,0,0,0,0,0|3,0,1]=4 26 B17R2.1057 CCc1ccccc1OCC2CNC(=O)O2 34a_100000210936_100000181169 [0,0,0,0,0,0|1,0,0]=1 27 B17R2.1057 CCc1ccccc1OCC2CNC(=O)O2 7a_100000210936_100000181169 [0,0,0,0,0,0|1,0,0]=1 28 B17R2.1057 CCc1ccccc1OCC2COC(=O)O2 34a_100000210936_100000073702 [0,0,0,0,0,0|2,0,0]=2 29 B17R2.1057 CCc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000210936_100015189358 [0,0,0,0,0,0|3,0,0]=3 30 B17R2.1057 CCc1ccccc1OC[C@H]2COC(=O)N2 34a_100000210936_100015307671 [0,0,0,0,0,0|3,0,0]=3 31 B17R2.1057 CCc1ccccc1OC[C@H]2COC(=O)N2 7a_100000210936_100015307671 [0,0,0,0,0,0|3,0,0]=3 32 B17R2.1057 CCc1ccccc1OCc2n[nH]c(=O)[nH]2 7a_100000210936_100000754189 [0,0,0,0,0,0|3,0,1]=4 33 B17R2.1057 CCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011215823 [0,0,0,0,0,0|1,1,0]=2 34 B17R2.1057 CCc1ccccc1SCC2CNC(=O)O2 62a_100011215823_100000181169 [0,0,0,0,0,0|1,1,0]=2 35 B17R2.1057 CCc1ccccc1SCC2COC(=O)O2 62a_100000073702_100011215823 [0,0,0,0,0,0|2,1,0]=3 36 B17R2.1057 CCc1ccccc1SCC2COC(=O)O2 62a_100011215823_100000073702 [0,0,0,0,0,0|2,1,0]=3 37 B17R2.1057 CCc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100011215823_100015189358 [0,0,0,0,0,0|3,1,0]=4 38 B17R2.1057 CCc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100011215823 [0,0,0,0,0,0|3,1,0]=4 39 B17R2.1057 CCc1ccccc1SC[C@H]2COC(=O)N2 62a_100011215823_100015307671 [0,0,0,0,0,0|3,1,0]=4 40 B17R2.1057 CCc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100011215823 [0,0,0,0,0,0|3,1,0]=4 41 B17R2.1057 CCc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100009819861 [0,0,0,0,0,0|2,1,0]=3 42 B17R2.1057 CCc1ccncc1SCC2CNC(=O)O2 62a_100009819861_100000181169 [0,0,0,0,0,0|2,1,0]=3 43 B17R2.1057 CCc1ccncc1SCC2COC(=O)O2 62a_100000073702_100009819861 [0,0,0,0,0,0|3,1,0]=4 44 B17R2.1057 CCc1ccncc1SCC2COC(=O)O2 62a_100009819861_100000073702 [0,0,0,0,0,0|3,1,0]=4 45 B17R2.1057 CCc1cnccc1SCC2CNC(=O)O2 62a_100000181169_100025704421 [0,0,0,0,0,0|2,1,0]=3 46 B17R2.1057 CCc1cnccc1SCC2CNC(=O)O2 62a_100025704421_100000181169 [0,0,0,0,0,0|2,1,0]=3 47 B17R2.1057 CCc1cnccc1SCC2COC(=O)O2 62a_100000073702_100025704421 [0,0,0,0,0,0|3,1,0]=4 48 B17R2.1057 CCc1cnccc1SCC2COC(=O)O2 62a_100025704421_100000073702 [0,0,0,0,0,0|3,1,0]=4 49 B17R2.1057 CCc1cncnc1SCC2CNC(=O)O2 62a_100000181169_200000100055 [0,0,0,0,0,0|3,1,0]=4 50 B17R2.1057 CCc1cncnc1SCC2CNC(=O)O2 62a_200000100055_100000181169 [0,0,0,0,0,0|3,1,0]=4 51 B17R2.1057 CCc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100009877225 [0,0,0,0,0,0|2,1,0]=3 52 B17R2.1057 CCc1ncccc1SCC2CNC(=O)O2 62a_100009877225_100000181169 [0,0,0,0,0,0|2,1,0]=3 53 B17R2.1057 CCc1ncccc1SCC2COC(=O)O2 62a_100000073702_100009877225 [0,0,0,0,0,0|3,1,0]=4 54 B17R2.1057 CCc1ncccc1SCC2COC(=O)O2 62a_100009877225_100000073702 [0,0,0,0,0,0|3,1,0]=4 55 B17R2.1057 CCc1nccnc1SCC2CNC(=O)O2 62a_100000181169_100011995844 [0,0,0,0,0,0|3,1,0]=4 56 B17R2.1057 CCc1nccnc1SCC2CNC(=O)O2 62a_100011995844_100000181169 [0,0,0,0,0,0|3,1,0]=4 57 B17R2.1057 CCc1ncncc1SCC2CNC(=O)O2 62a_100000181169_100009816992 [0,0,0,0,0,0|3,1,0]=4 58 B17R2.1057 CCc1ncncc1SCC2CNC(=O)O2 62a_100009816992_100000181169 [0,0,0,0,0,0|3,1,0]=4 59 B17R2.1057 CNc1ccccc1OCC2=CC(=O)OC2 34a_100000033821_100000716558 [0,0,0,0,0,0|3,0,1]=4 60 B17R2.1057 CNc1ccccc1OCC2CNC(=O)O2 34a_100000033821_100000181169 [0,0,0,0,0,0|1,0,0]=1 61 B17R2.1057 CNc1ccccc1OCC2COC(=O)O2 34a_100000033821_100000073702 [0,0,0,0,0,0|2,0,0]=2 62 B17R2.1057 CNc1ccccc1OC[C@H]2COC(=O)N2 34a_100000033821_100015307671 [0,0,0,0,0,0|3,0,0]=3 63 B17R2.1057 CNc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100020606079 [0,0,0,0,0,0|1,1,0]=2 64 B17R2.1057 CNc1ccccc1SCC2CNC(=O)O2 62a_100020606079_100000181169 [0,0,0,0,0,0|1,1,0]=2 65 B17R2.1057 CNc1ccccc1SCC2COC(=O)O2 62a_100000073702_100020606079 [0,0,0,0,0,0|2,1,0]=3 66 B17R2.1057 CNc1ccccc1SCC2COC(=O)O2 62a_100020606079_100000073702 [0,0,0,0,0,0|2,1,0]=3 67 B17R2.1057 CNc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100020606079 [0,0,0,0,0,0|3,1,0]=4 68 B17R2.1057 CNc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100020606079_100015189358 [0,0,0,0,0,0|3,1,0]=4 69 B17R2.1057 CNc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100020606079 [0,0,0,0,0,0|3,1,0]=4 70 B17R2.1057 CNc1ccccc1SC[C@H]2COC(=O)N2 62a_100020606079_100015307671 [0,0,0,0,0,0|3,1,0]=4 71 B17R2.1057 CNc1cccnc1SCC2CNC(=O)O2 62a_100000181169_200011806188 [0,0,0,0,0,0|2,1,0]=3 72 B17R2.1057 CNc1cccnc1SCC2COC(=O)O2 62a_100000073702_200011806188 [0,0,0,0,0,0|3,1,0]=4 73 B17R2.1057 CNc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100010069531 [0,0,0,0,0,0|2,1,0]=3 74 B17R2.1057 CNc1ccncc1SCC2CNC(=O)O2 62a_100010069531_100000181169 [0,0,0,0,0,0|2,1,0]=3 75 B17R2.1057 CNc1ccncc1SCC2COC(=O)O2 62a_100000073702_100010069531 [0,0,0,0,0,0|3,1,0]=4 76 B17R2.1057 CNc1ccncc1SCC2COC(=O)O2 62a_100010069531_100000073702 [0,0,0,0,0,0|3,1,0]=4 77 B17R2.1057 CNc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100000700899 [0,0,0,0,0,0|2,1,0]=3 78 B17R2.1057 CNc1ncccc1SCC2CNC(=O)O2 62a_100000700899_100000181169 [0,0,0,0,0,0|2,1,0]=3 79 B17R2.1057 CNc1ncccc1SCC2COC(=O)O2 62a_100000073702_100000700899 [0,0,0,0,0,0|3,1,0]=4 80 B17R2.1057 CNc1ncccc1SCC2COC(=O)O2 62a_100000700899_100000073702 [0,0,0,0,0,0|3,1,0]=4 81 B17R2.1057 CNc1nccnc1SCC2CNC(=O)O2 62a_100000181169_100011529439 [0,0,0,0,0,0|3,1,0]=4 82 B17R2.1057 CNc1ncncc1SCC2CNC(=O)O2 62a_100000181169_200012180720 [0,0,0,0,0,0|3,1,0]=4 83 B17R2.1057 CNc1ncncc1SCC2CNC(=O)O2 62a_200012180720_100000181169 [0,0,0,0,0,0|3,1,0]=4 84 B17R2.1057 COc1ccccc1CCN2CNC(=O)C2 2230a_200000708111_100011713687 [0,0,0,0,0,0|3,0,0]=3 85 B17R2.1057 COc1ccccc1CNC2CNC(=O)C2 207a_100000697751_100000169842 [0,0,0,0,0,0|3,0,0]=3 86 B17R2.1057 COc1ccccc1CNC2CNC(=O)C2 2230a_100000697751_100000210004 [0,0,0,0,0,0|3,0,0]=3 87 B17R2.1057 COc1ccccc1CNC2COC(=O)O2 34a_100000188900_100000032252 [0,0,0,0,0,0|3,0,0]=3 88 B17R2.1057 COc1ccccc1COC2CCC(=O)C2 34a_100012614533_100000210004 [0,0,0,0,0,0|4,0,0]=4 89 B17R2.1057 COc1ccccc1COC2CNC(=O)C2 34a_100000690082_100000210004 [0,0,0,0,0,0|3,0,0]=3 90 B17R2.1057 COc1ccccc1COC2COC(=O)O2 34a_100000211301_100000032252 [0,0,0,0,0,0|3,0,0]=3 91 B17R2.1057 COc1ccccc1CSC2COC(=O)O2 62a_100000210004_100000032252 [0,0,0,0,0,0|3,0,0]=3 92 B17R2.1057 COc1ccccc1NCC2=CC(=O)OC2 34a_100000210025_100000716558 [0,0,0,0,0,0|3,0,1]=4 93 B17R2.1057 COc1ccccc1NCC2CNC(=O)O2 34a_100000210025_100000181169 [0,0,0,0,0,0|1,0,0]=1 94 B17R2.1057 COc1ccccc1NCC2COC(=O)O2 34a_100000210025_100000073702 [0,0,0,0,0,0|2,0,0]=2 95 B17R2.1057 COc1ccccc1NC[C@H]2COC(=O)N2 34a_100000210025_100015307671 [0,0,0,0,0,0|3,0,0]=3 96 B17R2.1057 COc1ccccc1OCC2=CC(=O)OC2 34a_100000210385_100000716558 [0,0,0,0,0,0|2,0,1]=3 97 B17R2.1057 COc1ccccc1OCC2CCN(C2)C 34a_100000210385_200000690779 [0,0,0,0,0,0|4,0,0]=4 98 B17R2.1057 COc1ccccc1OCC2CNC(=O)O2 34a_100000210385_100000181169 [0,0,0,0,0,0|0,0,0]=0 99 B17R2.1057 COc1ccccc1OCC2COC(=O)O2 34a_100000210385_100000073702 [0,0,0,0,0,0|1,0,0]=1 100 B17R2.1057 COc1ccccc1OC[C@H]2COC(=O)N2 34a_100000210385_100015307671 [0,0,0,0,0,0|2,0,0]=2 101 B17R2.1057 COc1ccccc1SCC2=CC(=O)OC2 62a_100000210334_100000716558 [0,0,0,0,0,0|2,1,1]=4 102 B17R2.1057 COc1ccccc1SCC2=CC(=O)OC2 62a_100000716558_100000210334 [0,0,0,0,0,0|2,1,1]=4 103 B17R2.1057 COc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000210334 [0,0,0,0,0,0|0,1,0]=1 104 B17R2.1057 COc1ccccc1SCC2CNC(=O)O2 62a_100000210334_100000181169 [0,0,0,0,0,0|0,1,0]=1 105 B17R2.1057 COc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000210334 [0,0,0,0,0,0|1,1,0]=2 106 B17R2.1057 COc1ccccc1SCC2COC(=O)O2 62a_100000210334_100000073702 [0,0,0,0,0,0|1,1,0]=2 107 B17R2.1057 COc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100000210334_100015189358 [0,0,0,0,0,0|2,1,0]=3 108 B17R2.1057 COc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100000210334 [0,0,0,0,0,0|2,1,0]=3 109 B17R2.1057 COc1ccccc1SC[C@H]2COC(=O)N2 62a_100000210334_100015307671 [0,0,0,0,0,0|2,1,0]=3 110 B17R2.1057 COc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100000210334 [0,0,0,0,0,0|2,1,0]=3 111 B17R2.1057 COc1ccccc1SCc2n[nH]c(=O)[nH]2 62a_100000210334_100000754189 [0,0,0,0,0,0|2,1,1]=4 112 B17R2.1057 COc1cccnc1CNC2CNC(=O)C2 207a_100000697751_100011912573 [0,0,0,0,0,0|4,0,0]=4 113 B17R2.1057 COc1cccnc1COC2COC(=O)O2 34a_100011998681_100000032252 [0,0,0,0,0,0|4,0,0]=4 114 B17R2.1057 COc1cccnc1OCC2=CC(=O)OC2 34a_100025773188_100000716558 [0,0,0,0,0,0|3,0,1]=4 115 B17R2.1057 COc1cccnc1OCC2CNC(=O)O2 34a_100025773188_100000181169 [0,0,0,0,0,0|1,0,0]=1 116 B17R2.1057 COc1cccnc1OCC2COC(=O)O2 34a_100025773188_100000073702 [0,0,0,0,0,0|2,0,0]=2 117 B17R2.1057 COc1cccnc1OC[C@H]2COC(=O)N2 34a_100025773188_100015307671 [0,0,0,0,0,0|3,0,0]=3 118 B17R2.1057 COc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100000690851 [0,0,0,0,0,0|1,1,0]=2 119 B17R2.1057 COc1cccnc1SCC2CNC(=O)O2 62a_100000767102_100000181169 [0,0,0,0,0,0|1,1,0]=2 120 B17R2.1057 COc1cccnc1SCC2COC(=O)O2 62a_100000073702_100000690851 [0,0,0,0,0,0|2,1,0]=3 121 B17R2.1057 COc1cccnc1SCC2COC(=O)O2 62a_100000767102_100000073702 [0,0,0,0,0,0|2,1,0]=3 122 B17R2.1057 COc1cccnc1SC[C@@H]2CCC(=O)N2 62a_100000767102_100015189358 [0,0,0,0,0,0|3,1,0]=4 123 B17R2.1057 COc1cccnc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100000690851 [0,0,0,0,0,0|3,1,0]=4 124 B17R2.1057 COc1cccnc1SC[C@H]2COC(=O)N2 62a_100000767102_100015307671 [0,0,0,0,0,0|3,1,0]=4 125 B17R2.1057 COc1cccnc1SC[C@H]2COC(=O)N2 62a_100015307671_100000690851 [0,0,0,0,0,0|3,1,0]=4 126 B17R2.1057 COc1ccncc1CNC2CNC(=O)C2 207a_100000697751_200011997045 [0,0,0,0,0,0|4,0,0]=4 127 B17R2.1057 COc1ccncc1OCC2=CC(=O)OC2 34a_100000101186_100000716558 [0,0,0,0,0,0|3,0,1]=4 128 B17R2.1057 COc1ccncc1OCC2CNC(=O)O2 34a_100000101186_100000181169 [0,0,0,0,0,0|1,0,0]=1 129 B17R2.1057 COc1ccncc1OCC2COC(=O)O2 34a_100000101186_100000073702 [0,0,0,0,0,0|2,0,0]=2 130 B17R2.1057 COc1ccncc1OC[C@H]2COC(=O)N2 34a_100000101186_100015307671 [0,0,0,0,0,0|3,0,0]=3 131 B17R2.1057 COc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100011997281 [0,0,0,0,0,0|1,1,0]=2 132 B17R2.1057 COc1ccncc1SCC2CNC(=O)O2 62a_100011997281_100000181169 [0,0,0,0,0,0|1,1,0]=2 133 B17R2.1057 COc1ccncc1SCC2COC(=O)O2 62a_100000073702_100011997281 [0,0,0,0,0,0|2,1,0]=3 134 B17R2.1057 COc1ccncc1SCC2COC(=O)O2 62a_100011997281_100000073702 [0,0,0,0,0,0|2,1,0]=3 135 B17R2.1057 COc1ccncc1SC[C@@H]2CCC(=O)N2 62a_100011997281_100015189358 [0,0,0,0,0,0|3,1,0]=4 136 B17R2.1057 COc1ccncc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100011997281 [0,0,0,0,0,0|3,1,0]=4 137 B17R2.1057 COc1ccncc1SC[C@H]2COC(=O)N2 62a_100011997281_100015307671 [0,0,0,0,0,0|3,1,0]=4 138 B17R2.1057 COc1ccncc1SC[C@H]2COC(=O)N2 62a_100015307671_100011997281 [0,0,0,0,0,0|3,1,0]=4 139 B17R2.1057 COc1cnccc1CNC2CNC(=O)C2 207a_100000697751_100011361505 [0,0,0,0,0,0|4,0,0]=4 140 B17R2.1057 COc1cnccc1CNC2CNC(=O)C2 2230a_100000697751_100020635607 [0,0,0,0,0,0|4,0,0]=4 141 B17R2.1057 COc1cnccc1CSC2COC(=O)O2 62a_100020635607_100000032252 [0,0,0,0,0,0|4,0,0]=4 142 B17R2.1057 COc1cnccc1SCC2CNC(=O)O2 62a_100000181169_100016988167 [0,0,0,0,0,0|1,1,0]=2 143 B17R2.1057 COc1cnccc1SCC2CNC(=O)O2 62a_100016988167_100000181169 [0,0,0,0,0,0|1,1,0]=2 144 B17R2.1057 COc1cnccc1SCC2COC(=O)O2 62a_100000073702_100016988167 [0,0,0,0,0,0|2,1,0]=3 145 B17R2.1057 COc1cnccc1SCC2COC(=O)O2 62a_100016988167_100000073702 [0,0,0,0,0,0|2,1,0]=3 146 B17R2.1057 COc1cnccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100016988167 [0,0,0,0,0,0|3,1,0]=4 147 B17R2.1057 COc1cnccc1SC[C@@H]2CCC(=O)N2 62a_100016988167_100015189358 [0,0,0,0,0,0|3,1,0]=4 148 B17R2.1057 COc1cnccc1SC[C@H]2COC(=O)N2 62a_100015307671_100016988167 [0,0,0,0,0,0|3,1,0]=4 149 B17R2.1057 COc1cnccc1SC[C@H]2COC(=O)N2 62a_100016988167_100015307671 [0,0,0,0,0,0|3,1,0]=4 150 B17R2.1057 COc1cncnc1NCC2CNC(=O)C2 27a_100016993742_100012001275 [0,0,0,0,0,0|4,0,0]=4 151 B17R2.1057 COc1cncnc1SCC2CNC(=O)O2 62a_100000181169_100012001275 [0,0,0,0,0,0|2,1,0]=3 152 B17R2.1057 COc1cncnc1SCC2CNC(=O)O2 62a_100012001275_100000181169 [0,0,0,0,0,0|2,1,0]=3 153 B17R2.1057 COc1cncnc1SCC2COC(=O)O2 62a_100000073702_100012001275 [0,0,0,0,0,0|3,1,0]=4 154 B17R2.1057 COc1cncnc1SCC2COC(=O)O2 62a_100012001275_100000073702 [0,0,0,0,0,0|3,1,0]=4 155 B17R2.1057 COc1ncccc1CNC2CNC(=O)C2 207a_100000697751_100011290804 [0,0,0,0,0,0|4,0,0]=4 156 B17R2.1057 COc1ncccc1CNC2CNC(=O)C2 2230a_100000697751_100020631285 [0,0,0,0,0,0|4,0,0]=4 157 B17R2.1057 COc1ncccc1COC2CNC(=O)C2 34a_100000690082_100020631285 [0,0,0,0,0,0|4,0,0]=4 158 B17R2.1057 COc1ncccc1COC2COC(=O)O2 34a_100000717863_100000032252 [0,0,0,0,0,0|4,0,0]=4 159 B17R2.1057 COc1ncccc1CSC2COC(=O)O2 62a_100020631285_100000032252 [0,0,0,0,0,0|4,0,0]=4 160 B17R2.1057 COc1ncccc1OCC2=CC(=O)OC2 34a_100000698397_100000716558 [0,0,0,0,0,0|3,0,1]=4 161 B17R2.1057 COc1ncccc1OCC2CNC(=O)O2 34a_100000698397_100000181169 [0,0,0,0,0,0|1,0,0]=1 162 B17R2.1057 COc1ncccc1OCC2CNC(=O)O2 7a_100000698397_100000181169 [0,0,0,0,0,0|1,0,0]=1 163 B17R2.1057 COc1ncccc1OCC2COC(=O)O2 34a_100000698397_100000073702 [0,0,0,0,0,0|2,0,0]=2 164 B17R2.1057 COc1ncccc1OC[C@@H]2CCC(=O)N2 7a_100000698397_100015189358 [0,0,0,0,0,0|3,0,0]=3 165 B17R2.1057 COc1ncccc1OC[C@H]2COC(=O)N2 34a_100000698397_100015307671 [0,0,0,0,0,0|3,0,0]=3 166 B17R2.1057 COc1ncccc1OC[C@H]2COC(=O)N2 7a_100000698397_100015307671 [0,0,0,0,0,0|3,0,0]=3 167 B17R2.1057 COc1ncccc1OCc2n[nH]c(=O)[nH]2 7a_100000698397_100000754189 [0,0,0,0,0,0|3,0,1]=4 168 B17R2.1057 COc1ncccc1SCC2CNC(=O)O2 62a_100000047025_100000181169 [0,0,0,0,0,0|1,1,0]=2 169 B17R2.1057 COc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100000047025 [0,0,0,0,0,0|1,1,0]=2 170 B17R2.1057 COc1ncccc1SCC2COC(=O)O2 62a_100000047025_100000073702 [0,0,0,0,0,0|2,1,0]=3 171 B17R2.1057 COc1ncccc1SCC2COC(=O)O2 62a_100000073702_100000047025 [0,0,0,0,0,0|2,1,0]=3 172 B17R2.1057 COc1ncccc1SC[C@@H]2CCC(=O)N2 62a_100000047025_100015189358 [0,0,0,0,0,0|3,1,0]=4 173 B17R2.1057 COc1ncccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100000047025 [0,0,0,0,0,0|3,1,0]=4 174 B17R2.1057 COc1ncccc1SC[C@H]2COC(=O)N2 62a_100000047025_100015307671 [0,0,0,0,0,0|3,1,0]=4 175 B17R2.1057 COc1ncccc1SC[C@H]2COC(=O)N2 62a_100015307671_100000047025 [0,0,0,0,0,0|3,1,0]=4 176 B17R2.1057 COc1nccnc1NCC2CNC(=O)C2 27a_100016993742_100009858322 [0,0,0,0,0,0|4,0,0]=4 177 B17R2.1057 COc1nccnc1SCC2CNC(=O)O2 62a_100000181169_100000749998 [0,0,0,0,0,0|2,1,0]=3 178 B17R2.1057 COc1nccnc1SCC2CNC(=O)O2 62a_100009858322_100000181169 [0,0,0,0,0,0|2,1,0]=3 179 B17R2.1057 COc1nccnc1SCC2COC(=O)O2 62a_100000073702_100000749998 [0,0,0,0,0,0|3,1,0]=4 180 B17R2.1057 COc1nccnc1SCC2COC(=O)O2 62a_100009858322_100000073702 [0,0,0,0,0,0|3,1,0]=4 181 B17R2.1057 COc1ncncc1SCC2CNC(=O)O2 62a_100000181169_100000719902 [0,0,0,0,0,0|2,1,0]=3 182 B17R2.1057 COc1ncncc1SCC2CNC(=O)O2 62a_100000719902_100000181169 [0,0,0,0,0,0|2,1,0]=3 183 B17R2.1057 COc1ncncc1SCC2COC(=O)O2 62a_100000073702_100000719902 [0,0,0,0,0,0|3,1,0]=4 184 B17R2.1057 COc1ncncc1SCC2COC(=O)O2 62a_100000719902_100000073702 [0,0,0,0,0,0|3,1,0]=4 185 B17R2.1057 CSc1ccccc1CNC2CNC(=O)C2 207a_100000697751_100011217347 [0,0,0,0,0,0|3,1,0]=4 186 B17R2.1057 CSc1ccccc1CNC2CNC(=O)C2 2230a_100000697751_100000699184 [0,0,0,0,0,0|3,1,0]=4 187 B17R2.1057 CSc1ccccc1CNC2COC(=O)O2 34a_102495365025_100000032252 [0,0,0,0,0,0|3,1,0]=4 188 B17R2.1057 CSc1ccccc1COC2CNC(=O)C2 34a_100000690082_100000699184 [0,0,0,0,0,0|3,1,0]=4 189 B17R2.1057 CSc1ccccc1COC2COC(=O)O2 34a_100000699167_100000032252 [0,0,0,0,0,0|3,1,0]=4 190 B17R2.1057 CSc1ccccc1CSC2COC(=O)O2 62a_100000699184_100000032252 [0,0,0,0,0,0|3,1,0]=4 191 B17R2.1057 CSc1ccccc1NCC2CNC(=O)O2 34a_100000211160_100000181169 [0,0,0,0,0,0|1,1,0]=2 192 B17R2.1057 CSc1ccccc1NCC2COC(=O)O2 34a_100000211160_100000073702 [0,0,0,0,0,0|2,1,0]=3 193 B17R2.1057 CSc1ccccc1NC[C@H]2COC(=O)N2 34a_100000211160_100015307671 [0,0,0,0,0,0|3,1,0]=4 194 B17R2.1057 CSc1ccccc1OCC2=CC(=O)OC2 34a_100011216402_100000716558 [0,0,0,0,0,0|2,1,1]=4 195 B17R2.1057 CSc1ccccc1OCC2CNC(=O)O2 34a_100011216402_100000181169 [0,0,0,0,0,0|0,1,0]=1 196 B17R2.1057 CSc1ccccc1OCC2COC(=O)O2 34a_100011216402_100000073702 [0,0,0,0,0,0|1,1,0]=2 197 B17R2.1057 CSc1ccccc1OC[C@H]2COC(=O)N2 34a_100011216402_100015307671 [0,0,0,0,0,0|2,1,0]=3 198 B17R2.1057 CSc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011217816 [0,0,0,0,0,0|0,2,0]=2 199 B17R2.1057 CSc1ccccc1SCC2CNC(=O)O2 62a_100011217816_100000181169 [0,0,0,0,0,0|0,2,0]=2 200 B17R2.1057 CSc1ccccc1SCC2COC(=O)O2 62a_100000073702_100011217816 [0,0,0,0,0,0|1,2,0]=3 201 B17R2.1057 CSc1ccccc1SCC2COC(=O)O2 62a_100011217816_100000073702 [0,0,0,0,0,0|1,2,0]=3 202 B17R2.1057 CSc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100011217816_100015189358 [0,0,0,0,0,0|2,2,0]=4 203 B17R2.1057 CSc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100011217816 [0,0,0,0,0,0|2,2,0]=4 204 B17R2.1057 CSc1ccccc1SC[C@H]2COC(=O)N2 62a_100011217816_100015307671 [0,0,0,0,0,0|2,2,0]=4 205 B17R2.1057 CSc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100011217816 [0,0,0,0,0,0|2,2,0]=4 206 B17R2.1057 CSc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100011465278 [0,0,0,0,0,0|1,2,0]=3 207 B17R2.1057 CSc1ncccc1SCC2CNC(=O)O2 62a_100011465278_100000181169 [0,0,0,0,0,0|1,2,0]=3 208 B17R2.1057 CSc1ncccc1SCC2COC(=O)O2 62a_100000073702_100011465278 [0,0,0,0,0,0|2,2,0]=4 209 B17R2.1057 CSc1ncccc1SCC2COC(=O)O2 62a_100011465278_100000073702 [0,0,0,0,0,0|2,2,0]=4 210 B17R2.1057 N#Cc1ccccc1NCC2CNC(=O)O2 34a_100000211148_100000181169 [0,0,0,0,0,0|3,0,0]=3 211 B17R2.1057 N#Cc1ccccc1NCC2COC(=O)O2 34a_100000211148_100000073702 [0,0,0,0,0,0|4,0,0]=4 212 B17R2.1057 N#Cc1ccccc1OCC2CNC(=O)O2 34a_100000211048_100000181169 [0,0,0,0,0,0|2,0,0]=2 213 B17R2.1057 N#Cc1ccccc1OCC2CNC(=O)O2 7a_100000211048_100000181169 [0,0,0,0,0,0|2,0,0]=2 214 B17R2.1057 N#Cc1ccccc1OCC2COC(=O)O2 34a_100000211048_100000073702 [0,0,0,0,0,0|3,0,0]=3 215 B17R2.1057 N#Cc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000211048_100015189358 [0,0,0,0,0,0|4,0,0]=4 216 B17R2.1057 N#Cc1ccccc1OC[C@H]2COC(=O)N2 34a_100000211048_100015307671 [0,0,0,0,0,0|4,0,0]=4 217 B17R2.1057 N#Cc1ccccc1OC[C@H]2COC(=O)N2 7a_100000211048_100015307671 [0,0,0,0,0,0|4,0,0]=4 218 B17R2.1057 N#Cc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000188569 [0,0,0,0,0,0|2,1,0]=3 219 B17R2.1057 N#Cc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000188569 [0,0,0,0,0,0|3,1,0]=4 220 B17R2.1057 N#Cc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100000211984 [0,0,0,0,0,0|3,1,0]=4 221 B17R2.1057 N#Cc1ccncc1OCC2CNC(=O)O2 7a_100012181322_100000181169 [0,0,0,0,0,0|3,0,0]=3 222 B17R2.1057 N#Cc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100000684818 [0,0,0,0,0,0|3,1,0]=4 223 B17R2.1057 N#Cc1cnccc1SCC2CNC(=O)O2 62a_100000181169_100000687039 [0,0,0,0,0,0|3,1,0]=4 224 B17R2.1057 N#Cc1ncccc1OCC2CNC(=O)O2 34a_100000722750_100000181169 [0,0,0,0,0,0|3,0,0]=3 225 B17R2.1057 N#Cc1ncccc1OCC2CNC(=O)O2 7a_100000722750_100000181169 [0,0,0,0,0,0|3,0,0]=3 226 B17R2.1057 N#Cc1ncccc1OCC2COC(=O)O2 34a_100000722750_100000073702 [0,0,0,0,0,0|4,0,0]=4 227 B17R2.1057 N#Cc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100000685805 [0,0,0,0,0,0|3,1,0]=4 228 B17R2.1057 NCc1ccccc1OCC2CNC(=O)O2 34a_100000185550_100000181169 [0,0,0,0,0,0|2,0,0]=2 229 B17R2.1057 NCc1ccccc1OCC2COC(=O)O2 34a_100000185550_100000073702 [0,0,0,0,0,0|3,0,0]=3 230 B17R2.1057 NCc1ccccc1OC[C@H]2COC(=O)N2 34a_100000185550_100015307671 [0,0,0,0,0,0|4,0,0]=4 231 B17R2.1057 NCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000689332 [0,0,0,0,0,0|2,1,0]=3 232 B17R2.1057 NCc1ccccc1SCC2CNC(=O)O2 62a_100000689332_100000181169 [0,0,0,0,0,0|2,1,0]=3 233 B17R2.1057 NCc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000689332 [0,0,0,0,0,0|3,1,0]=4 234 B17R2.1057 NCc1ccccc1SCC2COC(=O)O2 62a_100000689332_100000073702 [0,0,0,0,0,0|3,1,0]=4 235 B17R2.1057 NCc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100015189234 [0,0,0,0,0,0|3,1,0]=4 236 B17R2.1057 NCc1cccnc1SCC2CNC(=O)O2 62a_100015189234_100000181169 [0,0,0,0,0,0|3,1,0]=4 237 B17R2.1057 NCc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100020640021 [0,0,0,0,0,0|3,1,0]=4 238 B17R2.1057 NCc1ccncc1SCC2CNC(=O)O2 62a_100020640021_100000181169 [0,0,0,0,0,0|3,1,0]=4 239 B17R2.1057 NCc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100020591323 [0,0,0,0,0,0|3,1,0]=4 240 B17R2.1057 NCc1ncccc1SCC2CNC(=O)O2 62a_100020591323_100000181169 [0,0,0,0,0,0|3,1,0]=4 241 B17R2.1057 NNc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000241748 [0,0,0,0,0,0|2,1,0]=3 242 B17R2.1057 NNc1ccccc1SCC2CNC(=O)O2 62a_100000241748_100000181169 [0,0,0,0,0,0|2,1,0]=3 243 B17R2.1057 NNc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000241748 [0,0,0,0,0,0|3,1,0]=4 244 B17R2.1057 NNc1ccccc1SCC2COC(=O)O2 62a_100000241748_100000073702 [0,0,0,0,0,0|3,1,0]=4 245 B17R2.1057 NNc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100013404636 [0,0,0,0,0,0|3,1,0]=4 246 B17R2.1057 NNc1ccncc1SCC2CNC(=O)O2 62a_100013404636_100000181169 [0,0,0,0,0,0|3,1,0]=4 247 B17R2.1057 NNc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100011464834 [0,0,0,0,0,0|3,1,0]=4 248 B17R2.1057 NNc1ncccc1SCC2CNC(=O)O2 62a_100011464834_100000181169 [0,0,0,0,0,0|3,1,0]=4 249 B17R2.1057 O=C1NCC(O1)CNc2ccccc2CO 34a_100000212039_100000181169 [0,0,0,0,0,0|3,0,0]=3 250 B17R2.1057 O=C1NCC(O1)COc2ccccc2CO 34a_100011216872_100000181169 [0,0,0,0,0,0|2,0,0]=2 251 B17R2.1057 O=C1NCC(O1)COc2cccnc2CBr 34a_200020655725_100000181169 [0,0,0,0,0,0|3,0,0]=3 252 B17R2.1057 O=C1NCC(O1)COc2cccnc2CBr 7a_200020655725_100000181169 [0,0,0,0,0,0|3,0,0]=3 253 B17R2.1057 O=C1NCC(O1)COc2cccnc2CO 34a_100000731849_100000181169 [0,0,0,0,0,0|3,0,0]=3 254 B17R2.1057 O=C1NCC(O1)COc2cnccc2CO 34a_100000078615_100000181169 [0,0,0,0,0,0|3,0,0]=3 255 B17R2.1057 O=C1NCC(O1)CSc2ccccc2CO 62a_100000181169_100000187465 [0,0,0,0,0,0|2,1,0]=3 256 B17R2.1057 O=C1NCC(O1)CSc2ccccc2CO 62a_100000187465_100000181169 [0,0,0,0,0,0|2,1,0]=3 257 B17R2.1057 O=C1NCC(O1)CSc2cccnc2CO 62a_100000181169_100011996772 [0,0,0,0,0,0|3,1,0]=4 258 B17R2.1057 O=C1NCC(O1)CSc2cccnc2CO 62a_100011996772_100000181169 [0,0,0,0,0,0|3,1,0]=4 259 B17R2.1057 O=C1NCC(O1)CSc2ccncc2CO 62a_100000117392_100000181169 [0,0,0,0,0,0|3,1,0]=4 260 B17R2.1057 O=C1NCC(O1)CSc2ccncc2CO 62a_100000181169_100000117392 [0,0,0,0,0,0|3,1,0]=4 261 B17R2.1057 O=C1NCC(O1)CSc2cnccc2CO 62a_100000181169_100009873359 [0,0,0,0,0,0|3,1,0]=4 262 B17R2.1057 O=C1NCC(O1)CSc2cnccc2CO 62a_100009873359_100000181169 [0,0,0,0,0,0|3,1,0]=4 263 B17R2.1057 O=C1NCC(O1)CSc2ncccc2CO 62a_100000181169_100000748726 [0,0,0,0,0,0|3,1,0]=4 264 B17R2.1057 O=C1NCC(O1)CSc2ncccc2CO 62a_100000748726_100000181169 [0,0,0,0,0,0|3,1,0]=4 265 B17R2.1057 O=C1N[C@H](CO1)COc2ccccc2CO 34a_100011216872_100015307671 [0,0,0,0,0,0|4,0,0]=4 266 B17R2.1057 O=C1OCC(O1)CNc2ccccc2CO 34a_100000212039_100000073702 [0,0,0,0,0,0|4,0,0]=4 267 B17R2.1057 O=C1OCC(O1)COc2ccccc2CO 34a_100011216872_100000073702 [0,0,0,0,0,0|3,0,0]=3 268 B17R2.1057 O=C1OCC(O1)COc2cccnc2CBr 34a_200020655725_100000073702 [0,0,0,0,0,0|4,0,0]=4 269 B17R2.1057 O=C1OCC(O1)COc2cccnc2CO 34a_100000731849_100000073702 [0,0,0,0,0,0|4,0,0]=4 270 B17R2.1057 O=C1OCC(O1)COc2cnccc2CO 34a_100000078615_100000073702 [0,0,0,0,0,0|4,0,0]=4 271 B17R2.1057 O=C1OCC(O1)CSc2ccccc2CO 62a_100000073702_100000187465 [0,0,0,0,0,0|3,1,0]=4 272 B17R2.1057 O=C1OCC(O1)CSc2ccccc2CO 62a_100000187465_100000073702 [0,0,0,0,0,0|3,1,0]=4 273 B17R2.1057 O=Cc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000210073 [0,0,0,0,0,0|2,1,0]=3 274 B17R2.1057 O=Cc1ccccc1SCC2CNC(=O)O2 62a_100000210073_100000181169 [0,0,0,0,0,0|2,1,0]=3 275 B17R2.1057 O=Cc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000210073 [0,0,0,0,0,0|3,1,0]=4 276 B17R2.1057 O=Cc1ccccc1SCC2COC(=O)O2 62a_100000210073_100000073702 [0,0,0,0,0,0|3,1,0]=4 277 B17R2.1057 O=Cc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100009816751 [0,0,0,0,0,0|3,1,0]=4 278 B17R2.1057 O=Cc1cccnc1SCC2CNC(=O)O2 62a_100009816751_100000181169 [0,0,0,0,0,0|3,1,0]=4 279 B17R2.1057 O=Cc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100011934409 [0,0,0,0,0,0|3,1,0]=4 280 B17R2.1057 O=Cc1ccncc1SCC2CNC(=O)O2 62a_100011934409_100000181169 [0,0,0,0,0,0|3,1,0]=4 281 B17R2.1057 O=Cc1cnccc1SCC2CNC(=O)O2 62a_100000050567_100000181169 [0,0,0,0,0,0|3,1,0]=4 282 B17R2.1057 O=Cc1cnccc1SCC2CNC(=O)O2 62a_100000181169_100000050567 [0,0,0,0,0,0|3,1,0]=4 283 B17R2.1057 O=Cc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100011934733 [0,0,0,0,0,0|3,1,0]=4 284 B17R2.1057 O=Cc1ncccc1SCC2CNC(=O)O2 62a_100011934733_100000181169 [0,0,0,0,0,0|3,1,0]=4 285 B16R2.1480 CCc1ccccc1OCC2CCCO2 7a_100000210936_100000203698 [1,0,0,0,0,0|2,0,1]=4 286 B16R2.1480 CNc1ccccc1OCC2CCCO2 34a_200011193920_200000210301 [1,0,0,0,0,0|2,0,1]=4 287 B16R2.1480 COc1ccccc1OCC2CCCC2 34a_100000210385_100000740388 [1,0,0,0,0,0|2,0,1]=4 288 B16R2.1480 COc1ccccc1OCC2CCOC2 34a_100000210385_100011261433 [1,0,0,0,0,0|2,0,1]=4 289 B16R2.1480 COc1ccccc1OCC2OCCO2 34a_100000210385_100000755774 [1,0,0,0,0,0|2,0,1]=4 290 B16R2.1480 COc1ccccc1OCc2c[nH]cn2 34a_100000210385_100000707719 [1,0,0,0,0,0|1,0,2]=4 291 B16R2.1480 COc1ccccc1OCc2ncco2 34a_100000210385_103436540062 [1,0,0,0,0,0|2,0,1]=4 292 B16R2.1480 COc1ccccc1SCC2CCCO2 62a_100000203698_100000210334 [1,0,0,0,0,0|1,1,1]=4 293 B16R2.1480 COc1ccccc1SCC2CCCO2 62a_100000210334_100000203698 [1,0,0,0,0,0|1,1,1]=4 294 B16R2.1480 COc1ncccc1OCC2CCCO2 7a_100000698397_100000203698 [1,0,0,0,0,0|2,0,1]=4 295 B16R2.1480 [13CH3]Nc1ccccc1OCC2CCCO2 34a_200011193920_200025704644 [1,0,0,0,0,0|2,0,1]=4 296 B16R2.11414 C[n+]1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000212160 [1,0,0,0,0,0|1,1,0]=3 297 B16R2.11414 C[n+]1ccccc1SCC2COC(=O)O2 62a_100000073702_100000212160 [1,0,0,0,0,0|2,1,0]=4 298 B16R2.11414 Cc1ccccc1CCN2CNC(=O)C2 2230a_200000708111_100011713688 [1,0,0,0,0,0|3,0,0]=4 299 B16R2.11414 Cc1ccccc1CNC2CNC(=O)C2 207a_100000697751_100000211143 [1,0,0,0,0,0|3,0,0]=4 300 B16R2.11414 Cc1ccccc1CNC2CNC(=O)C2 2230a_100000697751_100000211839 [1,0,0,0,0,0|3,0,0]=4 301 B16R2.11414 Cc1ccccc1CNC2COC(=O)O2 34a_100000174972_100000032252 [1,0,0,0,0,0|3,0,0]=4 302 B16R2.11414 Cc1ccccc1COC2CNC(=O)C2 34a_100000690082_100000211839 [1,0,0,0,0,0|3,0,0]=4 303 B16R2.11414 Cc1ccccc1COC2COC(=O)O2 34a_100000698903_100000032252 [1,0,0,0,0,0|3,0,0]=4 304 B16R2.11414 Cc1ccccc1CSC2COC(=O)O2 62a_100000211839_100000032252 [1,0,0,0,0,0|3,0,0]=4 305 B16R2.11414 Cc1ccccc1NCC2CNC(=O)O2 34a_100015192222_100000181169 [1,0,0,0,0,0|1,0,0]=2 306 B16R2.11414 Cc1ccccc1NCC2COC(=O)O2 34a_100015192222_100000073702 [1,0,0,0,0,0|2,0,0]=3 307 B16R2.11414 Cc1ccccc1NC[C@H]2COC(=O)N2 34a_100015192222_100015307671 [1,0,0,0,0,0|3,0,0]=4 308 B16R2.11414 Cc1ccccc1OCC2=CC(=O)OC2 34a_100000210338_100000716558 [1,0,0,0,0,0|2,0,1]=4 309 B16R2.11414 Cc1ccccc1OCC2CNC(=O)O2 34a_100000210338_100000181169 [1,0,0,0,0,0|0,0,0]=1 310 B16R2.11414 Cc1ccccc1OCC2CNC(=O)O2 7a_100000210338_100000181169 [1,0,0,0,0,0|0,0,0]=1 311 B16R2.11414 Cc1ccccc1OCC2COC(=O)O2 34a_100000210338_100000073702 [1,0,0,0,0,0|1,0,0]=2 312 B16R2.11414 Cc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000210338_100015189358 [1,0,0,0,0,0|2,0,0]=3 313 B16R2.11414 Cc1ccccc1OC[C@H]2COC(=O)N2 34a_100000210338_100015307671 [1,0,0,0,0,0|2,0,0]=3 314 B16R2.11414 Cc1ccccc1OC[C@H]2COC(=O)N2 7a_100000210338_100015307671 [1,0,0,0,0,0|2,0,0]=3 315 B16R2.11414 Cc1ccccc1OCc2n[nH]c(=O)[nH]2 7a_100000210338_100000754189 [1,0,0,0,0,0|2,0,1]=4 316 B16R2.11414 Cc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000210755 [1,0,0,0,0,0|0,1,0]=2 317 B16R2.11414 Cc1ccccc1SCC2CNC(=O)O2 62a_100000210755_100000181169 [1,0,0,0,0,0|0,1,0]=2 318 B16R2.11414 Cc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000210755 [1,0,0,0,0,0|1,1,0]=3 319 B16R2.11414 Cc1ccccc1SCC2COC(=O)O2 62a_100000210755_100000073702 [1,0,0,0,0,0|1,1,0]=3 320 B16R2.11414 Cc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100000210755_100015189358 [1,0,0,0,0,0|2,1,0]=4 321 B16R2.11414 Cc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100000210755 [1,0,0,0,0,0|2,1,0]=4 322 B16R2.11414 Cc1ccccc1SC[C@H]2COC(=O)N2 62a_100000210755_100015307671 [1,0,0,0,0,0|2,1,0]=4 323 B16R2.11414 Cc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100000210755 [1,0,0,0,0,0|2,1,0]=4 324 B16R2.11414 Cc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100000751373 [1,0,0,0,0,0|1,1,0]=3 325 B16R2.11414 Cc1cccnc1SCC2CNC(=O)O2 62a_100000751373_100000181169 [1,0,0,0,0,0|1,1,0]=3 326 B16R2.11414 Cc1cccnc1SCC2COC(=O)O2 62a_100000073702_100000751373 [1,0,0,0,0,0|2,1,0]=4 327 B16R2.11414 Cc1cccnc1SCC2COC(=O)O2 62a_100000751373_100000073702 [1,0,0,0,0,0|2,1,0]=4 328 B16R2.11414 Cc1ccncc1OCC2CNC(=O)O2 34a_100011997053_100000181169 [1,0,0,0,0,0|1,0,0]=2 329 B16R2.11414 Cc1ccncc1OCC2CNC(=O)O2 7a_100011997053_100000181169 [1,0,0,0,0,0|1,0,0]=2 330 B16R2.11414 Cc1ccncc1OCC2COC(=O)O2 34a_100011997053_100000073702 [1,0,0,0,0,0|2,0,0]=3 331 B16R2.11414 Cc1ccncc1OC[C@@H]2CCC(=O)N2 7a_100011997053_100015189358 [1,0,0,0,0,0|3,0,0]=4 332 B16R2.11414 Cc1ccncc1OC[C@H]2COC(=O)N2 34a_100011997053_100015307671 [1,0,0,0,0,0|3,0,0]=4 333 B16R2.11414 Cc1ccncc1OC[C@H]2COC(=O)N2 7a_100011997053_100015307671 [1,0,0,0,0,0|3,0,0]=4 334 B16R2.11414 Cc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100000761580 [1,0,0,0,0,0|1,1,0]=3 335 B16R2.11414 Cc1ccncc1SCC2CNC(=O)O2 62a_100000761580_100000181169 [1,0,0,0,0,0|1,1,0]=3 336 B16R2.11414 Cc1ccncc1SCC2COC(=O)O2 62a_100000073702_100000761580 [1,0,0,0,0,0|2,1,0]=4 337 B16R2.11414 Cc1ccncc1SCC2COC(=O)O2 62a_100000761580_100000073702 [1,0,0,0,0,0|2,1,0]=4 338 B16R2.11414 Cc1ccnnc1SCC2CNC(=O)O2 62a_100000181169_100000089043 [1,0,0,0,0,0|2,1,0]=4 339 B16R2.11414 Cc1cnccc1NCC2CNC(=O)C2 27a_100016993742_100000765111 [1,0,0,0,0,0|3,0,0]=4 340 B16R2.11414 Cc1cnccc1OCC2CNC(=O)O2 34a_100000694293_100000181169 [1,0,0,0,0,0|1,0,0]=2 341 B16R2.11414 Cc1cnccc1OCC2COC(=O)O2 34a_100000694293_100000073702 [1,0,0,0,0,0|2,0,0]=3 342 B16R2.11414 Cc1cnccc1OC[C@H]2COC(=O)N2 34a_100000694293_100015307671 [1,0,0,0,0,0|3,0,0]=4 343 B16R2.11414 Cc1cnccc1SCC2CNC(=O)O2 62a_100000181169_100000765111 [1,0,0,0,0,0|1,1,0]=3 344 B16R2.11414 Cc1cnccc1SCC2CNC(=O)O2 62a_100000765111_100000181169 [1,0,0,0,0,0|1,1,0]=3 345 B16R2.11414 Cc1cnccc1SCC2COC(=O)O2 62a_100000073702_100000765111 [1,0,0,0,0,0|2,1,0]=4 346 B16R2.11414 Cc1cnccc1SCC2COC(=O)O2 62a_100000765111_100000073702 [1,0,0,0,0,0|2,1,0]=4 347 B16R2.11414 Cc1cncnc1SCC2CNC(=O)O2 62a_100000181169_100011998708 [1,0,0,0,0,0|2,1,0]=4 348 B16R2.11414 Cc1cncnc1SCC2CNC(=O)O2 62a_100011998708_100000181169 [1,0,0,0,0,0|2,1,0]=4 349 B16R2.11414 Cc1ncccc1OCC2CNC(=O)O2 34a_100000745507_100000181169 [1,0,0,0,0,0|1,0,0]=2 350 B16R2.11414 Cc1ncccc1OCC2CNC(=O)O2 7a_100000745507_100000181169 [1,0,0,0,0,0|1,0,0]=2 351 B16R2.11414 Cc1ncccc1OCC2COC(=O)O2 34a_100000745507_100000073702 [1,0,0,0,0,0|2,0,0]=3 352 B16R2.11414 Cc1ncccc1OC[C@@H]2CCC(=O)N2 7a_100000745507_100015189358 [1,0,0,0,0,0|3,0,0]=4 353 B16R2.11414 Cc1ncccc1OC[C@H]2COC(=O)N2 34a_100000745507_100015307671 [1,0,0,0,0,0|3,0,0]=4 354 B16R2.11414 Cc1ncccc1OC[C@H]2COC(=O)N2 7a_100000745507_100015307671 [1,0,0,0,0,0|3,0,0]=4 355 B16R2.11414 Cc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100000751574 [1,0,0,0,0,0|1,1,0]=3 356 B16R2.11414 Cc1ncccc1SCC2CNC(=O)O2 62a_100000751574_100000181169 [1,0,0,0,0,0|1,1,0]=3 357 B16R2.11414 Cc1ncccc1SCC2COC(=O)O2 62a_100000073702_100000751574 [1,0,0,0,0,0|2,1,0]=4 358 B16R2.11414 Cc1ncccc1SCC2COC(=O)O2 62a_100000751574_100000073702 [1,0,0,0,0,0|2,1,0]=4 359 B16R2.11414 Cc1nccnc1OCC2CNC(=O)O2 34a_100000766352_100000181169 [1,0,0,0,0,0|2,0,0]=3 360 B16R2.11414 Cc1nccnc1OCC2COC(=O)O2 34a_100000766352_100000073702 [1,0,0,0,0,0|3,0,0]=4 361 B16R2.11414 Cc1nccnc1SCC2CNC(=O)O2 62a_100000181169_100011999405 [1,0,0,0,0,0|2,1,0]=4 362 B16R2.11414 Cc1nccnc1SCC2CNC(=O)O2 62a_100011999405_100000181169 [1,0,0,0,0,0|2,1,0]=4 363 B16R2.11414 Cc1ncncc1SCC2CNC(=O)O2 62a_100000181169_100009819671 [1,0,0,0,0,0|2,1,0]=4 364 B16R2.11414 Cc1ncncc1SCC2CNC(=O)O2 62a_100009819671_100000181169 [1,0,0,0,0,0|2,1,0]=4 365 B16R2.11414 Nc1ccccc1OCC2CNC(=O)O2 34a_100000185747_100000181169 [1,0,0,0,0,0|1,0,0]=2 366 B16R2.11414 Nc1ccccc1OCC2CNC(=O)O2 7a_100000185747_100000181169 [1,0,0,0,0,0|1,0,0]=2 367 B16R2.11414 Nc1ccccc1OCC2COC(=O)O2 34a_100000185747_100000073702 [1,0,0,0,0,0|2,0,0]=3 368 B16R2.11414 Nc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000185747_100015189358 [1,0,0,0,0,0|3,0,0]=4 369 B16R2.11414 Nc1ccccc1OC[C@H]2COC(=O)N2 34a_100000185747_100015307671 [1,0,0,0,0,0|3,0,0]=4 370 B16R2.11414 Nc1ccccc1OC[C@H]2COC(=O)N2 7a_100000185747_100015307671 [1,0,0,0,0,0|3,0,0]=4 371 B16R2.11414 Nc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000210017 [1,0,0,0,0,0|1,1,0]=3 372 B16R2.11414 Nc1ccccc1SCC2CNC(=O)O2 62a_100000210017_100000181169 [1,0,0,0,0,0|1,1,0]=3 373 B16R2.11414 Nc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000210017 [1,0,0,0,0,0|2,1,0]=4 374 B16R2.11414 Nc1ccccc1SCC2COC(=O)O2 62a_100000210017_100000073702 [1,0,0,0,0,0|2,1,0]=4 375 B16R2.11414 Nc1cccnc1OCC2CNC(=O)O2 34a_100000746358_100000181169 [1,0,0,0,0,0|2,0,0]=3 376 B16R2.11414 Nc1cccnc1OCC2COC(=O)O2 34a_100000746358_100000073702 [1,0,0,0,0,0|3,0,0]=4 377 B16R2.11414 Nc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100000688686 [1,0,0,0,0,0|2,1,0]=4 378 B16R2.11414 Nc1cccnc1SCC2CNC(=O)O2 62a_100000688686_100000181169 [1,0,0,0,0,0|2,1,0]=4 379 B16R2.11414 Nc1ccncc1OCC2CNC(=O)O2 34a_100000753702_100000181169 [1,0,0,0,0,0|2,0,0]=3 380 B16R2.11414 Nc1ccncc1OCC2COC(=O)O2 34a_100000753702_100000073702 [1,0,0,0,0,0|3,0,0]=4 381 B16R2.11414 Nc1ccncc1SCC2CNC(=O)O2 62a_100000047001_100000181169 [1,0,0,0,0,0|2,1,0]=4 382 B16R2.11414 Nc1ccncc1SCC2CNC(=O)O2 62a_100000181169_100000047001 [1,0,0,0,0,0|2,1,0]=4 383 B16R2.11414 Nc1cnccc1SCC2CNC(=O)O2 62a_100000181169_100000756074 [1,0,0,0,0,0|2,1,0]=4 384 B16R2.11414 Nc1cnccc1SCC2CNC(=O)O2 62a_100000756074_100000181169 [1,0,0,0,0,0|2,1,0]=4 385 B16R2.11414 Nc1ncccc1OCC2CNC(=O)O2 34a_100000211975_100000181169 [1,0,0,0,0,0|2,0,0]=3 386 B16R2.11414 Nc1ncccc1OCC2CNC(=O)O2 7a_100000211975_100000181169 [1,0,0,0,0,0|2,0,0]=3 387 B16R2.11414 Nc1ncccc1OCC2COC(=O)O2 34a_100000211975_100000073702 [1,0,0,0,0,0|3,0,0]=4 388 B16R2.11414 Nc1ncccc1SCC2CNC(=O)O2 62a_100000045569_100000181169 [1,0,0,0,0,0|2,1,0]=4 389 B16R2.11414 Nc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100000045569 [1,0,0,0,0,0|2,1,0]=4 390 B16R2.11414 Nc1ncncc1OCC2CNC(=O)O2 7a_100000112926_100000181169 [1,0,0,0,0,0|3,0,0]=4 391 B16R2.11414 O=C1CC[C@H](N1)COc2ccccc2Br 7a_100000181306_100015189358 [1,0,0,0,0,0|3,0,0]=4 392 B16R2.11414 O=C1CC[C@H](N1)COc2ccccc2Cl 7a_100000210172_100015189358 [1,0,0,0,0,0|3,0,0]=4 393 B16R2.11414 O=C1CC[C@H](N1)COc2ccccc2F 7a_100000210171_100015189358 [1,0,0,0,0,0|3,0,0]=4 394 B16R2.11414 O=C1CC[C@H](N1)COc2ccccc2I 7a_100000739446_100015189358 [1,0,0,0,0,0|3,0,0]=4 395 B16R2.11414 O=C1CC[C@H](N1)CSc2ccccc2O 62a_100000739446_100015189358 [1,0,0,0,0,0|2,1,0]=4 396 B16R2.11414 O=C1CC[C@H](N1)CSc2ccccc2O 62a_100015189358_100000739446 [1,0,0,0,0,0|2,1,0]=4 397 B16R2.11414 O=C1NCC(O1)CNc2ccccc2Br 34a_100000210017_100000181169 [1,0,0,0,0,0|2,0,0]=3 398 B16R2.11414 O=C1NCC(O1)CNc2ccccc2Cl 34a_100000185783_100000181169 [1,0,0,0,0,0|2,0,0]=3 399 B16R2.11414 O=C1NCC(O1)CNc2ccccc2F 34a_100000210422_100000181169 [1,0,0,0,0,0|2,0,0]=3 400 B16R2.11414 O=C1NCC(O1)CNc2ccccc2I 34a_100000210053_100000181169 [1,0,0,0,0,0|2,0,0]=3 401 B16R2.11414 O=C1NCC(O1)CNc2ccccc2O 34a_100000185747_100000181169 [1,0,0,0,0,0|1,0,0]=2 402 B16R2.11414 O=C1NCC(O1)COc2cccc[n+]2[O-] 7a_100000211761_100000181169 [1,0,0,0,0,0|1,0,1]=3 403 B16R2.11414 O=C1NCC(O1)COc2ccccc2Br 34a_100000181306_100000181169 [1,0,0,0,0,0|1,0,0]=2 404 B16R2.11414 O=C1NCC(O1)COc2ccccc2Br 7a_100000181306_100000181169 [1,0,0,0,0,0|1,0,0]=2 405 B16R2.11414 O=C1NCC(O1)COc2ccccc2Cl 34a_100000210172_100000181169 [1,0,0,0,0,0|1,0,0]=2 406 B16R2.11414 O=C1NCC(O1)COc2ccccc2Cl 7a_100000210172_100000181169 [1,0,0,0,0,0|1,0,0]=2 407 B16R2.11414 O=C1NCC(O1)COc2ccccc2F 34a_100000210171_100000181169 [1,0,0,0,0,0|1,0,0]=2 408 B16R2.11414 O=C1NCC(O1)COc2ccccc2F 7a_100000210171_100000181169 [1,0,0,0,0,0|1,0,0]=2 409 B16R2.11414 O=C1NCC(O1)COc2ccccc2I 34a_100000739446_100000181169 [1,0,0,0,0,0|1,0,0]=2 410 B16R2.11414 O=C1NCC(O1)COc2ccccc2I 7a_100000739446_100000181169 [1,0,0,0,0,0|1,0,0]=2 411 B16R2.11414 O=C1NCC(O1)COc2cccnc2Br 34a_100000744436_100000181169 [1,0,0,0,0,0|2,0,0]=3 412 B16R2.11414 O=C1NCC(O1)COc2cccnc2Br 7a_100000744436_100000181169 [1,0,0,0,0,0|2,0,0]=3 413 B16R2.11414 O=C1NCC(O1)COc2cccnc2Cl 34a_100000757616_100000181169 [1,0,0,0,0,0|2,0,0]=3 414 B16R2.11414 O=C1NCC(O1)COc2cccnc2Cl 7a_100000757616_100000181169 [1,0,0,0,0,0|2,0,0]=3 415 B16R2.11414 O=C1NCC(O1)COc2cccnc2F 34a_100000061740_100000181169 [1,0,0,0,0,0|2,0,0]=3 416 B16R2.11414 O=C1NCC(O1)COc2cccnc2F 7a_100000061740_100000181169 [1,0,0,0,0,0|2,0,0]=3 417 B16R2.11414 O=C1NCC(O1)COc2cccnc2I 34a_100000034122_100000181169 [1,0,0,0,0,0|2,0,0]=3 418 B16R2.11414 O=C1NCC(O1)COc2cccnc2I 7a_100000034122_100000181169 [1,0,0,0,0,0|2,0,0]=3 419 B16R2.11414 O=C1NCC(O1)COc2cccoc2=O 34a_100000077404_100000181169 [1,0,0,0,0,0|1,0,1]=3 420 B16R2.11414 O=C1NCC(O1)COc2cccoc2=O 7a_100000077404_100000181169 [1,0,0,0,0,0|1,0,1]=3 421 B16R2.11414 O=C1NCC(O1)COc2ccncc2Br 34a_100011996408_100000181169 [1,0,0,0,0,0|2,0,0]=3 422 B16R2.11414 O=C1NCC(O1)COc2ccncc2Cl 34a_100011997054_100000181169 [1,0,0,0,0,0|2,0,0]=3 423 B16R2.11414 O=C1NCC(O1)COc2ccncc2F 34a_200000081243_100000181169 [1,0,0,0,0,0|2,0,0]=3 424 B16R2.11414 O=C1NCC(O1)COc2cnccc2Cl 34a_100011996695_100000181169 [1,0,0,0,0,0|2,0,0]=3 425 B16R2.11414 O=C1NCC(O1)COc2cnccc2I 34a_100000050107_100000181169 [1,0,0,0,0,0|2,0,0]=3 426 B16R2.11414 O=C1NCC(O1)COc2coccc2=O 34a_100000060831_100000181169 [1,0,0,0,0,0|1,0,1]=3 427 B16R2.11414 O=C1NCC(O1)COc2ncccc2Cl 34a_100011290957_100000181169 [1,0,0,0,0,0|2,0,0]=3 428 B16R2.11414 O=C1NCC(O1)COc2ncccc2F 34a_100011219419_100000181169 [1,0,0,0,0,0|2,0,0]=3 429 B16R2.11414 O=C1NCC(O1)CSc2c[nH]ccc2=O 62a_100000181169_100009998708 [1,0,0,0,0,0|1,1,1]=4 430 B16R2.11414 O=C1NCC(O1)CSc2c[nH]ccc2=O 62a_100009998708_100000181169 [1,0,0,0,0,0|1,1,1]=4 431 B16R2.11414 O=C1NCC(O1)CSc2c[nH]ccc2=S 62a_100000181169_200012280681 [1,0,0,0,0,0|1,2,0]=4 432 B16R2.11414 O=C1NCC(O1)CSc2c[nH]ccc2=S 62a_200012280681_100000181169 [1,0,0,0,0,0|1,2,0]=4 433 B16R2.11414 O=C1NCC(O1)CSc2cccc[n+]2[O-] 62a_100000181169_200000042595 [1,0,0,0,0,0|1,1,1]=4 434 B16R2.11414 O=C1NCC(O1)CSc2ccccc2Br 62a_100000181169_100000695589 [1,0,0,0,0,0|1,1,0]=3 435 B16R2.11414 O=C1NCC(O1)CSc2ccccc2Br 62a_100000695589_100000181169 [1,0,0,0,0,0|1,1,0]=3 436 B16R2.11414 O=C1NCC(O1)CSc2ccccc2Cl 62a_100000181169_100000764095 [1,0,0,0,0,0|1,1,0]=3 437 B16R2.11414 O=C1NCC(O1)CSc2ccccc2Cl 62a_100000764095_100000181169 [1,0,0,0,0,0|1,1,0]=3 438 B16R2.11414 O=C1NCC(O1)CSc2ccccc2F 62a_100000181169_100011215700 [1,0,0,0,0,0|1,1,0]=3 439 B16R2.11414 O=C1NCC(O1)CSc2ccccc2F 62a_100011215700_100000181169 [1,0,0,0,0,0|1,1,0]=3 440 B16R2.11414 O=C1NCC(O1)CSc2ccccc2O 62a_100000181169_100000739446 [1,0,0,0,0,0|0,1,0]=2 441 B16R2.11414 O=C1NCC(O1)CSc2ccccc2O 62a_100000739446_100000181169 [1,0,0,0,0,0|0,1,0]=2 442 B16R2.11414 O=C1NCC(O1)CSc2cccnc2Br 62a_100000181169_100010202626 [1,0,0,0,0,0|2,1,0]=4 443 B16R2.11414 O=C1NCC(O1)CSc2cccnc2Br 62a_100010202626_100000181169 [1,0,0,0,0,0|2,1,0]=4 444 B16R2.11414 O=C1NCC(O1)CSc2cccnc2Cl 62a_100000036424_100000181169 [1,0,0,0,0,0|2,1,0]=4 445 B16R2.11414 O=C1NCC(O1)CSc2cccnc2Cl 62a_100000181169_100000036424 [1,0,0,0,0,0|2,1,0]=4 446 B16R2.11414 O=C1NCC(O1)CSc2cccnc2F 62a_100000181169_100009816115 [1,0,0,0,0,0|2,1,0]=4 447 B16R2.11414 O=C1NCC(O1)CSc2cccnc2F 62a_100009816115_100000181169 [1,0,0,0,0,0|2,1,0]=4 448 B16R2.11414 O=C1NCC(O1)CSc2cccnc2O 62a_100000181169_100000760158 [1,0,0,0,0,0|1,1,0]=3 449 B16R2.11414 O=C1NCC(O1)CSc2cccnc2O 62a_100000760158_100000181169 [1,0,0,0,0,0|1,1,0]=3 450 B16R2.11414 O=C1NCC(O1)CSc2ccncc2Br 62a_100000181169_100000726257 [1,0,0,0,0,0|2,1,0]=4 451 B16R2.11414 O=C1NCC(O1)CSc2ccncc2Br 62a_100000726257_100000181169 [1,0,0,0,0,0|2,1,0]=4 452 B16R2.11414 O=C1NCC(O1)CSc2ccncc2Cl 62a_100000181169_100000708259 [1,0,0,0,0,0|2,1,0]=4 453 B16R2.11414 O=C1NCC(O1)CSc2ccncc2Cl 62a_100000708259_100000181169 [1,0,0,0,0,0|2,1,0]=4 454 B16R2.11414 O=C1NCC(O1)CSc2ccncc2F 62a_100000047030_100000181169 [1,0,0,0,0,0|2,1,0]=4 455 B16R2.11414 O=C1NCC(O1)CSc2ccncc2F 62a_100000181169_100000047030 [1,0,0,0,0,0|2,1,0]=4 456 B16R2.11414 O=C1NCC(O1)CSc2ccncc2O 62a_100000181169_100009817591 [1,0,0,0,0,0|1,1,0]=3 457 B16R2.11414 O=C1NCC(O1)CSc2ccncc2O 62a_100009817591_100000181169 [1,0,0,0,0,0|1,1,0]=3 458 B16R2.11414 O=C1NCC(O1)CSc2cnccc2Br 62a_100000181169_100010138639 [1,0,0,0,0,0|2,1,0]=4 459 B16R2.11414 O=C1NCC(O1)CSc2cnccc2Br 62a_100010138639_100000181169 [1,0,0,0,0,0|2,1,0]=4 460 B16R2.11414 O=C1NCC(O1)CSc2cnccc2Cl 62a_100000181169_100009995489 [1,0,0,0,0,0|2,1,0]=4 461 B16R2.11414 O=C1NCC(O1)CSc2cnccc2Cl 62a_100009995489_100000181169 [1,0,0,0,0,0|2,1,0]=4 462 B16R2.11414 O=C1NCC(O1)CSc2cnccc2F 62a_100000181169_100009820683 [1,0,0,0,0,0|2,1,0]=4 463 B16R2.11414 O=C1NCC(O1)CSc2cnccc2F 62a_100009820683_100000181169 [1,0,0,0,0,0|2,1,0]=4 464 B16R2.11414 O=C1NCC(O1)CSc2cncnc2O 62a_100000181169_100000751107 [1,0,0,0,0,0|2,1,0]=4 465 B16R2.11414 O=C1NCC(O1)CSc2cncnc2O 62a_100000751107_100000181169 [1,0,0,0,0,0|2,1,0]=4 466 B16R2.11414 O=C1NCC(O1)CSc2ncccc2Br 62a_100000181169_100000696092 [1,0,0,0,0,0|2,1,0]=4 467 B16R2.11414 O=C1NCC(O1)CSc2ncccc2Br 62a_100000696092_100000181169 [1,0,0,0,0,0|2,1,0]=4 468 B16R2.11414 O=C1NCC(O1)CSc2ncccc2Cl 62a_100000181169_100011356963 [1,0,0,0,0,0|2,1,0]=4 469 B16R2.11414 O=C1NCC(O1)CSc2ncccc2Cl 62a_100011356963_100000181169 [1,0,0,0,0,0|2,1,0]=4 470 B16R2.11414 O=C1NCC(O1)CSc2ncccc2F 62a_100000181169_100000685392 [1,0,0,0,0,0|2,1,0]=4 471 B16R2.11414 O=C1NCC(O1)CSc2ncccc2F 62a_100000685392_100000181169 [1,0,0,0,0,0|2,1,0]=4 472 B16R2.11414 O=C1NCC(O1)CSc2ncccc2O 62a_100000034122_100000181169 [1,0,0,0,0,0|1,1,0]=3 473 B16R2.11414 O=C1NCC(O1)CSc2ncccc2O 62a_100000181169_100000034122 [1,0,0,0,0,0|1,1,0]=3 474 B16R2.11414 O=C1N[C@H](CO1)CNc2ccccc2O 34a_100000185747_100015307671 [1,0,0,0,0,0|3,0,0]=4 475 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2Br 34a_100000181306_100015307671 [1,0,0,0,0,0|3,0,0]=4 476 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2Br 7a_100000181306_100015307671 [1,0,0,0,0,0|3,0,0]=4 477 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2Cl 34a_100000210172_100015307671 [1,0,0,0,0,0|3,0,0]=4 478 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2Cl 7a_100000210172_100015307671 [1,0,0,0,0,0|3,0,0]=4 479 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2F 34a_100000210171_100015307671 [1,0,0,0,0,0|3,0,0]=4 480 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2F 7a_100000210171_100015307671 [1,0,0,0,0,0|3,0,0]=4 481 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2I 34a_100000739446_100015307671 [1,0,0,0,0,0|3,0,0]=4 482 B16R2.11414 O=C1N[C@H](CO1)COc2ccccc2I 7a_100000739446_100015307671 [1,0,0,0,0,0|3,0,0]=4 483 B16R2.11414 O=C1N[C@H](CO1)CSc2ccccc2O 62a_100000739446_100015307671 [1,0,0,0,0,0|2,1,0]=4 484 B16R2.11414 O=C1N[C@H](CO1)CSc2ccccc2O 62a_100015307671_100000739446 [1,0,0,0,0,0|2,1,0]=4 485 B16R2.11414 O=C1OCC(O1)CNc2ccccc2Br 34a_100000210017_100000073702 [1,0,0,0,0,0|3,0,0]=4 486 B16R2.11414 O=C1OCC(O1)CNc2ccccc2Cl 34a_100000185783_100000073702 [1,0,0,0,0,0|3,0,0]=4 487 B16R2.11414 O=C1OCC(O1)CNc2ccccc2F 34a_100000210422_100000073702 [1,0,0,0,0,0|3,0,0]=4 488 B16R2.11414 O=C1OCC(O1)CNc2ccccc2I 34a_100000210053_100000073702 [1,0,0,0,0,0|3,0,0]=4 489 B16R2.11414 O=C1OCC(O1)CNc2ccccc2O 34a_100000185747_100000073702 [1,0,0,0,0,0|2,0,0]=3 490 B16R2.11414 O=C1OCC(O1)COc2ccccc2Br 34a_100000181306_100000073702 [1,0,0,0,0,0|2,0,0]=3 491 B16R2.11414 O=C1OCC(O1)COc2ccccc2Cl 34a_100000210172_100000073702 [1,0,0,0,0,0|2,0,0]=3 492 B16R2.11414 O=C1OCC(O1)COc2ccccc2F 34a_100000210171_100000073702 [1,0,0,0,0,0|2,0,0]=3 493 B16R2.11414 O=C1OCC(O1)COc2ccccc2I 34a_100000739446_100000073702 [1,0,0,0,0,0|2,0,0]=3 494 B16R2.11414 O=C1OCC(O1)COc2cccnc2Br 34a_100000744436_100000073702 [1,0,0,0,0,0|3,0,0]=4 495 B16R2.11414 O=C1OCC(O1)COc2cccnc2Cl 34a_100000757616_100000073702 [1,0,0,0,0,0|3,0,0]=4 496 B16R2.11414 O=C1OCC(O1)COc2cccnc2F 34a_100000061740_100000073702 [1,0,0,0,0,0|3,0,0]=4 497 B16R2.11414 O=C1OCC(O1)COc2cccnc2I 34a_100000034122_100000073702 [1,0,0,0,0,0|3,0,0]=4 498 B16R2.11414 O=C1OCC(O1)COc2cccoc2=O 34a_100000077404_100000073702 [1,0,0,0,0,0|2,0,1]=4 499 B16R2.11414 O=C1OCC(O1)COc2ccncc2Br 34a_100011996408_100000073702 [1,0,0,0,0,0|3,0,0]=4 500 B16R2.11414 O=C1OCC(O1)COc2ccncc2Cl 34a_100011997054_100000073702 [1,0,0,0,0,0|3,0,0]=4 501 B16R2.11414 O=C1OCC(O1)COc2ccncc2F 34a_200000081243_100000073702 [1,0,0,0,0,0|3,0,0]=4 502 B16R2.11414 O=C1OCC(O1)COc2cnccc2Cl 34a_100011996695_100000073702 [1,0,0,0,0,0|3,0,0]=4 503 B16R2.11414 O=C1OCC(O1)COc2cnccc2I 34a_100000050107_100000073702 [1,0,0,0,0,0|3,0,0]=4 504 B16R2.11414 O=C1OCC(O1)COc2coccc2=O 34a_100000060831_100000073702 [1,0,0,0,0,0|2,0,1]=4 505 B16R2.11414 O=C1OCC(O1)COc2ncccc2Cl 34a_100011290957_100000073702 [1,0,0,0,0,0|3,0,0]=4 506 B16R2.11414 O=C1OCC(O1)COc2ncccc2F 34a_100011219419_100000073702 [1,0,0,0,0,0|3,0,0]=4 507 B16R2.11414 O=C1OCC(O1)CSc2ccccc2Br 62a_100000073702_100000695589 [1,0,0,0,0,0|2,1,0]=4 508 B16R2.11414 O=C1OCC(O1)CSc2ccccc2Br 62a_100000695589_100000073702 [1,0,0,0,0,0|2,1,0]=4 509 B16R2.11414 O=C1OCC(O1)CSc2ccccc2Cl 62a_100000073702_100000764095 [1,0,0,0,0,0|2,1,0]=4 510 B16R2.11414 O=C1OCC(O1)CSc2ccccc2Cl 62a_100000764095_100000073702 [1,0,0,0,0,0|2,1,0]=4 511 B16R2.11414 O=C1OCC(O1)CSc2ccccc2F 62a_100000073702_100011215700 [1,0,0,0,0,0|2,1,0]=4 512 B16R2.11414 O=C1OCC(O1)CSc2ccccc2F 62a_100011215700_100000073702 [1,0,0,0,0,0|2,1,0]=4 513 B16R2.11414 O=C1OCC(O1)CSc2ccccc2O 62a_100000073702_100000739446 [1,0,0,0,0,0|1,1,0]=3 514 B16R2.11414 O=C1OCC(O1)CSc2ccccc2O 62a_100000739446_100000073702 [1,0,0,0,0,0|1,1,0]=3 515 B16R2.11414 O=C1OCC(O1)CSc2cccnc2O 62a_100000073702_100000760158 [1,0,0,0,0,0|2,1,0]=4 516 B16R2.11414 O=C1OCC(O1)CSc2cccnc2O 62a_100000760158_100000073702 [1,0,0,0,0,0|2,1,0]=4 517 B16R2.11414 O=C1OCC(O1)CSc2ccncc2O 62a_100000073702_100009817591 [1,0,0,0,0,0|2,1,0]=4 518 B16R2.11414 O=C1OCC(O1)CSc2ccncc2O 62a_100009817591_100000073702 [1,0,0,0,0,0|2,1,0]=4 519 B16R2.11414 O=C1OCC(O1)CSc2ncccc2O 62a_100000034122_100000073702 [1,0,0,0,0,0|2,1,0]=4 520 B16R2.11414 O=C1OCC(O1)CSc2ncccc2O 62a_100000073702_100000034122 [1,0,0,0,0,0|2,1,0]=4 521 B16R2.11414 O=C1OCC(O1)NCc2ccccc2O 34a_100000185550_100000032252 [1,0,0,0,0,0|3,0,0]=4 522 B18R2.3068 COc1ccccc1CC(=O)C2CNC(=O)C2 1458a_100000747279_100000210004 [0,1,0,0,0,0|2,0,1]=4 523 B18R2.3068 COc1ccccc1CC(=O)C2CNC(=O)N2 1458a_100000033324_100000210004 [0,1,0,0,0,0|2,0,1]=4 524 B18R2.3068 COc1ccccc1CC(=O)[C@@H]2CCC(=O)O2 1458a_100009814974_100000210004 [0,1,0,0,0,0|2,0,1]=4 525 B18R2.3068 COc1ccccc1NC(=O)C2CNC(=O)C2 11a_100000210025_100000747279 [0,1,0,0,0,0|2,0,1]=4 526 B18R2.3068 COc1ccccc1NC(=O)C2CNC(=O)C2 1626a_100000210025_100000747279 [0,1,0,0,0,0|2,0,1]=4 527 B18R2.3068 COc1ccccc1NC(=O)C2CNC(=O)C2 22a_100000210025_100000747279 [0,1,0,0,0,0|2,0,1]=4 528 B18R2.3068 COc1ccccc1NC(=O)C2CNC(=O)C2 527a_100000210025_100000747279 [0,1,0,0,0,0|2,0,1]=4 529 B18R2.3068 COc1ccccc1NC(=O)C2CNC(=O)N2 11a_100000210025_100000033324 [0,1,0,0,0,0|2,0,1]=4 530 B18R2.3068 COc1ccccc1NC(=O)C2CNC(=O)N2 22a_100000210025_100000033324 [0,1,0,0,0,0|2,0,1]=4 531 B18R2.3068 COc1ccccc1NC(=O)[C@@H]2CCC(=O)O2 11a_100000210025_100009814974 [0,1,0,0,0,0|2,0,1]=4 532 B18R2.3068 COc1ccccc1NC(=O)[C@@H]2CCC(=O)O2 1626a_100000210025_100009814974 [0,1,0,0,0,0|2,0,1]=4 533 B18R2.3068 COc1ccccc1NC(=O)[C@@H]2CCC(=O)O2 22a_100000210025_100009814974 [0,1,0,0,0,0|2,0,1]=4 534 B18R2.3068 COc1ccccc1NC(=O)[C@@H]2CCC(=O)O2 527a_100000210025_100009814974 [0,1,0,0,0,0|2,0,1]=4 535 B18R2.3088 C#Cc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100011243808_100000181169 [0,1,0,0,0,0|2,0,1]=4 536 B18R2.3088 C=Cc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100011830265_100000181169 [0,1,0,0,0,0|2,0,1]=4 537 B18R2.3088 CCc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000689120_100000181169 [0,1,0,0,0,0|2,0,0]=3 538 B18R2.3088 CCc1ccccc1C(=O)CC2COC(=O)O2 1458a_100000689120_100000073702 [0,1,0,0,0,0|3,0,0]=4 539 B18R2.3088 CN(CC1CNC(=O)O1)c2ccccc2C#N 2230a_100000744078_100000181169 [0,1,0,0,0,0|3,0,0]=4 540 B18R2.3088 CN(CC1CNC(=O)O1)c2ccccc2C#N 269982a_100000744078_100000181169 [0,1,0,0,0,0|3,0,0]=4 541 B18R2.3088 COc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000185835_100000181169 [0,1,0,0,0,0|1,0,0]=2 542 B18R2.3088 COc1ccccc1C(=O)CC2COC(=O)O2 1458a_100000185835_100000073702 [0,1,0,0,0,0|2,0,0]=3 543 B18R2.3088 COc1ccccc1C(=O)C[C@@H]2CCC(=O)N2 1458a_100000185835_100015189358 [0,1,0,0,0,0|3,0,0]=4 544 B18R2.3088 COc1ccccc1C(=O)C[C@H]2COC(=O)N2 1458a_100000185835_100015307671 [0,1,0,0,0,0|3,0,0]=4 545 B18R2.3088 COc1ccccc1C(=O)NC2CNC(=O)C2 11a_100000697751_100000185835 [0,1,0,0,0,0|3,0,0]=4 546 B18R2.3088 COc1ccccc1C(=O)NC2CNC(=O)C2 1626a_100000697751_100000185835 [0,1,0,0,0,0|3,0,0]=4 547 B18R2.3088 COc1ccccc1C(=O)NC2CNC(=O)C2 240690a_100000697751_100000185835 [0,1,0,0,0,0|3,0,0]=4 548 B18R2.3088 COc1ccccc1C(=O)NC2CNC(=O)C2 527a_100000697751_100000185835 [0,1,0,0,0,0|3,0,0]=4 549 B18R2.3088 COc1ccccc1C(C)NC2CNC(=O)C2 269862a_100000697751_100000173324 [0,1,0,0,0,0|3,0,0]=4 550 B18R2.3088 COc1ccccc1N(C)CC2CNC(=O)O2 2230a_100000219746_100000181169 [0,1,0,0,0,0|1,0,0]=2 551 B18R2.3088 COc1ccccc1N(C)CC2CNC(=O)O2 269982a_100000219746_100000181169 [0,1,0,0,0,0|1,0,0]=2 552 B18R2.3088 COc1ccccc1N(C)CC2CNC(=O)O2 34a_100000219746_100000181169 [0,1,0,0,0,0|1,0,0]=2 553 B18R2.3088 COc1ccccc1N(C)CC2COC(=O)O2 269982a_100000219746_100000073702 [0,1,0,0,0,0|2,0,0]=3 554 B18R2.3088 COc1ccccc1N(C)CC2COC(=O)O2 34a_100000219746_100000073702 [0,1,0,0,0,0|2,0,0]=3 555 B18R2.3088 COc1ccccc1N(C)C[C@@H]2CCC(=O)N2 2230a_100000219746_100015189358 [0,1,0,0,0,0|3,0,0]=4 556 B18R2.3088 COc1ccccc1N(C)C[C@@H]2CCC(=O)N2 269982a_100000219746_100015189358 [0,1,0,0,0,0|3,0,0]=4 557 B18R2.3088 COc1ccccc1N(C)C[C@H]2COC(=O)N2 2230a_100000219746_100015307671 [0,1,0,0,0,0|3,0,0]=4 558 B18R2.3088 COc1ccccc1N(C)C[C@H]2COC(=O)N2 269982a_100000219746_100015307671 [0,1,0,0,0,0|3,0,0]=4 559 B18R2.3088 COc1ccccc1N(C)C[C@H]2COC(=O)N2 34a_100000219746_100015307671 [0,1,0,0,0,0|3,0,0]=4 560 B18R2.3088 CSc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000183967_100000181169 [0,1,0,0,0,0|1,1,0]=3 561 B18R2.3088 CSc1ccccc1C(=O)CC2COC(=O)O2 1458a_100000183967_100000073702 [0,1,0,0,0,0|2,1,0]=4 562 B18R2.3088 N#Cc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000742908_100000181169 [0,1,0,0,0,0|3,0,0]=4 563 B18R2.3088 O=C1NCC(O1)CC(=O)c2ccccc2CO 1458a_100011301526_100000181169 [0,1,0,0,0,0|3,0,0]=4 564 B18R2.3088 O=Ic1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000032414_100000181169 [0,1,0,0,0,0|3,0,0]=4 565 B18R2.5268 C/C=C/c1ccccc1OCC2CNC(=O)O2 34a_200000189419_100000181169 [0,1,0,0,0,0|1,0,0]=2 566 B18R2.5268 C/C=C/c1ccccc1OCC2CNC(=O)O2 7a_200000189419_100000181169 [0,1,0,0,0,0|1,0,0]=2 567 B18R2.5268 C/C=C/c1ccccc1OCC2COC(=O)O2 34a_200000189419_100000073702 [0,1,0,0,0,0|2,0,0]=3 568 B18R2.5268 C/C=C/c1ccccc1OC[C@@H]2CCC(=O)N2 7a_200000189419_100015189358 [0,1,0,0,0,0|3,0,0]=4 569 B18R2.5268 C/C=C/c1ccccc1OC[C@H]2COC(=O)N2 34a_200000189419_100015307671 [0,1,0,0,0,0|3,0,0]=4 570 B18R2.5268 C/C=C/c1ccccc1OC[C@H]2COC(=O)N2 7a_200000189419_100015307671 [0,1,0,0,0,0|3,0,0]=4 571 B18R2.5268 C=CCc1ccccc1NCC2CNC(=O)O2 2230a_200138433279_100000181169 [0,1,0,0,0,0|2,0,1]=4 572 B18R2.5268 C=CCc1ccccc1NCC2CNC(=O)O2 34a_200138433279_100000181169 [0,1,0,0,0,0|2,0,1]=4 573 B18R2.5268 C=CCc1ccccc1OCC2CNC(=O)O2 34a_100000211836_100000181169 [0,1,0,0,0,0|1,0,1]=3 574 B18R2.5268 C=CCc1ccccc1OCC2CNC(=O)O2 7a_100000211836_100000181169 [0,1,0,0,0,0|1,0,1]=3 575 B18R2.5268 C=CCc1ccccc1OCC2COC(=O)O2 34a_100000211836_100000073702 [0,1,0,0,0,0|2,0,1]=4 576 B18R2.5268 C=CCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100009828059 [0,1,0,0,0,0|1,1,1]=4 577 B18R2.5268 C=CCc1ccccc1SCC2CNC(=O)O2 62a_100009828059_100000181169 [0,1,0,0,0,0|1,1,1]=4 578 B18R2.5268 CCCc1ccccc1NCC2CNC(=O)O2 2230a_100000737634_100000181169 [0,1,0,0,0,0|2,0,0]=3 579 B18R2.5268 CCCc1ccccc1NCC2CNC(=O)O2 34a_100000737634_100000181169 [0,1,0,0,0,0|2,0,0]=3 580 B18R2.5268 CCCc1ccccc1NCC2CNC(=O)O2 7a_100000737634_100000181169 [0,1,0,0,0,0|2,0,0]=3 581 B18R2.5268 CCCc1ccccc1NCC2COC(=O)O2 34a_100000737634_100000073702 [0,1,0,0,0,0|3,0,0]=4 582 B18R2.5268 CCCc1ccccc1OCC2CNC(=O)O2 34a_100011217252_100000181169 [0,1,0,0,0,0|1,0,0]=2 583 B18R2.5268 CCCc1ccccc1OCC2CNC(=O)O2 7a_100011217252_100000181169 [0,1,0,0,0,0|1,0,0]=2 584 B18R2.5268 CCCc1ccccc1OCC2COC(=O)O2 34a_100011217252_100000073702 [0,1,0,0,0,0|2,0,0]=3 585 B18R2.5268 CCCc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100011217252_100015189358 [0,1,0,0,0,0|3,0,0]=4 586 B18R2.5268 CCCc1ccccc1OC[C@H]2COC(=O)N2 34a_100011217252_100015307671 [0,1,0,0,0,0|3,0,0]=4 587 B18R2.5268 CCCc1ccccc1OC[C@H]2COC(=O)N2 7a_100011217252_100015307671 [0,1,0,0,0,0|3,0,0]=4 588 B18R2.5268 CCNc1ccccc1OCC2CNC(=O)O2 34a_103624766699_100000181169 [0,1,0,0,0,0|1,0,0]=2 589 B18R2.5268 CCNc1ccccc1OCC2CNC(=O)O2 7a_103624766699_100000181169 [0,1,0,0,0,0|1,0,0]=2 590 B18R2.5268 CCNc1ccccc1OCC2COC(=O)O2 34a_103624766699_100000073702 [0,1,0,0,0,0|2,0,0]=3 591 B18R2.5268 CCNc1ccccc1OC[C@@H]2CCC(=O)N2 7a_103624766699_100015189358 [0,1,0,0,0,0|3,0,0]=4 592 B18R2.5268 CCNc1ccccc1OC[C@H]2COC(=O)N2 34a_103624766699_100015307671 [0,1,0,0,0,0|3,0,0]=4 593 B18R2.5268 CCNc1ccccc1OC[C@H]2COC(=O)N2 7a_103624766699_100015307671 [0,1,0,0,0,0|3,0,0]=4 594 B18R2.5268 CCNc1ccccc1SCC2CNC(=O)O2 62a_100000181169_114873767003 [0,1,0,0,0,0|1,1,0]=3 595 B18R2.5268 CCNc1ccccc1SCC2CNC(=O)O2 62a_114873767003_100000181169 [0,1,0,0,0,0|1,1,0]=3 596 B18R2.5268 CCNc1ccccc1SCC2COC(=O)O2 62a_100000073702_114873767003 [0,1,0,0,0,0|2,1,0]=4 597 B18R2.5268 CCNc1ccccc1SCC2COC(=O)O2 62a_114873767003_100000073702 [0,1,0,0,0,0|2,1,0]=4 598 B18R2.5268 CCOc1ccccc1CNC2CNC(=O)C2 207a_100000697751_100000169843 [0,1,0,0,0,0|3,0,0]=4 599 B18R2.5268 CCOc1ccccc1COC2COC(=O)O2 34a_100000708577_100000032252 [0,1,0,0,0,0|3,0,0]=4 600 B18R2.5268 CCOc1ccccc1NCC2CNC(=O)O2 34a_100000211218_100000181169 [0,1,0,0,0,0|1,0,0]=2 601 B18R2.5268 CCOc1ccccc1NCC2COC(=O)O2 34a_100000211218_100000073702 [0,1,0,0,0,0|2,0,0]=3 602 B18R2.5268 CCOc1ccccc1NC[C@H]2COC(=O)N2 34a_100000211218_100015307671 [0,1,0,0,0,0|3,0,0]=4 603 B18R2.5268 CCOc1ccccc1OCC2=CC(=O)OC2 34a_100000211404_100000716558 [0,1,0,0,0,0|2,0,1]=4 604 B18R2.5268 CCOc1ccccc1OCC2CNC(=O)O2 34a_100000211404_100000181169 [0,1,0,0,0,0|0,0,0]=1 605 B18R2.5268 CCOc1ccccc1OCC2CNC(=O)O2 7a_100000211404_100000181169 [0,1,0,0,0,0|0,0,0]=1 606 B18R2.5268 CCOc1ccccc1OCC2COC(=O)O2 34a_100000211404_100000073702 [0,1,0,0,0,0|1,0,0]=2 607 B18R2.5268 CCOc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000211404_100015189358 [0,1,0,0,0,0|2,0,0]=3 608 B18R2.5268 CCOc1ccccc1OC[C@H]2COC(=O)N2 34a_100000211404_100015307671 [0,1,0,0,0,0|2,0,0]=3 609 B18R2.5268 CCOc1ccccc1OC[C@H]2COC(=O)N2 7a_100000211404_100015307671 [0,1,0,0,0,0|2,0,0]=3 610 B18R2.5268 CCOc1ccccc1OCc2n[nH]c(=O)[nH]2 7a_100000211404_100000754189 [0,1,0,0,0,0|2,0,1]=4 611 B18R2.5268 CCOc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000230754 [0,1,0,0,0,0|0,1,0]=2 612 B18R2.5268 CCOc1ccccc1SCC2CNC(=O)O2 62a_100000230754_100000181169 [0,1,0,0,0,0|0,1,0]=2 613 B18R2.5268 CCOc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000230754 [0,1,0,0,0,0|1,1,0]=3 614 B18R2.5268 CCOc1ccccc1SCC2COC(=O)O2 62a_100000230754_100000073702 [0,1,0,0,0,0|1,1,0]=3 615 B18R2.5268 CCOc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100000230754_100015189358 [0,1,0,0,0,0|2,1,0]=4 616 B18R2.5268 CCOc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100000230754 [0,1,0,0,0,0|2,1,0]=4 617 B18R2.5268 CCOc1ccccc1SC[C@H]2COC(=O)N2 62a_100000230754_100015307671 [0,1,0,0,0,0|2,1,0]=4 618 B18R2.5268 CCOc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100000230754 [0,1,0,0,0,0|2,1,0]=4 619 B18R2.5268 CCOc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100011597540 [0,1,0,0,0,0|1,1,0]=3 620 B18R2.5268 CCOc1cccnc1SCC2CNC(=O)O2 62a_100011597540_100000181169 [0,1,0,0,0,0|1,1,0]=3 621 B18R2.5268 CCOc1cccnc1SCC2COC(=O)O2 62a_100000073702_100011597540 [0,1,0,0,0,0|2,1,0]=4 622 B18R2.5268 CCOc1cccnc1SCC2COC(=O)O2 62a_100011597540_100000073702 [0,1,0,0,0,0|2,1,0]=4 623 B18R2.5268 CCOc1ncccc1OCC2CNC(=O)O2 34a_100011998697_100000181169 [0,1,0,0,0,0|1,0,0]=2 624 B18R2.5268 CCOc1ncccc1OCC2COC(=O)O2 34a_100011998697_100000073702 [0,1,0,0,0,0|2,0,0]=3 625 B18R2.5268 CCOc1ncccc1OC[C@H]2COC(=O)N2 34a_100011998697_100015307671 [0,1,0,0,0,0|3,0,0]=4 626 B18R2.5268 CCOc1ncccc1SCC2CNC(=O)O2 62a_100000181169_100011465154 [0,1,0,0,0,0|1,1,0]=3 627 B18R2.5268 CCOc1ncccc1SCC2CNC(=O)O2 62a_100011465154_100000181169 [0,1,0,0,0,0|1,1,0]=3 628 B18R2.5268 CCOc1ncccc1SCC2COC(=O)O2 62a_100000073702_100011465154 [0,1,0,0,0,0|2,1,0]=4 629 B18R2.5268 CCOc1ncccc1SCC2COC(=O)O2 62a_100011465154_100000073702 [0,1,0,0,0,0|2,1,0]=4 630 B18R2.5268 CCOc1nccnc1SCC2CNC(=O)O2 62a_100000181169_200010128176 [0,1,0,0,0,0|2,1,0]=4 631 B18R2.5268 CCOc1nccnc1SCC2CNC(=O)O2 62a_200010128176_100000181169 [0,1,0,0,0,0|2,1,0]=4 632 B18R2.5268 CCSc1ccccc1NCC2CNC(=O)O2 34a_100011223125_100000181169 [0,1,0,0,0,0|1,1,0]=3 633 B18R2.5268 CCSc1ccccc1NCC2COC(=O)O2 34a_100011223125_100000073702 [0,1,0,0,0,0|2,1,0]=4 634 B18R2.5268 CCSc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000230856 [0,1,0,0,0,0|0,2,0]=3 635 B18R2.5268 CCSc1ccccc1SCC2CNC(=O)O2 62a_100000230856_100000181169 [0,1,0,0,0,0|0,2,0]=3 636 B18R2.5268 CCSc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000230856 [0,1,0,0,0,0|1,2,0]=4 637 B18R2.5268 CCSc1ccccc1SCC2COC(=O)O2 62a_100000230856_100000073702 [0,1,0,0,0,0|1,2,0]=4 638 B18R2.5268 CNCc1ccccc1OCC2CNC(=O)O2 34a_100015189988_100000181169 [0,1,0,0,0,0|1,0,0]=2 639 B18R2.5268 CNCc1ccccc1OCC2COC(=O)O2 34a_100015189988_100000073702 [0,1,0,0,0,0|2,0,0]=3 640 B18R2.5268 CNCc1ccccc1OC[C@H]2COC(=O)N2 34a_100015189988_100015307671 [0,1,0,0,0,0|3,0,0]=4 641 B18R2.5268 CNCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000184654 [0,1,0,0,0,0|1,1,0]=3 642 B18R2.5268 CNCc1ccccc1SCC2CNC(=O)O2 62a_100000184654_100000181169 [0,1,0,0,0,0|1,1,0]=3 643 B18R2.5268 CNCc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000184654 [0,1,0,0,0,0|2,1,0]=4 644 B18R2.5268 CNCc1ccccc1SCC2COC(=O)O2 62a_100000184654_100000073702 [0,1,0,0,0,0|2,1,0]=4 645 B18R2.5268 CNCc1cccnc1SCC2CNC(=O)O2 62a_100000181169_103496529121 [0,1,0,0,0,0|2,1,0]=4 646 B18R2.5268 CNCc1cccnc1SCC2CNC(=O)O2 62a_103496529121_100000181169 [0,1,0,0,0,0|2,1,0]=4 647 B18R2.5268 COCc1ccccc1OCC2=CC(=O)OC2 34a_100011488565_100000716558 [0,1,0,0,0,0|2,0,1]=4 648 B18R2.5268 COCc1ccccc1OCC2CNC(=O)O2 34a_100011488565_100000181169 [0,1,0,0,0,0|0,0,0]=1 649 B18R2.5268 COCc1ccccc1OCC2CNC(=O)O2 7a_100011488565_100000181169 [0,1,0,0,0,0|0,0,0]=1 650 B18R2.5268 COCc1ccccc1OCC2COC(=O)O2 34a_100011488565_100000073702 [0,1,0,0,0,0|1,0,0]=2 651 B18R2.5268 COCc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100011488565_100015189358 [0,1,0,0,0,0|2,0,0]=3 652 B18R2.5268 COCc1ccccc1OC[C@H]2COC(=O)N2 34a_100011488565_100015307671 [0,1,0,0,0,0|2,0,0]=3 653 B18R2.5268 COCc1ccccc1OC[C@H]2COC(=O)N2 7a_100011488565_100015307671 [0,1,0,0,0,0|2,0,0]=3 654 B18R2.5268 COCc1ccccc1OCc2n[nH]c(=O)[nH]2 7a_100011488565_100000754189 [0,1,0,0,0,0|2,0,1]=4 655 B18R2.5268 COCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011493684 [0,1,0,0,0,0|0,1,0]=2 656 B18R2.5268 COCc1ccccc1SCC2CNC(=O)O2 62a_100011493684_100000181169 [0,1,0,0,0,0|0,1,0]=2 657 B18R2.5268 COCc1ccccc1SCC2COC(=O)O2 62a_100000073702_100011493684 [0,1,0,0,0,0|1,1,0]=3 658 B18R2.5268 COCc1ccccc1SCC2COC(=O)O2 62a_100011493684_100000073702 [0,1,0,0,0,0|1,1,0]=3 659 B18R2.5268 COCc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100011493684_100015189358 [0,1,0,0,0,0|2,1,0]=4 660 B18R2.5268 COCc1ccccc1SC[C@@H]2CCC(=O)N2 62a_100015189358_100011493684 [0,1,0,0,0,0|2,1,0]=4 661 B18R2.5268 COCc1ccccc1SC[C@H]2COC(=O)N2 62a_100011493684_100015307671 [0,1,0,0,0,0|2,1,0]=4 662 B18R2.5268 COCc1ccccc1SC[C@H]2COC(=O)N2 62a_100015307671_100011493684 [0,1,0,0,0,0|2,1,0]=4 663 B18R2.5268 CSCc1ccccc1SCC2CNC(=O)O2 62a_100000148299_100000181169 [0,1,0,0,0,0|0,2,0]=3 664 B18R2.5268 CSCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000148299 [0,1,0,0,0,0|0,2,0]=3 665 B18R2.5268 CSCc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000148299 [0,1,0,0,0,0|1,2,0]=4 666 B18R2.5268 CSCc1ccccc1SCC2COC(=O)O2 62a_100000148299_100000073702 [0,1,0,0,0,0|1,2,0]=4 667 B18R2.5268 N#CCc1ccccc1OCC2CNC(=O)O2 34a_100000043107_100000181169 [0,1,0,0,0,0|1,0,1]=3 668 B18R2.5268 N#CCc1ccccc1OCC2CNC(=O)O2 7a_100000043107_100000181169 [0,1,0,0,0,0|1,0,1]=3 669 B18R2.5268 N#CCc1ccccc1OCC2COC(=O)O2 34a_100000043107_100000073702 [0,1,0,0,0,0|2,0,1]=4 670 B18R2.5268 N#CCc1ccccc1SCC2CNC(=O)O2 62a_100000033512_100000181169 [0,1,0,0,0,0|1,1,1]=4 671 B18R2.5268 N#CCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000033512 [0,1,0,0,0,0|1,1,1]=4 672 B18R2.5268 N#CNc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011685340 [0,1,0,0,0,0|1,1,1]=4 673 B18R2.5268 NCCc1ccccc1OCC2CNC(=O)O2 34a_100011207237_100000181169 [0,1,0,0,0,0|1,0,0]=2 674 B18R2.5268 NCCc1ccccc1OCC2COC(=O)O2 34a_100011207237_100000073702 [0,1,0,0,0,0|2,0,0]=3 675 B18R2.5268 NCCc1ccccc1OC[C@H]2COC(=O)N2 34a_100011207237_100015307671 [0,1,0,0,0,0|3,0,0]=4 676 B18R2.5268 NCCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000747383 [0,1,0,0,0,0|1,1,0]=3 677 B18R2.5268 NCCc1ccccc1SCC2CNC(=O)O2 62a_100000747383_100000181169 [0,1,0,0,0,0|1,1,0]=3 678 B18R2.5268 NCCc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000747383 [0,1,0,0,0,0|2,1,0]=4 679 B18R2.5268 NCCc1ccccc1SCC2COC(=O)O2 62a_100000747383_100000073702 [0,1,0,0,0,0|2,1,0]=4 680 B18R2.5268 NNCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_200016993956 [0,1,0,0,0,0|2,1,0]=4 681 B18R2.5268 NNCc1ccccc1SCC2CNC(=O)O2 62a_200016993956_100000181169 [0,1,0,0,0,0|2,1,0]=4 682 B18R2.5268 O=C1CC[C@H](N1)COc2ccccc2CCBr 7a_100000722297_100015189358 [0,1,0,0,0,0|3,0,0]=4 683 B18R2.5268 O=C1CC[C@H](N1)COc2ccccc2CCO 7a_100000719421_100015189358 [0,1,0,0,0,0|3,0,0]=4 684 B18R2.5268 O=C1NCC(O1)CNc2ccccc2CCO 2230a_100011215289_100000181169 [0,1,0,0,0,0|2,0,0]=3 685 B18R2.5268 O=C1NCC(O1)CNc2ccccc2CCO 34a_100011215289_100000181169 [0,1,0,0,0,0|2,0,0]=3 686 B18R2.5268 O=C1NCC(O1)COc2ccccc2CCBr 34a_100000722297_100000181169 [0,1,0,0,0,0|1,0,0]=2 687 B18R2.5268 O=C1NCC(O1)COc2ccccc2CCBr 7a_100000722297_100000181169 [0,1,0,0,0,0|1,0,0]=2 688 B18R2.5268 O=C1NCC(O1)COc2ccccc2CCO 34a_100000719421_100000181169 [0,1,0,0,0,0|1,0,0]=2 689 B18R2.5268 O=C1NCC(O1)COc2ccccc2CCO 7a_100000719421_100000181169 [0,1,0,0,0,0|1,0,0]=2 690 B18R2.5268 O=C1NCC(O1)CSc2ccccc2CCO 62a_100000181169_100000731337 [0,1,0,0,0,0|1,1,0]=3 691 B18R2.5268 O=C1NCC(O1)CSc2ccccc2CCO 62a_100000731337_100000181169 [0,1,0,0,0,0|1,1,0]=3 692 B18R2.5268 O=C1N[C@H](CO1)COc2ccccc2CCBr 34a_100000722297_100015307671 [0,1,0,0,0,0|3,0,0]=4 693 B18R2.5268 O=C1N[C@H](CO1)COc2ccccc2CCBr 7a_100000722297_100015307671 [0,1,0,0,0,0|3,0,0]=4 694 B18R2.5268 O=C1N[C@H](CO1)COc2ccccc2CCO 34a_100000719421_100015307671 [0,1,0,0,0,0|3,0,0]=4 695 B18R2.5268 O=C1N[C@H](CO1)COc2ccccc2CCO 7a_100000719421_100015307671 [0,1,0,0,0,0|3,0,0]=4 696 B18R2.5268 O=C1OCC(O1)CNc2ccccc2CCO 34a_100011215289_100000073702 [0,1,0,0,0,0|3,0,0]=4 697 B18R2.5268 O=C1OCC(O1)COc2ccccc2CCBr 34a_100000722297_100000073702 [0,1,0,0,0,0|2,0,0]=3 698 B18R2.5268 O=C1OCC(O1)COc2ccccc2CCO 34a_100000719421_100000073702 [0,1,0,0,0,0|2,0,0]=3 699 B18R2.5268 O=C1OCC(O1)CSc2ccccc2CCO 62a_100000073702_100000731337 [0,1,0,0,0,0|2,1,0]=4 700 B18R2.5268 O=C1OCC(O1)CSc2ccccc2CCO 62a_100000731337_100000073702 [0,1,0,0,0,0|2,1,0]=4 701 B18R2.5268 O=CNc1ccccc1SCC2CNC(=O)O2 62a_100000181169_200020615051 [0,1,0,0,0,0|1,1,1]=4 702 B18R2.5268 O=CNc1ccccc1SCC2CNC(=O)O2 62a_200020615051_100000181169 [0,1,0,0,0,0|1,1,1]=4 703 B18R2.5268 [N-]=[N+]=Nc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000762926 [0,1,0,0,0,0|2,1,0]=4 704 B18R2.13746 C=Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100012354420 [0,1,0,0,0,0|1,1,1]=4 705 B18R2.13746 C=Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100012354420_100000181169 [0,1,0,0,0,0|1,1,1]=4 706 B18R2.13746 CCc1ccc(cc1NCC2CNC(=O)O2)Br 2230a_100012354963_100000181169 [0,1,0,0,0,0|2,0,0]=3 707 B18R2.13746 CCc1ccc(cc1NCC2CNC(=O)O2)Br 34a_100012354963_100000181169 [0,1,0,0,0,0|2,0,0]=3 708 B18R2.13746 CCc1ccc(cc1NCC2CNC(=O)O2)Br 7a_100012354963_100000181169 [0,1,0,0,0,0|2,0,0]=3 709 B18R2.13746 CCc1ccc(cc1NCC2CNC(=O)O2)Cl 2230a_200012281948_100000181169 [0,1,0,0,0,0|2,0,0]=3 710 B18R2.13746 CCc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_200012281948_100000181169 [0,1,0,0,0,0|2,0,0]=3 711 B18R2.13746 CCc1ccc(cc1NCC2CNC(=O)O2)Cl 7a_200012281948_100000181169 [0,1,0,0,0,0|2,0,0]=3 712 B18R2.13746 CCc1ccc(cc1NCC2COC(=O)O2)Br 34a_100012354963_100000073702 [0,1,0,0,0,0|3,0,0]=4 713 B18R2.13746 CCc1ccc(cc1NCC2COC(=O)O2)Cl 34a_200012281948_100000073702 [0,1,0,0,0,0|3,0,0]=4 714 B18R2.13746 CCc1cnc(cc1SCC2CNC(=O)O2)C 62a_100000181169_100010291839 [0,1,0,0,0,0|2,1,0]=4 715 B18R2.13746 CCc1cnc(cc1SCC2CNC(=O)O2)C 62a_100010291839_100000181169 [0,1,0,0,0,0|2,1,0]=4 716 B18R2.13746 CCc1ncc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100013085292 [0,1,0,0,0,0|2,1,0]=4 717 B18R2.13746 CCc1ncc(cc1SCC2CNC(=O)O2)N 62a_100013085292_100000181169 [0,1,0,0,0,0|2,1,0]=4 718 B18R2.13746 CNc1ccc(cc1SCC2CNC(=O)O2)C 62a_100000181169_100000221369 [0,1,0,0,0,0|1,1,0]=3 719 B18R2.13746 CNc1ccc(cc1SCC2CNC(=O)O2)C 62a_100000221369_100000181169 [0,1,0,0,0,0|1,1,0]=3 720 B18R2.13746 CNc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100011246292 [0,1,0,0,0,0|1,1,0]=3 721 B18R2.13746 CNc1ccc(cc1SCC2CNC(=O)O2)F 62a_100011246292_100000181169 [0,1,0,0,0,0|1,1,0]=3 722 B18R2.13746 CNc1ccc(cc1SCC2COC(=O)O2)C 62a_100000073702_100000221369 [0,1,0,0,0,0|2,1,0]=4 723 B18R2.13746 CNc1ccc(cc1SCC2COC(=O)O2)C 62a_100000221369_100000073702 [0,1,0,0,0,0|2,1,0]=4 724 B18R2.13746 CNc1ccc(cc1SCC2COC(=O)O2)F 62a_100000073702_100011246292 [0,1,0,0,0,0|2,1,0]=4 725 B18R2.13746 CNc1ccc(cc1SCC2COC(=O)O2)F 62a_100011246292_100000073702 [0,1,0,0,0,0|2,1,0]=4 726 B18R2.13746 COc1c[nH]c(=O)cc1SCC2CNC(=O)O2 62a_100000181169_100121573661 [0,1,0,0,0,0|1,1,0]=3 727 B18R2.13746 COc1c[nH]c(=O)cc1SCC2CNC(=O)O2 62a_100121573661_100000181169 [0,1,0,0,0,0|1,1,0]=3 728 B18R2.13746 COc1c[nH]c(=O)cc1SCC2COC(=O)O2 62a_100000073702_100121573661 [0,1,0,0,0,0|2,1,0]=4 729 B18R2.13746 COc1c[nH]c(=O)cc1SCC2COC(=O)O2 62a_100121573661_100000073702 [0,1,0,0,0,0|2,1,0]=4 730 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)Br 207a_100000697751_100000170026 [0,1,0,0,0,0|3,0,0]=4 731 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)Br 2230a_100000697751_100000204665 [0,1,0,0,0,0|3,0,0]=4 732 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)C 207a_100000697751_100000203738 [0,1,0,0,0,0|3,0,0]=4 733 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)C 2230a_100000697751_100000199068 [0,1,0,0,0,0|3,0,0]=4 734 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)Cl 207a_100000697751_100000188328 [0,1,0,0,0,0|3,0,0]=4 735 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)Cl 2230a_100000697751_100000209806 [0,1,0,0,0,0|3,0,0]=4 736 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)F 207a_100000697751_100000722865 [0,1,0,0,0,0|3,0,0]=4 737 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)F 2230a_100000697751_100011830354 [0,1,0,0,0,0|3,0,0]=4 738 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)I 207a_100000697751_100011266407 [0,1,0,0,0,0|3,0,0]=4 739 B18R2.13746 COc1ccc(cc1CNC2CNC(=O)C2)O 207a_100000697751_100000067581 [0,1,0,0,0,0|3,0,0]=4 740 B18R2.13746 COc1ccc(cc1CNC2COC(=O)O2)Br 34a_100000690498_100000032252 [0,1,0,0,0,0|3,0,0]=4 741 B18R2.13746 COc1ccc(cc1CNC2COC(=O)O2)Cl 34a_100000740580_100000032252 [0,1,0,0,0,0|3,0,0]=4 742 B18R2.13746 COc1ccc(cc1CNC2COC(=O)O2)F 34a_100011199032_100000032252 [0,1,0,0,0,0|3,0,0]=4 743 B18R2.13746 COc1ccc(cc1COC2CNC(=O)C2)Br 34a_100000690082_100000204665 [0,1,0,0,0,0|3,0,0]=4 744 B18R2.13746 COc1ccc(cc1COC2CNC(=O)C2)C 34a_100000690082_100000199068 [0,1,0,0,0,0|3,0,0]=4 745 B18R2.13746 COc1ccc(cc1COC2CNC(=O)C2)Cl 34a_100000690082_100000209806 [0,1,0,0,0,0|3,0,0]=4 746 B18R2.13746 COc1ccc(cc1COC2CNC(=O)C2)F 34a_100000690082_100011830354 [0,1,0,0,0,0|3,0,0]=4 747 B18R2.13746 COc1ccc(cc1COC2COC(=O)O2)Br 34a_100000204679_100000032252 [0,1,0,0,0,0|3,0,0]=4 748 B18R2.13746 COc1ccc(cc1COC2COC(=O)O2)C 34a_200000246444_100000032252 [0,1,0,0,0,0|3,0,0]=4 749 B18R2.13746 COc1ccc(cc1COC2COC(=O)O2)F 34a_100011266440_100000032252 [0,1,0,0,0,0|3,0,0]=4 750 B18R2.13746 COc1ccc(cc1COC2COC(=O)O2)I 34a_200137411115_100000032252 [0,1,0,0,0,0|3,0,0]=4 751 B18R2.13746 COc1ccc(cc1CSC2COC(=O)O2)Br 62a_100000204665_100000032252 [0,1,0,0,0,0|3,0,0]=4 752 B18R2.13746 COc1ccc(cc1CSC2COC(=O)O2)C 62a_100000199068_100000032252 [0,1,0,0,0,0|3,0,0]=4 753 B18R2.13746 COc1ccc(cc1CSC2COC(=O)O2)Cl 62a_100000209806_100000032252 [0,1,0,0,0,0|3,0,0]=4 754 B18R2.13746 COc1ccc(cc1CSC2COC(=O)O2)F 62a_100011830354_100000032252 [0,1,0,0,0,0|3,0,0]=4 755 B18R2.13746 COc1ccc(cc1NCC2CNC(=O)O2)Br 34a_100000743470_100000181169 [0,1,0,0,0,0|1,0,0]=2 756 B18R2.13746 COc1ccc(cc1NCC2CNC(=O)O2)C 2230a_100000210980_100000181169 [0,1,0,0,0,0|1,0,0]=2 757 B18R2.13746 COc1ccc(cc1NCC2CNC(=O)O2)C 34a_100000210980_100000181169 [0,1,0,0,0,0|1,0,0]=2 758 B18R2.13746 COc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_100000182114_100000181169 [0,1,0,0,0,0|1,0,0]=2 759 B18R2.13746 COc1ccc(cc1NCC2CNC(=O)O2)F 34a_100000757179_100000181169 [0,1,0,0,0,0|1,0,0]=2 760 B18R2.13746 COc1ccc(cc1NCC2COC(=O)O2)Br 34a_100000743470_100000073702 [0,1,0,0,0,0|2,0,0]=3 761 B18R2.13746 COc1ccc(cc1NCC2COC(=O)O2)C 34a_100000210980_100000073702 [0,1,0,0,0,0|2,0,0]=3 762 B18R2.13746 COc1ccc(cc1NCC2COC(=O)O2)Cl 34a_100000182114_100000073702 [0,1,0,0,0,0|2,0,0]=3 763 B18R2.13746 COc1ccc(cc1NCC2COC(=O)O2)F 34a_100000757179_100000073702 [0,1,0,0,0,0|2,0,0]=3 764 B18R2.13746 COc1ccc(cc1NC[C@@H]2CCC(=O)N2)C 2230a_100000210980_100015189358 [0,1,0,0,0,0|3,0,0]=4 765 B18R2.13746 COc1ccc(cc1NC[C@H]2COC(=O)N2)Br 34a_100000743470_100015307671 [0,1,0,0,0,0|3,0,0]=4 766 B18R2.13746 COc1ccc(cc1NC[C@H]2COC(=O)N2)C 2230a_100000210980_100015307671 [0,1,0,0,0,0|3,0,0]=4 767 B18R2.13746 COc1ccc(cc1NC[C@H]2COC(=O)N2)C 34a_100000210980_100015307671 [0,1,0,0,0,0|3,0,0]=4 768 B18R2.13746 COc1ccc(cc1NC[C@H]2COC(=O)N2)Cl 34a_100000182114_100015307671 [0,1,0,0,0,0|3,0,0]=4 769 B18R2.13746 COc1ccc(cc1NC[C@H]2COC(=O)N2)F 34a_100000757179_100015307671 [0,1,0,0,0,0|3,0,0]=4 770 B18R2.13746 COc1ccc(cc1OCC2=CC(=O)OC2)Br 34a_100009816560_100000716558 [0,1,0,0,0,0|2,0,1]=4 771 B18R2.13746 COc1ccc(cc1OCC2=CC(=O)OC2)C 34a_100011216497_100000716558 [0,1,0,0,0,0|2,0,1]=4 772 B18R2.13746 COc1ccc(cc1OCC2=CC(=O)OC2)Cl 34a_100000101779_100000716558 [0,1,0,0,0,0|2,0,1]=4 773 B18R2.13746 COc1ccc(cc1OCC2=CC(=O)OC2)F 34a_100000034962_100000716558 [0,1,0,0,0,0|2,0,1]=4 774 B18R2.13746 COc1ccc(cc1OCC2=CC(=O)OC2)N 34a_100000211920_100000716558 [0,1,0,0,0,0|2,0,1]=4 775 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)Br 34a_100009816560_100000181169 [0,1,0,0,0,0|0,0,0]=1 776 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)Br 7a_100009816560_100000181169 [0,1,0,0,0,0|0,0,0]=1 777 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)C 34a_100011216497_100000181169 [0,1,0,0,0,0|0,0,0]=1 778 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)C 7a_100011216497_100000181169 [0,1,0,0,0,0|0,0,0]=1 779 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)Cl 34a_100000101779_100000181169 [0,1,0,0,0,0|0,0,0]=1 780 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)Cl 7a_100000101779_100000181169 [0,1,0,0,0,0|0,0,0]=1 781 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)F 34a_100000034962_100000181169 [0,1,0,0,0,0|0,0,0]=1 782 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)F 7a_100000034962_100000181169 [0,1,0,0,0,0|0,0,0]=1 783 B18R2.13746 COc1ccc(cc1OCC2CNC(=O)O2)N 34a_100000211920_100000181169 [0,1,0,0,0,0|0,0,0]=1 784 B18R2.13746 COc1ccc(cc1OCC2COC(=O)O2)Br 34a_100009816560_100000073702 [0,1,0,0,0,0|1,0,0]=2 785 B18R2.13746 COc1ccc(cc1OCC2COC(=O)O2)C 34a_100011216497_100000073702 [0,1,0,0,0,0|1,0,0]=2 786 B18R2.13746 COc1ccc(cc1OCC2COC(=O)O2)Cl 34a_100000101779_100000073702 [0,1,0,0,0,0|1,0,0]=2 787 B18R2.13746 COc1ccc(cc1OCC2COC(=O)O2)F 34a_100000034962_100000073702 [0,1,0,0,0,0|1,0,0]=2 788 B18R2.13746 COc1ccc(cc1OCC2COC(=O)O2)N 34a_100000211920_100000073702 [0,1,0,0,0,0|1,0,0]=2 789 B18R2.13746 COc1ccc(cc1OC[C@@H]2CCC(=O)N2)Br 7a_100009816560_100015189358 [0,1,0,0,0,0|2,0,0]=3 790 B18R2.13746 COc1ccc(cc1OC[C@@H]2CCC(=O)N2)C 7a_100011216497_100015189358 [0,1,0,0,0,0|2,0,0]=3 791 B18R2.13746 COc1ccc(cc1OC[C@@H]2CCC(=O)N2)Cl 7a_100000101779_100015189358 [0,1,0,0,0,0|2,0,0]=3 792 B18R2.13746 COc1ccc(cc1OC[C@@H]2CCC(=O)N2)F 7a_100000034962_100015189358 [0,1,0,0,0,0|2,0,0]=3 793 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)Br 34a_100009816560_100015307671 [0,1,0,0,0,0|2,0,0]=3 794 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)Br 7a_100009816560_100015307671 [0,1,0,0,0,0|2,0,0]=3 795 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)C 34a_100011216497_100015307671 [0,1,0,0,0,0|2,0,0]=3 796 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)C 7a_100011216497_100015307671 [0,1,0,0,0,0|2,0,0]=3 797 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)Cl 34a_100000101779_100015307671 [0,1,0,0,0,0|2,0,0]=3 798 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)Cl 7a_100000101779_100015307671 [0,1,0,0,0,0|2,0,0]=3 799 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)F 34a_100000034962_100015307671 [0,1,0,0,0,0|2,0,0]=3 800 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)F 7a_100000034962_100015307671 [0,1,0,0,0,0|2,0,0]=3 801 B18R2.13746 COc1ccc(cc1OC[C@H]2COC(=O)N2)N 34a_100000211920_100015307671 [0,1,0,0,0,0|2,0,0]=3 802 B18R2.13746 COc1ccc(cc1OCc2n[nH]c(=O)[nH]2)Br 7a_100009816560_100000754189 [0,1,0,0,0,0|2,0,1]=4 803 B18R2.13746 COc1ccc(cc1OCc2n[nH]c(=O)[nH]2)C 7a_100011216497_100000754189 [0,1,0,0,0,0|2,0,1]=4 804 B18R2.13746 COc1ccc(cc1OCc2n[nH]c(=O)[nH]2)Cl 7a_100000101779_100000754189 [0,1,0,0,0,0|2,0,1]=4 805 B18R2.13746 COc1ccc(cc1OCc2n[nH]c(=O)[nH]2)F 7a_100000034962_100000754189 [0,1,0,0,0,0|2,0,1]=4 806 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100012351588 [0,1,0,0,0,0|0,1,0]=2 807 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100012351588_100000181169 [0,1,0,0,0,0|0,1,0]=2 808 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)C 62a_100000181169_100000186399 [0,1,0,0,0,0|0,1,0]=2 809 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)C 62a_100000186399_100000181169 [0,1,0,0,0,0|0,1,0]=2 810 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100000181169_100011215930 [0,1,0,0,0,0|0,1,0]=2 811 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100011215930_100000181169 [0,1,0,0,0,0|0,1,0]=2 812 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000171694_100000181169 [0,1,0,0,0,0|0,1,0]=2 813 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100000171694 [0,1,0,0,0,0|0,1,0]=2 814 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100011356947 [0,1,0,0,0,0|0,1,0]=2 815 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)N 62a_100011356947_100000181169 [0,1,0,0,0,0|0,1,0]=2 816 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100010234764 [0,1,0,0,0,0|0,1,0]=2 817 B18R2.13746 COc1ccc(cc1SCC2CNC(=O)O2)O 62a_100010234764_100000181169 [0,1,0,0,0,0|0,1,0]=2 818 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)Br 62a_100000073702_100012351588 [0,1,0,0,0,0|1,1,0]=3 819 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)Br 62a_100012351588_100000073702 [0,1,0,0,0,0|1,1,0]=3 820 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)C 62a_100000073702_100000186399 [0,1,0,0,0,0|1,1,0]=3 821 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)C 62a_100000186399_100000073702 [0,1,0,0,0,0|1,1,0]=3 822 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)Cl 62a_100000073702_100011215930 [0,1,0,0,0,0|1,1,0]=3 823 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)Cl 62a_100011215930_100000073702 [0,1,0,0,0,0|1,1,0]=3 824 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)F 62a_100000073702_100000171694 [0,1,0,0,0,0|1,1,0]=3 825 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)F 62a_100000171694_100000073702 [0,1,0,0,0,0|1,1,0]=3 826 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)N 62a_100000073702_100011356947 [0,1,0,0,0,0|1,1,0]=3 827 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)N 62a_100011356947_100000073702 [0,1,0,0,0,0|1,1,0]=3 828 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)O 62a_100000073702_100010234764 [0,1,0,0,0,0|1,1,0]=3 829 B18R2.13746 COc1ccc(cc1SCC2COC(=O)O2)O 62a_100010234764_100000073702 [0,1,0,0,0,0|1,1,0]=3 830 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)Br 62a_100012351588_100015189358 [0,1,0,0,0,0|2,1,0]=4 831 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)Br 62a_100015189358_100012351588 [0,1,0,0,0,0|2,1,0]=4 832 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)C 62a_100000186399_100015189358 [0,1,0,0,0,0|2,1,0]=4 833 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)C 62a_100015189358_100000186399 [0,1,0,0,0,0|2,1,0]=4 834 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)Cl 62a_100011215930_100015189358 [0,1,0,0,0,0|2,1,0]=4 835 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)Cl 62a_100015189358_100011215930 [0,1,0,0,0,0|2,1,0]=4 836 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)F 62a_100000171694_100015189358 [0,1,0,0,0,0|2,1,0]=4 837 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)F 62a_100015189358_100000171694 [0,1,0,0,0,0|2,1,0]=4 838 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)N 62a_100011356947_100015189358 [0,1,0,0,0,0|2,1,0]=4 839 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)N 62a_100015189358_100011356947 [0,1,0,0,0,0|2,1,0]=4 840 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)O 62a_100010234764_100015189358 [0,1,0,0,0,0|2,1,0]=4 841 B18R2.13746 COc1ccc(cc1SC[C@@H]2CCC(=O)N2)O 62a_100015189358_100010234764 [0,1,0,0,0,0|2,1,0]=4 842 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)Br 62a_100012351588_100015307671 [0,1,0,0,0,0|2,1,0]=4 843 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)Br 62a_100015307671_100012351588 [0,1,0,0,0,0|2,1,0]=4 844 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)C 62a_100000186399_100015307671 [0,1,0,0,0,0|2,1,0]=4 845 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)C 62a_100015307671_100000186399 [0,1,0,0,0,0|2,1,0]=4 846 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)Cl 62a_100011215930_100015307671 [0,1,0,0,0,0|2,1,0]=4 847 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)Cl 62a_100015307671_100011215930 [0,1,0,0,0,0|2,1,0]=4 848 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)F 62a_100000171694_100015307671 [0,1,0,0,0,0|2,1,0]=4 849 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)F 62a_100015307671_100000171694 [0,1,0,0,0,0|2,1,0]=4 850 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)N 62a_100011356947_100015307671 [0,1,0,0,0,0|2,1,0]=4 851 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)N 62a_100015307671_100011356947 [0,1,0,0,0,0|2,1,0]=4 852 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)O 62a_100010234764_100015307671 [0,1,0,0,0,0|2,1,0]=4 853 B18R2.13746 COc1ccc(cc1SC[C@H]2COC(=O)N2)O 62a_100015307671_100010234764 [0,1,0,0,0,0|2,1,0]=4 854 B18R2.13746 COc1ccc(nc1SCC2CNC(=O)O2)C 62a_100000181169_100009820875 [0,1,0,0,0,0|1,1,0]=3 855 B18R2.13746 COc1ccc(nc1SCC2CNC(=O)O2)C 62a_100009820875_100000181169 [0,1,0,0,0,0|1,1,0]=3 856 B18R2.13746 COc1ccc(nc1SCC2CNC(=O)O2)N 62a_100000181169_100010172607 [0,1,0,0,0,0|1,1,0]=3 857 B18R2.13746 COc1ccc(nc1SCC2CNC(=O)O2)N 62a_100010172607_100000181169 [0,1,0,0,0,0|1,1,0]=3 858 B18R2.13746 COc1ccc(nc1SCC2COC(=O)O2)C 62a_100000073702_100009820875 [0,1,0,0,0,0|2,1,0]=4 859 B18R2.13746 COc1ccc(nc1SCC2COC(=O)O2)C 62a_100009820875_100000073702 [0,1,0,0,0,0|2,1,0]=4 860 B18R2.13746 COc1ccc(nc1SCC2COC(=O)O2)N 62a_100000073702_100010172607 [0,1,0,0,0,0|2,1,0]=4 861 B18R2.13746 COc1ccc(nc1SCC2COC(=O)O2)N 62a_100010172607_100000073702 [0,1,0,0,0,0|2,1,0]=4 862 B18R2.13746 COc1cnc(cc1OCC2CNC(=O)O2)Br 34a_100010264082_100000181169 [0,1,0,0,0,0|1,0,0]=2 863 B18R2.13746 COc1cnc(cc1OCC2CNC(=O)O2)Cl 34a_100009849459_100000181169 [0,1,0,0,0,0|1,0,0]=2 864 B18R2.13746 COc1cnc(cc1OCC2COC(=O)O2)Br 34a_100010264082_100000073702 [0,1,0,0,0,0|2,0,0]=3 865 B18R2.13746 COc1cnc(cc1OCC2COC(=O)O2)Cl 34a_100009849459_100000073702 [0,1,0,0,0,0|2,0,0]=3 866 B18R2.13746 COc1cnc(cc1OC[C@H]2COC(=O)N2)Br 34a_100010264082_100015307671 [0,1,0,0,0,0|3,0,0]=4 867 B18R2.13746 COc1cnc(cc1OC[C@H]2COC(=O)N2)Cl 34a_100009849459_100015307671 [0,1,0,0,0,0|3,0,0]=4 868 B18R2.13746 COc1cnc(cc1SCC2CNC(=O)O2)C 62a_100000181169_100010109759 [0,1,0,0,0,0|1,1,0]=3 869 B18R2.13746 COc1cnc(cc1SCC2CNC(=O)O2)C 62a_100010109759_100000181169 [0,1,0,0,0,0|1,1,0]=3 870 B18R2.13746 COc1cnc(cc1SCC2COC(=O)O2)C 62a_100000073702_100010109759 [0,1,0,0,0,0|2,1,0]=4 871 B18R2.13746 COc1cnc(cc1SCC2COC(=O)O2)C 62a_100010109759_100000073702 [0,1,0,0,0,0|2,1,0]=4 872 B18R2.13746 COc1ncc(cc1OCC2CNC(=O)O2)Br 34a_100010135713_100000181169 [0,1,0,0,0,0|1,0,0]=2 873 B18R2.13746 COc1ncc(cc1OCC2COC(=O)O2)Br 34a_100010135713_100000073702 [0,1,0,0,0,0|2,0,0]=3 874 B18R2.13746 COc1ncc(cc1OC[C@H]2COC(=O)N2)Br 34a_100010135713_100015307671 [0,1,0,0,0,0|3,0,0]=4 875 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100009814608 [0,1,0,0,0,0|1,1,0]=3 876 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)Br 62a_100009814608_100000181169 [0,1,0,0,0,0|1,1,0]=3 877 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)C 62a_100000181169_100012353929 [0,1,0,0,0,0|1,1,0]=3 878 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)C 62a_100012353929_100000181169 [0,1,0,0,0,0|1,1,0]=3 879 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100009828472 [0,1,0,0,0,0|1,1,0]=3 880 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)F 62a_100009828472_100000181169 [0,1,0,0,0,0|1,1,0]=3 881 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100012351452 [0,1,0,0,0,0|1,1,0]=3 882 B18R2.13746 COc1ncc(cc1SCC2CNC(=O)O2)N 62a_100012351452_100000181169 [0,1,0,0,0,0|1,1,0]=3 883 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)Br 62a_100000073702_100009814608 [0,1,0,0,0,0|2,1,0]=4 884 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)Br 62a_100009814608_100000073702 [0,1,0,0,0,0|2,1,0]=4 885 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)C 62a_100000073702_100012353929 [0,1,0,0,0,0|2,1,0]=4 886 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)C 62a_100012353929_100000073702 [0,1,0,0,0,0|2,1,0]=4 887 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)F 62a_100000073702_100009828472 [0,1,0,0,0,0|2,1,0]=4 888 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)F 62a_100009828472_100000073702 [0,1,0,0,0,0|2,1,0]=4 889 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)N 62a_100000073702_100012351452 [0,1,0,0,0,0|2,1,0]=4 890 B18R2.13746 COc1ncc(cc1SCC2COC(=O)O2)N 62a_100012351452_100000073702 [0,1,0,0,0,0|2,1,0]=4 891 B18R2.13746 COc1nnc(cc1SCC2CNC(=O)O2)Cl 62a_100000181169_100000725446 [0,1,0,0,0,0|2,1,0]=4 892 B18R2.13746 COc1nnc(cc1SCC2CNC(=O)O2)Cl 62a_100000725446_100000181169 [0,1,0,0,0,0|2,1,0]=4 893 B18R2.13746 CSc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_100000745667_100000181169 [0,1,0,0,0,0|1,1,0]=3 894 B18R2.13746 CSc1ccc(cc1NCC2COC(=O)O2)Cl 34a_100000745667_100000073702 [0,1,0,0,0,0|2,1,0]=4 895 B18R2.13746 CSc1ccc(cc1SCC2CNC(=O)O2)C 62a_100000181169_200010201864 [0,1,0,0,0,0|0,2,0]=3 896 B18R2.13746 CSc1ccc(cc1SCC2CNC(=O)O2)C 62a_200010201864_100000181169 [0,1,0,0,0,0|0,2,0]=3 897 B18R2.13746 CSc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100009817003 [0,1,0,0,0,0|0,2,0]=3 898 B18R2.13746 CSc1ccc(cc1SCC2CNC(=O)O2)F 62a_100009817003_100000181169 [0,1,0,0,0,0|0,2,0]=3 899 B18R2.13746 CSc1ccc(cc1SCC2COC(=O)O2)C 62a_100000073702_200010201864 [0,1,0,0,0,0|1,2,0]=4 900 B18R2.13746 CSc1ccc(cc1SCC2COC(=O)O2)C 62a_200010201864_100000073702 [0,1,0,0,0,0|1,2,0]=4 901 B18R2.13746 CSc1ccc(cc1SCC2COC(=O)O2)F 62a_100000073702_100009817003 [0,1,0,0,0,0|1,2,0]=4 902 B18R2.13746 CSc1ccc(cc1SCC2COC(=O)O2)F 62a_100009817003_100000073702 [0,1,0,0,0,0|1,2,0]=4 903 B18R2.13746 Cc1ccc(c(c1)NCC2CNC(=O)O2)C#N 34a_100011218341_100000181169 [0,1,0,0,0,0|3,0,0]=4 904 B18R2.13746 Cc1ccc(c(c1)NCC2CNC(=O)O2)C#N 7a_100011218341_100000181169 [0,1,0,0,0,0|3,0,0]=4 905 B18R2.13746 Cc1ccc(c(c1)NCC2CNC(=O)O2)CO 34a_100000087799_100000181169 [0,1,0,0,0,0|3,0,0]=4 906 B18R2.13746 Cc1ccc(c(c1)OCC2CNC(=O)O2)C#N 34a_100011640519_100000181169 [0,1,0,0,0,0|2,0,0]=3 907 B18R2.13746 Cc1ccc(c(c1)OCC2CNC(=O)O2)C#N 7a_100011640519_100000181169 [0,1,0,0,0,0|2,0,0]=3 908 B18R2.13746 Cc1ccc(c(c1)OCC2COC(=O)O2)C#N 34a_100011640519_100000073702 [0,1,0,0,0,0|3,0,0]=4 909 B18R2.13746 Cc1ccc(c(c1)SCC2CNC(=O)O2)C#N 62a_100000181169_100000693804 [0,1,0,0,0,0|2,1,0]=4 910 B18R2.13746 Cc1ccc(c(c1)SCC2CNC(=O)O2)C=O 62a_100000181169_100011935181 [0,1,0,0,0,0|2,1,0]=4 911 B18R2.13746 Cc1ccc(c(c1)SCC2CNC(=O)O2)C=O 62a_100011935181_100000181169 [0,1,0,0,0,0|2,1,0]=4 912 B18R2.13746 Cc1ccc(c(c1)SCC2CNC(=O)O2)NN 62a_100000181169_100016996181 [0,1,0,0,0,0|2,1,0]=4 913 B18R2.13746 Cc1ccc(c(c1)SCC2CNC(=O)O2)NN 62a_100016996181_100000181169 [0,1,0,0,0,0|2,1,0]=4 914 B18R2.13746 N#Cc1ccc(cc1NCC2CNC(=O)O2)Br 7a_100000699244_100000181169 [0,1,0,0,0,0|3,0,0]=4 915 B18R2.13746 N#Cc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_100000211392_100000181169 [0,1,0,0,0,0|3,0,0]=4 916 B18R2.13746 N#Cc1ccc(cc1NCC2CNC(=O)O2)Cl 7a_100000211392_100000181169 [0,1,0,0,0,0|3,0,0]=4 917 B18R2.13746 N#Cc1ccc(cc1NCC2CNC(=O)O2)F 34a_100011935279_100000181169 [0,1,0,0,0,0|3,0,0]=4 918 B18R2.13746 N#Cc1ccc(cc1NCC2CNC(=O)O2)F 7a_100011935279_100000181169 [0,1,0,0,0,0|3,0,0]=4 919 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)Br 34a_100011934713_100000181169 [0,1,0,0,0,0|2,0,0]=3 920 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)Br 7a_100011934713_100000181169 [0,1,0,0,0,0|2,0,0]=3 921 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)Cl 34a_100000688488_100000181169 [0,1,0,0,0,0|2,0,0]=3 922 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)Cl 7a_100000688488_100000181169 [0,1,0,0,0,0|2,0,0]=3 923 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)F 34a_100012185923_100000181169 [0,1,0,0,0,0|2,0,0]=3 924 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)F 7a_100012185923_100000181169 [0,1,0,0,0,0|2,0,0]=3 925 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)N 34a_100000094571_100000181169 [0,1,0,0,0,0|2,0,0]=3 926 B18R2.13746 N#Cc1ccc(cc1OCC2CNC(=O)O2)N 7a_100000094571_100000181169 [0,1,0,0,0,0|2,0,0]=3 927 B18R2.13746 N#Cc1ccc(cc1OCC2COC(=O)O2)Br 34a_100011934713_100000073702 [0,1,0,0,0,0|3,0,0]=4 928 B18R2.13746 N#Cc1ccc(cc1OCC2COC(=O)O2)Cl 34a_100000688488_100000073702 [0,1,0,0,0,0|3,0,0]=4 929 B18R2.13746 N#Cc1ccc(cc1OCC2COC(=O)O2)F 34a_100012185923_100000073702 [0,1,0,0,0,0|3,0,0]=4 930 B18R2.13746 N#Cc1ccc(cc1OCC2COC(=O)O2)N 34a_100000094571_100000073702 [0,1,0,0,0,0|3,0,0]=4 931 B18R2.13746 N#Cc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100010214477 [0,1,0,0,0,0|2,1,0]=4 932 B18R2.13746 N#Cc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100000181169_100012355178 [0,1,0,0,0,0|2,1,0]=4 933 B18R2.13746 N#Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100011935285 [0,1,0,0,0,0|2,1,0]=4 934 B18R2.13746 N#Cc1ccc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100000689153 [0,1,0,0,0,0|2,1,0]=4 935 B18R2.13746 N#Cc1ccc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100012184851 [0,1,0,0,0,0|2,1,0]=4 936 B18R2.13746 N#Cc1ncc(cc1OCC2CNC(=O)O2)Br 34a_200013853302_100000181169 [0,1,0,0,0,0|3,0,0]=4 937 B18R2.13746 N#Cc1ncc(cc1OCC2CNC(=O)O2)Br 7a_200013853302_100000181169 [0,1,0,0,0,0|3,0,0]=4 938 B18R2.13746 NCc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100000708791 [0,1,0,0,0,0|2,1,0]=4 939 B18R2.13746 NCc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000708791_100000181169 [0,1,0,0,0,0|2,1,0]=4 940 B18R2.13746 O=C1NCC(O1)CNc2cc(ccc2CO)Br 34a_100000718831_100000181169 [0,1,0,0,0,0|3,0,0]=4 941 B18R2.13746 O=C1NCC(O1)CNc2cc(ccc2CO)Cl 34a_100000238622_100000181169 [0,1,0,0,0,0|3,0,0]=4 942 B18R2.13746 O=C1NCC(O1)CNc2cc(ccc2CO)F 34a_100011996588_100000181169 [0,1,0,0,0,0|3,0,0]=4 943 B18R2.13746 O=C1NCC(O1)COc2cc(ccc2CO)Br 34a_100000071718_100000181169 [0,1,0,0,0,0|2,0,0]=3 944 B18R2.13746 O=C1NCC(O1)COc2cc(ccc2CO)Br 7a_100000071718_100000181169 [0,1,0,0,0,0|2,0,0]=3 945 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)Br 62a_100000181169_100010146605 [0,1,0,0,0,0|2,1,0]=4 946 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)Br 62a_100010146605_100000181169 [0,1,0,0,0,0|2,1,0]=4 947 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)Cl 62a_100000181169_100000722340 [0,1,0,0,0,0|2,1,0]=4 948 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)Cl 62a_100000722340_100000181169 [0,1,0,0,0,0|2,1,0]=4 949 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)F 62a_100000181169_100000744086 [0,1,0,0,0,0|2,1,0]=4 950 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)F 62a_100000744086_100000181169 [0,1,0,0,0,0|2,1,0]=4 951 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)O 62a_100000181169_100010146404 [0,1,0,0,0,0|2,1,0]=4 952 B18R2.13746 O=C1NCC(O1)CSc2cc(ccc2CO)O 62a_100010146404_100000181169 [0,1,0,0,0,0|2,1,0]=4 953 B18R2.13746 O=C1OCC(O1)COc2cc(ccc2CO)Br 34a_100000071718_100000073702 [0,1,0,0,0,0|3,0,0]=4 954 B18R2.13746 O=Cc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100010146562 [0,1,0,0,0,0|2,1,0]=4 955 B18R2.13746 O=Cc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100010146562_100000181169 [0,1,0,0,0,0|2,1,0]=4 956 B18R2.13746 O=Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100000752949 [0,1,0,0,0,0|2,1,0]=4 957 B18R2.13746 O=Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000752949_100000181169 [0,1,0,0,0,0|2,1,0]=4 958 B18R2.13746 O=Cc1ccc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100011236494 [0,1,0,0,0,0|2,1,0]=4 959 B18R2.13746 O=Cc1ccc(cc1SCC2CNC(=O)O2)O 62a_100011236494_100000181169 [0,1,0,0,0,0|2,1,0]=4 960 B18R2.15285 C#Cc1cc(ccc1NCC2CNC(=O)O2)C 34a_200012001881_100000181169 [0,1,0,0,0,0|2,0,1]=4 961 B18R2.15285 C=Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100012356183 [0,1,0,0,0,0|1,1,1]=4 962 B18R2.15285 C=Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100012356183_100000181169 [0,1,0,0,0,0|1,1,1]=4 963 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)Br 2230a_100000686106_100000181169 [0,1,0,0,0,0|2,0,0]=3 964 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)Br 34a_100000686106_100000181169 [0,1,0,0,0,0|2,0,0]=3 965 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)Br 7a_100000686106_100000181169 [0,1,0,0,0,0|2,0,0]=3 966 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)Cl 2230a_100012017146_100000181169 [0,1,0,0,0,0|2,0,0]=3 967 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)Cl 34a_100012017146_100000181169 [0,1,0,0,0,0|2,0,0]=3 968 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)Cl 7a_100012017146_100000181169 [0,1,0,0,0,0|2,0,0]=3 969 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)I 2230a_100000014069_100000181169 [0,1,0,0,0,0|2,0,0]=3 970 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)I 34a_100000014069_100000181169 [0,1,0,0,0,0|2,0,0]=3 971 B18R2.15285 CCc1cc(ccc1NCC2CNC(=O)O2)I 7a_100000014069_100000181169 [0,1,0,0,0,0|2,0,0]=3 972 B18R2.15285 CCc1cc(ccc1NCC2COC(=O)O2)Br 34a_100000686106_100000073702 [0,1,0,0,0,0|3,0,0]=4 973 B18R2.15285 CCc1cc(ccc1NCC2COC(=O)O2)Cl 34a_100012017146_100000073702 [0,1,0,0,0,0|3,0,0]=4 974 B18R2.15285 CCc1cc(ccc1NCC2COC(=O)O2)I 34a_100000014069_100000073702 [0,1,0,0,0,0|3,0,0]=4 975 B18R2.15285 CCc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100012338938_100000181169 [0,1,0,0,0,0|1,0,0]=2 976 B18R2.15285 CCc1cc(ccc1OCC2CNC(=O)O2)Br 7a_100012338938_100000181169 [0,1,0,0,0,0|1,0,0]=2 977 B18R2.15285 CCc1cc(ccc1OCC2CNC(=O)O2)C 34a_100009844793_100000181169 [0,1,0,0,0,0|1,0,0]=2 978 B18R2.15285 CCc1cc(ccc1OCC2CNC(=O)O2)C 7a_100009844793_100000181169 [0,1,0,0,0,0|1,0,0]=2 979 B18R2.15285 CCc1cc(ccc1OCC2CNC(=O)O2)F 34a_200000035566_100000181169 [0,1,0,0,0,0|1,0,0]=2 980 B18R2.15285 CCc1cc(ccc1OCC2CNC(=O)O2)F 7a_200000035566_100000181169 [0,1,0,0,0,0|1,0,0]=2 981 B18R2.15285 CCc1cc(ccc1OCC2COC(=O)O2)Br 34a_100012338938_100000073702 [0,1,0,0,0,0|2,0,0]=3 982 B18R2.15285 CCc1cc(ccc1OCC2COC(=O)O2)C 34a_100009844793_100000073702 [0,1,0,0,0,0|2,0,0]=3 983 B18R2.15285 CCc1cc(ccc1OCC2COC(=O)O2)F 34a_200000035566_100000073702 [0,1,0,0,0,0|2,0,0]=3 984 B18R2.15285 CCc1cc(ccc1OC[C@@H]2CCC(=O)N2)Br 7a_100012338938_100015189358 [0,1,0,0,0,0|3,0,0]=4 985 B18R2.15285 CCc1cc(ccc1OC[C@@H]2CCC(=O)N2)C 7a_100009844793_100015189358 [0,1,0,0,0,0|3,0,0]=4 986 B18R2.15285 CCc1cc(ccc1OC[C@@H]2CCC(=O)N2)F 7a_200000035566_100015189358 [0,1,0,0,0,0|3,0,0]=4 987 B18R2.15285 CCc1cc(ccc1OC[C@H]2COC(=O)N2)Br 34a_100012338938_100015307671 [0,1,0,0,0,0|3,0,0]=4 988 B18R2.15285 CCc1cc(ccc1OC[C@H]2COC(=O)N2)Br 7a_100012338938_100015307671 [0,1,0,0,0,0|3,0,0]=4 989 B18R2.15285 CCc1cc(ccc1OC[C@H]2COC(=O)N2)C 34a_100009844793_100015307671 [0,1,0,0,0,0|3,0,0]=4 990 B18R2.15285 CCc1cc(ccc1OC[C@H]2COC(=O)N2)C 7a_100009844793_100015307671 [0,1,0,0,0,0|3,0,0]=4 991 B18R2.15285 CCc1cc(ccc1OC[C@H]2COC(=O)N2)F 34a_200000035566_100015307671 [0,1,0,0,0,0|3,0,0]=4 992 B18R2.15285 CCc1cc(ccc1OC[C@H]2COC(=O)N2)F 7a_200000035566_100015307671 [0,1,0,0,0,0|3,0,0]=4 993 B18R2.15285 CCc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100011216195 [0,1,0,0,0,0|1,1,0]=3 994 B18R2.15285 CCc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100011216195_100000181169 [0,1,0,0,0,0|1,1,0]=3 995 B18R2.15285 CCc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_100010109747 [0,1,0,0,0,0|1,1,0]=3 996 B18R2.15285 CCc1cc(ccc1SCC2CNC(=O)O2)N 62a_100010109747_100000181169 [0,1,0,0,0,0|1,1,0]=3 997 B18R2.15285 CCc1cc(ccc1SCC2COC(=O)O2)Br 62a_100000073702_100011216195 [0,1,0,0,0,0|2,1,0]=4 998 B18R2.15285 CCc1cc(ccc1SCC2COC(=O)O2)Br 62a_100011216195_100000073702 [0,1,0,0,0,0|2,1,0]=4 999 B18R2.15285 CCc1cc(ccc1SCC2COC(=O)O2)N 62a_100000073702_100010109747 [0,1,0,0,0,0|2,1,0]=4 1000 B18R2.15285 CCc1cc(ccc1SCC2COC(=O)O2)N 62a_100010109747_100000073702 [0,1,0,0,0,0|2,1,0]=4 1001 B18R2.15285 CCc1nc(ccc1OCC2CNC(=O)O2)C 34a_100000718140_100000181169 [0,1,0,0,0,0|2,0,0]=3 1002 B18R2.15285 CCc1nc(ccc1OCC2CNC(=O)O2)C 7a_100000718140_100000181169 [0,1,0,0,0,0|2,0,0]=3 1003 B18R2.15285 CCc1nc(ccc1OCC2COC(=O)O2)C 34a_100000718140_100000073702 [0,1,0,0,0,0|3,0,0]=4 1004 B18R2.15285 CNc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100020633008 [0,1,0,0,0,0|1,1,0]=3 1005 B18R2.15285 CNc1cc(ccc1SCC2CNC(=O)O2)F 62a_100020633008_100000181169 [0,1,0,0,0,0|1,1,0]=3 1006 B18R2.15285 CNc1cc(ccc1SCC2COC(=O)O2)F 62a_100000073702_100020633008 [0,1,0,0,0,0|2,1,0]=4 1007 B18R2.15285 CNc1cc(ccc1SCC2COC(=O)O2)F 62a_100020633008_100000073702 [0,1,0,0,0,0|2,1,0]=4 1008 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)Br 207a_100000697751_100000697075 [0,1,0,0,0,0|3,0,0]=4 1009 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)Br 2230a_100000697751_100012359436 [0,1,0,0,0,0|3,0,0]=4 1010 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)C 207a_100000697751_100000689369 [0,1,0,0,0,0|3,0,0]=4 1011 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)Cl 207a_100000697751_100000235374 [0,1,0,0,0,0|3,0,0]=4 1012 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)F 207a_100000697751_100000042785 [0,1,0,0,0,0|3,0,0]=4 1013 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)F 2230a_100000697751_200010171551 [0,1,0,0,0,0|3,0,0]=4 1014 B18R2.15285 COc1cc(ccc1CNC2CNC(=O)C2)I 207a_100000697751_100010290300 [0,1,0,0,0,0|3,0,0]=4 1015 B18R2.15285 COc1cc(ccc1CNC2COC(=O)O2)F 34a_100000062129_100000032252 [0,1,0,0,0,0|3,0,0]=4 1016 B18R2.15285 COc1cc(ccc1COC2CNC(=O)C2)Br 34a_100000690082_100012359436 [0,1,0,0,0,0|3,0,0]=4 1017 B18R2.15285 COc1cc(ccc1COC2CNC(=O)C2)F 34a_100000690082_200010171551 [0,1,0,0,0,0|3,0,0]=4 1018 B18R2.15285 COc1cc(ccc1COC2COC(=O)O2)Br 34a_100011277633_100000032252 [0,1,0,0,0,0|3,0,0]=4 1019 B18R2.15285 COc1cc(ccc1COC2COC(=O)O2)C 34a_200012017176_100000032252 [0,1,0,0,0,0|3,0,0]=4 1020 B18R2.15285 COc1cc(ccc1COC2COC(=O)O2)Cl 34a_200011215853_100000032252 [0,1,0,0,0,0|3,0,0]=4 1021 B18R2.15285 COc1cc(ccc1COC2COC(=O)O2)F 34a_100000117171_100000032252 [0,1,0,0,0,0|3,0,0]=4 1022 B18R2.15285 COc1cc(ccc1COC2COC(=O)O2)I 34a_100010233823_100000032252 [0,1,0,0,0,0|3,0,0]=4 1023 B18R2.15285 COc1cc(ccc1COC2COC(=O)O2)N 34a_100012183141_100000032252 [0,1,0,0,0,0|3,0,0]=4 1024 B18R2.15285 COc1cc(ccc1CSC2COC(=O)O2)Br 62a_100012359436_100000032252 [0,1,0,0,0,0|3,0,0]=4 1025 B18R2.15285 COc1cc(ccc1CSC2COC(=O)O2)F 62a_200010171551_100000032252 [0,1,0,0,0,0|3,0,0]=4 1026 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)Br 34a_100011279103_100000181169 [0,1,0,0,0,0|1,0,0]=2 1027 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)C 2230a_100000746441_100000181169 [0,1,0,0,0,0|1,0,0]=2 1028 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)C 34a_100000746441_100000181169 [0,1,0,0,0,0|1,0,0]=2 1029 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)Cl 34a_100000707585_100000181169 [0,1,0,0,0,0|1,0,0]=2 1030 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)F 34a_100000737216_100000181169 [0,1,0,0,0,0|1,0,0]=2 1031 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)I 34a_100015196925_100000181169 [0,1,0,0,0,0|1,0,0]=2 1032 B18R2.15285 COc1cc(ccc1NCC2CNC(=O)O2)O 34a_100015326901_100000181169 [0,1,0,0,0,0|1,0,0]=2 1033 B18R2.15285 COc1cc(ccc1NCC2COC(=O)O2)Br 34a_100011279103_100000073702 [0,1,0,0,0,0|2,0,0]=3 1034 B18R2.15285 COc1cc(ccc1NCC2COC(=O)O2)C 34a_100000746441_100000073702 [0,1,0,0,0,0|2,0,0]=3 1035 B18R2.15285 COc1cc(ccc1NCC2COC(=O)O2)Cl 34a_100000707585_100000073702 [0,1,0,0,0,0|2,0,0]=3 1036 B18R2.15285 COc1cc(ccc1NCC2COC(=O)O2)F 34a_100000737216_100000073702 [0,1,0,0,0,0|2,0,0]=3 1037 B18R2.15285 COc1cc(ccc1NCC2COC(=O)O2)I 34a_100015196925_100000073702 [0,1,0,0,0,0|2,0,0]=3 1038 B18R2.15285 COc1cc(ccc1NCC2COC(=O)O2)O 34a_100015326901_100000073702 [0,1,0,0,0,0|2,0,0]=3 1039 B18R2.15285 COc1cc(ccc1NC[C@@H]2CCC(=O)N2)C 2230a_100000746441_100015189358 [0,1,0,0,0,0|3,0,0]=4 1040 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)Br 34a_100011279103_100015307671 [0,1,0,0,0,0|3,0,0]=4 1041 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)C 2230a_100000746441_100015307671 [0,1,0,0,0,0|3,0,0]=4 1042 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)C 34a_100000746441_100015307671 [0,1,0,0,0,0|3,0,0]=4 1043 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)Cl 34a_100000707585_100015307671 [0,1,0,0,0,0|3,0,0]=4 1044 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)F 34a_100000737216_100015307671 [0,1,0,0,0,0|3,0,0]=4 1045 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)I 34a_100015196925_100015307671 [0,1,0,0,0,0|3,0,0]=4 1046 B18R2.15285 COc1cc(ccc1NC[C@H]2COC(=O)N2)O 34a_100015326901_100015307671 [0,1,0,0,0,0|3,0,0]=4 1047 B18R2.15285 COc1cc(ccc1OCC2=CC(=O)OC2)Br 34a_100000694246_100000716558 [0,1,0,0,0,0|2,0,1]=4 1048 B18R2.15285 COc1cc(ccc1OCC2=CC(=O)OC2)C 34a_100000186466_100000716558 [0,1,0,0,0,0|2,0,1]=4 1049 B18R2.15285 COc1cc(ccc1OCC2=CC(=O)OC2)Cl 34a_100000033002_100000716558 [0,1,0,0,0,0|2,0,1]=4 1050 B18R2.15285 COc1cc(ccc1OCC2=CC(=O)OC2)F 34a_100000036057_100000716558 [0,1,0,0,0,0|2,0,1]=4 1051 B18R2.15285 COc1cc(ccc1OCC2=CC(=O)OC2)I 34a_100000049635_100000716558 [0,1,0,0,0,0|2,0,1]=4 1052 B18R2.15285 COc1cc(ccc1OCC2=CC(=O)OC2)N 34a_100000726020_100000716558 [0,1,0,0,0,0|2,0,1]=4 1053 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000694246_100000181169 [0,1,0,0,0,0|0,0,0]=1 1054 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000694246_100000181169 [0,1,0,0,0,0|0,0,0]=1 1055 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)C 34a_100000186466_100000181169 [0,1,0,0,0,0|0,0,0]=1 1056 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000033002_100000181169 [0,1,0,0,0,0|0,0,0]=1 1057 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)F 34a_100000036057_100000181169 [0,1,0,0,0,0|0,0,0]=1 1058 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)F 7a_100000036057_100000181169 [0,1,0,0,0,0|0,0,0]=1 1059 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)I 34a_100000049635_100000181169 [0,1,0,0,0,0|0,0,0]=1 1060 B18R2.15285 COc1cc(ccc1OCC2CNC(=O)O2)N 34a_100000726020_100000181169 [0,1,0,0,0,0|0,0,0]=1 1061 B18R2.15285 COc1cc(ccc1OCC2COC(=O)O2)Br 34a_100000694246_100000073702 [0,1,0,0,0,0|1,0,0]=2 1062 B18R2.15285 COc1cc(ccc1OCC2COC(=O)O2)C 34a_100000186466_100000073702 [0,1,0,0,0,0|1,0,0]=2 1063 B18R2.15285 COc1cc(ccc1OCC2COC(=O)O2)Cl 34a_100000033002_100000073702 [0,1,0,0,0,0|1,0,0]=2 1064 B18R2.15285 COc1cc(ccc1OCC2COC(=O)O2)F 34a_100000036057_100000073702 [0,1,0,0,0,0|1,0,0]=2 1065 B18R2.15285 COc1cc(ccc1OCC2COC(=O)O2)I 34a_100000049635_100000073702 [0,1,0,0,0,0|1,0,0]=2 1066 B18R2.15285 COc1cc(ccc1OCC2COC(=O)O2)N 34a_100000726020_100000073702 [0,1,0,0,0,0|1,0,0]=2 1067 B18R2.15285 COc1cc(ccc1OC[C@@H]2CCC(=O)N2)Br 7a_100000694246_100015189358 [0,1,0,0,0,0|2,0,0]=3 1068 B18R2.15285 COc1cc(ccc1OC[C@@H]2CCC(=O)N2)F 7a_100000036057_100015189358 [0,1,0,0,0,0|2,0,0]=3 1069 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)Br 34a_100000694246_100015307671 [0,1,0,0,0,0|2,0,0]=3 1070 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)Br 7a_100000694246_100015307671 [0,1,0,0,0,0|2,0,0]=3 1071 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)C 34a_100000186466_100015307671 [0,1,0,0,0,0|2,0,0]=3 1072 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)Cl 34a_100000033002_100015307671 [0,1,0,0,0,0|2,0,0]=3 1073 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)F 34a_100000036057_100015307671 [0,1,0,0,0,0|2,0,0]=3 1074 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)F 7a_100000036057_100015307671 [0,1,0,0,0,0|2,0,0]=3 1075 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)I 34a_100000049635_100015307671 [0,1,0,0,0,0|2,0,0]=3 1076 B18R2.15285 COc1cc(ccc1OC[C@H]2COC(=O)N2)N 34a_100000726020_100015307671 [0,1,0,0,0,0|2,0,0]=3 1077 B18R2.15285 COc1cc(ccc1OCc2n[nH]c(=O)[nH]2)Br 7a_100000694246_100000754189 [0,1,0,0,0,0|2,0,1]=4 1078 B18R2.15285 COc1cc(ccc1OCc2n[nH]c(=O)[nH]2)F 7a_100000036057_100000754189 [0,1,0,0,0,0|2,0,1]=4 1079 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100010245111 [0,1,0,0,0,0|0,1,0]=2 1080 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100010245111_100000181169 [0,1,0,0,0,0|0,1,0]=2 1081 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)C 62a_100000181169_100010200004 [0,1,0,0,0,0|0,1,0]=2 1082 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)C 62a_100010200004_100000181169 [0,1,0,0,0,0|0,1,0]=2 1083 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000050115_100000181169 [0,1,0,0,0,0|0,1,0]=2 1084 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100000050115 [0,1,0,0,0,0|0,1,0]=2 1085 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100000757151 [0,1,0,0,0,0|0,1,0]=2 1086 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000757151_100000181169 [0,1,0,0,0,0|0,1,0]=2 1087 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_100000765947 [0,1,0,0,0,0|0,1,0]=2 1088 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000765947_100000181169 [0,1,0,0,0,0|0,1,0]=2 1089 B18R2.15285 COc1cc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_100011827694 [0,1,0,0,0,0|0,1,0]=2 1090 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)Br 62a_100000073702_100010245111 [0,1,0,0,0,0|1,1,0]=3 1091 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)Br 62a_100010245111_100000073702 [0,1,0,0,0,0|1,1,0]=3 1092 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)C 62a_100000073702_100010200004 [0,1,0,0,0,0|1,1,0]=3 1093 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)C 62a_100010200004_100000073702 [0,1,0,0,0,0|1,1,0]=3 1094 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)Cl 62a_100000050115_100000073702 [0,1,0,0,0,0|1,1,0]=3 1095 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)Cl 62a_100000073702_100000050115 [0,1,0,0,0,0|1,1,0]=3 1096 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)F 62a_100000073702_100000757151 [0,1,0,0,0,0|1,1,0]=3 1097 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)F 62a_100000757151_100000073702 [0,1,0,0,0,0|1,1,0]=3 1098 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)N 62a_100000073702_100000765947 [0,1,0,0,0,0|1,1,0]=3 1099 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)N 62a_100000765947_100000073702 [0,1,0,0,0,0|1,1,0]=3 1100 B18R2.15285 COc1cc(ccc1SCC2COC(=O)O2)O 62a_100000073702_100011827694 [0,1,0,0,0,0|1,1,0]=3 1101 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)Br 62a_100010245111_100015189358 [0,1,0,0,0,0|2,1,0]=4 1102 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)Br 62a_100015189358_100010245111 [0,1,0,0,0,0|2,1,0]=4 1103 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)C 62a_100010200004_100015189358 [0,1,0,0,0,0|2,1,0]=4 1104 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)C 62a_100015189358_100010200004 [0,1,0,0,0,0|2,1,0]=4 1105 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)Cl 62a_100000050115_100015189358 [0,1,0,0,0,0|2,1,0]=4 1106 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)Cl 62a_100015189358_100000050115 [0,1,0,0,0,0|2,1,0]=4 1107 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)F 62a_100000757151_100015189358 [0,1,0,0,0,0|2,1,0]=4 1108 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)F 62a_100015189358_100000757151 [0,1,0,0,0,0|2,1,0]=4 1109 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)N 62a_100000765947_100015189358 [0,1,0,0,0,0|2,1,0]=4 1110 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)N 62a_100015189358_100000765947 [0,1,0,0,0,0|2,1,0]=4 1111 B18R2.15285 COc1cc(ccc1SC[C@@H]2CCC(=O)N2)O 62a_100015189358_100011827694 [0,1,0,0,0,0|2,1,0]=4 1112 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)Br 62a_100010245111_100015307671 [0,1,0,0,0,0|2,1,0]=4 1113 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)Br 62a_100015307671_100010245111 [0,1,0,0,0,0|2,1,0]=4 1114 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)C 62a_100010200004_100015307671 [0,1,0,0,0,0|2,1,0]=4 1115 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)C 62a_100015307671_100010200004 [0,1,0,0,0,0|2,1,0]=4 1116 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)Cl 62a_100000050115_100015307671 [0,1,0,0,0,0|2,1,0]=4 1117 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)Cl 62a_100015307671_100000050115 [0,1,0,0,0,0|2,1,0]=4 1118 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)F 62a_100000757151_100015307671 [0,1,0,0,0,0|2,1,0]=4 1119 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)F 62a_100015307671_100000757151 [0,1,0,0,0,0|2,1,0]=4 1120 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)N 62a_100000765947_100015307671 [0,1,0,0,0,0|2,1,0]=4 1121 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)N 62a_100015307671_100000765947 [0,1,0,0,0,0|2,1,0]=4 1122 B18R2.15285 COc1cc(ccc1SC[C@H]2COC(=O)N2)O 62a_100015307671_100011827694 [0,1,0,0,0,0|2,1,0]=4 1123 B18R2.15285 COc1cc(cnc1OCC2CNC(=O)O2)Cl 34a_200009845368_100000181169 [0,1,0,0,0,0|1,0,0]=2 1124 B18R2.15285 COc1cc(cnc1OCC2COC(=O)O2)Cl 34a_200009845368_100000073702 [0,1,0,0,0,0|2,0,0]=3 1125 B18R2.15285 COc1cc(cnc1OC[C@H]2COC(=O)N2)Cl 34a_200009845368_100015307671 [0,1,0,0,0,0|3,0,0]=4 1126 B18R2.15285 COc1cc(cnc1SCC2CNC(=O)O2)C 62a_100000181169_200000118316 [0,1,0,0,0,0|1,1,0]=3 1127 B18R2.15285 COc1cc(cnc1SCC2CNC(=O)O2)F 62a_100000181169_100009867738 [0,1,0,0,0,0|1,1,0]=3 1128 B18R2.15285 COc1cc(cnc1SCC2CNC(=O)O2)F 62a_100010136273_100000181169 [0,1,0,0,0,0|1,1,0]=3 1129 B18R2.15285 COc1cc(cnc1SCC2CNC(=O)O2)N 62a_100000181169_100000097218 [0,1,0,0,0,0|1,1,0]=3 1130 B18R2.15285 COc1cc(cnc1SCC2CNC(=O)O2)N 62a_200010291755_100000181169 [0,1,0,0,0,0|1,1,0]=3 1131 B18R2.15285 COc1cc(cnc1SCC2COC(=O)O2)C 62a_100000073702_200000118316 [0,1,0,0,0,0|2,1,0]=4 1132 B18R2.15285 COc1cc(cnc1SCC2COC(=O)O2)F 62a_100000073702_100009867738 [0,1,0,0,0,0|2,1,0]=4 1133 B18R2.15285 COc1cc(cnc1SCC2COC(=O)O2)F 62a_100010136273_100000073702 [0,1,0,0,0,0|2,1,0]=4 1134 B18R2.15285 COc1cc(cnc1SCC2COC(=O)O2)N 62a_100000073702_100000097218 [0,1,0,0,0,0|2,1,0]=4 1135 B18R2.15285 COc1cc(cnc1SCC2COC(=O)O2)N 62a_200010291755_100000073702 [0,1,0,0,0,0|2,1,0]=4 1136 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)C 62a_100000181169_100000717771 [0,1,0,0,0,0|1,1,0]=3 1137 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)C 62a_100000717771_100000181169 [0,1,0,0,0,0|1,1,0]=3 1138 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010154656 [0,1,0,0,0,0|1,1,0]=3 1139 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)Cl 62a_100010154656_100000181169 [0,1,0,0,0,0|1,1,0]=3 1140 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)F 62a_100000181169_100010135560 [0,1,0,0,0,0|1,1,0]=3 1141 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)F 62a_100010135560_100000181169 [0,1,0,0,0,0|1,1,0]=3 1142 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)N 62a_100000181169_100015506990 [0,1,0,0,0,0|1,1,0]=3 1143 B18R2.15285 COc1cc(ncc1SCC2CNC(=O)O2)N 62a_100015506990_100000181169 [0,1,0,0,0,0|1,1,0]=3 1144 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)C 62a_100000073702_100000717771 [0,1,0,0,0,0|2,1,0]=4 1145 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)C 62a_100000717771_100000073702 [0,1,0,0,0,0|2,1,0]=4 1146 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)Cl 62a_100000073702_100010154656 [0,1,0,0,0,0|2,1,0]=4 1147 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)Cl 62a_100010154656_100000073702 [0,1,0,0,0,0|2,1,0]=4 1148 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)F 62a_100000073702_100010135560 [0,1,0,0,0,0|2,1,0]=4 1149 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)F 62a_100010135560_100000073702 [0,1,0,0,0,0|2,1,0]=4 1150 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)N 62a_100000073702_100015506990 [0,1,0,0,0,0|2,1,0]=4 1151 B18R2.15285 COc1cc(ncc1SCC2COC(=O)O2)N 62a_100015506990_100000073702 [0,1,0,0,0,0|2,1,0]=4 1152 B18R2.15285 COc1nc(ccc1OCC2CNC(=O)O2)Br 34a_100010893133_100000181169 [0,1,0,0,0,0|1,0,0]=2 1153 B18R2.15285 COc1nc(ccc1OCC2COC(=O)O2)Br 34a_100010893133_100000073702 [0,1,0,0,0,0|2,0,0]=3 1154 B18R2.15285 COc1nc(ccc1OC[C@H]2COC(=O)N2)Br 34a_100010893133_100015307671 [0,1,0,0,0,0|3,0,0]=4 1155 B18R2.15285 COc1nc(ccc1SCC2CNC(=O)O2)C 62a_100000181169_100010138632 [0,1,0,0,0,0|1,1,0]=3 1156 B18R2.15285 COc1nc(ccc1SCC2CNC(=O)O2)C 62a_100010138632_100000181169 [0,1,0,0,0,0|1,1,0]=3 1157 B18R2.15285 COc1nc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_100010187630 [0,1,0,0,0,0|1,1,0]=3 1158 B18R2.15285 COc1nc(ccc1SCC2CNC(=O)O2)N 62a_100010187630_100000181169 [0,1,0,0,0,0|1,1,0]=3 1159 B18R2.15285 COc1nc(ccc1SCC2COC(=O)O2)C 62a_100000073702_100010138632 [0,1,0,0,0,0|2,1,0]=4 1160 B18R2.15285 COc1nc(ccc1SCC2COC(=O)O2)C 62a_100010138632_100000073702 [0,1,0,0,0,0|2,1,0]=4 1161 B18R2.15285 COc1nc(ccc1SCC2COC(=O)O2)N 62a_100000073702_100010187630 [0,1,0,0,0,0|2,1,0]=4 1162 B18R2.15285 COc1nc(ccc1SCC2COC(=O)O2)N 62a_100010187630_100000073702 [0,1,0,0,0,0|2,1,0]=4 1163 B18R2.15285 COc1nc(cnc1SCC2CNC(=O)O2)Br 62a_100000181169_100010214903 [0,1,0,0,0,0|2,1,0]=4 1164 B18R2.15285 COc1nc(cnc1SCC2CNC(=O)O2)Br 62a_100010214903_100000181169 [0,1,0,0,0,0|2,1,0]=4 1165 B18R2.15285 COc1nc(cnc1SCC2CNC(=O)O2)N 62a_100000181169_100010128448 [0,1,0,0,0,0|2,1,0]=4 1166 B18R2.15285 COc1nc(cnc1SCC2CNC(=O)O2)N 62a_100010128448_100000181169 [0,1,0,0,0,0|2,1,0]=4 1167 B18R2.15285 COc1nc(ncc1SCC2CNC(=O)O2)Cl 62a_100000181169_200010294032 [0,1,0,0,0,0|2,1,0]=4 1168 B18R2.15285 COc1nc(ncc1SCC2CNC(=O)O2)Cl 62a_200010294032_100000181169 [0,1,0,0,0,0|2,1,0]=4 1169 B18R2.15285 COc1nc(ncc1SCC2CNC(=O)O2)N 62a_100000181169_100010240410 [0,1,0,0,0,0|2,1,0]=4 1170 B18R2.15285 COc1nc(ncc1SCC2CNC(=O)O2)N 62a_100010240410_100000181169 [0,1,0,0,0,0|2,1,0]=4 1171 B18R2.15285 CSc1cc(ccc1SCC2CNC(=O)O2)C 62a_100000181169_200010709736 [0,1,0,0,0,0|0,2,0]=3 1172 B18R2.15285 CSc1cc(ccc1SCC2CNC(=O)O2)C 62a_200010709736_100000181169 [0,1,0,0,0,0|0,2,0]=3 1173 B18R2.15285 CSc1cc(ccc1SCC2COC(=O)O2)C 62a_100000073702_200010709736 [0,1,0,0,0,0|1,2,0]=4 1174 B18R2.15285 CSc1cc(ccc1SCC2COC(=O)O2)C 62a_200010709736_100000073702 [0,1,0,0,0,0|1,2,0]=4 1175 B18R2.15285 CSc1cc(cnc1SCC2CNC(=O)O2)C 62a_100000181169_100010884634 [0,1,0,0,0,0|1,2,0]=4 1176 B18R2.15285 CSc1cc(cnc1SCC2CNC(=O)O2)C 62a_100010884634_100000181169 [0,1,0,0,0,0|1,2,0]=4 1177 B18R2.15285 Cc1ccc(c(c1)C#N)NCC2CNC(=O)O2 7a_100011934023_100000181169 [0,1,0,0,0,0|3,0,0]=4 1178 B18R2.15285 Cc1ccc(c(c1)C#N)OCC2CNC(=O)O2 34a_200012180384_100000181169 [0,1,0,0,0,0|2,0,0]=3 1179 B18R2.15285 Cc1ccc(c(c1)C#N)OCC2CNC(=O)O2 7a_200012180384_100000181169 [0,1,0,0,0,0|2,0,0]=3 1180 B18R2.15285 Cc1ccc(c(c1)C#N)OCC2COC(=O)O2 34a_200012180384_100000073702 [0,1,0,0,0,0|3,0,0]=4 1181 B18R2.15285 Cc1ccc(c(c1)C#N)SCC2CNC(=O)O2 62a_100000181169_100011935190 [0,1,0,0,0,0|2,1,0]=4 1182 B18R2.15285 Cc1ccc(c(c1)C=O)SCC2CNC(=O)O2 62a_100000181169_100011551863 [0,1,0,0,0,0|2,1,0]=4 1183 B18R2.15285 Cc1ccc(c(c1)C=O)SCC2CNC(=O)O2 62a_100011551863_100000181169 [0,1,0,0,0,0|2,1,0]=4 1184 B18R2.15285 Cc1ccc(c(c1)CO)NCC2CNC(=O)O2 34a_100011215565_100000181169 [0,1,0,0,0,0|3,0,0]=4 1185 B18R2.15285 Cc1ccc(c(c1)CO)OCC2CNC(=O)O2 34a_200011846009_100000181169 [0,1,0,0,0,0|2,0,0]=3 1186 B18R2.15285 Cc1ccc(c(c1)CO)OCC2CNC(=O)O2 7a_200011846009_100000181169 [0,1,0,0,0,0|2,0,0]=3 1187 B18R2.15285 Cc1ccc(c(c1)CO)OCC2COC(=O)O2 34a_200011846009_100000073702 [0,1,0,0,0,0|3,0,0]=4 1188 B18R2.15285 Cc1ccc(c(c1)CO)SCC2CNC(=O)O2 62a_100000181169_100012361352 [0,1,0,0,0,0|2,1,0]=4 1189 B18R2.15285 Cc1ccc(c(c1)CO)SCC2CNC(=O)O2 62a_100012361352_100000181169 [0,1,0,0,0,0|2,1,0]=4 1190 B18R2.15285 Cc1ccc(c(n1)CCl)OCC2CNC(=O)O2 34a_100020630696_100000181169 [0,1,0,0,0,0|3,0,0]=4 1191 B18R2.15285 Cc1ccc(c(n1)CCl)OCC2CNC(=O)O2 7a_100020630696_100000181169 [0,1,0,0,0,0|3,0,0]=4 1192 B18R2.15285 Cc1ccc(c(n1)CO)OCC2CNC(=O)O2 34a_100000751967_100000181169 [0,1,0,0,0,0|3,0,0]=4 1193 B18R2.15285 N#Cc1cc(ccc1NCC2CNC(=O)O2)Br 7a_100000688460_100000181169 [0,1,0,0,0,0|3,0,0]=4 1194 B18R2.15285 N#Cc1cc(ccc1NCC2CNC(=O)O2)Cl 7a_100011219925_100000181169 [0,1,0,0,0,0|3,0,0]=4 1195 B18R2.15285 N#Cc1cc(ccc1NCC2CNC(=O)O2)F 34a_100000685569_100000181169 [0,1,0,0,0,0|3,0,0]=4 1196 B18R2.15285 N#Cc1cc(ccc1NCC2CNC(=O)O2)F 7a_100000685569_100000181169 [0,1,0,0,0,0|3,0,0]=4 1197 B18R2.15285 N#Cc1cc(ccc1NCC2CNC(=O)O2)I 7a_100000049818_100000181169 [0,1,0,0,0,0|3,0,0]=4 1198 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000687585_100000181169 [0,1,0,0,0,0|2,0,0]=3 1199 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000687585_100000181169 [0,1,0,0,0,0|2,0,0]=3 1200 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100011219380_100000181169 [0,1,0,0,0,0|2,0,0]=3 1201 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)Cl 7a_100011219380_100000181169 [0,1,0,0,0,0|2,0,0]=3 1202 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)F 34a_100011900173_100000181169 [0,1,0,0,0,0|2,0,0]=3 1203 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)F 7a_100011900173_100000181169 [0,1,0,0,0,0|2,0,0]=3 1204 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)I 34a_200000049958_100000181169 [0,1,0,0,0,0|2,0,0]=3 1205 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)I 7a_200000049958_100000181169 [0,1,0,0,0,0|2,0,0]=3 1206 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)N 34a_100011249283_100000181169 [0,1,0,0,0,0|2,0,0]=3 1207 B18R2.15285 N#Cc1cc(ccc1OCC2CNC(=O)O2)N 7a_100011249283_100000181169 [0,1,0,0,0,0|2,0,0]=3 1208 B18R2.15285 N#Cc1cc(ccc1OCC2COC(=O)O2)Br 34a_100000687585_100000073702 [0,1,0,0,0,0|3,0,0]=4 1209 B18R2.15285 N#Cc1cc(ccc1OCC2COC(=O)O2)Cl 34a_100011219380_100000073702 [0,1,0,0,0,0|3,0,0]=4 1210 B18R2.15285 N#Cc1cc(ccc1OCC2COC(=O)O2)F 34a_100011900173_100000073702 [0,1,0,0,0,0|3,0,0]=4 1211 B18R2.15285 N#Cc1cc(ccc1OCC2COC(=O)O2)I 34a_200000049958_100000073702 [0,1,0,0,0,0|3,0,0]=4 1212 B18R2.15285 N#Cc1cc(ccc1OCC2COC(=O)O2)N 34a_100011249283_100000073702 [0,1,0,0,0,0|3,0,0]=4 1213 B18R2.15285 N#Cc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100011219714 [0,1,0,0,0,0|2,1,0]=4 1214 B18R2.15285 N#Cc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000181169_200011356825 [0,1,0,0,0,0|2,1,0]=4 1215 B18R2.15285 N#Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100000747550 [0,1,0,0,0,0|2,1,0]=4 1216 B18R2.15285 N#Cc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_100011934039 [0,1,0,0,0,0|2,1,0]=4 1217 B18R2.15285 N#Cc1cc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_100009818209 [0,1,0,0,0,0|2,1,0]=4 1218 B18R2.15285 NCc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000730032_100000181169 [0,1,0,0,0,0|2,0,0]=3 1219 B18R2.15285 NCc1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000238540_100000181169 [0,1,0,0,0,0|2,0,0]=3 1220 B18R2.15285 NCc1cc(ccc1OCC2COC(=O)O2)Br 34a_100000730032_100000073702 [0,1,0,0,0,0|3,0,0]=4 1221 B18R2.15285 NCc1cc(ccc1OCC2COC(=O)O2)Cl 34a_100000238540_100000073702 [0,1,0,0,0,0|3,0,0]=4 1222 B18R2.15285 NCc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100000742738 [0,1,0,0,0,0|2,1,0]=4 1223 B18R2.15285 NCc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000742738_100000181169 [0,1,0,0,0,0|2,1,0]=4 1224 B18R2.15285 NNc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100012362518 [0,1,0,0,0,0|2,1,0]=4 1225 B18R2.15285 NNc1cc(ccc1SCC2CNC(=O)O2)F 62a_100012362518_100000181169 [0,1,0,0,0,0|2,1,0]=4 1226 B18R2.15285 Nc1ccc(c(c1)CO)SCC2CNC(=O)O2 62a_100000181169_100012347228 [0,1,0,0,0,0|2,1,0]=4 1227 B18R2.15285 Nc1ccc(c(c1)CO)SCC2CNC(=O)O2 62a_100012347228_100000181169 [0,1,0,0,0,0|2,1,0]=4 1228 B18R2.15285 O=C1NCC(O1)CNc2ccc(cc2CO)Br 34a_100012353972_100000181169 [0,1,0,0,0,0|3,0,0]=4 1229 B18R2.15285 O=C1NCC(O1)CNc2ccc(cc2CO)Cl 34a_100011214999_100000181169 [0,1,0,0,0,0|3,0,0]=4 1230 B18R2.15285 O=C1NCC(O1)CNc2ccc(cc2CO)F 34a_100011296978_100000181169 [0,1,0,0,0,0|3,0,0]=4 1231 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CBr)F 34a_100010161318_100000181169 [0,1,0,0,0,0|2,0,0]=3 1232 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CBr)F 7a_100010161318_100000181169 [0,1,0,0,0,0|2,0,0]=3 1233 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)Br 34a_100000184703_100000181169 [0,1,0,0,0,0|2,0,0]=3 1234 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)Br 7a_100000184703_100000181169 [0,1,0,0,0,0|2,0,0]=3 1235 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)Cl 34a_100011218961_100000181169 [0,1,0,0,0,0|2,0,0]=3 1236 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)Cl 7a_100011218961_100000181169 [0,1,0,0,0,0|2,0,0]=3 1237 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)F 34a_100011291448_100000181169 [0,1,0,0,0,0|2,0,0]=3 1238 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)F 7a_100011291448_100000181169 [0,1,0,0,0,0|2,0,0]=3 1239 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)I 34a_100000049520_100000181169 [0,1,0,0,0,0|2,0,0]=3 1240 B18R2.15285 O=C1NCC(O1)COc2ccc(cc2CO)I 7a_100000049520_100000181169 [0,1,0,0,0,0|2,0,0]=3 1241 B18R2.15285 O=C1NCC(O1)CSc2ccc(cc2CO)Br 62a_100000181169_100011356890 [0,1,0,0,0,0|2,1,0]=4 1242 B18R2.15285 O=C1NCC(O1)CSc2ccc(cc2CO)Br 62a_100011356890_100000181169 [0,1,0,0,0,0|2,1,0]=4 1243 B18R2.15285 O=C1NCC(O1)CSc2ccc(cc2CO)F 62a_100000181169_100011217561 [0,1,0,0,0,0|2,1,0]=4 1244 B18R2.15285 O=C1NCC(O1)CSc2ccc(cc2CO)F 62a_100011217561_100000181169 [0,1,0,0,0,0|2,1,0]=4 1245 B18R2.15285 O=C1NCC(O1)CSc2ccc(cc2CO)O 62a_100000181169_100012351483 [0,1,0,0,0,0|2,1,0]=4 1246 B18R2.15285 O=C1NCC(O1)CSc2ccc(cc2CO)O 62a_100012351483_100000181169 [0,1,0,0,0,0|2,1,0]=4 1247 B18R2.15285 O=C1OCC(O1)COc2ccc(cc2CBr)F 34a_100010161318_100000073702 [0,1,0,0,0,0|3,0,0]=4 1248 B18R2.15285 O=C1OCC(O1)COc2ccc(cc2CO)Br 34a_100000184703_100000073702 [0,1,0,0,0,0|3,0,0]=4 1249 B18R2.15285 O=C1OCC(O1)COc2ccc(cc2CO)Cl 34a_100011218961_100000073702 [0,1,0,0,0,0|3,0,0]=4 1250 B18R2.15285 O=C1OCC(O1)COc2ccc(cc2CO)F 34a_100011291448_100000073702 [0,1,0,0,0,0|3,0,0]=4 1251 B18R2.15285 O=C1OCC(O1)COc2ccc(cc2CO)I 34a_100000049520_100000073702 [0,1,0,0,0,0|3,0,0]=4 1252 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100010185651 [0,1,0,0,0,0|2,1,0]=4 1253 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100010185651_100000181169 [0,1,0,0,0,0|2,1,0]=4 1254 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010254386 [0,1,0,0,0,0|2,1,0]=4 1255 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100010254386_100000181169 [0,1,0,0,0,0|2,1,0]=4 1256 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100011218309 [0,1,0,0,0,0|2,1,0]=4 1257 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100011218309_100000181169 [0,1,0,0,0,0|2,1,0]=4 1258 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_100000690577 [0,1,0,0,0,0|2,1,0]=4 1259 B18R2.15285 O=Cc1cc(ccc1SCC2CNC(=O)O2)O 62a_100000690577_100000181169 [0,1,0,0,0,0|2,1,0]=4 1260 B18R2.15651 COc1ccccc1OCc2ccc(o2)C=O 34a_100000210385_200000079136 [0,1,0,0,0,0|1,0,2]=4 1261 B18R2.25452 CNc1c(cccc1SCC2CNC(=O)O2)N 62a_100010510394_100000181169 [0,1,0,0,0,0|1,1,0]=3 1262 B18R2.25452 CNc1c(cccc1SCC2COC(=O)O2)N 62a_100010510394_100000073702 [0,1,0,0,0,0|2,1,0]=4 1263 B18R2.25452 COc1c(cccc1CNC2CNC(=O)C2)Br 207a_100000697751_100000692592 [0,1,0,0,0,0|3,0,0]=4 1264 B18R2.25452 COc1c(cccc1CNC2CNC(=O)C2)Br 2230a_100000697751_100011470457 [0,1,0,0,0,0|3,0,0]=4 1265 B18R2.25452 COc1c(cccc1CNC2CNC(=O)C2)C 207a_100000697751_100011361485 [0,1,0,0,0,0|3,0,0]=4 1266 B18R2.25452 COc1c(cccc1CNC2CNC(=O)C2)C 2230a_100000697751_100012349798 [0,1,0,0,0,0|3,0,0]=4 1267 B18R2.25452 COc1c(cccc1CNC2CNC(=O)C2)Cl 207a_100000697751_100011466644 [0,1,0,0,0,0|3,0,0]=4 1268 B18R2.25452 COc1c(cccc1CNC2CNC(=O)C2)F 207a_100000697751_100011830294 [0,1,0,0,0,0|3,0,0]=4 1269 B18R2.25452 COc1c(cccc1CNC2COC(=O)O2)F 34a_100137345168_100000032252 [0,1,0,0,0,0|3,0,0]=4 1270 B18R2.25452 COc1c(cccc1COC2CNC(=O)C2)Br 34a_100000690082_100011470457 [0,1,0,0,0,0|3,0,0]=4 1271 B18R2.25452 COc1c(cccc1COC2CNC(=O)C2)C 34a_100000690082_100012349798 [0,1,0,0,0,0|3,0,0]=4 1272 B18R2.25452 COc1c(cccc1COC2COC(=O)O2)Br 34a_100000704359_100000032252 [0,1,0,0,0,0|3,0,0]=4 1273 B18R2.25452 COc1c(cccc1COC2COC(=O)O2)C 34a_100012184769_100000032252 [0,1,0,0,0,0|3,0,0]=4 1274 B18R2.25452 COc1c(cccc1COC2COC(=O)O2)F 34a_100011830279_100000032252 [0,1,0,0,0,0|3,0,0]=4 1275 B18R2.25452 COc1c(cccc1CSC2COC(=O)O2)Br 62a_100011470457_100000032252 [0,1,0,0,0,0|3,0,0]=4 1276 B18R2.25452 COc1c(cccc1CSC2COC(=O)O2)C 62a_100012349798_100000032252 [0,1,0,0,0,0|3,0,0]=4 1277 B18R2.25452 COc1c(cccc1NCC2CNC(=O)O2)Br 34a_100011935253_100000181169 [0,1,0,0,0,0|1,0,0]=2 1278 B18R2.25452 COc1c(cccc1NCC2CNC(=O)O2)C 34a_100012017360_100000181169 [0,1,0,0,0,0|1,0,0]=2 1279 B18R2.25452 COc1c(cccc1NCC2CNC(=O)O2)Cl 2230a_100000743799_100000181169 [0,1,0,0,0,0|1,0,0]=2 1280 B18R2.25452 COc1c(cccc1NCC2CNC(=O)O2)Cl 34a_100000743799_100000181169 [0,1,0,0,0,0|1,0,0]=2 1281 B18R2.25452 COc1c(cccc1NCC2CNC(=O)O2)F 34a_100011215007_100000181169 [0,1,0,0,0,0|1,0,0]=2 1282 B18R2.25452 COc1c(cccc1NCC2COC(=O)O2)Br 34a_100011935253_100000073702 [0,1,0,0,0,0|2,0,0]=3 1283 B18R2.25452 COc1c(cccc1NCC2COC(=O)O2)C 34a_100012017360_100000073702 [0,1,0,0,0,0|2,0,0]=3 1284 B18R2.25452 COc1c(cccc1NCC2COC(=O)O2)Cl 34a_100000743799_100000073702 [0,1,0,0,0,0|2,0,0]=3 1285 B18R2.25452 COc1c(cccc1NCC2COC(=O)O2)F 34a_100011215007_100000073702 [0,1,0,0,0,0|2,0,0]=3 1286 B18R2.25452 COc1c(cccc1NC[C@@H]2CCC(=O)N2)Cl 2230a_100000743799_100015189358 [0,1,0,0,0,0|3,0,0]=4 1287 B18R2.25452 COc1c(cccc1NC[C@H]2COC(=O)N2)Br 34a_100011935253_100015307671 [0,1,0,0,0,0|3,0,0]=4 1288 B18R2.25452 COc1c(cccc1NC[C@H]2COC(=O)N2)C 34a_100012017360_100015307671 [0,1,0,0,0,0|3,0,0]=4 1289 B18R2.25452 COc1c(cccc1NC[C@H]2COC(=O)N2)Cl 2230a_100000743799_100015307671 [0,1,0,0,0,0|3,0,0]=4 1290 B18R2.25452 COc1c(cccc1NC[C@H]2COC(=O)N2)Cl 34a_100000743799_100015307671 [0,1,0,0,0,0|3,0,0]=4 1291 B18R2.25452 COc1c(cccc1NC[C@H]2COC(=O)N2)F 34a_100011215007_100015307671 [0,1,0,0,0,0|3,0,0]=4 1292 B18R2.25452 COc1c(cccc1OCC2=CC(=O)OC2)Br 34a_100010234590_100000716558 [0,1,0,0,0,0|2,0,1]=4 1293 B18R2.25452 COc1c(cccc1OCC2=CC(=O)OC2)Cl 34a_200009886253_100000716558 [0,1,0,0,0,0|2,0,1]=4 1294 B18R2.25452 COc1c(cccc1OCC2CNC(=O)O2)Br 34a_100010234590_100000181169 [0,1,0,0,0,0|0,0,0]=1 1295 B18R2.25452 COc1c(cccc1OCC2CNC(=O)O2)Cl 34a_200009886253_100000181169 [0,1,0,0,0,0|0,0,0]=1 1296 B18R2.25452 COc1c(cccc1OCC2CNC(=O)O2)Cl 7a_200009886253_100000181169 [0,1,0,0,0,0|0,0,0]=1 1297 B18R2.25452 COc1c(cccc1OCC2COC(=O)O2)Br 34a_100010234590_100000073702 [0,1,0,0,0,0|1,0,0]=2 1298 B18R2.25452 COc1c(cccc1OCC2COC(=O)O2)Cl 34a_200009886253_100000073702 [0,1,0,0,0,0|1,0,0]=2 1299 B18R2.25452 COc1c(cccc1OC[C@@H]2CCC(=O)N2)Cl 7a_200009886253_100015189358 [0,1,0,0,0,0|2,0,0]=3 1300 B18R2.25452 COc1c(cccc1OC[C@H]2COC(=O)N2)Br 34a_100010234590_100015307671 [0,1,0,0,0,0|2,0,0]=3 1301 B18R2.25452 COc1c(cccc1OC[C@H]2COC(=O)N2)Cl 34a_200009886253_100015307671 [0,1,0,0,0,0|2,0,0]=3 1302 B18R2.25452 COc1c(cccc1OC[C@H]2COC(=O)N2)Cl 7a_200009886253_100015307671 [0,1,0,0,0,0|2,0,0]=3 1303 B18R2.25452 COc1c(cccc1OCc2n[nH]c(=O)[nH]2)Cl 7a_200009886253_100000754189 [0,1,0,0,0,0|2,0,1]=4 1304 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)Br 62a_100000181169_100010146560 [0,1,0,0,0,0|0,1,0]=2 1305 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)Br 62a_100010146560_100000181169 [0,1,0,0,0,0|0,1,0]=2 1306 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)C 62a_100000181169_100010141385 [0,1,0,0,0,0|0,1,0]=2 1307 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)C 62a_100010141385_100000181169 [0,1,0,0,0,0|0,1,0]=2 1308 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010147678 [0,1,0,0,0,0|0,1,0]=2 1309 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100010147678_100000181169 [0,1,0,0,0,0|0,1,0]=2 1310 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100009816759 [0,1,0,0,0,0|0,1,0]=2 1311 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)F 62a_100009816759_100000181169 [0,1,0,0,0,0|0,1,0]=2 1312 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)N 62a_100011935253_100000181169 [0,1,0,0,0,0|0,1,0]=2 1313 B18R2.25452 COc1c(cccc1SCC2CNC(=O)O2)O 62a_100000181169_100010234590 [0,1,0,0,0,0|0,1,0]=2 1314 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)Br 62a_100000073702_100010146560 [0,1,0,0,0,0|1,1,0]=3 1315 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)Br 62a_100010146560_100000073702 [0,1,0,0,0,0|1,1,0]=3 1316 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)C 62a_100000073702_100010141385 [0,1,0,0,0,0|1,1,0]=3 1317 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)C 62a_100010141385_100000073702 [0,1,0,0,0,0|1,1,0]=3 1318 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)Cl 62a_100000073702_100010147678 [0,1,0,0,0,0|1,1,0]=3 1319 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)Cl 62a_100010147678_100000073702 [0,1,0,0,0,0|1,1,0]=3 1320 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)F 62a_100000073702_100009816759 [0,1,0,0,0,0|1,1,0]=3 1321 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)F 62a_100009816759_100000073702 [0,1,0,0,0,0|1,1,0]=3 1322 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)N 62a_100011935253_100000073702 [0,1,0,0,0,0|1,1,0]=3 1323 B18R2.25452 COc1c(cccc1SCC2COC(=O)O2)O 62a_100000073702_100010234590 [0,1,0,0,0,0|1,1,0]=3 1324 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)Br 62a_100010146560_100015189358 [0,1,0,0,0,0|2,1,0]=4 1325 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)Br 62a_100015189358_100010146560 [0,1,0,0,0,0|2,1,0]=4 1326 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)C 62a_100010141385_100015189358 [0,1,0,0,0,0|2,1,0]=4 1327 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)C 62a_100015189358_100010141385 [0,1,0,0,0,0|2,1,0]=4 1328 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)Cl 62a_100010147678_100015189358 [0,1,0,0,0,0|2,1,0]=4 1329 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)Cl 62a_100015189358_100010147678 [0,1,0,0,0,0|2,1,0]=4 1330 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)F 62a_100009816759_100015189358 [0,1,0,0,0,0|2,1,0]=4 1331 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)F 62a_100015189358_100009816759 [0,1,0,0,0,0|2,1,0]=4 1332 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)N 62a_100011935253_100015189358 [0,1,0,0,0,0|2,1,0]=4 1333 B18R2.25452 COc1c(cccc1SC[C@@H]2CCC(=O)N2)O 62a_100015189358_100010234590 [0,1,0,0,0,0|2,1,0]=4 1334 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)Br 62a_100010146560_100015307671 [0,1,0,0,0,0|2,1,0]=4 1335 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)Br 62a_100015307671_100010146560 [0,1,0,0,0,0|2,1,0]=4 1336 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)C 62a_100010141385_100015307671 [0,1,0,0,0,0|2,1,0]=4 1337 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)C 62a_100015307671_100010141385 [0,1,0,0,0,0|2,1,0]=4 1338 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)Cl 62a_100010147678_100015307671 [0,1,0,0,0,0|2,1,0]=4 1339 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)Cl 62a_100015307671_100010147678 [0,1,0,0,0,0|2,1,0]=4 1340 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)F 62a_100009816759_100015307671 [0,1,0,0,0,0|2,1,0]=4 1341 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)F 62a_100015307671_100009816759 [0,1,0,0,0,0|2,1,0]=4 1342 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)N 62a_100011935253_100015307671 [0,1,0,0,0,0|2,1,0]=4 1343 B18R2.25452 COc1c(cccc1SC[C@H]2COC(=O)N2)O 62a_100015307671_100010234590 [0,1,0,0,0,0|2,1,0]=4 1344 B18R2.25452 COc1c(ccnc1C)SCC2CNC(=O)O2 62a_100000181169_100000685116 [0,1,0,0,0,0|1,1,0]=3 1345 B18R2.25452 COc1c(ccnc1C)SCC2CNC(=O)O2 62a_100000685116_100000181169 [0,1,0,0,0,0|1,1,0]=3 1346 B18R2.25452 COc1c(ccnc1C)SCC2COC(=O)O2 62a_100000073702_100000685116 [0,1,0,0,0,0|2,1,0]=4 1347 B18R2.25452 COc1c(ccnc1C)SCC2COC(=O)O2 62a_100000685116_100000073702 [0,1,0,0,0,0|2,1,0]=4 1348 B18R2.25452 COc1c(ccnc1Cl)OCC2CNC(=O)O2 34a_100000104430_100000181169 [0,1,0,0,0,0|1,0,0]=2 1349 B18R2.25452 COc1c(ccnc1Cl)OCC2COC(=O)O2 34a_100000104430_100000073702 [0,1,0,0,0,0|2,0,0]=3 1350 B18R2.25452 COc1c(ccnc1Cl)OC[C@H]2COC(=O)N2 34a_100000104430_100015307671 [0,1,0,0,0,0|3,0,0]=4 1351 B18R2.25452 COc1c(ccnc1Cl)SCC2CNC(=O)O2 62a_100000181169_100010068014 [0,1,0,0,0,0|1,1,0]=3 1352 B18R2.25452 COc1c(ccnc1Cl)SCC2CNC(=O)O2 62a_100010068014_100000181169 [0,1,0,0,0,0|1,1,0]=3 1353 B18R2.25452 COc1c(ccnc1Cl)SCC2COC(=O)O2 62a_100000073702_100010068014 [0,1,0,0,0,0|2,1,0]=4 1354 B18R2.25452 COc1c(ccnc1Cl)SCC2COC(=O)O2 62a_100010068014_100000073702 [0,1,0,0,0,0|2,1,0]=4 1355 B18R2.25452 COc1c(ccnc1N)SCC2CNC(=O)O2 62a_100000181169_100009880012 [0,1,0,0,0,0|1,1,0]=3 1356 B18R2.25452 COc1c(ccnc1N)SCC2CNC(=O)O2 62a_100009880012_100000181169 [0,1,0,0,0,0|1,1,0]=3 1357 B18R2.25452 COc1c(ccnc1N)SCC2COC(=O)O2 62a_100000073702_100009880012 [0,1,0,0,0,0|2,1,0]=4 1358 B18R2.25452 COc1c(ccnc1N)SCC2COC(=O)O2 62a_100009880012_100000073702 [0,1,0,0,0,0|2,1,0]=4 1359 B18R2.25452 COc1c(ccnc1SCC2CNC(=O)O2)N 62a_100000104429_100000181169 [0,1,0,0,0,0|1,1,0]=3 1360 B18R2.25452 COc1c(ccnc1SCC2CNC(=O)O2)N 62a_100000181169_100000104429 [0,1,0,0,0,0|1,1,0]=3 1361 B18R2.25452 COc1c(ccnc1SCC2CNC(=O)O2)O 62a_100000181169_100000104430 [0,1,0,0,0,0|1,1,0]=3 1362 B18R2.25452 COc1c(ccnc1SCC2COC(=O)O2)N 62a_100000073702_100000104429 [0,1,0,0,0,0|2,1,0]=4 1363 B18R2.25452 COc1c(ccnc1SCC2COC(=O)O2)N 62a_100000104429_100000073702 [0,1,0,0,0,0|2,1,0]=4 1364 B18R2.25452 COc1c(ccnc1SCC2COC(=O)O2)O 62a_100000073702_100000104430 [0,1,0,0,0,0|2,1,0]=4 1365 B18R2.25452 COc1c(cncc1SCC2CNC(=O)O2)N 62a_100000181169_100012359933 [0,1,0,0,0,0|1,1,0]=3 1366 B18R2.25452 COc1c(cncc1SCC2CNC(=O)O2)N 62a_100012359933_100000181169 [0,1,0,0,0,0|1,1,0]=3 1367 B18R2.25452 COc1c(cncc1SCC2COC(=O)O2)N 62a_100000073702_100012359933 [0,1,0,0,0,0|2,1,0]=4 1368 B18R2.25452 COc1c(cncc1SCC2COC(=O)O2)N 62a_100012359933_100000073702 [0,1,0,0,0,0|2,1,0]=4 1369 B18R2.25452 COc1c(ncnc1SCC2CNC(=O)O2)N 62a_100000181169_100011998528 [0,1,0,0,0,0|2,1,0]=4 1370 B18R2.25452 COc1c(ncnc1SCC2CNC(=O)O2)N 62a_100011998528_100000181169 [0,1,0,0,0,0|2,1,0]=4 1371 B18R2.25452 CSc1c(cccc1OCC2CNC(=O)O2)C 34a_200000099257_100000181169 [0,1,0,0,0,0|0,1,0]=2 1372 B18R2.25452 CSc1c(cccc1OCC2CNC(=O)O2)C 7a_200000099257_100000181169 [0,1,0,0,0,0|0,1,0]=2 1373 B18R2.25452 CSc1c(cccc1OCC2COC(=O)O2)C 34a_200000099257_100000073702 [0,1,0,0,0,0|1,1,0]=3 1374 B18R2.25452 CSc1c(cccc1OC[C@@H]2CCC(=O)N2)C 7a_200000099257_100015189358 [0,1,0,0,0,0|2,1,0]=4 1375 B18R2.25452 CSc1c(cccc1OC[C@H]2COC(=O)N2)C 34a_200000099257_100015307671 [0,1,0,0,0,0|2,1,0]=4 1376 B18R2.25452 CSc1c(cccc1OC[C@H]2COC(=O)N2)C 7a_200000099257_100015307671 [0,1,0,0,0,0|2,1,0]=4 1377 B18R2.25452 CSc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_200010709249 [0,1,0,0,0,0|0,2,0]=3 1378 B18R2.25452 CSc1c(cccc1SCC2CNC(=O)O2)F 62a_200010709249_100000181169 [0,1,0,0,0,0|0,2,0]=3 1379 B18R2.25452 CSc1c(cccc1SCC2COC(=O)O2)F 62a_100000073702_200010709249 [0,1,0,0,0,0|1,2,0]=4 1380 B18R2.25452 CSc1c(cccc1SCC2COC(=O)O2)F 62a_200010709249_100000073702 [0,1,0,0,0,0|1,2,0]=4 1381 B18R2.25452 Cc1cccc(c1C#N)NCC2CNC(=O)O2 2230a_100000763283_100000181169 [0,1,0,0,0,0|3,0,0]=4 1382 B18R2.25452 Cc1cccc(c1C#N)NCC2CNC(=O)O2 34a_100000763283_100000181169 [0,1,0,0,0,0|3,0,0]=4 1383 B18R2.25452 Cc1cccc(c1C#N)NCC2CNC(=O)O2 7a_100000763283_100000181169 [0,1,0,0,0,0|3,0,0]=4 1384 B18R2.25452 Cc1cccc(c1C#N)OCC2CNC(=O)O2 34a_100000079363_100000181169 [0,1,0,0,0,0|2,0,0]=3 1385 B18R2.25452 Cc1cccc(c1C#N)OCC2CNC(=O)O2 7a_100000079363_100000181169 [0,1,0,0,0,0|2,0,0]=3 1386 B18R2.25452 Cc1cccc(c1C#N)OCC2COC(=O)O2 34a_100000079363_100000073702 [0,1,0,0,0,0|3,0,0]=4 1387 B18R2.25452 Cc1cccc(c1C#N)SCC2CNC(=O)O2 62a_100000181169_100009819585 [0,1,0,0,0,0|2,1,0]=4 1388 B18R2.25452 Cc1cccc(c1C=O)SCC2CNC(=O)O2 62a_100000041122_100000181169 [0,1,0,0,0,0|2,1,0]=4 1389 B18R2.25452 Cc1cccc(c1C=O)SCC2CNC(=O)O2 62a_100000181169_100000041122 [0,1,0,0,0,0|2,1,0]=4 1390 B18R2.25452 Cc1cccc(c1CO)OCC2CNC(=O)O2 34a_200009874777_100000181169 [0,1,0,0,0,0|2,0,0]=3 1391 B18R2.25452 Cc1cccc(c1CO)OCC2CNC(=O)O2 7a_200009874777_100000181169 [0,1,0,0,0,0|2,0,0]=3 1392 B18R2.25452 Cc1cccc(c1CO)OCC2COC(=O)O2 34a_200009874777_100000073702 [0,1,0,0,0,0|3,0,0]=4 1393 B18R2.25452 N#Cc1c(cccc1NCC2CNC(=O)O2)Br 7a_100011935054_100000181169 [0,1,0,0,0,0|3,0,0]=4 1394 B18R2.25452 N#Cc1c(cccc1NCC2CNC(=O)O2)Cl 2230a_100000236969_100000181169 [0,1,0,0,0,0|3,0,0]=4 1395 B18R2.25452 N#Cc1c(cccc1NCC2CNC(=O)O2)Cl 7a_100000236969_100000181169 [0,1,0,0,0,0|3,0,0]=4 1396 B18R2.25452 N#Cc1c(cccc1NCC2CNC(=O)O2)F 2230a_100000236971_100000181169 [0,1,0,0,0,0|3,0,0]=4 1397 B18R2.25452 N#Cc1c(cccc1NCC2CNC(=O)O2)F 34a_100000236971_100000181169 [0,1,0,0,0,0|3,0,0]=4 1398 B18R2.25452 N#Cc1c(cccc1NCC2CNC(=O)O2)F 7a_100000236971_100000181169 [0,1,0,0,0,0|3,0,0]=4 1399 B18R2.25452 N#Cc1c(cccc1OCC2CNC(=O)O2)Br 34a_100012180507_100000181169 [0,1,0,0,0,0|2,0,0]=3 1400 B18R2.25452 N#Cc1c(cccc1OCC2CNC(=O)O2)Br 7a_100012180507_100000181169 [0,1,0,0,0,0|2,0,0]=3 1401 B18R2.25452 N#Cc1c(cccc1OCC2CNC(=O)O2)Cl 34a_100000764475_100000181169 [0,1,0,0,0,0|2,0,0]=3 1402 B18R2.25452 N#Cc1c(cccc1OCC2CNC(=O)O2)Cl 7a_100000764475_100000181169 [0,1,0,0,0,0|2,0,0]=3 1403 B18R2.25452 N#Cc1c(cccc1OCC2CNC(=O)O2)F 34a_100000741147_100000181169 [0,1,0,0,0,0|2,0,0]=3 1404 B18R2.25452 N#Cc1c(cccc1OCC2CNC(=O)O2)F 7a_100000741147_100000181169 [0,1,0,0,0,0|2,0,0]=3 1405 B18R2.25452 N#Cc1c(cccc1OCC2COC(=O)O2)Br 34a_100012180507_100000073702 [0,1,0,0,0,0|3,0,0]=4 1406 B18R2.25452 N#Cc1c(cccc1OCC2COC(=O)O2)Cl 34a_100000764475_100000073702 [0,1,0,0,0,0|3,0,0]=4 1407 B18R2.25452 N#Cc1c(cccc1OCC2COC(=O)O2)F 34a_100000741147_100000073702 [0,1,0,0,0,0|3,0,0]=4 1408 B18R2.25452 N#Cc1c(cccc1SCC2CNC(=O)O2)Br 62a_100000181169_100010071968 [0,1,0,0,0,0|2,1,0]=4 1409 B18R2.25452 N#Cc1c(cccc1SCC2CNC(=O)O2)Br 62a_100010071968_100000181169 [0,1,0,0,0,0|2,1,0]=4 1410 B18R2.25452 N#Cc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100000181169_200000049503 [0,1,0,0,0,0|2,1,0]=4 1411 B18R2.25452 N#Cc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100000039607 [0,1,0,0,0,0|2,1,0]=4 1412 B18R2.25452 N#Cc1c(cccc1SCC2CNC(=O)O2)N 62a_100000181169_100011935054 [0,1,0,0,0,0|2,1,0]=4 1413 B18R2.25452 N#Cc1c(cccc1SCC2CNC(=O)O2)O 62a_100000181169_100012180507 [0,1,0,0,0,0|2,1,0]=4 1414 B18R2.25452 NCc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100012349121 [0,1,0,0,0,0|2,1,0]=4 1415 B18R2.25452 NCc1c(cccc1SCC2CNC(=O)O2)F 62a_100012349121_100000181169 [0,1,0,0,0,0|2,1,0]=4 1416 B18R2.25452 NNc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100016994982 [0,1,0,0,0,0|2,1,0]=4 1417 B18R2.25452 NNc1c(cccc1SCC2CNC(=O)O2)F 62a_100016994982_100000181169 [0,1,0,0,0,0|2,1,0]=4 1418 B18R2.25452 Nc1cccc(c1C=O)SCC2CNC(=O)O2 62a_100010232536_100000181169 [0,1,0,0,0,0|2,1,0]=4 1419 B18R2.25452 Nc1cccc(c1CO)SCC2CNC(=O)O2 62a_100000181169_100000747656 [0,1,0,0,0,0|2,1,0]=4 1420 B18R2.25452 Nc1cccc(c1CO)SCC2CNC(=O)O2 62a_100000747656_100000181169 [0,1,0,0,0,0|2,1,0]=4 1421 B18R2.25452 O=C1NCC(O1)CNc2cccc(c2CO)Br 34a_100000747656_100000181169 [0,1,0,0,0,0|3,0,0]=4 1422 B18R2.25452 O=C1NCC(O1)CNc2cccc(c2CO)Cl 34a_100011916388_100000181169 [0,1,0,0,0,0|3,0,0]=4 1423 B18R2.25452 O=C1NCC(O1)CNc2cccc(c2CO)F 34a_100011846719_100000181169 [0,1,0,0,0,0|3,0,0]=4 1424 B18R2.25452 O=C1NCC(O1)CSc2cccc(c2CO)F 62a_100000181169_100012355691 [0,1,0,0,0,0|2,1,0]=4 1425 B18R2.25452 O=C1NCC(O1)CSc2cccc(c2CO)F 62a_100012355691_100000181169 [0,1,0,0,0,0|2,1,0]=4 1426 B18R2.25452 O=Cc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010147682 [0,1,0,0,0,0|2,1,0]=4 1427 B18R2.25452 O=Cc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100010147682_100000181169 [0,1,0,0,0,0|2,1,0]=4 1428 B18R2.25452 O=Cc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100000210083 [0,1,0,0,0,0|2,1,0]=4 1429 B18R2.25452 O=Cc1c(cccc1SCC2CNC(=O)O2)F 62a_100000210083_100000181169 [0,1,0,0,0,0|2,1,0]=4 1430 B18R2.25452 O=Cc1c(cccc1SCC2CNC(=O)O2)O 62a_100000181169_100010193437 [0,1,0,0,0,0|2,1,0]=4 1431 B18R2.29411 C=C(C)c1ccccc1NCC2CNC(=O)O2 34a_100000037685_100000181169 [0,1,0,0,0,0|2,0,0]=3 1432 B18R2.29411 C=C(C)c1ccccc1NCC2COC(=O)O2 34a_100000037685_100000073702 [0,1,0,0,0,0|3,0,0]=4 1433 B18R2.29411 CC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000751169_100000181169 [0,1,0,0,0,0|1,1,0]=3 1434 B18R2.29411 CC(=O)c1ccccc1SCC2COC(=O)O2 62a_100000751169_100000073702 [0,1,0,0,0,0|2,1,0]=4 1435 B18R2.29411 CC(=O)c1cccnc1SCC2CNC(=O)O2 62a_100000181169_100000753718 [0,1,0,0,0,0|2,1,0]=4 1436 B18R2.29411 CC(=O)c1cccnc1SCC2CNC(=O)O2 62a_100000753718_100000181169 [0,1,0,0,0,0|2,1,0]=4 1437 B18R2.29411 CC(=O)c1ccncc1OCC2CNC(=O)O2 7a_100009872882_100000181169 [0,1,0,0,0,0|2,0,0]=3 1438 B18R2.29411 CC(=O)c1ccncc1SCC2CNC(=O)O2 62a_100000181169_100009993184 [0,1,0,0,0,0|2,1,0]=4 1439 B18R2.29411 CC(=O)c1ccncc1SCC2CNC(=O)O2 62a_100009993184_100000181169 [0,1,0,0,0,0|2,1,0]=4 1440 B18R2.29411 CC(=O)c1cnccc1SCC2CNC(=O)O2 62a_100000181169_100160469449 [0,1,0,0,0,0|2,1,0]=4 1441 B18R2.29411 CC(=O)c1cnccc1SCC2CNC(=O)O2 62a_100160469449_100000181169 [0,1,0,0,0,0|2,1,0]=4 1442 B18R2.29411 CC(=O)c1ncccc1OCC2CNC(=O)O2 34a_100000087166_100000181169 [0,1,0,0,0,0|2,0,0]=3 1443 B18R2.29411 CC(=O)c1ncccc1OCC2CNC(=O)O2 7a_100000087166_100000181169 [0,1,0,0,0,0|2,0,0]=3 1444 B18R2.29411 CC(=O)c1ncccc1OCC2COC(=O)O2 34a_100000087166_100000073702 [0,1,0,0,0,0|3,0,0]=4 1445 B18R2.29411 CC(=O)c1ncccc1SCC2CNC(=O)O2 62a_100000181169_100012348690 [0,1,0,0,0,0|2,1,0]=4 1446 B18R2.29411 CC(=O)c1ncccc1SCC2CNC(=O)O2 62a_100012348690_100000181169 [0,1,0,0,0,0|2,1,0]=4 1447 B18R2.29411 CC(C)c1ccccc1NCC2CNC(=O)O2 2230a_100000210643_100000181169 [0,1,0,0,0,0|2,0,0]=3 1448 B18R2.29411 CC(C)c1ccccc1NCC2CNC(=O)O2 34a_100000210643_100000181169 [0,1,0,0,0,0|2,0,0]=3 1449 B18R2.29411 CC(C)c1ccccc1NCC2CNC(=O)O2 7a_100000210643_100000181169 [0,1,0,0,0,0|2,0,0]=3 1450 B18R2.29411 CC(C)c1ccccc1NCC2COC(=O)O2 34a_100000210643_100000073702 [0,1,0,0,0,0|3,0,0]=4 1451 B18R2.29411 CC(C)c1ccccc1OCC2CNC(=O)O2 34a_100000211617_100000181169 [0,1,0,0,0,0|1,0,0]=2 1452 B18R2.29411 CC(C)c1ccccc1OCC2CNC(=O)O2 7a_100000211617_100000181169 [0,1,0,0,0,0|1,0,0]=2 1453 B18R2.29411 CC(C)c1ccccc1OCC2COC(=O)O2 34a_100000211617_100000073702 [0,1,0,0,0,0|2,0,0]=3 1454 B18R2.29411 CC(C)c1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000211617_100015189358 [0,1,0,0,0,0|3,0,0]=4 1455 B18R2.29411 CC(C)c1ccccc1OC[C@H]2COC(=O)N2 34a_100000211617_100015307671 [0,1,0,0,0,0|3,0,0]=4 1456 B18R2.29411 CC(C)c1ccccc1OC[C@H]2COC(=O)N2 7a_100000211617_100015307671 [0,1,0,0,0,0|3,0,0]=4 1457 B18R2.29411 CC(C)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000708600 [0,1,0,0,0,0|1,1,0]=3 1458 B18R2.29411 CC(C)c1ccccc1SCC2CNC(=O)O2 62a_100000708600_100000181169 [0,1,0,0,0,0|1,1,0]=3 1459 B18R2.29411 CC(C)c1ccccc1SCC2COC(=O)O2 62a_100000073702_100000708600 [0,1,0,0,0,0|2,1,0]=4 1460 B18R2.29411 CC(C)c1ccccc1SCC2COC(=O)O2 62a_100000708600_100000073702 [0,1,0,0,0,0|2,1,0]=4 1461 B18R2.29411 CC(C)c1cccnc1SCC2CNC(=O)O2 62a_100000181169_200010382935 [0,1,0,0,0,0|2,1,0]=4 1462 B18R2.29411 CC(C)c1cccnc1SCC2CNC(=O)O2 62a_200010382935_100000181169 [0,1,0,0,0,0|2,1,0]=4 1463 B18R2.29411 CC(C)c1ncccc1OCC2CNC(=O)O2 34a_100012183336_100000181169 [0,1,0,0,0,0|2,0,0]=3 1464 B18R2.29411 CC(C)c1ncccc1OCC2CNC(=O)O2 7a_100012183336_100000181169 [0,1,0,0,0,0|2,0,0]=3 1465 B18R2.29411 CC(C)c1ncccc1OCC2COC(=O)O2 34a_100012183336_100000073702 [0,1,0,0,0,0|3,0,0]=4 1466 B18R2.29411 CC(N)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000181357 [0,1,0,0,0,0|1,1,0]=3 1467 B18R2.29411 CC(N)c1ccccc1SCC2CNC(=O)O2 62a_100000181357_100000181169 [0,1,0,0,0,0|1,1,0]=3 1468 B18R2.29411 CC(N)c1ccccc1SCC2COC(=O)O2 62a_100000073702_100000181357 [0,1,0,0,0,0|2,1,0]=4 1469 B18R2.29411 CC(N)c1ccccc1SCC2COC(=O)O2 62a_100000181357_100000073702 [0,1,0,0,0,0|2,1,0]=4 1470 B18R2.29411 CC(N)c1ncccc1SCC2CNC(=O)O2 62a_100000181169_100159271932 [0,1,0,0,0,0|2,1,0]=4 1471 B18R2.29411 CC(N)c1ncccc1SCC2CNC(=O)O2 62a_100159271932_100000181169 [0,1,0,0,0,0|2,1,0]=4 1472 B18R2.29411 CC(O)c1ccccc1NCC2CNC(=O)O2 2230a_100011405641_100000181169 [0,1,0,0,0,0|2,0,0]=3 1473 B18R2.29411 CC(O)c1ccccc1OCC2CNC(=O)O2 34a_200011232679_100000181169 [0,1,0,0,0,0|1,0,0]=2 1474 B18R2.29411 CC(O)c1ccccc1OCC2CNC(=O)O2 7a_200011232679_100000181169 [0,1,0,0,0,0|1,0,0]=2 1475 B18R2.29411 CC(O)c1ccccc1OCC2COC(=O)O2 34a_200011232679_100000073702 [0,1,0,0,0,0|2,0,0]=3 1476 B18R2.29411 CC(O)c1ccccc1OC[C@@H]2CCC(=O)N2 7a_200011232679_100015189358 [0,1,0,0,0,0|3,0,0]=4 1477 B18R2.29411 CC(O)c1ccccc1OC[C@H]2COC(=O)N2 34a_200011232679_100015307671 [0,1,0,0,0,0|3,0,0]=4 1478 B18R2.29411 CC(O)c1ccccc1OC[C@H]2COC(=O)N2 7a_200011232679_100015307671 [0,1,0,0,0,0|3,0,0]=4 1479 B18R2.29411 CC(O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000702211 [0,1,0,0,0,0|1,1,0]=3 1480 B18R2.29411 CC(O)c1ccccc1SCC2CNC(=O)O2 62a_100000702211_100000181169 [0,1,0,0,0,0|1,1,0]=3 1481 B18R2.29411 CC(O)c1ccccc1SCC2COC(=O)O2 62a_100000073702_100000702211 [0,1,0,0,0,0|2,1,0]=4 1482 B18R2.29411 CC(O)c1ccccc1SCC2COC(=O)O2 62a_100000702211_100000073702 [0,1,0,0,0,0|2,1,0]=4 1483 B18R2.29411 CC(O)c1cccnc1SCC2CNC(=O)O2 62a_100000181169_100009865335 [0,1,0,0,0,0|2,1,0]=4 1484 B18R2.29411 CC(O)c1cccnc1SCC2CNC(=O)O2 62a_100009865335_100000181169 [0,1,0,0,0,0|2,1,0]=4 1485 B18R2.29411 CN(C)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011290883 [0,1,0,0,0,0|1,1,0]=3 1486 B18R2.29411 CN(C)c1ccccc1SCC2CNC(=O)O2 62a_100011290883_100000181169 [0,1,0,0,0,0|1,1,0]=3 1487 B18R2.29411 CN(C)c1ccccc1SCC2COC(=O)O2 62a_100000073702_100011290883 [0,1,0,0,0,0|2,1,0]=4 1488 B18R2.29411 CN(C)c1ccccc1SCC2COC(=O)O2 62a_100011290883_100000073702 [0,1,0,0,0,0|2,1,0]=4 1489 B18R2.29411 CN(C)c1ccncc1SCC2CNC(=O)O2 62a_100000181169_100012355995 [0,1,0,0,0,0|2,1,0]=4 1490 B18R2.29411 CN(C)c1ccncc1SCC2CNC(=O)O2 62a_100012355995_100000181169 [0,1,0,0,0,0|2,1,0]=4 1491 B18R2.29411 CN(C)c1ncccc1SCC2CNC(=O)O2 62a_100000181169_100011465059 [0,1,0,0,0,0|2,1,0]=4 1492 B18R2.29411 CN(C)c1ncccc1SCC2CNC(=O)O2 62a_100011465059_100000181169 [0,1,0,0,0,0|2,1,0]=4 1493 B18R2.29411 CS(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000734199_100000181169 [0,1,0,0,0,0|0,2,0]=3 1494 B18R2.29411 CS(=O)c1ccccc1SCC2COC(=O)O2 62a_100000734199_100000073702 [0,1,0,0,0,0|1,2,0]=4 1495 B18R2.29411 C[C@@H](N)c1ccccc1OCC2CNC(=O)O2 34a_100025703389_100000181169 [0,1,0,0,0,0|1,0,0]=2 1496 B18R2.29411 C[C@@H](N)c1ccccc1OCC2COC(=O)O2 34a_100025703389_100000073702 [0,1,0,0,0,0|2,0,0]=3 1497 B18R2.29411 C[C@@H](N)c1ccccc1OC[C@H]2COC(=O)N2 34a_100025703389_100015307671 [0,1,0,0,0,0|3,0,0]=4 1498 B18R2.29411 C[C@H](O)c1ncccc1SCC2CNC(=O)O2 62a_100000181169_100013325542 [0,1,0,0,0,0|2,1,0]=4 1499 B18R2.29411 C[C@H](O)c1ncccc1SCC2CNC(=O)O2 62a_100013325542_100000181169 [0,1,0,0,0,0|2,1,0]=4 1500 B18R2.29411 NC(=O)c1ccccc1NCC2CNC(=O)O2 34a_100000185089_100000181169 [0,1,0,0,0,0|3,0,0]=4 1501 B18R2.29411 NC(=O)c1ccccc1OCC2CNC(=O)O2 34a_100000192804_100000181169 [0,1,0,0,0,0|2,0,0]=3 1502 B18R2.29411 NC(=O)c1ccccc1OCC2CNC(=O)O2 7a_100000192804_100000181169 [0,1,0,0,0,0|2,0,0]=3 1503 B18R2.29411 NC(=O)c1ccccc1OCC2COC(=O)O2 34a_100000192804_100000073702 [0,1,0,0,0,0|3,0,0]=4 1504 B18R2.29411 NC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000162227_100000181169 [0,1,0,0,0,0|2,1,0]=4 1505 B18R2.29411 NC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000162227 [0,1,0,0,0,0|2,1,0]=4 1506 B18R2.29411 NC(=O)c1ccncc1OCC2CNC(=O)O2 7a_100012022987_100000181169 [0,1,0,0,0,0|3,0,0]=4 1507 B18R2.29411 NC(=O)c1cnccc1OCC2CNC(=O)O2 34a_200011998761_100000181169 [0,1,0,0,0,0|3,0,0]=4 1508 B18R2.29411 NC(=O)c1ncccc1OCC2CNC(=O)O2 34a_200011215183_100000181169 [0,1,0,0,0,0|3,0,0]=4 1509 B18R2.29411 NC(=O)c1ncccc1OCC2CNC(=O)O2 7a_200011215183_100000181169 [0,1,0,0,0,0|3,0,0]=4 1510 B18R2.29411 NC(=S)c1ccccc1OCC2CNC(=O)O2 7a_100000745089_100000181169 [0,1,0,0,0,0|2,0,0]=3 1511 B18R2.29411 O=C1NCC(O1)CNc2ccccc2C(F)F 2230a_100000734540_100000181169 [0,1,0,0,0,0|3,0,0]=4 1512 B18R2.29411 O=C1NCC(O1)CNc2ccccc2C(F)F 34a_100000734540_100000181169 [0,1,0,0,0,0|3,0,0]=4 1513 B18R2.29411 O=C1NCC(O1)CNc2ccccc2C(F)F 7a_100000734540_100000181169 [0,1,0,0,0,0|3,0,0]=4 1514 B18R2.29411 O=C1NCC(O1)COc2ccccc2C(=O)[O-] 7a_100015234032_100000181169 [0,1,0,0,0,0|2,0,0]=3 1515 B18R2.29411 O=C1NCC(O1)COc2ccccc2[N+](=O)[O-] 34a_100000186319_100000181169 [0,1,0,0,0,0|2,0,0]=3 1516 B18R2.29411 O=C1NCC(O1)COc2ccccc2[N+](=O)[O-] 7a_100000186319_100000181169 [0,1,0,0,0,0|2,0,0]=3 1517 B18R2.29411 O=C1NCC(O1)COc2cccnc2[N+](=O)[O-] 7a_100000183951_100000181169 [0,1,0,0,0,0|3,0,0]=4 1518 B18R2.29411 O=C1NCC(O1)COc2cnccc2C(F)F 34a_100010834524_100000181169 [0,1,0,0,0,0|3,0,0]=4 1519 B18R2.29411 O=C1NCC(O1)COc2cnccc2C(F)F 7a_100010834524_100000181169 [0,1,0,0,0,0|3,0,0]=4 1520 B18R2.29411 O=C1NCC(O1)CSc2ccccc2B(O)O 62a_100000181169_100000693059 [0,1,0,0,0,0|2,1,0]=4 1521 B18R2.29411 O=C1NCC(O1)CSc2ccccc2B(O)O 62a_100000693059_100000181169 [0,1,0,0,0,0|2,1,0]=4 1522 B18R2.29411 O=C1NCC(O1)CSc2ccccc2C(=O)O 62a_100000181169_100000734275 [0,1,0,0,0,0|2,1,0]=4 1523 B18R2.29411 O=C1NCC(O1)CSc2ccccc2C(=O)O 62a_202125556159_100000181169 [0,1,0,0,0,0|2,1,0]=4 1524 B18R2.29411 O=C1NCC(O1)CSc2ccccc2C(F)F 62a_100000181169_100010169824 [0,1,0,0,0,0|2,1,0]=4 1525 B18R2.29411 O=C1NCC(O1)CSc2ccccc2C(F)F 62a_100010169824_100000181169 [0,1,0,0,0,0|2,1,0]=4 1526 B18R2.29411 O=C1OCC(O1)COc2ccccc2[N+](=O)[O-] 34a_100000186319_100000073702 [0,1,0,0,0,0|3,0,0]=4 1527 B18R2.104605 COc1ccccc1CNC2CC(=O)N(C2)C 207a_100000748898_100000169842 [0,1,0,0,0,0|3,0,0]=4 1528 B18R2.104605 COc1ccccc1CNC2CC(=O)N(C2)C 2230a_100000748898_100000210004 [0,1,0,0,0,0|3,0,0]=4 1529 B18R2.104605 COc1ccccc1CNC2CC(=O)N(C2)C 270004a_100000748898_100000169842 [0,1,0,0,0,0|3,0,0]=4 1530 B18R2.104605 COc1ccccc1CNC2CC(=O)N(C2)C 34a_100000748898_100000210004 [0,1,0,0,0,0|3,0,0]=4 1531 B18R2.118302 CCc1cccc(c1NCC2CNC(=O)O2)C 2230a_100000210048_100000181169 [0,1,0,0,0,0|2,0,0]=3 1532 B18R2.118302 CCc1cccc(c1NCC2CNC(=O)O2)C 34a_100000210048_100000181169 [0,1,0,0,0,0|2,0,0]=3 1533 B18R2.118302 CCc1cccc(c1NCC2CNC(=O)O2)C 7a_100000210048_100000181169 [0,1,0,0,0,0|2,0,0]=3 1534 B18R2.118302 CCc1cccc(c1NCC2COC(=O)O2)C 34a_100000210048_100000073702 [0,1,0,0,0,0|3,0,0]=4 1535 B18R2.118302 CCc1cccc(c1OCC2CNC(=O)O2)Br 34a_200010001580_100000181169 [0,1,0,0,0,0|1,0,0]=2 1536 B18R2.118302 CCc1cccc(c1OCC2CNC(=O)O2)Br 7a_200010001580_100000181169 [0,1,0,0,0,0|1,0,0]=2 1537 B18R2.118302 CCc1cccc(c1OCC2CNC(=O)O2)C 34a_100000034007_100000181169 [0,1,0,0,0,0|1,0,0]=2 1538 B18R2.118302 CCc1cccc(c1OCC2CNC(=O)O2)C 7a_100000034007_100000181169 [0,1,0,0,0,0|1,0,0]=2 1539 B18R2.118302 CCc1cccc(c1OCC2COC(=O)O2)Br 34a_200010001580_100000073702 [0,1,0,0,0,0|2,0,0]=3 1540 B18R2.118302 CCc1cccc(c1OCC2COC(=O)O2)C 34a_100000034007_100000073702 [0,1,0,0,0,0|2,0,0]=3 1541 B18R2.118302 CCc1cccc(c1OC[C@@H]2CCC(=O)N2)Br 7a_200010001580_100015189358 [0,1,0,0,0,0|3,0,0]=4 1542 B18R2.118302 CCc1cccc(c1OC[C@@H]2CCC(=O)N2)C 7a_100000034007_100015189358 [0,1,0,0,0,0|3,0,0]=4 1543 B18R2.118302 CCc1cccc(c1OC[C@H]2COC(=O)N2)Br 34a_200010001580_100015307671 [0,1,0,0,0,0|3,0,0]=4 1544 B18R2.118302 CCc1cccc(c1OC[C@H]2COC(=O)N2)Br 7a_200010001580_100015307671 [0,1,0,0,0,0|3,0,0]=4 1545 B18R2.118302 CCc1cccc(c1OC[C@H]2COC(=O)N2)C 34a_100000034007_100015307671 [0,1,0,0,0,0|3,0,0]=4 1546 B18R2.118302 CCc1cccc(c1OC[C@H]2COC(=O)N2)C 7a_100000034007_100015307671 [0,1,0,0,0,0|3,0,0]=4 1547 B18R2.118302 CCc1cccc(c1SCC2CNC(=O)O2)C 62a_100000036235_100000181169 [0,1,0,0,0,0|1,1,0]=3 1548 B18R2.118302 CCc1cccc(c1SCC2CNC(=O)O2)C 62a_100000181169_100000036235 [0,1,0,0,0,0|1,1,0]=3 1549 B18R2.118302 CCc1cccc(c1SCC2COC(=O)O2)C 62a_100000036235_100000073702 [0,1,0,0,0,0|2,1,0]=4 1550 B18R2.118302 CCc1cccc(c1SCC2COC(=O)O2)C 62a_100000073702_100000036235 [0,1,0,0,0,0|2,1,0]=4 1551 B18R2.118302 CCc1occc(=O)c1OCC2CNC(=O)O2 34a_100000033269_100000181169 [0,1,0,0,0,0|2,0,0]=3 1552 B18R2.118302 CCc1occc(=O)c1OCC2COC(=O)O2 34a_100000033269_100000073702 [0,1,0,0,0,0|3,0,0]=4 1553 B18R2.118302 COc1cccc(c1CNC2CNC(=O)C2)Br 207a_100000697751_100009814803 [0,1,0,0,0,0|3,0,0]=4 1554 B18R2.118302 COc1cccc(c1CNC2CNC(=O)C2)C 207a_100000697751_100000050978 [0,1,0,0,0,0|3,0,0]=4 1555 B18R2.118302 COc1cccc(c1CNC2CNC(=O)C2)Cl 207a_100000697751_100000757644 [0,1,0,0,0,0|3,0,0]=4 1556 B18R2.118302 COc1cccc(c1CNC2CNC(=O)C2)Cl 2230a_100000697751_100012349678 [0,1,0,0,0,0|3,0,0]=4 1557 B18R2.118302 COc1cccc(c1CNC2CNC(=O)C2)F 207a_100000697751_100011216730 [0,1,0,0,0,0|3,0,0]=4 1558 B18R2.118302 COc1cccc(c1CNC2CNC(=O)C2)F 2230a_100000697751_100011216731 [0,1,0,0,0,0|3,0,0]=4 1559 B18R2.118302 COc1cccc(c1CNC2COC(=O)O2)F 34a_100016992011_100000032252 [0,1,0,0,0,0|3,0,0]=4 1560 B18R2.118302 COc1cccc(c1COC2CNC(=O)C2)Cl 34a_100000690082_100012349678 [0,1,0,0,0,0|3,0,0]=4 1561 B18R2.118302 COc1cccc(c1COC2CNC(=O)C2)F 34a_100000690082_100011216731 [0,1,0,0,0,0|3,0,0]=4 1562 B18R2.118302 COc1cccc(c1COC2COC(=O)O2)F 34a_100011216733_100000032252 [0,1,0,0,0,0|3,0,0]=4 1563 B18R2.118302 COc1cccc(c1CSC2COC(=O)O2)Cl 62a_100012349678_100000032252 [0,1,0,0,0,0|3,0,0]=4 1564 B18R2.118302 COc1cccc(c1CSC2COC(=O)O2)F 62a_100011216731_100000032252 [0,1,0,0,0,0|3,0,0]=4 1565 B18R2.118302 COc1cccc(c1NCC2CNC(=O)O2)Br 34a_100000708083_100000181169 [0,1,0,0,0,0|1,0,0]=2 1566 B18R2.118302 COc1cccc(c1NCC2CNC(=O)O2)C 2230a_100000758225_100000181169 [0,1,0,0,0,0|1,0,0]=2 1567 B18R2.118302 COc1cccc(c1NCC2CNC(=O)O2)C 34a_100000758225_100000181169 [0,1,0,0,0,0|1,0,0]=2 1568 B18R2.118302 COc1cccc(c1NCC2CNC(=O)O2)Cl 34a_100011309317_100000181169 [0,1,0,0,0,0|1,0,0]=2 1569 B18R2.118302 COc1cccc(c1NCC2CNC(=O)O2)F 34a_100000686744_100000181169 [0,1,0,0,0,0|1,0,0]=2 1570 B18R2.118302 COc1cccc(c1NCC2CNC(=O)O2)O 34a_100012022766_100000181169 [0,1,0,0,0,0|1,0,0]=2 1571 B18R2.118302 COc1cccc(c1NCC2COC(=O)O2)Br 34a_100000708083_100000073702 [0,1,0,0,0,0|2,0,0]=3 1572 B18R2.118302 COc1cccc(c1NCC2COC(=O)O2)C 34a_100000758225_100000073702 [0,1,0,0,0,0|2,0,0]=3 1573 B18R2.118302 COc1cccc(c1NCC2COC(=O)O2)Cl 34a_100011309317_100000073702 [0,1,0,0,0,0|2,0,0]=3 1574 B18R2.118302 COc1cccc(c1NCC2COC(=O)O2)F 34a_100000686744_100000073702 [0,1,0,0,0,0|2,0,0]=3 1575 B18R2.118302 COc1cccc(c1NCC2COC(=O)O2)O 34a_100012022766_100000073702 [0,1,0,0,0,0|2,0,0]=3 1576 B18R2.118302 COc1cccc(c1NC[C@@H]2CCC(=O)N2)C 2230a_100000758225_100015189358 [0,1,0,0,0,0|3,0,0]=4 1577 B18R2.118302 COc1cccc(c1NC[C@H]2COC(=O)N2)Br 34a_100000708083_100015307671 [0,1,0,0,0,0|3,0,0]=4 1578 B18R2.118302 COc1cccc(c1NC[C@H]2COC(=O)N2)C 2230a_100000758225_100015307671 [0,1,0,0,0,0|3,0,0]=4 1579 B18R2.118302 COc1cccc(c1NC[C@H]2COC(=O)N2)C 34a_100000758225_100015307671 [0,1,0,0,0,0|3,0,0]=4 1580 B18R2.118302 COc1cccc(c1NC[C@H]2COC(=O)N2)Cl 34a_100011309317_100015307671 [0,1,0,0,0,0|3,0,0]=4 1581 B18R2.118302 COc1cccc(c1NC[C@H]2COC(=O)N2)F 34a_100000686744_100015307671 [0,1,0,0,0,0|3,0,0]=4 1582 B18R2.118302 COc1cccc(c1NC[C@H]2COC(=O)N2)O 34a_100012022766_100015307671 [0,1,0,0,0,0|3,0,0]=4 1583 B18R2.118302 COc1cccc(c1OCC2=CC(=O)OC2)Br 34a_100000686866_100000716558 [0,1,0,0,0,0|2,0,1]=4 1584 B18R2.118302 COc1cccc(c1OCC2=CC(=O)OC2)C 34a_100011219253_100000716558 [0,1,0,0,0,0|2,0,1]=4 1585 B18R2.118302 COc1cccc(c1OCC2=CC(=O)OC2)Cl 34a_100009851661_100000716558 [0,1,0,0,0,0|2,0,1]=4 1586 B18R2.118302 COc1cccc(c1OCC2=CC(=O)OC2)F 34a_100000036725_100000716558 [0,1,0,0,0,0|2,0,1]=4 1587 B18R2.118302 COc1cccc(c1OCC2=CC(=O)OC2)N 34a_100000123586_100000716558 [0,1,0,0,0,0|2,0,1]=4 1588 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)Br 34a_100000686866_100000181169 [0,1,0,0,0,0|0,0,0]=1 1589 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)C 34a_100011219253_100000181169 [0,1,0,0,0,0|0,0,0]=1 1590 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)C 7a_100011219253_100000181169 [0,1,0,0,0,0|0,0,0]=1 1591 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)Cl 34a_100009851661_100000181169 [0,1,0,0,0,0|0,0,0]=1 1592 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)Cl 7a_100009851661_100000181169 [0,1,0,0,0,0|0,0,0]=1 1593 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)F 34a_100000036725_100000181169 [0,1,0,0,0,0|0,0,0]=1 1594 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)F 7a_100000036725_100000181169 [0,1,0,0,0,0|0,0,0]=1 1595 B18R2.118302 COc1cccc(c1OCC2CNC(=O)O2)N 34a_100000123586_100000181169 [0,1,0,0,0,0|0,0,0]=1 1596 B18R2.118302 COc1cccc(c1OCC2COC(=O)O2)Br 34a_100000686866_100000073702 [0,1,0,0,0,0|1,0,0]=2 1597 B18R2.118302 COc1cccc(c1OCC2COC(=O)O2)C 34a_100011219253_100000073702 [0,1,0,0,0,0|1,0,0]=2 1598 B18R2.118302 COc1cccc(c1OCC2COC(=O)O2)Cl 34a_100009851661_100000073702 [0,1,0,0,0,0|1,0,0]=2 1599 B18R2.118302 COc1cccc(c1OCC2COC(=O)O2)F 34a_100000036725_100000073702 [0,1,0,0,0,0|1,0,0]=2 1600 B18R2.118302 COc1cccc(c1OCC2COC(=O)O2)N 34a_100000123586_100000073702 [0,1,0,0,0,0|1,0,0]=2 1601 B18R2.118302 COc1cccc(c1OC[C@@H]2CCC(=O)N2)C 7a_100011219253_100015189358 [0,1,0,0,0,0|2,0,0]=3 1602 B18R2.118302 COc1cccc(c1OC[C@@H]2CCC(=O)N2)Cl 7a_100009851661_100015189358 [0,1,0,0,0,0|2,0,0]=3 1603 B18R2.118302 COc1cccc(c1OC[C@@H]2CCC(=O)N2)F 7a_100000036725_100015189358 [0,1,0,0,0,0|2,0,0]=3 1604 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)Br 34a_100000686866_100015307671 [0,1,0,0,0,0|2,0,0]=3 1605 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)C 34a_100011219253_100015307671 [0,1,0,0,0,0|2,0,0]=3 1606 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)C 7a_100011219253_100015307671 [0,1,0,0,0,0|2,0,0]=3 1607 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)Cl 34a_100009851661_100015307671 [0,1,0,0,0,0|2,0,0]=3 1608 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)Cl 7a_100009851661_100015307671 [0,1,0,0,0,0|2,0,0]=3 1609 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)F 34a_100000036725_100015307671 [0,1,0,0,0,0|2,0,0]=3 1610 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)F 7a_100000036725_100015307671 [0,1,0,0,0,0|2,0,0]=3 1611 B18R2.118302 COc1cccc(c1OC[C@H]2COC(=O)N2)N 34a_100000123586_100015307671 [0,1,0,0,0,0|2,0,0]=3 1612 B18R2.118302 COc1cccc(c1OCc2n[nH]c(=O)[nH]2)C 7a_100011219253_100000754189 [0,1,0,0,0,0|2,0,1]=4 1613 B18R2.118302 COc1cccc(c1OCc2n[nH]c(=O)[nH]2)Cl 7a_100009851661_100000754189 [0,1,0,0,0,0|2,0,1]=4 1614 B18R2.118302 COc1cccc(c1OCc2n[nH]c(=O)[nH]2)F 7a_100000036725_100000754189 [0,1,0,0,0,0|2,0,1]=4 1615 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)Br 62a_100000181169_100010131421 [0,1,0,0,0,0|0,1,0]=2 1616 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)Br 62a_100010131421_100000181169 [0,1,0,0,0,0|0,1,0]=2 1617 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)C 62a_100000181169_100010191535 [0,1,0,0,0,0|0,1,0]=2 1618 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)C 62a_100010191535_100000181169 [0,1,0,0,0,0|0,1,0]=2 1619 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100000703912 [0,1,0,0,0,0|0,1,0]=2 1620 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)F 62a_100000703912_100000181169 [0,1,0,0,0,0|0,1,0]=2 1621 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)N 62a_100000181169_100000703447 [0,1,0,0,0,0|0,1,0]=2 1622 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)N 62a_100000703447_100000181169 [0,1,0,0,0,0|0,1,0]=2 1623 B18R2.118302 COc1cccc(c1SCC2CNC(=O)O2)O 62a_100000181169_100010202623 [0,1,0,0,0,0|0,1,0]=2 1624 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)Br 62a_100000073702_100010131421 [0,1,0,0,0,0|1,1,0]=3 1625 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)Br 62a_100010131421_100000073702 [0,1,0,0,0,0|1,1,0]=3 1626 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)C 62a_100000073702_100010191535 [0,1,0,0,0,0|1,1,0]=3 1627 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)C 62a_100010191535_100000073702 [0,1,0,0,0,0|1,1,0]=3 1628 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)F 62a_100000073702_100000703912 [0,1,0,0,0,0|1,1,0]=3 1629 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)F 62a_100000703912_100000073702 [0,1,0,0,0,0|1,1,0]=3 1630 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)N 62a_100000073702_100000703447 [0,1,0,0,0,0|1,1,0]=3 1631 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)N 62a_100000703447_100000073702 [0,1,0,0,0,0|1,1,0]=3 1632 B18R2.118302 COc1cccc(c1SCC2COC(=O)O2)O 62a_100000073702_100010202623 [0,1,0,0,0,0|1,1,0]=3 1633 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)Br 62a_100010131421_100015189358 [0,1,0,0,0,0|2,1,0]=4 1634 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)Br 62a_100015189358_100010131421 [0,1,0,0,0,0|2,1,0]=4 1635 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)C 62a_100010191535_100015189358 [0,1,0,0,0,0|2,1,0]=4 1636 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)C 62a_100015189358_100010191535 [0,1,0,0,0,0|2,1,0]=4 1637 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)F 62a_100000703912_100015189358 [0,1,0,0,0,0|2,1,0]=4 1638 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)F 62a_100015189358_100000703912 [0,1,0,0,0,0|2,1,0]=4 1639 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)N 62a_100000703447_100015189358 [0,1,0,0,0,0|2,1,0]=4 1640 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)N 62a_100015189358_100000703447 [0,1,0,0,0,0|2,1,0]=4 1641 B18R2.118302 COc1cccc(c1SC[C@@H]2CCC(=O)N2)O 62a_100015189358_100010202623 [0,1,0,0,0,0|2,1,0]=4 1642 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)Br 62a_100010131421_100015307671 [0,1,0,0,0,0|2,1,0]=4 1643 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)Br 62a_100015307671_100010131421 [0,1,0,0,0,0|2,1,0]=4 1644 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)C 62a_100010191535_100015307671 [0,1,0,0,0,0|2,1,0]=4 1645 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)C 62a_100015307671_100010191535 [0,1,0,0,0,0|2,1,0]=4 1646 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)F 62a_100000703912_100015307671 [0,1,0,0,0,0|2,1,0]=4 1647 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)F 62a_100015307671_100000703912 [0,1,0,0,0,0|2,1,0]=4 1648 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)N 62a_100000703447_100015307671 [0,1,0,0,0,0|2,1,0]=4 1649 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)N 62a_100015307671_100000703447 [0,1,0,0,0,0|2,1,0]=4 1650 B18R2.118302 COc1cccc(c1SC[C@H]2COC(=O)N2)O 62a_100015307671_100010202623 [0,1,0,0,0,0|2,1,0]=4 1651 B18R2.118302 COc1ccnc(c1SCC2CNC(=O)O2)Cl 62a_100000181169_100010154655 [0,1,0,0,0,0|1,1,0]=3 1652 B18R2.118302 COc1ccnc(c1SCC2CNC(=O)O2)Cl 62a_100010154655_100000181169 [0,1,0,0,0,0|1,1,0]=3 1653 B18R2.118302 COc1ccnc(c1SCC2COC(=O)O2)Cl 62a_100000073702_100010154655 [0,1,0,0,0,0|2,1,0]=4 1654 B18R2.118302 COc1ccnc(c1SCC2COC(=O)O2)Cl 62a_100010154655_100000073702 [0,1,0,0,0,0|2,1,0]=4 1655 B18R2.118302 COc1cn[nH]c(=O)c1SCC2CNC(=O)O2 62a_100000181169_100000020519 [0,1,0,0,0,0|2,1,0]=4 1656 B18R2.118302 COc1nccc(c1SCC2CNC(=O)O2)C 62a_100000181169_100012353928 [0,1,0,0,0,0|1,1,0]=3 1657 B18R2.118302 COc1nccc(c1SCC2CNC(=O)O2)C 62a_100012353928_100000181169 [0,1,0,0,0,0|1,1,0]=3 1658 B18R2.118302 COc1nccc(c1SCC2CNC(=O)O2)N 62a_100000181169_100010243811 [0,1,0,0,0,0|1,1,0]=3 1659 B18R2.118302 COc1nccc(c1SCC2CNC(=O)O2)N 62a_100010243811_100000181169 [0,1,0,0,0,0|1,1,0]=3 1660 B18R2.118302 COc1nccc(c1SCC2COC(=O)O2)C 62a_100000073702_100012353928 [0,1,0,0,0,0|2,1,0]=4 1661 B18R2.118302 COc1nccc(c1SCC2COC(=O)O2)C 62a_100012353928_100000073702 [0,1,0,0,0,0|2,1,0]=4 1662 B18R2.118302 COc1nccc(c1SCC2COC(=O)O2)N 62a_100000073702_100010243811 [0,1,0,0,0,0|2,1,0]=4 1663 B18R2.118302 COc1nccc(c1SCC2COC(=O)O2)N 62a_100010243811_100000073702 [0,1,0,0,0,0|2,1,0]=4 1664 B18R2.118302 COc1ncnc(c1SCC2CNC(=O)O2)C 62a_100000181169_100010110394 [0,1,0,0,0,0|2,1,0]=4 1665 B18R2.118302 COc1ncnc(c1SCC2CNC(=O)O2)C 62a_100010110394_100000181169 [0,1,0,0,0,0|2,1,0]=4 1666 B18R2.118302 Cc1cccc(c1NCC2CNC(=O)O2)C#N 2230a_100011826843_100000181169 [0,1,0,0,0,0|3,0,0]=4 1667 B18R2.118302 Cc1cccc(c1NCC2CNC(=O)O2)CO 34a_100011215590_100000181169 [0,1,0,0,0,0|3,0,0]=4 1668 B18R2.118302 Cc1cccc(c1OCC2CNC(=O)O2)C#N 34a_100011659161_100000181169 [0,1,0,0,0,0|2,0,0]=3 1669 B18R2.118302 Cc1cccc(c1OCC2CNC(=O)O2)C#N 7a_100011659161_100000181169 [0,1,0,0,0,0|2,0,0]=3 1670 B18R2.118302 Cc1cccc(c1OCC2CNC(=O)O2)CN 34a_100020639391_100000181169 [0,1,0,0,0,0|2,0,0]=3 1671 B18R2.118302 Cc1cccc(c1OCC2COC(=O)O2)C#N 34a_100011659161_100000073702 [0,1,0,0,0,0|3,0,0]=4 1672 B18R2.118302 Cc1cccc(c1OCC2COC(=O)O2)CN 34a_100020639391_100000073702 [0,1,0,0,0,0|3,0,0]=4 1673 B18R2.118302 Cc1cccc(c1SCC2CNC(=O)O2)C#N 62a_100000181169_100011934862 [0,1,0,0,0,0|2,1,0]=4 1674 B18R2.118302 Cc1cccc(c1SCC2CNC(=O)O2)C=O 62a_100000181169_100012186367 [0,1,0,0,0,0|2,1,0]=4 1675 B18R2.118302 Cc1cccc(c1SCC2CNC(=O)O2)C=O 62a_100012186367_100000181169 [0,1,0,0,0,0|2,1,0]=4 1676 B18R2.118302 Cc1cccc(c1SCC2CNC(=O)O2)CO 62a_100000181169_100011659289 [0,1,0,0,0,0|2,1,0]=4 1677 B18R2.118302 Cc1cccc(c1SCC2CNC(=O)O2)CO 62a_100011659289_100000181169 [0,1,0,0,0,0|2,1,0]=4 1678 B18R2.118302 N#Cc1cccc(c1NCC2CNC(=O)O2)F 2230a_100011219409_100000181169 [0,1,0,0,0,0|3,0,0]=4 1679 B18R2.118302 N#Cc1cccc(c1NCC2CNC(=O)O2)F 34a_100011219409_100000181169 [0,1,0,0,0,0|3,0,0]=4 1680 B18R2.118302 N#Cc1cccc(c1OCC2CNC(=O)O2)Br 34a_100009817103_100000181169 [0,1,0,0,0,0|2,0,0]=3 1681 B18R2.118302 N#Cc1cccc(c1OCC2CNC(=O)O2)Cl 34a_100009866432_100000181169 [0,1,0,0,0,0|2,0,0]=3 1682 B18R2.118302 N#Cc1cccc(c1OCC2CNC(=O)O2)Cl 7a_100009866432_100000181169 [0,1,0,0,0,0|2,0,0]=3 1683 B18R2.118302 N#Cc1cccc(c1OCC2CNC(=O)O2)F 34a_100000117915_100000181169 [0,1,0,0,0,0|2,0,0]=3 1684 B18R2.118302 N#Cc1cccc(c1OCC2CNC(=O)O2)F 7a_100000117915_100000181169 [0,1,0,0,0,0|2,0,0]=3 1685 B18R2.118302 N#Cc1cccc(c1OCC2COC(=O)O2)Br 34a_100009817103_100000073702 [0,1,0,0,0,0|3,0,0]=4 1686 B18R2.118302 N#Cc1cccc(c1OCC2COC(=O)O2)Cl 34a_100009866432_100000073702 [0,1,0,0,0,0|3,0,0]=4 1687 B18R2.118302 N#Cc1cccc(c1OCC2COC(=O)O2)F 34a_100000117915_100000073702 [0,1,0,0,0,0|3,0,0]=4 1688 B18R2.118302 N#Cc1cccc(c1SCC2CNC(=O)O2)Br 62a_100000181169_100000703783 [0,1,0,0,0,0|2,1,0]=4 1689 B18R2.118302 N#Cc1cccc(c1SCC2CNC(=O)O2)Br 62a_100000703783_100000181169 [0,1,0,0,0,0|2,1,0]=4 1690 B18R2.118302 N#Cc1cccc(c1SCC2CNC(=O)O2)Cl 62a_100000181169_100010134094 [0,1,0,0,0,0|2,1,0]=4 1691 B18R2.118302 N#Cc1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100011219237 [0,1,0,0,0,0|2,1,0]=4 1692 B18R2.118302 N#Cc1cccc(c1SCC2CNC(=O)O2)N 62a_100000181169_100009877206 [0,1,0,0,0,0|2,1,0]=4 1693 B18R2.118302 N#Cc1cccc(c1SCC2CNC(=O)O2)O 62a_100000181169_100009818990 [0,1,0,0,0,0|2,1,0]=4 1694 B18R2.118302 NCc1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100020638964 [0,1,0,0,0,0|2,1,0]=4 1695 B18R2.118302 NCc1cccc(c1SCC2CNC(=O)O2)F 62a_100020638964_100000181169 [0,1,0,0,0,0|2,1,0]=4 1696 B18R2.118302 O=C1NCC(O1)CNc2c(cccc2CO)Cl 34a_100012182729_100000181169 [0,1,0,0,0,0|3,0,0]=4 1697 B18R2.118302 O=C1NCC(O1)CNc2c(cccc2CO)F 34a_100000692437_100000181169 [0,1,0,0,0,0|3,0,0]=4 1698 B18R2.118302 O=C1NCC(O1)COc2c(cccc2CO)F 34a_100011997349_100000181169 [0,1,0,0,0,0|2,0,0]=3 1699 B18R2.118302 O=C1NCC(O1)COc2c(cccc2CO)F 7a_100011997349_100000181169 [0,1,0,0,0,0|2,0,0]=3 1700 B18R2.118302 O=C1NCC(O1)CSc2c(cccc2CO)Br 62a_100000181169_100010146604 [0,1,0,0,0,0|2,1,0]=4 1701 B18R2.118302 O=C1NCC(O1)CSc2c(cccc2CO)Br 62a_100010146604_100000181169 [0,1,0,0,0,0|2,1,0]=4 1702 B18R2.118302 O=C1NCC(O1)CSc2c(cccc2CO)F 62a_100000181169_100012351117 [0,1,0,0,0,0|2,1,0]=4 1703 B18R2.118302 O=C1NCC(O1)CSc2c(cccc2CO)F 62a_100012351117_100000181169 [0,1,0,0,0,0|2,1,0]=4 1704 B18R2.118302 O=C1OCC(O1)COc2c(cccc2CO)F 34a_100011997349_100000073702 [0,1,0,0,0,0|3,0,0]=4 1705 B18R2.118302 O=Cc1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100011934749 [0,1,0,0,0,0|2,1,0]=4 1706 B18R2.118302 O=Cc1cccc(c1SCC2CNC(=O)O2)F 62a_100011934749_100000181169 [0,1,0,0,0,0|2,1,0]=4 1707 B18R2.118302 O=Cc1cccc(c1SCC2CNC(=O)O2)O 62a_100000181169_100009816417 [0,1,0,0,0,0|2,1,0]=4 1708 B18R2.118302 O=Cc1cccc(c1SCC2CNC(=O)O2)O 62a_100009816417_100000181169 [0,1,0,0,0,0|2,1,0]=4 1709 B16R1.56 COc1ccccc1CCN(C)CC(=O)N 2230a_100000231131_100000747473 [0,0,1,0,0,0|3,0,0]=4 1710 B16R1.56 COc1ccccc1CCN(C)CC(=O)N 2230a_100000739694_100011713687 [0,0,1,0,0,0|3,0,0]=4 1711 B16R1.56 COc1ccccc1CCN(C)CC(=O)N 269982a_100000231131_100000187820 [0,0,1,0,0,0|3,0,0]=4 1712 B16R1.56 COc1ccccc1CCN(C)CC(=O)N 270004a_100000739694_100011713418 [0,0,1,0,0,0|3,0,0]=4 1713 B16R1.56 COc1ccccc1CSC(C)OC(=O)C 62a_100000210004_100009818208 [0,0,1,0,0,0|3,0,0]=4 1714 B16R1.56 COc1ccccc1CSC(C)OC(=O)C 62a_100009818208_100000210004 [0,0,1,0,0,0|3,0,0]=4 1715 B16R1.56 COc1ccccc1OCC(=O)CC(=O)N 1458a_100000182946_100000187820 [0,0,1,0,0,0|2,0,1]=4 1716 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 11a_100000743626_100015343762 [0,0,1,0,0,0|2,0,0]=3 1717 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 1626a_100000743626_100015343762 [0,0,1,0,0,0|2,0,0]=3 1718 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 240690a_100000743626_100015343762 [0,0,1,0,0,0|2,0,0]=3 1719 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 527a_100000743626_100103153847 [0,0,1,0,0,0|2,0,0]=3 1720 B16R1.56 COc1ccccc1OCC(C)OC(C)C 34a_100000242603_100000210206 [0,0,1,0,0,0|2,0,1]=4 1721 B16R1.56 COc1ccccc1OCC(C)OC(C)C 7a_100000242603_100000210206 [0,0,1,0,0,0|2,0,1]=4 1722 B16R1.57 CC(=O)NCCCOc1ccccc1C#N 11a_100011220211_100015343762 [0,0,1,0,0,0|3,0,0]=4 1723 B16R1.57 CC(=O)NCCCOc1ccccc1C#N 1626a_100011220211_100015343762 [0,0,1,0,0,0|3,0,0]=4 1724 B16R1.57 CC(=O)NCCCOc1ccccc1C#N 240690a_100011220211_100015343762 [0,0,1,0,0,0|3,0,0]=4 1725 B16R1.57 CC(=O)NCCCOc1ccccc1C#N 527a_100011220211_100103153847 [0,0,1,0,0,0|3,0,0]=4 1726 B16R1.57 CCc1ccccc1OCCCCC(=O)C 34a_100000210936_100009817362 [0,0,1,0,0,0|3,0,0]=4 1727 B16R1.57 CCc1ccccc1OCCCCC(=O)C 7a_100000210936_100000735457 [0,0,1,0,0,0|3,0,0]=4 1728 B16R1.57 CCc1ccccc1OCCCOC(=O)C 34a_100000210936_100000042594 [0,0,1,0,0,0|3,0,0]=4 1729 B16R1.57 CCc1ccccc1OCCCOC(=O)C 7a_100000210936_100000042594 [0,0,1,0,0,0|3,0,0]=4 1730 B16R1.57 CCc1ccccc1OCCCSC(=O)C 34a_100000210936_100000038929 [0,0,1,0,0,0|3,0,0]=4 1731 B16R1.57 CCc1ccccc1OCCCSC(=O)C 7a_100000210936_100000038929 [0,0,1,0,0,0|3,0,0]=4 1732 B16R1.57 CNc1ccccc1OCCCCC(=O)C 34a_100000033821_100009817362 [0,0,1,0,0,0|3,0,0]=4 1733 B16R1.57 CNc1ccccc1OCCCOC(=O)C 34a_100000033821_100000042594 [0,0,1,0,0,0|3,0,0]=4 1734 B16R1.57 CNc1ccccc1OCCCSC(=O)C 34a_100000033821_100000038929 [0,0,1,0,0,0|3,0,0]=4 1735 B16R1.57 COc1ccccc1CNCCNC(=O)C 207a_100000209853_100000169842 [0,0,1,0,0,0|3,0,0]=4 1736 B16R1.57 COc1ccccc1CNCCNC(=O)C 2230a_100000209853_100000210004 [0,0,1,0,0,0|3,0,0]=4 1737 B16R1.57 COc1ccccc1CNCCNC(=O)N 207a_100020590234_100000169842 [0,0,1,0,0,0|3,0,0]=4 1738 B16R1.57 COc1ccccc1CNCCNC(=O)N 34a_100020590234_100000210004 [0,0,1,0,0,0|3,0,0]=4 1739 B16R1.57 COc1ccccc1COCCNC(=O)C 34a_100000158858_100000210004 [0,0,1,0,0,0|3,0,0]=4 1740 B16R1.57 COc1ccccc1COCCNC(=O)N 34a_100000181757_100000210004 [0,0,1,0,0,0|3,0,0]=4 1741 B16R1.57 COc1ccccc1CSCCNC(=O)C 62a_100000189650_100000210004 [0,0,1,0,0,0|3,0,0]=4 1742 B16R1.57 COc1ccccc1CSCCNC(=O)C 62a_100000210004_100000189650 [0,0,1,0,0,0|3,0,0]=4 1743 B16R1.57 COc1ccccc1CSCCNC(=O)N 62a_100000210004_200000034859 [0,0,1,0,0,0|3,0,0]=4 1744 B16R1.57 COc1ccccc1CSCCNC(=O)N 62a_200000034859_100000210004 [0,0,1,0,0,0|3,0,0]=4 1745 B16R1.57 COc1ccccc1NCCCCC(=O)C 34a_100000210025_100009817362 [0,0,1,0,0,0|3,0,0]=4 1746 B16R1.57 COc1ccccc1NCCCOC(=O)C 34a_100000210025_100000042594 [0,0,1,0,0,0|3,0,0]=4 1747 B16R1.57 COc1ccccc1NCCCSC(=O)C 34a_100000210025_100000038929 [0,0,1,0,0,0|3,0,0]=4 1748 B16R1.57 COc1ccccc1OCCCCB(O)O 34a_100000210385_200009817182 [0,0,1,0,0,0|2,0,1]=4 1749 B16R1.57 COc1ccccc1OCCCCC(=O)C 1458a_100000070787_200011219331 [0,0,1,0,0,0|2,0,0]=3 1750 B16R1.57 COc1ccccc1OCCCCC(=O)C 34a_100000210385_100009817362 [0,0,1,0,0,0|2,0,0]=3 1751 B16R1.57 COc1ccccc1OCCCNC(=O)C 11a_100000752037_100015343762 [0,0,1,0,0,0|1,0,0]=2 1752 B16R1.57 COc1ccccc1OCCCNC(=O)C 1626a_100000752037_100015343762 [0,0,1,0,0,0|1,0,0]=2 1753 B16R1.57 COc1ccccc1OCCCNC(=O)C 240690a_100000752037_100015343762 [0,0,1,0,0,0|1,0,0]=2 1754 B16R1.57 COc1ccccc1OCCCNC(=O)C 527a_100000752037_100103153847 [0,0,1,0,0,0|1,0,0]=2 1755 B16R1.57 COc1ccccc1OCCCNC(C)C 2230a_100138425928_100011259231 [0,0,1,0,0,0|2,0,1]=4 1756 B16R1.57 COc1ccccc1OCCCNC(C)C 34a_100000752037_100000210206 [0,0,1,0,0,0|2,0,1]=4 1757 B16R1.57 COc1ccccc1OCCCNC(C)C 34a_100138425928_100011259231 [0,0,1,0,0,0|2,0,1]=4 1758 B16R1.57 COc1ccccc1OCCCOC(=O)C 34a_100000210385_100000042594 [0,0,1,0,0,0|2,0,0]=3 1759 B16R1.57 COc1ccccc1OCCCOC(=S)C 34a_100000210385_200135323944 [0,0,1,0,0,0|2,1,0]=4 1760 B16R1.57 COc1ccccc1OCCCSC(=O)C 34a_100000210385_100000038929 [0,0,1,0,0,0|2,0,0]=3 1761 B16R1.57 COc1ccccc1OCCNCC(=O)N 2230a_100000683763_100000747473 [0,0,1,0,0,0|3,0,0]=4 1762 B16R1.57 COc1ccccc1OCCNCC(=O)N 2230a_100000711301_100000188471 [0,0,1,0,0,0|3,0,0]=4 1763 B16R1.57 COc1ccccc1OCCNCC(=O)N 34a_100000683763_100000187820 [0,0,1,0,0,0|3,0,0]=4 1764 B16R1.57 COc1ccccc1OCCNCC(=O)O 269956a_100016091260_100000188471 [0,0,1,0,0,0|2,0,0]=3 1765 B16R1.57 COc1ccccc1OCCNCC(=O)[O-] 34a_100000683763_100020667443 [0,0,1,0,0,0|2,0,1]=4 1766 B16R1.57 COc1ccccc1OCCOCC(=O)C 34a_100000211253_100000188471 [0,0,1,0,0,0|3,0,0]=4 1767 B16R1.57 COc1ccccc1OCCOCC(=O)N 34a_100000210385_100000076697 [0,0,1,0,0,0|3,0,0]=4 1768 B16R1.57 COc1ccccc1OCCSCC(=O)N 62a_100000188471_100000747473 [0,0,1,0,0,0|3,0,0]=4 1769 B16R1.57 COc1ccccc1OCCSCC(=O)N 62a_100000747473_100000188471 [0,0,1,0,0,0|3,0,0]=4 1770 B16R1.57 COc1ccccc1OCCSCC(=O)[O-] 62a_100000188471_100020667443 [0,0,1,0,0,0|2,0,1]=4 1771 B16R1.57 COc1ccccc1OCCSCC(=O)[O-] 62a_100020667443_100000188471 [0,0,1,0,0,0|2,0,1]=4 1772 B16R1.57 COc1ccccc1SCCCCC(=O)C 62a_100000210334_100000735457 [0,0,1,0,0,0|2,1,0]=4 1773 B16R1.57 COc1ccccc1SCCCCC(=O)C 62a_100000735457_100000210334 [0,0,1,0,0,0|2,1,0]=4 1774 B16R1.57 COc1ccccc1SCCCOC(=O)C 62a_100000042594_100000210334 [0,0,1,0,0,0|2,1,0]=4 1775 B16R1.57 COc1ccccc1SCCCOC(=O)C 62a_100000210334_100000042594 [0,0,1,0,0,0|2,1,0]=4 1776 B16R1.57 COc1ccccc1SCCCSC(=O)C 62a_100000038929_100000210334 [0,0,1,0,0,0|2,1,0]=4 1777 B16R1.57 COc1ccccc1SCCCSC(=O)C 62a_100000210334_100000038929 [0,0,1,0,0,0|2,1,0]=4 1778 B16R1.57 COc1cccnc1OCCCCC(=O)C 34a_100025773188_100009817362 [0,0,1,0,0,0|3,0,0]=4 1779 B16R1.57 COc1cccnc1OCCCOC(=O)C 34a_100025773188_100000042594 [0,0,1,0,0,0|3,0,0]=4 1780 B16R1.57 COc1cccnc1OCCCSC(=O)C 34a_100025773188_100000038929 [0,0,1,0,0,0|3,0,0]=4 1781 B16R1.57 COc1ccncc1OCCCCC(=O)C 34a_100000101186_100009817362 [0,0,1,0,0,0|3,0,0]=4 1782 B16R1.57 COc1ccncc1OCCCOC(=O)C 34a_100000101186_100000042594 [0,0,1,0,0,0|3,0,0]=4 1783 B16R1.57 COc1ccncc1OCCCSC(=O)C 34a_100000101186_100000038929 [0,0,1,0,0,0|3,0,0]=4 1784 B16R1.57 COc1ncccc1OCCCCC(=O)C 34a_100000698397_100009817362 [0,0,1,0,0,0|3,0,0]=4 1785 B16R1.57 COc1ncccc1OCCCCC(=O)C 7a_100000698397_100000735457 [0,0,1,0,0,0|3,0,0]=4 1786 B16R1.57 COc1ncccc1OCCCOC(=O)C 34a_100000698397_100000042594 [0,0,1,0,0,0|3,0,0]=4 1787 B16R1.57 COc1ncccc1OCCCOC(=O)C 7a_100000698397_100000042594 [0,0,1,0,0,0|3,0,0]=4 1788 B16R1.57 COc1ncccc1OCCCSC(=O)C 34a_100000698397_100000038929 [0,0,1,0,0,0|3,0,0]=4 1789 B16R1.57 COc1ncccc1OCCCSC(=O)C 7a_100000698397_100000038929 [0,0,1,0,0,0|3,0,0]=4 1790 B16R1.57 CSc1ccccc1OCCCCC(=O)C 34a_100011216402_100009817362 [0,0,1,0,0,0|2,1,0]=4 1791 B16R1.57 CSc1ccccc1OCCCOC(=O)C 34a_100011216402_100000042594 [0,0,1,0,0,0|2,1,0]=4 1792 B16R1.57 CSc1ccccc1OCCCSC(=O)C 34a_100011216402_100000038929 [0,0,1,0,0,0|2,1,0]=4 1793 B16R1.642 CCC/C=C/C=C/COCC1CNC(=O)O1 34a_100016294078_100000181169 [0,0,1,0,0,0|1,0,2]=4 1794 B16R1.1454 COc1ccccc1OCC(C)NCC=O 2230a_100000743626_200015260668 [0,0,1,0,0,0|3,0,0]=4 1795 B16R1.1454 COc1ccccc1OCC(C)OCC=O 34a_100000242603_200009817547 [0,0,1,0,0,0|3,0,0]=4 1796 B16R1.1454 COc1ccccc1OCC(C)OCC=O 7a_100000242603_200015260668 [0,0,1,0,0,0|3,0,0]=4 1797 B16R1.3910 C#CC(=O)CCCOc1ccccc1OC 1458a_100000211873_100011259231 [0,0,1,0,0,0|2,0,1]=4 1798 B16R1.3910 C#Cc1ccccc1NCCOC(=O)NC 34a_100011470550_200011997002 [0,0,1,0,0,0|2,0,1]=4 1799 B16R1.3910 C#Cc1ccccc1OCCCC(=O)NC 34a_200011470546_100000741757 [0,0,1,0,0,0|2,0,1]=4 1800 B16R1.3910 C#Cc1ccccc1OCCCC(=O)NC 7a_200011470546_100000741757 [0,0,1,0,0,0|2,0,1]=4 1801 B16R1.3910 C#Cc1ccccc1OCCOC(=O)NC 34a_200011470546_200011997002 [0,0,1,0,0,0|1,0,1]=3 1802 B16R1.3910 C#Cc1ccccc1OCCOC(=O)NC 7a_200011470546_200011997002 [0,0,1,0,0,0|1,0,1]=3 1803 B16R1.3910 C=CC(=O)CCCOc1ccccc1OC 1458a_100000185746_100011259231 [0,0,1,0,0,0|2,0,1]=4 1804 B16R1.3910 C=CC(=O)NCCOc1ccccc1OC 1626a_100000683763_100000185746 [0,0,1,0,0,0|2,0,1]=4 1805 B16R1.3910 C=CC(=O)NCCOc1ccccc1OC 240690a_100000683763_200121576911 [0,0,1,0,0,0|2,0,1]=4 1806 B16R1.3910 C=CC(=O)OCCNc1ccccc1OC 34a_100000210025_100009813456 [0,0,1,0,0,0|2,0,1]=4 1807 B16R1.3910 C=CC(=O)OCCOc1ccccc1CC 34a_100000210936_100009813456 [0,0,1,0,0,0|2,0,1]=4 1808 B16R1.3910 C=CC(=O)OCCOc1ccccc1CC 7a_100000210936_100009813456 [0,0,1,0,0,0|2,0,1]=4 1809 B16R1.3910 C=CC(=O)OCCOc1ccccc1NC 34a_100000033821_100009813456 [0,0,1,0,0,0|2,0,1]=4 1810 B16R1.3910 C=CC(=O)OCCOc1ccccc1OC 34a_100000210385_100009813456 [0,0,1,0,0,0|1,0,1]=3 1811 B16R1.3910 C=CC(=O)OCCOc1ccccc1SC 34a_100011216402_100009813456 [0,0,1,0,0,0|1,1,1]=4 1812 B16R1.3910 C=CC(=O)OCCOc1cccnc1OC 34a_100000698397_100009813456 [0,0,1,0,0,0|2,0,1]=4 1813 B16R1.3910 C=CC(=O)OCCOc1cccnc1OC 7a_100000698397_100009813456 [0,0,1,0,0,0|2,0,1]=4 1814 B16R1.3910 C=CC(=O)OCCOc1cnccc1OC 34a_100000101186_100009813456 [0,0,1,0,0,0|2,0,1]=4 1815 B16R1.3910 C=CC(=O)OCCOc1ncccc1OC 34a_100025773188_100009813456 [0,0,1,0,0,0|2,0,1]=4 1816 B16R1.3910 C=CC(=O)OCCSc1ccccc1OC 62a_100000210334_100009813456 [0,0,1,0,0,0|1,1,1]=4 1817 B16R1.3910 C=CC(=O)OCCSc1ccccc1OC 62a_100009813456_100000210334 [0,0,1,0,0,0|1,1,1]=4 1818 B16R1.3910 C=Cc1ccccc1NCCOC(=O)NC 34a_100012022501_200011997002 [0,0,1,0,0,0|2,0,1]=4 1819 B16R1.3910 C=Cc1ccccc1SCCOC(=O)NC 62a_100011218376_200011997002 [0,0,1,0,0,0|1,1,1]=4 1820 B16R1.3910 C=Cc1ccccc1SCCOC(=O)NC 62a_200011997002_100011218376 [0,0,1,0,0,0|1,1,1]=4 1821 B16R1.3910 CCC(=O)CCCOc1ccccc1OC 1458a_100000210414_100011259231 [0,0,1,0,0,0|2,0,0]=3 1822 B16R1.3910 CCC(=O)NCCOc1ccccc1OC 11a_100000683763_100000210414 [0,0,1,0,0,0|2,0,0]=3 1823 B16R1.3910 CCC(=O)NCCOc1ccccc1OC 1626a_100000683763_100000210414 [0,0,1,0,0,0|2,0,0]=3 1824 B16R1.3910 CCC(=O)NCCOc1ccccc1OC 240690a_100000683763_100000210414 [0,0,1,0,0,0|2,0,0]=3 1825 B16R1.3910 CCC(=O)NCCOc1ccccc1OC 527a_100000683763_100000210414 [0,0,1,0,0,0|2,0,0]=3 1826 B16R1.3910 CCC(=O)NCCOc1ccccc1SC 11a_100011893647_100000210414 [0,0,1,0,0,0|2,1,0]=4 1827 B16R1.3910 CCC(=O)NCCOc1ccccc1SC 240690a_100011893647_100000210414 [0,0,1,0,0,0|2,1,0]=4 1828 B16R1.3910 CCC(=O)NCCOc1ccccc1SC 527a_100011893647_100000210414 [0,0,1,0,0,0|2,1,0]=4 1829 B16R1.3910 CCC(C)OCCOc1ccccc1OC 7a_100000210228_100000188471 [0,0,1,0,0,0|2,0,1]=4 1830 B16R1.3910 CCc1ccccc1NCCCC(=O)NC 2230a_100000212081_100000741757 [0,0,1,0,0,0|3,0,0]=4 1831 B16R1.3910 CCc1ccccc1NCCCC(=O)NC 34a_100000212081_100000741757 [0,0,1,0,0,0|3,0,0]=4 1832 B16R1.3910 CCc1ccccc1NCCCC(=O)NC 7a_100000212081_100000741757 [0,0,1,0,0,0|3,0,0]=4 1833 B16R1.3910 CCc1ccccc1NCCOC(=O)NC 34a_100000212081_200011997002 [0,0,1,0,0,0|2,0,0]=3 1834 B16R1.3910 CCc1ccccc1NCCOC(=O)NC 7a_100000212081_200011997002 [0,0,1,0,0,0|2,0,0]=3 1835 B16R1.3910 CCc1ccccc1OCCCC(=O)NC 34a_100000210936_100000741757 [0,0,1,0,0,0|2,0,0]=3 1836 B16R1.3910 CCc1ccccc1OCCCC(=O)NC 7a_100000210936_100000741757 [0,0,1,0,0,0|2,0,0]=3 1837 B16R1.3910 CCc1ccccc1OCCCC(=O)OC 34a_100000210936_100000742333 [0,0,1,0,0,0|3,0,0]=4 1838 B16R1.3910 CCc1ccccc1OCCCC(=O)OC 7a_100000210936_100011218270 [0,0,1,0,0,0|3,0,0]=4 1839 B16R1.3910 CCc1ccccc1OCCOC(=O)NC 34a_100000210936_200011997002 [0,0,1,0,0,0|1,0,0]=2 1840 B16R1.3910 CCc1ccccc1OCCOC(=O)NC 7a_100000210936_200011997002 [0,0,1,0,0,0|1,0,0]=2 1841 B16R1.3910 CCc1ccccc1SCCCC(=O)NC 62a_100000741757_100011215823 [0,0,1,0,0,0|2,1,0]=4 1842 B16R1.3910 CCc1ccccc1SCCCC(=O)NC 62a_100011215823_100000741757 [0,0,1,0,0,0|2,1,0]=4 1843 B16R1.3910 CCc1ccccc1SCCOC(=O)NC 62a_100011215823_200011997002 [0,0,1,0,0,0|1,1,0]=3 1844 B16R1.3910 CCc1ccccc1SCCOC(=O)NC 62a_200011997002_100011215823 [0,0,1,0,0,0|1,1,0]=3 1845 B16R1.3910 CCc1ccncc1SCCOC(=O)NC 62a_100009819861_200011997002 [0,0,1,0,0,0|2,1,0]=4 1846 B16R1.3910 CCc1ccncc1SCCOC(=O)NC 62a_200011997002_100009819861 [0,0,1,0,0,0|2,1,0]=4 1847 B16R1.3910 CCc1cnccc1SCCOC(=O)NC 62a_100025704421_200011997002 [0,0,1,0,0,0|2,1,0]=4 1848 B16R1.3910 CCc1cnccc1SCCOC(=O)NC 62a_200011997002_100025704421 [0,0,1,0,0,0|2,1,0]=4 1849 B16R1.3910 CCc1ncccc1SCCOC(=O)NC 62a_100009877225_200011997002 [0,0,1,0,0,0|2,1,0]=4 1850 B16R1.3910 CCc1ncccc1SCCOC(=O)NC 62a_200011997002_100009877225 [0,0,1,0,0,0|2,1,0]=4 1851 B16R1.3910 CNC(=O)CCCNc1ccccc1OC 34a_100000210025_100000741757 [0,0,1,0,0,0|2,0,0]=3 1852 B16R1.3910 CNC(=O)CCCNc1ccccc1SC 34a_100000211160_100000741757 [0,0,1,0,0,0|2,1,0]=4 1853 B16R1.3910 CNC(=O)CCCOc1ccccc1C#N 34a_100000211048_100000741757 [0,0,1,0,0,0|3,0,0]=4 1854 B16R1.3910 CNC(=O)CCCOc1ccccc1C#N 7a_100000211048_100000741757 [0,0,1,0,0,0|3,0,0]=4 1855 B16R1.3910 CNC(=O)CCCOc1ccccc1CN 34a_100000185550_100000741757 [0,0,1,0,0,0|3,0,0]=4 1856 B16R1.3910 CNC(=O)CCCOc1ccccc1CO 34a_100011216872_100000741757 [0,0,1,0,0,0|3,0,0]=4 1857 B16R1.3910 CNC(=O)CCCOc1ccccc1NC 34a_100000033821_100000741757 [0,0,1,0,0,0|2,0,0]=3 1858 B16R1.3910 CNC(=O)CCCOc1ccccc1OC 34a_100000210385_100000741757 [0,0,1,0,0,0|1,0,0]=2 1859 B16R1.3910 CNC(=O)CCCOc1ccccc1SC 34a_100011216402_100000741757 [0,0,1,0,0,0|1,1,0]=3 1860 B16R1.3910 CNC(=O)CCCOc1cccnc1OC 34a_100000698397_100000741757 [0,0,1,0,0,0|2,0,0]=3 1861 B16R1.3910 CNC(=O)CCCOc1cccnc1OC 7a_100000698397_100000741757 [0,0,1,0,0,0|2,0,0]=3 1862 B16R1.3910 CNC(=O)CCCOc1cnccc1OC 34a_100000101186_100000741757 [0,0,1,0,0,0|2,0,0]=3 1863 B16R1.3910 CNC(=O)CCCOc1ncccc1OC 34a_100025773188_100000741757 [0,0,1,0,0,0|2,0,0]=3 1864 B16R1.3910 CNC(=O)CCCSc1ccccc1NC 62a_100000741757_100020606079 [0,0,1,0,0,0|2,1,0]=4 1865 B16R1.3910 CNC(=O)CCCSc1ccccc1NC 62a_100020606079_100000741757 [0,0,1,0,0,0|2,1,0]=4 1866 B16R1.3910 CNC(=O)CCCSc1ccccc1OC 62a_100000210334_100000741757 [0,0,1,0,0,0|1,1,0]=3 1867 B16R1.3910 CNC(=O)CCCSc1ccccc1OC 62a_100000741757_100000210334 [0,0,1,0,0,0|1,1,0]=3 1868 B16R1.3910 CNC(=O)CCCSc1ccccc1SC 62a_100000741757_100011217816 [0,0,1,0,0,0|1,2,0]=4 1869 B16R1.3910 CNC(=O)CCCSc1ccccc1SC 62a_100011217816_100000741757 [0,0,1,0,0,0|1,2,0]=4 1870 B16R1.3910 CNC(=O)CCCSc1cccnc1OC 62a_100000047025_100000741757 [0,0,1,0,0,0|2,1,0]=4 1871 B16R1.3910 CNC(=O)CCCSc1cccnc1OC 62a_100000741757_100000047025 [0,0,1,0,0,0|2,1,0]=4 1872 B16R1.3910 CNC(=O)CCCSc1ccncc1OC 62a_100000741757_100016988167 [0,0,1,0,0,0|2,1,0]=4 1873 B16R1.3910 CNC(=O)CCCSc1ccncc1OC 62a_100016988167_100000741757 [0,0,1,0,0,0|2,1,0]=4 1874 B16R1.3910 CNC(=O)CCCSc1cnccc1OC 62a_100000741757_100011997281 [0,0,1,0,0,0|2,1,0]=4 1875 B16R1.3910 CNC(=O)CCCSc1cnccc1OC 62a_100011997281_100000741757 [0,0,1,0,0,0|2,1,0]=4 1876 B16R1.3910 CNC(=O)CCCSc1ncccc1OC 62a_100000741757_100000690851 [0,0,1,0,0,0|2,1,0]=4 1877 B16R1.3910 CNC(=O)CCCSc1ncccc1OC 62a_100000767102_100000741757 [0,0,1,0,0,0|2,1,0]=4 1878 B16R1.3910 CNC(=O)CCNCc1ccccc1OC 207a_100000738227_100000169842 [0,0,1,0,0,0|3,0,0]=4 1879 B16R1.3910 CNC(=O)CCNCc1ccccc1OC 2230a_100000738227_100000210004 [0,0,1,0,0,0|3,0,0]=4 1880 B16R1.3910 CNC(=O)CCNCc1ccccc1OC 270004a_100000738227_100000169842 [0,0,1,0,0,0|3,0,0]=4 1881 B16R1.3910 CNC(=O)CCNCc1ccccc1OC 34a_100000188900_100012179268 [0,0,1,0,0,0|3,0,0]=4 1882 B16R1.3910 CNC(=O)CCNCc1ccccc1OC 34a_100000738227_100000210004 [0,0,1,0,0,0|3,0,0]=4 1883 B16R1.3910 CNC(=O)CCOCc1ccccc1OC 34a_100000211301_100012179268 [0,0,1,0,0,0|3,0,0]=4 1884 B16R1.3910 CNC(=O)CCOCc1ccccc1OC 34a_100000754576_100000210004 [0,0,1,0,0,0|3,0,0]=4 1885 B16R1.3910 CNC(=O)CCSCc1ccccc1OC 62a_100000210004_100000737683 [0,0,1,0,0,0|3,0,0]=4 1886 B16R1.3910 CNC(=O)CCSCc1ccccc1OC 62a_100000737683_100000210004 [0,0,1,0,0,0|3,0,0]=4 1887 B16R1.3910 CNC(=O)CNCCc1ccccc1OC 2230a_100000211851_100000183359 [0,0,1,0,0,0|3,0,0]=4 1888 B16R1.3910 CNC(=O)CNCCc1ccccc1OC 2230a_100000693194_100011713687 [0,0,1,0,0,0|3,0,0]=4 1889 B16R1.3910 CNC(=O)CNCCc1ccccc1OC 270004a_100000693194_100011713418 [0,0,1,0,0,0|3,0,0]=4 1890 B16R1.3910 CNC(=O)CNCCc1ccccc1OC 34a_100000211851_100000183359 [0,0,1,0,0,0|3,0,0]=4 1891 B16R1.3910 CNC(=O)COCCc1ccccc1OC 34a_100000750040_100011713687 [0,0,1,0,0,0|3,0,0]=4 1892 B16R1.3910 CNC(=O)COCCc1ccccc1OC 34a_100011218620_100000183359 [0,0,1,0,0,0|3,0,0]=4 1893 B16R1.3910 CNC(=O)COCCc1ccccc1OC 7a_100011218620_100000183359 [0,0,1,0,0,0|3,0,0]=4 1894 B16R1.3910 CNC(=O)CSCCc1ccccc1OC 62a_100000183359_100011713687 [0,0,1,0,0,0|3,0,0]=4 1895 B16R1.3910 CNC(=O)CSCCc1ccccc1OC 62a_100011713687_100000183359 [0,0,1,0,0,0|3,0,0]=4 1896 B16R1.3910 CNC(=O)NCCOc1ccccc1C#N 2708a_100102657272_106726388804 [0,0,1,0,0,0|3,0,0]=4 1897 B16R1.3910 CNC(=O)NCCOc1ccccc1C#N 2708a_106726388804_106832991635 [0,0,1,0,0,0|3,0,0]=4 1898 B16R1.3910 CNC(=O)NCCOc1ccccc1C#N 273464a_100102657272_106726388804 [0,0,1,0,0,0|3,0,0]=4 1899 B16R1.3910 CNC(=O)NCCOc1ccccc1C#N 273464a_106726388804_100102657272 [0,0,1,0,0,0|3,0,0]=4 1900 B16R1.3910 CNC(=O)NCCOc1ccccc1C#N 512a_106726388804_100102657272 [0,0,1,0,0,0|3,0,0]=4 1901 B16R1.3910 CNC(=O)NCCOc1ccccc1C#N 512a_106832991638_106726388804 [0,0,1,0,0,0|3,0,0]=4 1902 B16R1.3910 CNC(=O)NCCOc1ccccc1OC 2708a_100000683763_106832991635 [0,0,1,0,0,0|1,0,0]=2 1903 B16R1.3910 CNC(=O)NCCOc1ccccc1OC 2708a_100102657272_100000683763 [0,0,1,0,0,0|1,0,0]=2 1904 B16R1.3910 CNC(=O)NCCOc1ccccc1OC 273464a_100000683763_100102657272 [0,0,1,0,0,0|1,0,0]=2 1905 B16R1.3910 CNC(=O)NCCOc1ccccc1OC 273464a_100102657272_100000683763 [0,0,1,0,0,0|1,0,0]=2 1906 B16R1.3910 CNC(=O)NCCOc1ccccc1OC 512a_100000683763_100102657272 [0,0,1,0,0,0|1,0,0]=2 1907 B16R1.3910 CNC(=O)NCCOc1ccccc1OC 512a_106832991638_100000683763 [0,0,1,0,0,0|1,0,0]=2 1908 B16R1.3910 CNC(=O)NCCOc1ccccc1SC 2708a_100011893647_106832991635 [0,0,1,0,0,0|1,1,0]=3 1909 B16R1.3910 CNC(=O)NCCOc1ccccc1SC 2708a_100102657272_100011893647 [0,0,1,0,0,0|1,1,0]=3 1910 B16R1.3910 CNC(=O)NCCOc1ccccc1SC 273464a_100011893647_100102657272 [0,0,1,0,0,0|1,1,0]=3 1911 B16R1.3910 CNC(=O)NCCOc1ccccc1SC 273464a_100102657272_100011893647 [0,0,1,0,0,0|1,1,0]=3 1912 B16R1.3910 CNC(=O)NCCOc1ccccc1SC 512a_100011893647_100102657272 [0,0,1,0,0,0|1,1,0]=3 1913 B16R1.3910 CNC(=O)NCCOc1ccccc1SC 512a_106832991638_100011893647 [0,0,1,0,0,0|1,1,0]=3 1914 B16R1.3910 CNC(=O)OCCNc1ccccc1C#N 34a_100000211148_200011997002 [0,0,1,0,0,0|3,0,0]=4 1915 B16R1.3910 CNC(=O)OCCNc1ccccc1CO 34a_100000212039_200011997002 [0,0,1,0,0,0|3,0,0]=4 1916 B16R1.3910 CNC(=O)OCCNc1ccccc1OC 34a_100000210025_200011997002 [0,0,1,0,0,0|1,0,0]=2 1917 B16R1.3910 CNC(=O)OCCNc1ccccc1SC 34a_100000211160_200011997002 [0,0,1,0,0,0|1,1,0]=3 1918 B16R1.3910 CNC(=O)OCCOc1ccccc1C#N 34a_100000211048_200011997002 [0,0,1,0,0,0|2,0,0]=3 1919 B16R1.3910 CNC(=O)OCCOc1ccccc1C#N 7a_100000211048_200011997002 [0,0,1,0,0,0|2,0,0]=3 1920 B16R1.3910 CNC(=O)OCCOc1ccccc1CN 34a_100000185550_200011997002 [0,0,1,0,0,0|2,0,0]=3 1921 B16R1.3910 CNC(=O)OCCOc1ccccc1CO 34a_100011216872_200011997002 [0,0,1,0,0,0|2,0,0]=3 1922 B16R1.3910 CNC(=O)OCCOc1ccccc1NC 34a_100000033821_200011997002 [0,0,1,0,0,0|1,0,0]=2 1923 B16R1.3910 CNC(=O)OCCOc1ccccc1OC 34a_100000210385_200011997002 [0,0,1,0,0,0|0,0,0]=1 1924 B16R1.3910 CNC(=O)OCCOc1ccccc1SC 34a_100011216402_200011997002 [0,0,1,0,0,0|0,1,0]=2 1925 B16R1.3910 CNC(=O)OCCOc1cccnc1C#N 34a_100000722750_200011997002 [0,0,1,0,0,0|3,0,0]=4 1926 B16R1.3910 CNC(=O)OCCOc1cccnc1C#N 7a_100000722750_200011997002 [0,0,1,0,0,0|3,0,0]=4 1927 B16R1.3910 CNC(=O)OCCOc1cccnc1CBr 34a_200020655725_200011997002 [0,0,1,0,0,0|3,0,0]=4 1928 B16R1.3910 CNC(=O)OCCOc1cccnc1CBr 7a_200020655725_200011997002 [0,0,1,0,0,0|3,0,0]=4 1929 B16R1.3910 CNC(=O)OCCOc1cccnc1CO 34a_100000731849_200011997002 [0,0,1,0,0,0|3,0,0]=4 1930 B16R1.3910 CNC(=O)OCCOc1cccnc1OC 34a_100000698397_200011997002 [0,0,1,0,0,0|1,0,0]=2 1931 B16R1.3910 CNC(=O)OCCOc1cccnc1OC 7a_100000698397_200011997002 [0,0,1,0,0,0|1,0,0]=2 1932 B16R1.3910 CNC(=O)OCCOc1cnccc1C#N 7a_100012181322_200011997002 [0,0,1,0,0,0|3,0,0]=4 1933 B16R1.3910 CNC(=O)OCCOc1cnccc1CO 34a_100000078615_200011997002 [0,0,1,0,0,0|3,0,0]=4 1934 B16R1.3910 CNC(=O)OCCOc1cnccc1OC 34a_100000101186_200011997002 [0,0,1,0,0,0|1,0,0]=2 1935 B16R1.3910 CNC(=O)OCCOc1ncccc1OC 34a_100025773188_200011997002 [0,0,1,0,0,0|1,0,0]=2 1936 B16R1.3910 CNC(=O)OCCSc1ccccc1C#N 62a_200011997002_100000188569 [0,0,1,0,0,0|2,1,0]=4 1937 B16R1.3910 CNC(=O)OCCSc1ccccc1C=O 62a_100000210073_200011997002 [0,0,1,0,0,0|2,1,0]=4 1938 B16R1.3910 CNC(=O)OCCSc1ccccc1C=O 62a_200011997002_100000210073 [0,0,1,0,0,0|2,1,0]=4 1939 B16R1.3910 CNC(=O)OCCSc1ccccc1CN 62a_100000689332_200011997002 [0,0,1,0,0,0|2,1,0]=4 1940 B16R1.3910 CNC(=O)OCCSc1ccccc1CN 62a_200011997002_100000689332 [0,0,1,0,0,0|2,1,0]=4 1941 B16R1.3910 CNC(=O)OCCSc1ccccc1CO 62a_100000187465_200011997002 [0,0,1,0,0,0|2,1,0]=4 1942 B16R1.3910 CNC(=O)OCCSc1ccccc1CO 62a_200011997002_100000187465 [0,0,1,0,0,0|2,1,0]=4 1943 B16R1.3910 CNC(=O)OCCSc1ccccc1NC 62a_100020606079_200011997002 [0,0,1,0,0,0|1,1,0]=3 1944 B16R1.3910 CNC(=O)OCCSc1ccccc1NC 62a_200011997002_100020606079 [0,0,1,0,0,0|1,1,0]=3 1945 B16R1.3910 CNC(=O)OCCSc1ccccc1NN 62a_100000241748_200011997002 [0,0,1,0,0,0|2,1,0]=4 1946 B16R1.3910 CNC(=O)OCCSc1ccccc1NN 62a_200011997002_100000241748 [0,0,1,0,0,0|2,1,0]=4 1947 B16R1.3910 CNC(=O)OCCSc1ccccc1OC 62a_100000210334_200011997002 [0,0,1,0,0,0|0,1,0]=2 1948 B16R1.3910 CNC(=O)OCCSc1ccccc1OC 62a_200011997002_100000210334 [0,0,1,0,0,0|0,1,0]=2 1949 B16R1.3910 CNC(=O)OCCSc1ccccc1SC 62a_100011217816_200011997002 [0,0,1,0,0,0|0,2,0]=3 1950 B16R1.3910 CNC(=O)OCCSc1ccccc1SC 62a_200011997002_100011217816 [0,0,1,0,0,0|0,2,0]=3 1951 B16R1.3910 CNC(=O)OCCSc1cccnc1NC 62a_100000700899_200011997002 [0,0,1,0,0,0|2,1,0]=4 1952 B16R1.3910 CNC(=O)OCCSc1cccnc1NC 62a_200011997002_100000700899 [0,0,1,0,0,0|2,1,0]=4 1953 B16R1.3910 CNC(=O)OCCSc1cccnc1OC 62a_100000047025_200011997002 [0,0,1,0,0,0|1,1,0]=3 1954 B16R1.3910 CNC(=O)OCCSc1cccnc1OC 62a_200011997002_100000047025 [0,0,1,0,0,0|1,1,0]=3 1955 B16R1.3910 CNC(=O)OCCSc1cccnc1SC 62a_100011465278_200011997002 [0,0,1,0,0,0|1,2,0]=4 1956 B16R1.3910 CNC(=O)OCCSc1cccnc1SC 62a_200011997002_100011465278 [0,0,1,0,0,0|1,2,0]=4 1957 B16R1.3910 CNC(=O)OCCSc1ccncc1OC 62a_100016988167_200011997002 [0,0,1,0,0,0|1,1,0]=3 1958 B16R1.3910 CNC(=O)OCCSc1ccncc1OC 62a_200011997002_100016988167 [0,0,1,0,0,0|1,1,0]=3 1959 B16R1.3910 CNC(=O)OCCSc1cnccc1NC 62a_100010069531_200011997002 [0,0,1,0,0,0|2,1,0]=4 1960 B16R1.3910 CNC(=O)OCCSc1cnccc1NC 62a_200011997002_100010069531 [0,0,1,0,0,0|2,1,0]=4 1961 B16R1.3910 CNC(=O)OCCSc1cnccc1OC 62a_100011997281_200011997002 [0,0,1,0,0,0|1,1,0]=3 1962 B16R1.3910 CNC(=O)OCCSc1cnccc1OC 62a_200011997002_100011997281 [0,0,1,0,0,0|1,1,0]=3 1963 B16R1.3910 CNC(=O)OCCSc1cncnc1OC 62a_100000719902_200011997002 [0,0,1,0,0,0|2,1,0]=4 1964 B16R1.3910 CNC(=O)OCCSc1cncnc1OC 62a_200011997002_100000719902 [0,0,1,0,0,0|2,1,0]=4 1965 B16R1.3910 CNC(=O)OCCSc1ncccc1NC 62a_200011997002_200011806188 [0,0,1,0,0,0|2,1,0]=4 1966 B16R1.3910 CNC(=O)OCCSc1ncccc1OC 62a_100000767102_200011997002 [0,0,1,0,0,0|1,1,0]=3 1967 B16R1.3910 CNC(=O)OCCSc1ncccc1OC 62a_200011997002_100000690851 [0,0,1,0,0,0|1,1,0]=3 1968 B16R1.3910 CNC(=O)OCCSc1nccnc1OC 62a_100009858322_200011997002 [0,0,1,0,0,0|2,1,0]=4 1969 B16R1.3910 CNC(=O)OCCSc1nccnc1OC 62a_200011997002_100000749998 [0,0,1,0,0,0|2,1,0]=4 1970 B16R1.3910 CNC(=O)OCCSc1ncncc1OC 62a_100012001275_200011997002 [0,0,1,0,0,0|2,1,0]=4 1971 B16R1.3910 CNC(=O)OCCSc1ncncc1OC 62a_200011997002_100012001275 [0,0,1,0,0,0|2,1,0]=4 1972 B16R1.3910 CNc1ccccc1OCCCC(=O)OC 34a_100000033821_100000742333 [0,0,1,0,0,0|3,0,0]=4 1973 B16R1.3910 COC(=O)/C=C/COc1ccccc1OC 34a_100000210385_100000742655 [0,0,1,0,0,0|2,0,1]=4 1974 B16R1.3910 COC(=O)CCCNc1ccccc1OC 34a_100000210025_100000742333 [0,0,1,0,0,0|3,0,0]=4 1975 B16R1.3910 COC(=O)CCCOc1ccccc1OC 34a_100000210385_100000742333 [0,0,1,0,0,0|2,0,0]=3 1976 B16R1.3910 COC(=O)CCCOc1ccccc1SC 34a_100011216402_100000742333 [0,0,1,0,0,0|2,1,0]=4 1977 B16R1.3910 COC(=O)CCCOc1cccnc1OC 34a_100000698397_100000742333 [0,0,1,0,0,0|3,0,0]=4 1978 B16R1.3910 COC(=O)CCCOc1cccnc1OC 7a_100000698397_100011218270 [0,0,1,0,0,0|3,0,0]=4 1979 B16R1.3910 COC(=O)CCCOc1cnccc1OC 34a_100000101186_100000742333 [0,0,1,0,0,0|3,0,0]=4 1980 B16R1.3910 COC(=O)CCCOc1ncccc1OC 34a_100025773188_100000742333 [0,0,1,0,0,0|3,0,0]=4 1981 B16R1.3910 COC(=O)CCCSc1ccccc1OC 62a_100000210334_100011218270 [0,0,1,0,0,0|2,1,0]=4 1982 B16R1.3910 COC(=O)CCCSc1ccccc1OC 62a_100011218270_100000210334 [0,0,1,0,0,0|2,1,0]=4 1983 B16R1.3910 COC(=O)OCSCc1ccccc1OC 62a_100000210004_100000139417 [0,0,1,0,0,0|3,0,0]=4 1984 B16R1.3910 COc1ccccc1OCCCC(=O)CO 1458a_100000210174_100011259231 [0,0,1,0,0,0|3,0,0]=4 1985 B16R1.3910 COc1ccccc1OCCNC(=O)CO 240690a_100000683763_100000210174 [0,0,1,0,0,0|3,0,0]=4 1986 B16R1.3910 COc1ccccc1OCCNC(=O)CO 527a_100000683763_100000210174 [0,0,1,0,0,0|3,0,0]=4 1987 B16R2.173 C#Cc1ccccc1OC2COC(=O)O2 34a_200011470546_100000032252 [0,0,0,0,1,0|2,0,1]=4 1988 B16R2.173 CCc1ccccc1NC2COC(=O)O2 34a_100000212081_100000032252 [0,0,0,0,1,0|3,0,0]=4 1989 B16R2.173 CCc1ccccc1OC2COC(=O)O2 34a_100000210936_100000032252 [0,0,0,0,1,0|2,0,0]=3 1990 B16R2.173 CCc1ccccc1SC2COC(=O)O2 62a_100011215823_100000032252 [0,0,0,0,1,0|2,1,0]=4 1991 B16R2.173 CNc1ccccc1OC2COC(=O)O2 34a_100000033821_100000032252 [0,0,0,0,1,0|2,0,0]=3 1992 B16R2.173 CNc1ccccc1SC2COC(=O)O2 62a_100020606079_100000032252 [0,0,0,0,1,0|2,1,0]=4 1993 B16R2.173 COc1ccccc1CN2CNC(=O)C2 2230a_200000708111_100000210004 [0,0,0,0,1,0|2,0,0]=3 1994 B16R2.173 COc1ccccc1NC2COC(=O)O2 34a_100000210025_100000032252 [0,0,0,0,1,0|2,0,0]=3 1995 B16R2.173 COc1ccccc1OC2COC(=O)O2 34a_100000210385_100000032252 [0,0,0,0,1,0|1,0,0]=2 1996 B16R2.173 COc1ccccc1SC2COC(=O)O2 62a_100000210334_100000032252 [0,0,0,0,1,0|1,1,0]=3 1997 B16R2.173 COc1cccnc1OC2COC(=O)O2 34a_100025773188_100000032252 [0,0,0,0,1,0|2,0,0]=3 1998 B16R2.173 COc1cccnc1SC2COC(=O)O2 62a_100000767102_100000032252 [0,0,0,0,1,0|2,1,0]=4 1999 B16R2.173 COc1ccncc1OC2COC(=O)O2 34a_100000101186_100000032252 [0,0,0,0,1,0|2,0,0]=3 2000 B16R2.173 COc1ccncc1SC2COC(=O)O2 62a_100011997281_100000032252 [0,0,0,0,1,0|2,1,0]=4 2001 B16R2.173 COc1cnccc1CN2CNC(=O)C2 2230a_200000708111_100020635607 [0,0,0,0,1,0|3,0,0]=4 2002 B16R2.173 COc1cnccc1SC2COC(=O)O2 62a_100016988167_100000032252 [0,0,0,0,1,0|2,1,0]=4 2003 B16R2.173 COc1ncccc1CN2CNC(=O)C2 2230a_200000708111_100020631285 [0,0,0,0,1,0|3,0,0]=4 2004 B16R2.173 COc1ncccc1OC2COC(=O)O2 34a_100000698397_100000032252 [0,0,0,0,1,0|2,0,0]=3 2005 B16R2.173 COc1ncccc1SC2COC(=O)O2 62a_100000047025_100000032252 [0,0,0,0,1,0|2,1,0]=4 2006 B16R2.173 CSc1ccccc1CN2CNC(=O)C2 2230a_200000708111_100000699184 [0,0,0,0,1,0|2,1,0]=4 2007 B16R2.173 CSc1ccccc1NC2COC(=O)O2 34a_100000211160_100000032252 [0,0,0,0,1,0|2,1,0]=4 2008 B16R2.173 CSc1ccccc1OC2COC(=O)O2 34a_100011216402_100000032252 [0,0,0,0,1,0|1,1,0]=3 2009 B16R2.173 CSc1ccccc1SC2COC(=O)O2 62a_100011217816_100000032252 [0,0,0,0,1,0|1,2,0]=4 2010 B16R2.173 N#Cc1ccccc1OC2COC(=O)O2 34a_100000211048_100000032252 [0,0,0,0,1,0|3,0,0]=4 2011 B16R2.173 NCc1ccccc1OC2COC(=O)O2 34a_100000185550_100000032252 [0,0,0,0,1,0|3,0,0]=4 2012 B16R2.173 O=C1OCC(O1)Oc2ccccc2CO 34a_100011216872_100000032252 [0,0,0,0,1,0|3,0,0]=4 2013 B16R2.1513 CCc1ccsc1SCC2CNC(=O)O2 62a_100000181169_200009875468 [0,0,0,0,1,0|2,1,0]=4 2014 B16R2.1513 CCc1ccsc1SCC2CNC(=O)O2 62a_200009875468_100000181169 [0,0,0,0,1,0|2,1,0]=4 2015 B16R2.1513 CCc1cscc1SCC2CNC(=O)O2 62a_100000181169_100011068457 [0,0,0,0,1,0|2,1,0]=4 2016 B16R2.1513 CCc1cscc1SCC2CNC(=O)O2 62a_100011068457_100000181169 [0,0,0,0,1,0|2,1,0]=4 2017 B16R2.1513 CCn1nccc1OCC2CNC(=O)O2 34a_100012181048_100000181169 [0,0,0,0,1,0|3,0,0]=4 2018 B16R2.1513 COc1[nH]ncc1SCC2CNC(=O)O2 62a_100010349828_100000181169 [0,0,0,0,1,0|2,1,0]=4 2019 B16R2.1513 COc1n[nH]cc1SCC2CNC(=O)O2 62a_100000181169_100010982843 [0,0,0,0,1,0|2,1,0]=4 2020 B16R2.1513 CSc1sccc1SCC2CNC(=O)O2 62a_100000181169_200010341309 [0,0,0,0,1,0|1,2,0]=4 2021 B16R2.1513 CSc1sccc1SCC2CNC(=O)O2 62a_200010341309_100000181169 [0,0,0,0,1,0|1,2,0]=4 2022 B16R2.2468 COc1ccccc1CNC2CCC2=O 34a_100000188900_100009892977 [0,0,0,0,1,0|3,0,0]=4 2023 B16R2.2468 COc1ccccc1COC2CCC2=O 34a_100000211301_100009892977 [0,0,0,0,1,0|3,0,0]=4 2024 B16R2.2468 COc1ccccc1CSC2CCC2=O 62a_100000210004_100009892977 [0,0,0,0,1,0|3,0,0]=4 2025 B16R2.2468 COc1ccccc1CSC2CCC2=O 62a_100009892977_100000210004 [0,0,0,0,1,0|3,0,0]=4 2026 B16R2.36503 C#Cc1ccccc1OCC2CC(=O)C2 7a_200011470546_100009874392 [0,0,0,0,1,0|2,0,1]=4 2027 B16R2.36503 CCc1ccccc1NCC2CC(=O)C2 2230a_100000212081_100009874392 [0,0,0,0,1,0|3,0,0]=4 2028 B16R2.36503 CCc1ccccc1NCC2CC(=O)C2 7a_100000212081_100009874392 [0,0,0,0,1,0|3,0,0]=4 2029 B16R2.36503 CCc1ccccc1OCC2CC(=O)C2 7a_100000210936_100009874392 [0,0,0,0,1,0|2,0,0]=3 2030 B16R2.36503 CCc1ccccc1SCC2CC(=O)C2 62a_100009874392_100011215823 [0,0,0,0,1,0|2,1,0]=4 2031 B16R2.36503 CCc1ccccc1SCC2CC(=O)C2 62a_100011215823_100009874392 [0,0,0,0,1,0|2,1,0]=4 2032 B16R2.36503 CNc1ccccc1SCC2CC(=O)C2 62a_100009874392_100020606079 [0,0,0,0,1,0|2,1,0]=4 2033 B16R2.36503 CNc1ccccc1SCC2CC(=O)C2 62a_100020606079_100009874392 [0,0,0,0,1,0|2,1,0]=4 2034 B16R2.36503 COc1ccccc1CSC2CC(=O)C2 62a_100009894365_100000210004 [0,0,0,0,1,0|3,0,0]=4 2035 B16R2.36503 COc1ccccc1SCC2CC(=O)C2 62a_100000210334_100009874392 [0,0,0,0,1,0|1,1,0]=3 2036 B16R2.36503 COc1ccccc1SCC2CC(=O)C2 62a_100009874392_100000210334 [0,0,0,0,1,0|1,1,0]=3 2037 B16R2.36503 COc1cccnc1SCC2CC(=O)C2 62a_100000767102_100009874392 [0,0,0,0,1,0|2,1,0]=4 2038 B16R2.36503 COc1cccnc1SCC2CC(=O)C2 62a_100009874392_100000690851 [0,0,0,0,1,0|2,1,0]=4 2039 B16R2.36503 COc1ccncc1SCC2CC(=O)C2 62a_100009874392_100011997281 [0,0,0,0,1,0|2,1,0]=4 2040 B16R2.36503 COc1ccncc1SCC2CC(=O)C2 62a_100011997281_100009874392 [0,0,0,0,1,0|2,1,0]=4 2041 B16R2.36503 COc1cnccc1SCC2CC(=O)C2 62a_100009874392_100016988167 [0,0,0,0,1,0|2,1,0]=4 2042 B16R2.36503 COc1cnccc1SCC2CC(=O)C2 62a_100016988167_100009874392 [0,0,0,0,1,0|2,1,0]=4 2043 B16R2.36503 COc1ncccc1OCC2CC(=O)C2 7a_100000698397_100009874392 [0,0,0,0,1,0|2,0,0]=3 2044 B16R2.36503 COc1ncccc1SCC2CC(=O)C2 62a_100000047025_100009874392 [0,0,0,0,1,0|2,1,0]=4 2045 B16R2.36503 COc1ncccc1SCC2CC(=O)C2 62a_100009874392_100000047025 [0,0,0,0,1,0|2,1,0]=4 2046 B16R2.36503 CSc1ccccc1SCC2CC(=O)C2 62a_100009874392_100011217816 [0,0,0,0,1,0|1,2,0]=4 2047 B16R2.36503 CSc1ccccc1SCC2CC(=O)C2 62a_100011217816_100009874392 [0,0,0,0,1,0|1,2,0]=4 2048 B16R2.36503 N#Cc1ccccc1OCC2CC(=O)C2 7a_100000211048_100009874392 [0,0,0,0,1,0|3,0,0]=4 2049 B18R2.327 COc1ccccc1CNC2CCC(=O)NC2 207a_100000748762_100000169842 [0,0,0,0,0,1|3,0,0]=4 2050 B18R2.327 COc1ccccc1CNC2CCC(=O)NC2 2230a_100000748762_100000210004 [0,0,0,0,0,1|3,0,0]=4 2051 B18R2.327 COc1ccccc1CNC2CCC(=O)NC2 270004a_100000748762_100000169842 [0,0,0,0,0,1|3,0,0]=4 2052 B18R2.327 COc1ccccc1CNC2CCC(=O)NC2 34a_100000748762_100000210004 [0,0,0,0,0,1|3,0,0]=4 2053 B18R2.327 COc1ccccc1COC2CCC(=O)NC2 34a_100000079199_100000210004 [0,0,0,0,0,1|3,0,0]=4 2054 B18R2.327 COc1ccccc1COC2CNC(=O)NC2 34a_100000080929_100000210004 [0,0,0,0,0,1|3,0,0]=4 2055 B18R2.444 COc1ccccc1CCN2CCNC(=O)C2 2230a_100000184651_100011713687 [0,0,0,0,0,1|3,0,0]=4 2056 B18R2.444 COc1ccccc1CCN2CCNC(=O)C2 270004a_100000184651_100011713418 [0,0,0,0,0,1|3,0,0]=4 2057 B18R2.444 COc1ccccc1CNC2CCNC(=O)C2 207a_100016994916_100000169842 [0,0,0,0,0,1|3,0,0]=4 2058 B18R2.444 COc1ccccc1CNC2CCNC(=O)C2 2230a_100016994916_100000210004 [0,0,0,0,0,1|3,0,0]=4 2059 B18R2.444 COc1ccccc1CNC2CCNC(=O)C2 34a_100016994916_100000210004 [0,0,0,0,0,1|3,0,0]=4 2060 B18R2.444 COc1ccccc1CO[C@@H]2CCNC(=O)C2 34a_100015189427_100000210004 [0,0,0,0,0,1|3,0,0]=4 2061 B18R2.3069 C#Cc1ccccc1CNCC2CNC(=O)O2 34a_100020634229_100000181169 [0,0,0,0,0,1|2,0,1]=4 2062 B18R2.3069 C#Cc1ccccc1COCC2CNC(=O)O2 34a_100000054652_100000181169 [0,0,0,0,0,1|1,0,1]=3 2063 B18R2.3069 C#Cc1ccccc1COCC2CNC(=O)O2 7a_100000054652_100000181169 [0,0,0,0,0,1|1,0,1]=3 2064 B18R2.3069 C#Cc1ccccc1COCC2COC(=O)O2 34a_100000054652_100000073702 [0,0,0,0,0,1|2,0,1]=4 2065 B18R2.3069 C=Cc1ccccc1COCC2CNC(=O)O2 34a_200010883148_100000181169 [0,0,0,0,0,1|1,0,1]=3 2066 B18R2.3069 C=Cc1ccccc1COCC2CNC(=O)O2 7a_200010883148_100000181169 [0,0,0,0,0,1|1,0,1]=3 2067 B18R2.3069 C=Cc1ccccc1COCC2COC(=O)O2 34a_200010883148_100000073702 [0,0,0,0,0,1|2,0,1]=4 2068 B18R2.3069 CCc1ccccc1CCNC2COC(=O)O2 34a_100011663701_100000032252 [0,0,0,0,0,1|3,0,0]=4 2069 B18R2.3069 CCc1ccccc1CNCC2CNC(=O)C2 207a_100016993742_100011219594 [0,0,0,0,0,1|3,0,0]=4 2070 B18R2.3069 CCc1ccccc1COCC2CNC(=O)O2 34a_100011663872_100000181169 [0,0,0,0,0,1|1,0,0]=2 2071 B18R2.3069 CCc1ccccc1COCC2CNC(=O)O2 7a_100011663872_100000181169 [0,0,0,0,0,1|1,0,0]=2 2072 B18R2.3069 CCc1ccccc1COCC2COC(=O)O2 34a_100011663872_100000073702 [0,0,0,0,0,1|2,0,0]=3 2073 B18R2.3069 CCc1ccccc1COC[C@@H]2CCC(=O)N2 7a_100011663872_100015189358 [0,0,0,0,0,1|3,0,0]=4 2074 B18R2.3069 CCc1ccccc1COC[C@H]2COC(=O)N2 34a_100011663872_100015307671 [0,0,0,0,0,1|3,0,0]=4 2075 B18R2.3069 CCc1ccccc1COC[C@H]2COC(=O)N2 7a_100011663872_100015307671 [0,0,0,0,0,1|3,0,0]=4 2076 B18R2.3069 CCc1ccccc1OCCC2COS(=O)O2 7a_100000210936_100009840081 [0,0,0,0,0,1|3,0,0]=4 2077 B18R2.3069 COc1ccccc1CCNC2CNC(=O)C2 2230a_100000697751_100011713687 [0,0,0,0,0,1|2,0,0]=3 2078 B18R2.3069 COc1ccccc1CCNC2COC(=O)O2 34a_100000211851_100000032252 [0,0,0,0,0,1|2,0,0]=3 2079 B18R2.3069 COc1ccccc1CCOC2CCC(=O)C2 34a_100012614533_100011713687 [0,0,0,0,0,1|3,0,0]=4 2080 B18R2.3069 COc1ccccc1CCOC2CNC(=O)C2 34a_100000690082_100011713687 [0,0,0,0,0,1|2,0,0]=3 2081 B18R2.3069 COc1ccccc1CCOC2COC(=O)O2 34a_100011218620_100000032252 [0,0,0,0,0,1|2,0,0]=3 2082 B18R2.3069 COc1ccccc1CCSC2COC(=O)O2 62a_100011713687_100000032252 [0,0,0,0,0,1|2,0,0]=3 2083 B18R2.3069 COc1ccccc1CNCC2CNC(=O)C2 207a_100016993742_100000169842 [0,0,0,0,0,1|2,0,0]=3 2084 B18R2.3069 COc1ccccc1CNCC2CNC(=O)C2 2230a_100016993742_100000210004 [0,0,0,0,0,1|2,0,0]=3 2085 B18R2.3069 COc1ccccc1CNCC2CNC(=O)C2 34a_100016993742_100000210004 [0,0,0,0,0,1|2,0,0]=3 2086 B18R2.3069 COc1ccccc1CNCC2CNC(=O)O2 34a_100000188900_100000181169 [0,0,0,0,0,1|1,0,0]=2 2087 B18R2.3069 COc1ccccc1CNCC2COC(=O)O2 34a_100000188900_100000073702 [0,0,0,0,0,1|2,0,0]=3 2088 B18R2.3069 COc1ccccc1CNC[C@H]2CCC(=O)N2 207a_100015423886_100000169842 [0,0,0,0,0,1|3,0,0]=4 2089 B18R2.3069 COc1ccccc1CNC[C@H]2CCC(=O)N2 2230a_100015423886_100000210004 [0,0,0,0,0,1|3,0,0]=4 2090 B18R2.3069 COc1ccccc1CNC[C@H]2CCC(=O)N2 270004a_100015423886_100000169842 [0,0,0,0,0,1|3,0,0]=4 2091 B18R2.3069 COc1ccccc1CNC[C@H]2CCC(=O)N2 34a_100015423886_100000210004 [0,0,0,0,0,1|3,0,0]=4 2092 B18R2.3069 COc1ccccc1CNC[C@H]2COC(=O)N2 34a_100000188900_100015307671 [0,0,0,0,0,1|3,0,0]=4 2093 B18R2.3069 COc1ccccc1COCC2=CC(=O)OC2 34a_100000211301_100000716558 [0,0,0,0,0,1|2,0,1]=4 2094 B18R2.3069 COc1ccccc1COCC2CCC(=O)N2 34a_100000737831_100000210004 [0,0,0,0,0,1|2,0,0]=3 2095 B18R2.3069 COc1ccccc1COCC2CNC(=O)C2 34a_100016041077_100000210004 [0,0,0,0,0,1|1,0,0]=2 2096 B18R2.3069 COc1ccccc1COCC2CNC(=O)O2 34a_100000211301_100000181169 [0,0,0,0,0,1|0,0,0]=1 2097 B18R2.3069 COc1ccccc1COCC2CNC(=O)O2 34a_100011315639_100000210004 [0,0,0,0,0,1|0,0,0]=1 2098 B18R2.3069 COc1ccccc1COCC2COC(=O)O2 34a_100000211301_100000073702 [0,0,0,0,0,1|1,0,0]=2 2099 B18R2.3069 COc1ccccc1COC[C@H]2COC(=O)N2 34a_100000211301_100015307671 [0,0,0,0,0,1|2,0,0]=3 2100 B18R2.3069 COc1ccccc1CSCC2CNC(=O)O2 62a_100000181169_100000210004 [0,0,0,0,0,1|0,1,0]=2 2101 B18R2.3069 COc1ccccc1CSCC2CNC(=O)O2 62a_100000210004_100000181169 [0,0,0,0,0,1|0,1,0]=2 2102 B18R2.3069 COc1ccccc1CSCC2COC(=O)O2 62a_100000073702_100000210004 [0,0,0,0,0,1|1,1,0]=3 2103 B18R2.3069 COc1ccccc1CSCC2COC(=O)O2 62a_100000210004_100000073702 [0,0,0,0,0,1|1,1,0]=3 2104 B18R2.3069 COc1ccccc1CSC[C@@H]2CCC(=O)N2 62a_100000210004_100015189358 [0,0,0,0,0,1|2,1,0]=4 2105 B18R2.3069 COc1ccccc1CSC[C@@H]2CCC(=O)N2 62a_100015189358_100000210004 [0,0,0,0,0,1|2,1,0]=4 2106 B18R2.3069 COc1ccccc1CSC[C@H]2COC(=O)N2 62a_100000210004_100015307671 [0,0,0,0,0,1|2,1,0]=4 2107 B18R2.3069 COc1ccccc1CSC[C@H]2COC(=O)N2 62a_100015307671_100000210004 [0,0,0,0,0,1|2,1,0]=4 2108 B18R2.3069 COc1ccccc1OCCN2CNC(=O)C2 2230a_200000708111_100000188471 [0,0,0,0,0,1|2,0,0]=3 2109 B18R2.3069 COc1ccccc1SCCC2COS(=O)O2 62a_100000210334_100009840081 [0,0,0,0,0,1|2,1,0]=4 2110 B18R2.3069 COc1cccnc1CNCC2CNC(=O)C2 207a_100016993742_100011912573 [0,0,0,0,0,1|3,0,0]=4 2111 B18R2.3069 COc1cccnc1COCC2CNC(=O)O2 34a_100011998681_100000181169 [0,0,0,0,0,1|1,0,0]=2 2112 B18R2.3069 COc1cccnc1COCC2COC(=O)O2 34a_100011998681_100000073702 [0,0,0,0,0,1|2,0,0]=3 2113 B18R2.3069 COc1cccnc1COC[C@H]2COC(=O)N2 34a_100011998681_100015307671 [0,0,0,0,0,1|3,0,0]=4 2114 B18R2.3069 COc1ccncc1CNCC2CNC(=O)C2 207a_100016993742_200011997045 [0,0,0,0,0,1|3,0,0]=4 2115 B18R2.3069 COc1cnccc1CNCC2CNC(=O)C2 207a_100016993742_100011361505 [0,0,0,0,0,1|3,0,0]=4 2116 B18R2.3069 COc1cnccc1CNCC2CNC(=O)C2 2230a_100016993742_100020635607 [0,0,0,0,0,1|3,0,0]=4 2117 B18R2.3069 COc1cnccc1CSCC2CNC(=O)O2 62a_100000181169_100020635607 [0,0,0,0,0,1|1,1,0]=3 2118 B18R2.3069 COc1cnccc1CSCC2CNC(=O)O2 62a_100020635607_100000181169 [0,0,0,0,0,1|1,1,0]=3 2119 B18R2.3069 COc1cnccc1CSCC2COC(=O)O2 62a_100000073702_100020635607 [0,0,0,0,0,1|2,1,0]=4 2120 B18R2.3069 COc1cnccc1CSCC2COC(=O)O2 62a_100020635607_100000073702 [0,0,0,0,0,1|2,1,0]=4 2121 B18R2.3069 COc1ncccc1CNCC2CNC(=O)C2 207a_100016993742_100011290804 [0,0,0,0,0,1|3,0,0]=4 2122 B18R2.3069 COc1ncccc1CNCC2CNC(=O)C2 2230a_100016993742_100020631285 [0,0,0,0,0,1|3,0,0]=4 2123 B18R2.3069 COc1ncccc1CNCC2CNC(=O)C2 34a_100016993742_100020631285 [0,0,0,0,0,1|3,0,0]=4 2124 B18R2.3069 COc1ncccc1COCC2CCC(=O)N2 34a_100000737831_100020631285 [0,0,0,0,0,1|3,0,0]=4 2125 B18R2.3069 COc1ncccc1COCC2CNC(=O)C2 34a_100016041077_100020631285 [0,0,0,0,0,1|2,0,0]=3 2126 B18R2.3069 COc1ncccc1COCC2CNC(=O)O2 34a_100000717863_100000181169 [0,0,0,0,0,1|1,0,0]=2 2127 B18R2.3069 COc1ncccc1COCC2CNC(=O)O2 34a_100011315639_100020631285 [0,0,0,0,0,1|1,0,0]=2 2128 B18R2.3069 COc1ncccc1COCC2COC(=O)O2 34a_100000717863_100000073702 [0,0,0,0,0,1|2,0,0]=3 2129 B18R2.3069 COc1ncccc1COC[C@H]2COC(=O)N2 34a_100000717863_100015307671 [0,0,0,0,0,1|3,0,0]=4 2130 B18R2.3069 COc1ncccc1CSCC2CNC(=O)O2 62a_100000181169_100020631285 [0,0,0,0,0,1|1,1,0]=3 2131 B18R2.3069 COc1ncccc1CSCC2CNC(=O)O2 62a_100020631285_100000181169 [0,0,0,0,0,1|1,1,0]=3 2132 B18R2.3069 COc1ncccc1CSCC2COC(=O)O2 62a_100000073702_100020631285 [0,0,0,0,0,1|2,1,0]=4 2133 B18R2.3069 COc1ncccc1CSCC2COC(=O)O2 62a_100020631285_100000073702 [0,0,0,0,0,1|2,1,0]=4 2134 B18R2.3069 COc1ncccc1OCCC2COS(=O)O2 7a_100000698397_100009840081 [0,0,0,0,0,1|3,0,0]=4 2135 B18R2.3069 CSc1ccccc1CNCC2CNC(=O)C2 207a_100016993742_100011217347 [0,0,0,0,0,1|2,1,0]=4 2136 B18R2.3069 CSc1ccccc1CNCC2CNC(=O)C2 2230a_100016993742_100000699184 [0,0,0,0,0,1|2,1,0]=4 2137 B18R2.3069 CSc1ccccc1CNCC2CNC(=O)C2 34a_100016993742_100000699184 [0,0,0,0,0,1|2,1,0]=4 2138 B18R2.3069 CSc1ccccc1CNCC2CNC(=O)O2 34a_102495365025_100000181169 [0,0,0,0,0,1|1,1,0]=3 2139 B18R2.3069 CSc1ccccc1CNCC2COC(=O)O2 34a_102495365025_100000073702 [0,0,0,0,0,1|2,1,0]=4 2140 B18R2.3069 CSc1ccccc1COCC2CCC(=O)N2 34a_100000737831_100000699184 [0,0,0,0,0,1|2,1,0]=4 2141 B18R2.3069 CSc1ccccc1COCC2CNC(=O)C2 34a_100016041077_100000699184 [0,0,0,0,0,1|1,1,0]=3 2142 B18R2.3069 CSc1ccccc1COCC2CNC(=O)O2 34a_100000699167_100000181169 [0,0,0,0,0,1|0,1,0]=2 2143 B18R2.3069 CSc1ccccc1COCC2CNC(=O)O2 34a_100011315639_100000699184 [0,0,0,0,0,1|0,1,0]=2 2144 B18R2.3069 CSc1ccccc1COCC2COC(=O)O2 34a_100000699167_100000073702 [0,0,0,0,0,1|1,1,0]=3 2145 B18R2.3069 CSc1ccccc1COC[C@H]2COC(=O)N2 34a_100000699167_100015307671 [0,0,0,0,0,1|2,1,0]=4 2146 B18R2.3069 CSc1ccccc1CSCC2CNC(=O)O2 62a_100000181169_100000699184 [0,0,0,0,0,1|0,2,0]=3 2147 B18R2.3069 CSc1ccccc1CSCC2CNC(=O)O2 62a_100000699184_100000181169 [0,0,0,0,0,1|0,2,0]=3 2148 B18R2.3069 CSc1ccccc1CSCC2COC(=O)O2 62a_100000073702_100000699184 [0,0,0,0,0,1|1,2,0]=4 2149 B18R2.3069 CSc1ccccc1CSCC2COC(=O)O2 62a_100000699184_100000073702 [0,0,0,0,0,1|1,2,0]=4 2150 B18R2.3069 N#Cc1ccccc1CNCC2CNC(=O)O2 34a_100016989011_100000181169 [0,0,0,0,0,1|3,0,0]=4 2151 B18R2.3069 N#Cc1ccccc1COCC2CNC(=O)C2 34a_100016041077_100000181865 [0,0,0,0,0,1|3,0,0]=4 2152 B18R2.3069 N#Cc1ccccc1COCC2CNC(=O)O2 34a_100011315639_100000181865 [0,0,0,0,0,1|2,0,0]=3 2153 B18R2.3069 N#Cc1ccccc1COCC2CNC(=O)O2 34a_200011269968_100000181169 [0,0,0,0,0,1|2,0,0]=3 2154 B18R2.3069 N#Cc1ccccc1COCC2CNC(=O)O2 7a_200011269968_100000181169 [0,0,0,0,0,1|2,0,0]=3 2155 B18R2.3069 N#Cc1ccccc1COCC2COC(=O)O2 34a_200011269968_100000073702 [0,0,0,0,0,1|3,0,0]=4 2156 B18R2.3069 N#Cc1ccccc1CSCC2CNC(=O)O2 62a_100000181169_100000181865 [0,0,0,0,0,1|2,1,0]=4 2157 B18R2.3069 N#Cc1ccccc1CSCC2CNC(=O)O2 62a_100000186380_100000181169 [0,0,0,0,0,1|2,1,0]=4 2158 B18R2.3069 N#Cc1ncccc1COCC2CNC(=O)O2 34a_100011315639_100011768898 [0,0,0,0,0,1|3,0,0]=4 2159 B18R2.3069 NCc1ccccc1COCC2CNC(=O)O2 34a_100000743596_100000181169 [0,0,0,0,0,1|2,0,0]=3 2160 B18R2.3069 NCc1ccccc1COCC2COC(=O)O2 34a_100000743596_100000073702 [0,0,0,0,0,1|3,0,0]=4 2161 B18R2.3069 O=C1CC(CN1)COCc2ccccc2CO 34a_100016041077_100009816955 [0,0,0,0,0,1|3,0,0]=4 2162 B18R2.3069 O=C1NCC(O1)COCc2ccccc2CBr 34a_100009816955_100000181169 [0,0,0,0,0,1|2,0,0]=3 2163 B18R2.3069 O=C1NCC(O1)COCc2ccccc2CBr 7a_100009816955_100000181169 [0,0,0,0,0,1|2,0,0]=3 2164 B18R2.3069 O=C1NCC(O1)COCc2ccccc2CO 34a_100011315639_100009816955 [0,0,0,0,0,1|2,0,0]=3 2165 B18R2.3069 O=C1NCC(O1)CSCc2ccccc2CO 62a_100000181169_100009816955 [0,0,0,0,0,1|2,1,0]=4 2166 B18R2.3069 O=C1NCC(O1)CSCc2ccccc2CO 62a_100009816955_100000181169 [0,0,0,0,0,1|2,1,0]=4 2167 B18R2.3069 O=C1OCC(O1)COCc2ccccc2CBr 34a_100009816955_100000073702 [0,0,0,0,0,1|3,0,0]=4 2168 B18R2.3069 O=Cc1ccccc1COCC2CNC(=O)C2 34a_100016041077_200009853537 [0,0,0,0,0,1|3,0,0]=4 2169 B18R2.3069 O=Cc1ccccc1COCC2CNC(=O)O2 34a_100011315639_200009853537 [0,0,0,0,0,1|2,0,0]=3 2170 B18R2.3069 O=Cc1ccccc1CSCC2CNC(=O)O2 62a_100000181169_200009853537 [0,0,0,0,0,1|2,1,0]=4 2171 B18R2.3069 O=Cc1ccccc1CSCC2CNC(=O)O2 62a_200009853537_100000181169 [0,0,0,0,0,1|2,1,0]=4 2172 B15R1.84 C#Cc1ccccc1OCCOC(=O)C 34a_200011470546_100009814007 [1,0,1,0,0,0|1,0,1]=4 2173 B15R1.84 C#Cc1ccccc1OCCOC(=O)C 7a_200011470546_100009814007 [1,0,1,0,0,0|1,0,1]=4 2174 B15R1.84 C#Cc1ccccc1OCCOC(=O)N 34a_200011470546_200011214921 [1,0,1,0,0,0|1,0,1]=4 2175 B15R1.84 C#Cc1ccccc1OCCOC(=O)N 7a_200011470546_200011214921 [1,0,1,0,0,0|1,0,1]=4 2176 B15R1.84 CC(=O)OCCOc1ccccc1C#N 34a_100000211048_100009814007 [1,0,1,0,0,0|2,0,0]=4 2177 B15R1.84 CC(=O)OCCOc1ccccc1C#N 7a_100000211048_100009814007 [1,0,1,0,0,0|2,0,0]=4 2178 B15R1.84 CC(=O)OCCOc1ccccc1CN 34a_100000185550_100009814007 [1,0,1,0,0,0|2,0,0]=4 2179 B15R1.84 CC(=O)OCCOc1ccccc1CO 34a_100011216872_100009814007 [1,0,1,0,0,0|2,0,0]=4 2180 B15R1.84 CCc1ccccc1NCCOC(=O)C 34a_100000212081_100009814007 [1,0,1,0,0,0|2,0,0]=4 2181 B15R1.84 CCc1ccccc1NCCOC(=O)C 7a_100000212081_100009814007 [1,0,1,0,0,0|2,0,0]=4 2182 B15R1.84 CCc1ccccc1NCCOC(=O)N 34a_100000212081_200011214921 [1,0,1,0,0,0|2,0,0]=4 2183 B15R1.84 CCc1ccccc1NCCOC(=O)N 7a_100000212081_200011214921 [1,0,1,0,0,0|2,0,0]=4 2184 B15R1.84 CCc1ccccc1OCCCC(=O)C 34a_100000210936_100000685027 [1,0,1,0,0,0|2,0,0]=4 2185 B15R1.84 CCc1ccccc1OCCCC(=O)C 7a_100000210936_100011215641 [1,0,1,0,0,0|2,0,0]=4 2186 B15R1.84 CCc1ccccc1OCCCC(=O)N 34a_100000210936_100102525003 [1,0,1,0,0,0|2,0,0]=4 2187 B15R1.84 CCc1ccccc1OCCCC(=O)N 7a_100000210936_100102525003 [1,0,1,0,0,0|2,0,0]=4 2188 B15R1.84 CCc1ccccc1OCCNC(=O)C 7a_100000210936_100000189650 [1,0,1,0,0,0|2,0,0]=4 2189 B15R1.84 CCc1ccccc1OCCNC(=O)N 7a_100000210936_200000034859 [1,0,1,0,0,0|2,0,0]=4 2190 B15R1.84 CCc1ccccc1OCCOC(=O)C 34a_100000210936_100009814007 [1,0,1,0,0,0|1,0,0]=3 2191 B15R1.84 CCc1ccccc1OCCOC(=O)C 7a_100000210936_100009814007 [1,0,1,0,0,0|1,0,0]=3 2192 B15R1.84 CCc1ccccc1OCCOC(=O)N 34a_100000210936_200011214921 [1,0,1,0,0,0|1,0,0]=3 2193 B15R1.84 CCc1ccccc1OCCOC(=O)N 7a_100000210936_200011214921 [1,0,1,0,0,0|1,0,0]=3 2194 B15R1.84 CCc1ccccc1SCCOC(=O)C 62a_100009814007_100011215823 [1,0,1,0,0,0|1,1,0]=4 2195 B15R1.84 CCc1ccccc1SCCOC(=O)C 62a_100011215823_100009814007 [1,0,1,0,0,0|1,1,0]=4 2196 B15R1.84 CCc1ccccc1SCCOC(=O)N 62a_100011215823_200011214921 [1,0,1,0,0,0|1,1,0]=4 2197 B15R1.84 CCc1ccccc1SCCOC(=O)N 62a_200011214921_100011215823 [1,0,1,0,0,0|1,1,0]=4 2198 B15R1.84 CNc1ccccc1OCCCC(=O)C 34a_100000033821_100000685027 [1,0,1,0,0,0|2,0,0]=4 2199 B15R1.84 CNc1ccccc1OCCCC(=O)N 34a_100000033821_100102525003 [1,0,1,0,0,0|2,0,0]=4 2200 B15R1.84 CNc1ccccc1OCCOC(=O)C 34a_100000033821_100009814007 [1,0,1,0,0,0|1,0,0]=3 2201 B15R1.84 CNc1ccccc1OCCOC(=O)N 34a_100000033821_200011214921 [1,0,1,0,0,0|1,0,0]=3 2202 B15R1.84 CNc1ccccc1SCCOC(=O)C 62a_100009814007_100020606079 [1,0,1,0,0,0|1,1,0]=4 2203 B15R1.84 CNc1ccccc1SCCOC(=O)C 62a_100020606079_100009814007 [1,0,1,0,0,0|1,1,0]=4 2204 B15R1.84 CNc1ccccc1SCCOC(=O)N 62a_100020606079_200011214921 [1,0,1,0,0,0|1,1,0]=4 2205 B15R1.84 CNc1ccccc1SCCOC(=O)N 62a_200011214921_100020606079 [1,0,1,0,0,0|1,1,0]=4 2206 B15R1.84 COc1ccccc1C=CCOC(=O)C 271570a_200000047263_100000174000 [1,0,1,0,0,0|1,0,1]=4 2207 B15R1.84 COc1ccccc1CNCOC(=O)C 34a_100000188900_100009813279 [1,0,1,0,0,0|2,0,0]=4 2208 B15R1.84 COc1ccccc1COCOC(=O)C 34a_100000211301_100009813279 [1,0,1,0,0,0|2,0,0]=4 2209 B15R1.84 COc1ccccc1CSCOC(=O)C 62a_100000076356_100000210004 [1,0,1,0,0,0|2,0,0]=4 2210 B15R1.84 COc1ccccc1CSCOC(=O)C 62a_100000210004_100000076356 [1,0,1,0,0,0|2,0,0]=4 2211 B15R1.84 COc1ccccc1NCCCC(=O)C 34a_100000210025_100000685027 [1,0,1,0,0,0|2,0,0]=4 2212 B15R1.84 COc1ccccc1NCCCC(=O)N 34a_100000210025_100102525003 [1,0,1,0,0,0|2,0,0]=4 2213 B15R1.84 COc1ccccc1NCCOC(=O)C 34a_100000210025_100009814007 [1,0,1,0,0,0|1,0,0]=3 2214 B15R1.84 COc1ccccc1NCCOC(=O)N 34a_100000210025_200011214921 [1,0,1,0,0,0|1,0,0]=3 2215 B15R1.84 COc1ccccc1OCCC=C(C)C 34a_100000210385_100011217483 [1,0,1,0,0,0|2,0,0]=4 2216 B15R1.84 COc1ccccc1OCCCC(=O)C 1458a_100000070787_100011259231 [1,0,1,0,0,0|1,0,0]=3 2217 B15R1.84 COc1ccccc1OCCCC(=O)C 34a_100000210385_100000685027 [1,0,1,0,0,0|1,0,0]=3 2218 B15R1.84 COc1ccccc1OCCCC(=O)N 34a_100000210385_100102525003 [1,0,1,0,0,0|1,0,0]=3 2219 B15R1.84 COc1ccccc1OCCNC(=O)C 11a_100000683763_100015343762 [1,0,1,0,0,0|1,0,0]=3 2220 B15R1.84 COc1ccccc1OCCNC(=O)C 1626a_100000683763_100015343762 [1,0,1,0,0,0|1,0,0]=3 2221 B15R1.84 COc1ccccc1OCCNC(=O)C 240690a_100000683763_100015343762 [1,0,1,0,0,0|1,0,0]=3 2222 B15R1.84 COc1ccccc1OCCNC(=O)C 527a_100000683763_100103153847 [1,0,1,0,0,0|1,0,0]=3 2223 B15R1.84 COc1ccccc1OCCOC(=O)C 34a_100000210385_100009814007 [1,0,1,0,0,0|0,0,0]=2 2224 B15R1.84 COc1ccccc1OCCOC(=O)N 34a_100000210385_200011214921 [1,0,1,0,0,0|0,0,0]=2 2225 B15R1.84 COc1ccccc1OCCOC(C)C 34a_100000210385_100000211751 [1,0,1,0,0,0|1,0,1]=4 2226 B15R1.84 COc1ccccc1OCCOC(C)C 34a_100000212225_100000188471 [1,0,1,0,0,0|1,0,1]=4 2227 B15R1.84 COc1ccccc1SCCCC(=O)C 62a_100000210334_100011215641 [1,0,1,0,0,0|1,1,0]=4 2228 B15R1.84 COc1ccccc1SCCCC(=O)C 62a_100011215641_100000210334 [1,0,1,0,0,0|1,1,0]=4 2229 B15R1.84 COc1ccccc1SCCCC(=O)N 62a_100000210334_100102525003 [1,0,1,0,0,0|1,1,0]=4 2230 B15R1.84 COc1ccccc1SCCCC(=O)N 62a_100102525003_100000210334 [1,0,1,0,0,0|1,1,0]=4 2231 B15R1.84 COc1ccccc1SCCNC(=O)C 62a_100000189650_100000210334 [1,0,1,0,0,0|1,1,0]=4 2232 B15R1.84 COc1ccccc1SCCNC(=O)C 62a_100000210334_100000189650 [1,0,1,0,0,0|1,1,0]=4 2233 B15R1.84 COc1ccccc1SCCNC(=O)N 62a_100000210334_200000034859 [1,0,1,0,0,0|1,1,0]=4 2234 B15R1.84 COc1ccccc1SCCNC(=O)N 62a_200000034859_100000210334 [1,0,1,0,0,0|1,1,0]=4 2235 B15R1.84 COc1ccccc1SCCOC(=O)C 62a_100000210334_100009814007 [1,0,1,0,0,0|0,1,0]=3 2236 B15R1.84 COc1ccccc1SCCOC(=O)C 62a_100009814007_100000210334 [1,0,1,0,0,0|0,1,0]=3 2237 B15R1.84 COc1ccccc1SCCOC(=O)N 62a_100000210334_200011214921 [1,0,1,0,0,0|0,1,0]=3 2238 B15R1.84 COc1ccccc1SCCOC(=O)N 62a_200011214921_100000210334 [1,0,1,0,0,0|0,1,0]=3 2239 B15R1.84 COc1cccnc1OCCCC(=O)C 34a_100025773188_100000685027 [1,0,1,0,0,0|2,0,0]=4 2240 B15R1.84 COc1cccnc1OCCCC(=O)N 34a_100025773188_100102525003 [1,0,1,0,0,0|2,0,0]=4 2241 B15R1.84 COc1cccnc1OCCOC(=O)C 34a_100025773188_100009814007 [1,0,1,0,0,0|1,0,0]=3 2242 B15R1.84 COc1cccnc1OCCOC(=O)N 34a_100025773188_200011214921 [1,0,1,0,0,0|1,0,0]=3 2243 B15R1.84 COc1cccnc1SCCOC(=O)C 62a_100000767102_100009814007 [1,0,1,0,0,0|1,1,0]=4 2244 B15R1.84 COc1cccnc1SCCOC(=O)C 62a_100009814007_100000690851 [1,0,1,0,0,0|1,1,0]=4 2245 B15R1.84 COc1cccnc1SCCOC(=O)N 62a_100000767102_200011214921 [1,0,1,0,0,0|1,1,0]=4 2246 B15R1.84 COc1cccnc1SCCOC(=O)N 62a_200011214921_100000690851 [1,0,1,0,0,0|1,1,0]=4 2247 B15R1.84 COc1ccncc1OCCCC(=O)C 34a_100000101186_100000685027 [1,0,1,0,0,0|2,0,0]=4 2248 B15R1.84 COc1ccncc1OCCCC(=O)N 34a_100000101186_100102525003 [1,0,1,0,0,0|2,0,0]=4 2249 B15R1.84 COc1ccncc1OCCOC(=O)C 34a_100000101186_100009814007 [1,0,1,0,0,0|1,0,0]=3 2250 B15R1.84 COc1ccncc1OCCOC(=O)N 34a_100000101186_200011214921 [1,0,1,0,0,0|1,0,0]=3 2251 B15R1.84 COc1ccncc1SCCOC(=O)C 62a_100009814007_100011997281 [1,0,1,0,0,0|1,1,0]=4 2252 B15R1.84 COc1ccncc1SCCOC(=O)C 62a_100011997281_100009814007 [1,0,1,0,0,0|1,1,0]=4 2253 B15R1.84 COc1ccncc1SCCOC(=O)N 62a_100011997281_200011214921 [1,0,1,0,0,0|1,1,0]=4 2254 B15R1.84 COc1ccncc1SCCOC(=O)N 62a_200011214921_100011997281 [1,0,1,0,0,0|1,1,0]=4 2255 B15R1.84 COc1cnccc1SCCOC(=O)C 62a_100009814007_100016988167 [1,0,1,0,0,0|1,1,0]=4 2256 B15R1.84 COc1cnccc1SCCOC(=O)C 62a_100016988167_100009814007 [1,0,1,0,0,0|1,1,0]=4 2257 B15R1.84 COc1cnccc1SCCOC(=O)N 62a_100016988167_200011214921 [1,0,1,0,0,0|1,1,0]=4 2258 B15R1.84 COc1cnccc1SCCOC(=O)N 62a_200011214921_100016988167 [1,0,1,0,0,0|1,1,0]=4 2259 B15R1.84 COc1ncccc1OCCCC(=O)C 34a_100000698397_100000685027 [1,0,1,0,0,0|2,0,0]=4 2260 B15R1.84 COc1ncccc1OCCCC(=O)C 7a_100000698397_100011215641 [1,0,1,0,0,0|2,0,0]=4 2261 B15R1.84 COc1ncccc1OCCCC(=O)N 34a_100000698397_100102525003 [1,0,1,0,0,0|2,0,0]=4 2262 B15R1.84 COc1ncccc1OCCCC(=O)N 7a_100000698397_100102525003 [1,0,1,0,0,0|2,0,0]=4 2263 B15R1.84 COc1ncccc1OCCNC(=O)C 7a_100000698397_100000189650 [1,0,1,0,0,0|2,0,0]=4 2264 B15R1.84 COc1ncccc1OCCNC(=O)N 7a_100000698397_200000034859 [1,0,1,0,0,0|2,0,0]=4 2265 B15R1.84 COc1ncccc1OCCOC(=O)C 34a_100000698397_100009814007 [1,0,1,0,0,0|1,0,0]=3 2266 B15R1.84 COc1ncccc1OCCOC(=O)C 7a_100000698397_100009814007 [1,0,1,0,0,0|1,0,0]=3 2267 B15R1.84 COc1ncccc1OCCOC(=O)N 34a_100000698397_200011214921 [1,0,1,0,0,0|1,0,0]=3 2268 B15R1.84 COc1ncccc1OCCOC(=O)N 7a_100000698397_200011214921 [1,0,1,0,0,0|1,0,0]=3 2269 B15R1.84 COc1ncccc1SCCOC(=O)C 62a_100000047025_100009814007 [1,0,1,0,0,0|1,1,0]=4 2270 B15R1.84 COc1ncccc1SCCOC(=O)C 62a_100009814007_100000047025 [1,0,1,0,0,0|1,1,0]=4 2271 B15R1.84 COc1ncccc1SCCOC(=O)N 62a_100000047025_200011214921 [1,0,1,0,0,0|1,1,0]=4 2272 B15R1.84 COc1ncccc1SCCOC(=O)N 62a_200011214921_100000047025 [1,0,1,0,0,0|1,1,0]=4 2273 B15R1.84 CSc1ccccc1NCCOC(=O)C 34a_100000211160_100009814007 [1,0,1,0,0,0|1,1,0]=4 2274 B15R1.84 CSc1ccccc1NCCOC(=O)N 34a_100000211160_200011214921 [1,0,1,0,0,0|1,1,0]=4 2275 B15R1.84 CSc1ccccc1OCCCC(=O)C 34a_100011216402_100000685027 [1,0,1,0,0,0|1,1,0]=4 2276 B15R1.84 CSc1ccccc1OCCCC(=O)N 34a_100011216402_100102525003 [1,0,1,0,0,0|1,1,0]=4 2277 B15R1.84 CSc1ccccc1OCCNC(=O)C 11a_100011893647_100015343762 [1,0,1,0,0,0|1,1,0]=4 2278 B15R1.84 CSc1ccccc1OCCNC(=O)C 240690a_100011893647_100015343762 [1,0,1,0,0,0|1,1,0]=4 2279 B15R1.84 CSc1ccccc1OCCNC(=O)C 527a_100011893647_100103153847 [1,0,1,0,0,0|1,1,0]=4 2280 B15R1.84 CSc1ccccc1OCCOC(=O)C 34a_100011216402_100009814007 [1,0,1,0,0,0|0,1,0]=3 2281 B15R1.84 CSc1ccccc1OCCOC(=O)N 34a_100011216402_200011214921 [1,0,1,0,0,0|0,1,0]=3 2282 B15R1.84 CSc1ccccc1SCCOC(=O)C 62a_100009814007_100011217816 [1,0,1,0,0,0|0,2,0]=4 2283 B15R1.84 CSc1ccccc1SCCOC(=O)C 62a_100011217816_100009814007 [1,0,1,0,0,0|0,2,0]=4 2284 B15R1.84 CSc1ccccc1SCCOC(=O)N 62a_100011217816_200011214921 [1,0,1,0,0,0|0,2,0]=4 2285 B15R1.84 CSc1ccccc1SCCOC(=O)N 62a_200011214921_100011217816 [1,0,1,0,0,0|0,2,0]=4 2286 B15R1.84 N#Cc1ccccc1OCCOC(=O)N 34a_100000211048_200011214921 [1,0,1,0,0,0|2,0,0]=4 2287 B15R1.84 N#Cc1ccccc1OCCOC(=O)N 7a_100000211048_200011214921 [1,0,1,0,0,0|2,0,0]=4 2288 B15R1.84 NC(=O)OCCOc1ccccc1CO 34a_100011216872_200011214921 [1,0,1,0,0,0|2,0,0]=4 2289 B15R1.84 NCc1ccccc1OCCOC(=O)N 34a_100000185550_200011214921 [1,0,1,0,0,0|2,0,0]=4 2290 B15R1.130 CC(=O)NC(C)COc1ccccc1C 11a_100000744241_100015343762 [1,0,1,0,0,0|2,0,0]=4 2291 B15R1.130 CC(=O)NC(C)COc1ccccc1C 1626a_100000744241_100015343762 [1,0,1,0,0,0|2,0,0]=4 2292 B15R1.130 CC(=O)NC(C)COc1ccccc1C 240690a_100000744241_100015343762 [1,0,1,0,0,0|2,0,0]=4 2293 B15R1.130 CC(=O)NC(C)COc1ccccc1C 527a_100000744241_100103153847 [1,0,1,0,0,0|2,0,0]=4 2294 B15R1.768 CCOC(C)COc1ccccc1OC 34a_100000242603_100000210202 [1,0,1,0,0,0|1,0,1]=4 2295 B15R1.768 CCOC(C)COc1ccccc1OC 7a_100000242603_100000210202 [1,0,1,0,0,0|1,0,1]=4 2296 B15R1.768 COCC(O)COc1ccccc1OC 34a_100000210385_100011215053 [1,0,1,0,0,0|1,0,1]=4 2297 B15R1.768 COc1ccccc1OCC(C)OCF 34a_100000242603_100015361967 [1,0,1,0,0,0|1,0,1]=4 2298 B15R1.768 COc1ccccc1OCC(C)OCF 7a_100000242603_100015361967 [1,0,1,0,0,0|1,0,1]=4 2299 B15R1.131 CC(=O)CCCCOc1ccccc1C 34a_100000210338_100009817362 [1,0,1,0,0,0|2,0,0]=4 2300 B15R1.131 CC(=O)CCCCOc1ccccc1C 7a_100000210338_100000735457 [1,0,1,0,0,0|2,0,0]=4 2301 B15R1.131 CC(=O)NCCCOc1ccccc1C 11a_106633784460_100015343762 [1,0,1,0,0,0|1,0,0]=3 2302 B15R1.131 CC(=O)NCCCOc1ccccc1C 1626a_106633784460_100015343762 [1,0,1,0,0,0|1,0,0]=3 2303 B15R1.131 CC(=O)NCCCOc1ccccc1C 240690a_106633784460_100015343762 [1,0,1,0,0,0|1,0,0]=3 2304 B15R1.131 CC(=O)NCCCOc1ccccc1C 527a_106633784460_100103153847 [1,0,1,0,0,0|1,0,0]=3 2305 B15R1.131 CC(=O)NCCCOc1ccccc1F 11a_100000707858_100015343762 [1,0,1,0,0,0|2,0,0]=4 2306 B15R1.131 CC(=O)NCCCOc1ccccc1F 1626a_100000707858_100015343762 [1,0,1,0,0,0|2,0,0]=4 2307 B15R1.131 CC(=O)NCCCOc1ccccc1F 240690a_100000707858_100015343762 [1,0,1,0,0,0|2,0,0]=4 2308 B15R1.131 CC(=O)NCCCOc1ccccc1F 527a_100000707858_100103153847 [1,0,1,0,0,0|2,0,0]=4 2309 B15R1.131 CC(=O)NNCCOc1ccccc1C 22a_100000684149_100000070787 [1,0,1,0,0,0|2,0,0]=4 2310 B15R1.131 CC(=O)OCCCOc1ccccc1C 34a_100000210338_100000042594 [1,0,1,0,0,0|2,0,0]=4 2311 B15R1.131 CC(=O)OCCCOc1ccccc1C 7a_100000210338_100000042594 [1,0,1,0,0,0|2,0,0]=4 2312 B15R1.131 CC(=O)SCCCOc1ccccc1C 34a_100000210338_100000038929 [1,0,1,0,0,0|2,0,0]=4 2313 B15R1.131 CC(=O)SCCCOc1ccccc1C 7a_100000210338_100000038929 [1,0,1,0,0,0|2,0,0]=4 2314 B15R1.131 Cc1ccccc1OCCNCC(=O)O 269956a_100016091260_100000184434 [1,0,1,0,0,0|2,0,0]=4 2315 B15R1.1045 C=CCCCCOc1ccccc1OC 34a_100000210385_100011215482 [1,0,1,0,0,0|2,0,0]=4 2316 B15R1.1045 CC/C=C\CCOc1ccccc1OC 34a_100000210385_100015370543 [1,0,1,0,0,0|2,0,0]=4 2317 B15R1.1045 CCCOCCOc1ccccc1OC 34a_100000210258_100000188471 [1,0,1,0,0,0|1,0,1]=4 2318 B15R1.1045 CCCOCCOc1ccccc1OC 34a_100000210385_100011215938 [1,0,1,0,0,0|1,0,1]=4 2319 B15R1.1045 CCNCCCOc1ccccc1OC 2230a_100015525214_100011259231 [1,0,1,0,0,0|1,0,1]=4 2320 B15R1.1045 CCNCCCOc1ccccc1OC 34a_100000752037_100000210202 [1,0,1,0,0,0|1,0,1]=4 2321 B15R1.1045 CCc1ccccc1OCCCCC=O 7a_100000210936_100000139335 [1,0,1,0,0,0|2,0,0]=4 2322 B15R1.1045 CNCCCCOc1ccccc1OC 2230a_106832991635_200011219331 [1,0,1,0,0,0|1,0,1]=4 2323 B15R1.1045 CNCCCCOc1ccccc1OC 34a_100102657272_200011219331 [1,0,1,0,0,0|1,0,1]=4 2324 B15R1.1045 CNCCCCOc1ccccc1OC 7a_106832991635_200011219331 [1,0,1,0,0,0|1,0,1]=4 2325 B15R1.1045 COc1ccccc1OCCCCCO 34a_100000210385_100000746330 [1,0,1,0,0,0|1,0,1]=4 2326 B15R1.1045 COc1ccccc1OCCCNCF 34a_100000752037_100015361967 [1,0,1,0,0,0|1,0,1]=4 2327 B15R1.1045 COc1ccccc1OCCNCC=O 2230a_100000683763_200015260668 [1,0,1,0,0,0|2,0,0]=4 2328 B15R1.1045 COc1ccccc1OCCNCC=O 34a_100000683763_200009817547 [1,0,1,0,0,0|2,0,0]=4 2329 B15R1.1045 COc1ccccc1OCCSCC=O 62a_100000188471_200015260668 [1,0,1,0,0,0|2,0,0]=4 2330 B15R1.1045 COc1ccccc1OCCSCC=O 62a_200015260668_100000188471 [1,0,1,0,0,0|2,0,0]=4 2331 B15R1.1045 COc1ccccc1SCCCCC=O 62a_100000139335_100000210334 [1,0,1,0,0,0|1,1,0]=4 2332 B15R1.1045 COc1ccccc1SCCCCC=O 62a_100000210334_100000139335 [1,0,1,0,0,0|1,1,0]=4 2333 B15R1.1045 COc1ncccc1OCCCCC=O 7a_100000698397_100000139335 [1,0,1,0,0,0|2,0,0]=4 2334 B15R1.1091 C=CC(=O)OCCOc1ccccc1C 34a_100000210338_100009813456 [1,0,1,0,0,0|1,0,1]=4 2335 B15R1.1091 C=CC(=O)OCCOc1ccccc1C 7a_100000210338_100009813456 [1,0,1,0,0,0|1,0,1]=4 2336 B15R1.1091 CCC(=O)CCCOc1ccccc1C 1458a_100000210414_100000742659 [1,0,1,0,0,0|2,0,0]=4 2337 B15R1.1091 CCC(=O)CCCOc1ccccc1C 1458a_100000735866_100000210202 [1,0,1,0,0,0|2,0,0]=4 2338 B15R1.1091 CCC(=O)NCCOc1ccccc1C 11a_100000743344_100000210414 [1,0,1,0,0,0|2,0,0]=4 2339 B15R1.1091 CCC(=O)NCCOc1ccccc1C 1626a_100000743344_100000210414 [1,0,1,0,0,0|2,0,0]=4 2340 B15R1.1091 CCC(=O)NCCOc1ccccc1C 240690a_100000743344_100000210414 [1,0,1,0,0,0|2,0,0]=4 2341 B15R1.1091 CCC(=O)NCCOc1ccccc1C 527a_100000743344_100000210414 [1,0,1,0,0,0|2,0,0]=4 2342 B15R1.1091 CNC(=O)CCCNc1ccccc1C 34a_100015192222_100000741757 [1,0,1,0,0,0|2,0,0]=4 2343 B15R1.1091 CNC(=O)CCCNc1ccccc1O 34a_100000185747_100000741757 [1,0,1,0,0,0|2,0,0]=4 2344 B15R1.1091 CNC(=O)CCCOc1ccccc1Br 34a_100000181306_100000741757 [1,0,1,0,0,0|2,0,0]=4 2345 B15R1.1091 CNC(=O)CCCOc1ccccc1Br 7a_100000181306_100000741757 [1,0,1,0,0,0|2,0,0]=4 2346 B15R1.1091 CNC(=O)CCCOc1ccccc1C 11a_106832991635_100000735866 [1,0,1,0,0,0|1,0,0]=3 2347 B15R1.1091 CNC(=O)CCCOc1ccccc1C 1626a_100102657272_100000735866 [1,0,1,0,0,0|1,0,0]=3 2348 B15R1.1091 CNC(=O)CCCOc1ccccc1C 240690a_100102657272_100000735866 [1,0,1,0,0,0|1,0,0]=3 2349 B15R1.1091 CNC(=O)CCCOc1ccccc1C 34a_100000210338_100000741757 [1,0,1,0,0,0|1,0,0]=3 2350 B15R1.1091 CNC(=O)CCCOc1ccccc1C 527a_100102657272_100000735866 [1,0,1,0,0,0|1,0,0]=3 2351 B15R1.1091 CNC(=O)CCCOc1ccccc1C 7a_100000210338_100000741757 [1,0,1,0,0,0|1,0,0]=3 2352 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 11a_106832991635_100000747900 [1,0,1,0,0,0|2,0,0]=4 2353 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 1626a_100102657272_100000747900 [1,0,1,0,0,0|2,0,0]=4 2354 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 240690a_100102657272_100000747900 [1,0,1,0,0,0|2,0,0]=4 2355 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 34a_100000210172_100000741757 [1,0,1,0,0,0|2,0,0]=4 2356 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 527a_100102657272_100000747900 [1,0,1,0,0,0|2,0,0]=4 2357 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 7a_100000210172_100000741757 [1,0,1,0,0,0|2,0,0]=4 2358 B15R1.1091 CNC(=O)CCCOc1ccccc1F 34a_100000210171_100000741757 [1,0,1,0,0,0|2,0,0]=4 2359 B15R1.1091 CNC(=O)CCCOc1ccccc1F 7a_100000210171_100000741757 [1,0,1,0,0,0|2,0,0]=4 2360 B15R1.1091 CNC(=O)CCCOc1ccccc1I 34a_100000739446_100000741757 [1,0,1,0,0,0|2,0,0]=4 2361 B15R1.1091 CNC(=O)CCCOc1ccccc1I 7a_100000739446_100000741757 [1,0,1,0,0,0|2,0,0]=4 2362 B15R1.1091 CNC(=O)CCCOc1ccccc1N 34a_100000185747_100000741757 [1,0,1,0,0,0|2,0,0]=4 2363 B15R1.1091 CNC(=O)CCCOc1ccccc1N 7a_100000185747_100000741757 [1,0,1,0,0,0|2,0,0]=4 2364 B15R1.1091 CNC(=O)CCCOc1cccnc1C 34a_100000745507_100000741757 [1,0,1,0,0,0|2,0,0]=4 2365 B15R1.1091 CNC(=O)CCCOc1cccnc1C 7a_100000745507_100000741757 [1,0,1,0,0,0|2,0,0]=4 2366 B15R1.1091 CNC(=O)CCCOc1ccncc1C 34a_100000694293_100000741757 [1,0,1,0,0,0|2,0,0]=4 2367 B15R1.1091 CNC(=O)CCCOc1cnccc1C 34a_100011997053_100000741757 [1,0,1,0,0,0|2,0,0]=4 2368 B15R1.1091 CNC(=O)CCCOc1cnccc1C 7a_100011997053_100000741757 [1,0,1,0,0,0|2,0,0]=4 2369 B15R1.1091 CNC(=O)CCCSc1ccccc1C 62a_100000210755_100000741757 [1,0,1,0,0,0|1,1,0]=4 2370 B15R1.1091 CNC(=O)CCCSc1ccccc1C 62a_100000741757_100000210755 [1,0,1,0,0,0|1,1,0]=4 2371 B15R1.1091 CNC(=O)CCCSc1ccccc1O 62a_100000739446_100000741757 [1,0,1,0,0,0|1,1,0]=4 2372 B15R1.1091 CNC(=O)CCCSc1ccccc1O 62a_100000741757_100000739446 [1,0,1,0,0,0|1,1,0]=4 2373 B15R1.1091 CNC(=O)NCCOc1ccccc1Br 2708a_100000744007_106832991635 [1,0,1,0,0,0|2,0,0]=4 2374 B15R1.1091 CNC(=O)NCCOc1ccccc1Br 2708a_100102657272_100000744007 [1,0,1,0,0,0|2,0,0]=4 2375 B15R1.1091 CNC(=O)NCCOc1ccccc1Br 273464a_100000744007_100102657272 [1,0,1,0,0,0|2,0,0]=4 2376 B15R1.1091 CNC(=O)NCCOc1ccccc1Br 273464a_100102657272_100000744007 [1,0,1,0,0,0|2,0,0]=4 2377 B15R1.1091 CNC(=O)NCCOc1ccccc1Br 512a_100000744007_100102657272 [1,0,1,0,0,0|2,0,0]=4 2378 B15R1.1091 CNC(=O)NCCOc1ccccc1Br 512a_106832991638_100000744007 [1,0,1,0,0,0|2,0,0]=4 2379 B15R1.1091 CNC(=O)NCCOc1ccccc1C 2708a_100000743344_106832991635 [1,0,1,0,0,0|1,0,0]=3 2380 B15R1.1091 CNC(=O)NCCOc1ccccc1C 2708a_100102657272_100000743344 [1,0,1,0,0,0|1,0,0]=3 2381 B15R1.1091 CNC(=O)NCCOc1ccccc1C 273464a_100000743344_100102657272 [1,0,1,0,0,0|1,0,0]=3 2382 B15R1.1091 CNC(=O)NCCOc1ccccc1C 273464a_100102657272_100000743344 [1,0,1,0,0,0|1,0,0]=3 2383 B15R1.1091 CNC(=O)NCCOc1ccccc1C 512a_100000743344_100102657272 [1,0,1,0,0,0|1,0,0]=3 2384 B15R1.1091 CNC(=O)NCCOc1ccccc1C 512a_106832991638_100000743344 [1,0,1,0,0,0|1,0,0]=3 2385 B15R1.1091 CNC(=O)NCCOc1ccccc1Cl 2708a_100000174932_106832991635 [1,0,1,0,0,0|2,0,0]=4 2386 B15R1.1091 CNC(=O)NCCOc1ccccc1Cl 2708a_100102657272_100000174932 [1,0,1,0,0,0|2,0,0]=4 2387 B15R1.1091 CNC(=O)NCCOc1ccccc1Cl 273464a_100000174932_100102657272 [1,0,1,0,0,0|2,0,0]=4 2388 B15R1.1091 CNC(=O)NCCOc1ccccc1Cl 273464a_100102657272_100000174932 [1,0,1,0,0,0|2,0,0]=4 2389 B15R1.1091 CNC(=O)NCCOc1ccccc1Cl 512a_100000174932_100102657272 [1,0,1,0,0,0|2,0,0]=4 2390 B15R1.1091 CNC(=O)NCCOc1ccccc1Cl 512a_106832991638_100000174932 [1,0,1,0,0,0|2,0,0]=4 2391 B15R1.1091 CNC(=O)NCCOc1ccccc1F 2708a_100000683764_106832991635 [1,0,1,0,0,0|2,0,0]=4 2392 B15R1.1091 CNC(=O)NCCOc1ccccc1F 2708a_100102657272_100000683764 [1,0,1,0,0,0|2,0,0]=4 2393 B15R1.1091 CNC(=O)NCCOc1ccccc1F 273464a_100000683764_100102657272 [1,0,1,0,0,0|2,0,0]=4 2394 B15R1.1091 CNC(=O)NCCOc1ccccc1F 273464a_100102657272_100000683764 [1,0,1,0,0,0|2,0,0]=4 2395 B15R1.1091 CNC(=O)NCCOc1ccccc1F 512a_100000683764_100102657272 [1,0,1,0,0,0|2,0,0]=4 2396 B15R1.1091 CNC(=O)NCCOc1ccccc1F 512a_106832991638_100000683764 [1,0,1,0,0,0|2,0,0]=4 2397 B15R1.1091 CNC(=O)OCCNc1ccccc1Br 34a_100000210017_200011997002 [1,0,1,0,0,0|2,0,0]=4 2398 B15R1.1091 CNC(=O)OCCNc1ccccc1C 34a_100015192222_200011997002 [1,0,1,0,0,0|1,0,0]=3 2399 B15R1.1091 CNC(=O)OCCNc1ccccc1Cl 34a_100000185783_200011997002 [1,0,1,0,0,0|2,0,0]=4 2400 B15R1.1091 CNC(=O)OCCNc1ccccc1F 34a_100000210422_200011997002 [1,0,1,0,0,0|2,0,0]=4 2401 B15R1.1091 CNC(=O)OCCNc1ccccc1I 34a_100000210053_200011997002 [1,0,1,0,0,0|2,0,0]=4 2402 B15R1.1091 CNC(=O)OCCNc1ccccc1O 34a_100000185747_200011997002 [1,0,1,0,0,0|1,0,0]=3 2403 B15R1.1091 CNC(=O)OCCOc1cccc[n+]1[O-] 7a_100000211761_200011997002 [1,0,1,0,0,0|1,0,1]=4 2404 B15R1.1091 CNC(=O)OCCOc1ccccc1Br 34a_100000181306_200011997002 [1,0,1,0,0,0|1,0,0]=3 2405 B15R1.1091 CNC(=O)OCCOc1ccccc1Br 7a_100000181306_200011997002 [1,0,1,0,0,0|1,0,0]=3 2406 B15R1.1091 CNC(=O)OCCOc1ccccc1C 34a_100000210338_200011997002 [1,0,1,0,0,0|0,0,0]=2 2407 B15R1.1091 CNC(=O)OCCOc1ccccc1C 7a_100000210338_200011997002 [1,0,1,0,0,0|0,0,0]=2 2408 B15R1.1091 CNC(=O)OCCOc1ccccc1Cl 34a_100000210172_200011997002 [1,0,1,0,0,0|1,0,0]=3 2409 B15R1.1091 CNC(=O)OCCOc1ccccc1Cl 7a_100000210172_200011997002 [1,0,1,0,0,0|1,0,0]=3 2410 B15R1.1091 CNC(=O)OCCOc1ccccc1F 34a_100000210171_200011997002 [1,0,1,0,0,0|1,0,0]=3 2411 B15R1.1091 CNC(=O)OCCOc1ccccc1F 7a_100000210171_200011997002 [1,0,1,0,0,0|1,0,0]=3 2412 B15R1.1091 CNC(=O)OCCOc1ccccc1I 34a_100000739446_200011997002 [1,0,1,0,0,0|1,0,0]=3 2413 B15R1.1091 CNC(=O)OCCOc1ccccc1I 7a_100000739446_200011997002 [1,0,1,0,0,0|1,0,0]=3 2414 B15R1.1091 CNC(=O)OCCOc1ccccc1N 34a_100000185747_200011997002 [1,0,1,0,0,0|1,0,0]=3 2415 B15R1.1091 CNC(=O)OCCOc1ccccc1N 7a_100000185747_200011997002 [1,0,1,0,0,0|1,0,0]=3 2416 B15R1.1091 CNC(=O)OCCOc1cccnc1Br 34a_100000744436_200011997002 [1,0,1,0,0,0|2,0,0]=4 2417 B15R1.1091 CNC(=O)OCCOc1cccnc1Br 7a_100000744436_200011997002 [1,0,1,0,0,0|2,0,0]=4 2418 B15R1.1091 CNC(=O)OCCOc1cccnc1C 34a_100000745507_200011997002 [1,0,1,0,0,0|1,0,0]=3 2419 B15R1.1091 CNC(=O)OCCOc1cccnc1C 7a_100000745507_200011997002 [1,0,1,0,0,0|1,0,0]=3 2420 B15R1.1091 CNC(=O)OCCOc1cccnc1Cl 34a_100000757616_200011997002 [1,0,1,0,0,0|2,0,0]=4 2421 B15R1.1091 CNC(=O)OCCOc1cccnc1Cl 7a_100000757616_200011997002 [1,0,1,0,0,0|2,0,0]=4 2422 B15R1.1091 CNC(=O)OCCOc1cccnc1F 34a_100000061740_200011997002 [1,0,1,0,0,0|2,0,0]=4 2423 B15R1.1091 CNC(=O)OCCOc1cccnc1F 7a_100000061740_200011997002 [1,0,1,0,0,0|2,0,0]=4 2424 B15R1.1091 CNC(=O)OCCOc1cccnc1I 34a_100000034122_200011997002 [1,0,1,0,0,0|2,0,0]=4 2425 B15R1.1091 CNC(=O)OCCOc1cccnc1I 7a_100000034122_200011997002 [1,0,1,0,0,0|2,0,0]=4 2426 B15R1.1091 CNC(=O)OCCOc1cccnc1N 34a_100000211975_200011997002 [1,0,1,0,0,0|2,0,0]=4 2427 B15R1.1091 CNC(=O)OCCOc1cccnc1N 7a_100000211975_200011997002 [1,0,1,0,0,0|2,0,0]=4 2428 B15R1.1091 CNC(=O)OCCOc1cccoc1=O 34a_100000077404_200011997002 [1,0,1,0,0,0|1,0,1]=4 2429 B15R1.1091 CNC(=O)OCCOc1cccoc1=O 7a_100000077404_200011997002 [1,0,1,0,0,0|1,0,1]=4 2430 B15R1.1091 CNC(=O)OCCOc1ccncc1Br 34a_100011996408_200011997002 [1,0,1,0,0,0|2,0,0]=4 2431 B15R1.1091 CNC(=O)OCCOc1ccncc1C 34a_100000694293_200011997002 [1,0,1,0,0,0|1,0,0]=3 2432 B15R1.1091 CNC(=O)OCCOc1ccncc1Cl 34a_100011997054_200011997002 [1,0,1,0,0,0|2,0,0]=4 2433 B15R1.1091 CNC(=O)OCCOc1ccncc1F 34a_200000081243_200011997002 [1,0,1,0,0,0|2,0,0]=4 2434 B15R1.1091 CNC(=O)OCCOc1cnccc1C 34a_100011997053_200011997002 [1,0,1,0,0,0|1,0,0]=3 2435 B15R1.1091 CNC(=O)OCCOc1cnccc1C 7a_100011997053_200011997002 [1,0,1,0,0,0|1,0,0]=3 2436 B15R1.1091 CNC(=O)OCCOc1cnccc1Cl 34a_100011996695_200011997002 [1,0,1,0,0,0|2,0,0]=4 2437 B15R1.1091 CNC(=O)OCCOc1cnccc1I 34a_100000050107_200011997002 [1,0,1,0,0,0|2,0,0]=4 2438 B15R1.1091 CNC(=O)OCCOc1cnccc1N 34a_100000753702_200011997002 [1,0,1,0,0,0|2,0,0]=4 2439 B15R1.1091 CNC(=O)OCCOc1coccc1=O 34a_100000060831_200011997002 [1,0,1,0,0,0|1,0,1]=4 2440 B15R1.1091 CNC(=O)OCCOc1ncccc1Cl 34a_100011290957_200011997002 [1,0,1,0,0,0|2,0,0]=4 2441 B15R1.1091 CNC(=O)OCCOc1ncccc1F 34a_100011219419_200011997002 [1,0,1,0,0,0|2,0,0]=4 2442 B15R1.1091 CNC(=O)OCCOc1ncccc1N 34a_100000746358_200011997002 [1,0,1,0,0,0|2,0,0]=4 2443 B15R1.1091 CNC(=O)OCCOc1nccnc1C 34a_100000766352_200011997002 [1,0,1,0,0,0|2,0,0]=4 2444 B15R1.1091 CNC(=O)OCCSc1cccc[n+]1C 62a_200011997002_100000212160 [1,0,1,0,0,0|1,1,0]=4 2445 B15R1.1091 CNC(=O)OCCSc1ccccc1Br 62a_100000695589_200011997002 [1,0,1,0,0,0|1,1,0]=4 2446 B15R1.1091 CNC(=O)OCCSc1ccccc1Br 62a_200011997002_100000695589 [1,0,1,0,0,0|1,1,0]=4 2447 B15R1.1091 CNC(=O)OCCSc1ccccc1C 62a_100000210755_200011997002 [1,0,1,0,0,0|0,1,0]=3 2448 B15R1.1091 CNC(=O)OCCSc1ccccc1C 62a_200011997002_100000210755 [1,0,1,0,0,0|0,1,0]=3 2449 B15R1.1091 CNC(=O)OCCSc1ccccc1Cl 62a_100000764095_200011997002 [1,0,1,0,0,0|1,1,0]=4 2450 B15R1.1091 CNC(=O)OCCSc1ccccc1Cl 62a_200011997002_100000764095 [1,0,1,0,0,0|1,1,0]=4 2451 B15R1.1091 CNC(=O)OCCSc1ccccc1F 62a_100011215700_200011997002 [1,0,1,0,0,0|1,1,0]=4 2452 B15R1.1091 CNC(=O)OCCSc1ccccc1F 62a_200011997002_100011215700 [1,0,1,0,0,0|1,1,0]=4 2453 B15R1.1091 CNC(=O)OCCSc1ccccc1N 62a_100000210017_200011997002 [1,0,1,0,0,0|1,1,0]=4 2454 B15R1.1091 CNC(=O)OCCSc1ccccc1N 62a_200011997002_100000210017 [1,0,1,0,0,0|1,1,0]=4 2455 B15R1.1091 CNC(=O)OCCSc1ccccc1O 62a_100000739446_200011997002 [1,0,1,0,0,0|0,1,0]=3 2456 B15R1.1091 CNC(=O)OCCSc1ccccc1O 62a_200011997002_100000739446 [1,0,1,0,0,0|0,1,0]=3 2457 B15R1.1091 CNC(=O)OCCSc1cccnc1C 62a_100000751574_200011997002 [1,0,1,0,0,0|1,1,0]=4 2458 B15R1.1091 CNC(=O)OCCSc1cccnc1C 62a_200011997002_100000751574 [1,0,1,0,0,0|1,1,0]=4 2459 B15R1.1091 CNC(=O)OCCSc1cccnc1O 62a_100000760158_200011997002 [1,0,1,0,0,0|1,1,0]=4 2460 B15R1.1091 CNC(=O)OCCSc1cccnc1O 62a_200011997002_100000760158 [1,0,1,0,0,0|1,1,0]=4 2461 B15R1.1091 CNC(=O)OCCSc1ccncc1C 62a_100000765111_200011997002 [1,0,1,0,0,0|1,1,0]=4 2462 B15R1.1091 CNC(=O)OCCSc1ccncc1C 62a_200011997002_100000765111 [1,0,1,0,0,0|1,1,0]=4 2463 B15R1.1091 CNC(=O)OCCSc1ccncc1O 62a_100009817591_200011997002 [1,0,1,0,0,0|1,1,0]=4 2464 B15R1.1091 CNC(=O)OCCSc1ccncc1O 62a_200011997002_100009817591 [1,0,1,0,0,0|1,1,0]=4 2465 B15R1.1091 CNC(=O)OCCSc1cnccc1C 62a_100000761580_200011997002 [1,0,1,0,0,0|1,1,0]=4 2466 B15R1.1091 CNC(=O)OCCSc1cnccc1C 62a_200011997002_100000761580 [1,0,1,0,0,0|1,1,0]=4 2467 B15R1.1091 CNC(=O)OCCSc1ncccc1C 62a_100000751373_200011997002 [1,0,1,0,0,0|1,1,0]=4 2468 B15R1.1091 CNC(=O)OCCSc1ncccc1C 62a_200011997002_100000751373 [1,0,1,0,0,0|1,1,0]=4 2469 B15R1.1091 CNC(=O)OCCSc1ncccc1O 62a_100000034122_200011997002 [1,0,1,0,0,0|1,1,0]=4 2470 B15R1.1091 CNC(=O)OCCSc1ncccc1O 62a_200011997002_100000034122 [1,0,1,0,0,0|1,1,0]=4 2471 B15R1.1091 COC(=O)CCCOc1ccccc1C 34a_100000210338_100000742333 [1,0,1,0,0,0|2,0,0]=4 2472 B15R1.1091 COC(=O)CCCOc1ccccc1C 7a_100000210338_100011218270 [1,0,1,0,0,0|2,0,0]=4 2473 B15R2.562 Cc1ccccc1OCC2CCCO2 7a_100000210338_100000203698 [2,0,0,0,0,0|1,0,1]=4 2474 B15R2.283 O=C1CC[C@H](N1)COc2ccccc2 7a_100000210340_100015189358 [2,0,0,0,0,0|2,0,0]=4 2475 B15R2.283 O=C1NCC(O1)CNc2ccccc2 34a_100000106764_100000181169 [2,0,0,0,0,0|1,0,0]=3 2476 B15R2.283 O=C1NCC(O1)COc2ccccc2 34a_100000210340_100000181169 [2,0,0,0,0,0|0,0,0]=2 2477 B15R2.283 O=C1NCC(O1)COc2ccccc2 7a_100000210340_100000181169 [2,0,0,0,0,0|0,0,0]=2 2478 B15R2.283 O=C1NCC(O1)COc2cccnc2 34a_100000210849_100000181169 [2,0,0,0,0,0|1,0,0]=3 2479 B15R2.283 O=C1NCC(O1)COc2cccnc2 7a_100000210849_100000181169 [2,0,0,0,0,0|1,0,0]=3 2480 B15R2.283 O=C1NCC(O1)COc2ccncc2 34a_100000212176_100000181169 [2,0,0,0,0,0|1,0,0]=3 2481 B15R2.283 O=C1NCC(O1)COc2ccnnc2 34a_100015204005_100000181169 [2,0,0,0,0,0|2,0,0]=4 2482 B15R2.283 O=C1NCC(O1)COc2cncnc2 7a_100000754086_100000181169 [2,0,0,0,0,0|2,0,0]=4 2483 B15R2.283 O=C1NCC(O1)CSc2ccccc2 62a_100000181169_100000041952 [2,0,0,0,0,0|0,1,0]=3 2484 B15R2.283 O=C1NCC(O1)CSc2ccccc2 62a_100000719477_100000181169 [2,0,0,0,0,0|0,1,0]=3 2485 B15R2.283 O=C1NCC(O1)CSc2ccccn2 62a_100000181169_100011216584 [2,0,0,0,0,0|1,1,0]=4 2486 B15R2.283 O=C1NCC(O1)CSc2ccccn2 62a_100011216584_100000181169 [2,0,0,0,0,0|1,1,0]=4 2487 B15R2.283 O=C1NCC(O1)CSc2cccnc2 62a_100000181169_100000210063 [2,0,0,0,0,0|1,1,0]=4 2488 B15R2.283 O=C1NCC(O1)CSc2cccnc2 62a_100000210063_100000181169 [2,0,0,0,0,0|1,1,0]=4 2489 B15R2.283 O=C1NCC(O1)CSc2ccncc2 62a_100000181169_100000728582 [2,0,0,0,0,0|1,1,0]=4 2490 B15R2.283 O=C1NCC(O1)CSc2ccncc2 62a_100000728582_100000181169 [2,0,0,0,0,0|1,1,0]=4 2491 B15R2.283 O=C1N[C@H](CO1)COc2ccccc2 34a_100000210340_100015307671 [2,0,0,0,0,0|2,0,0]=4 2492 B15R2.283 O=C1N[C@H](CO1)COc2ccccc2 7a_100000210340_100015307671 [2,0,0,0,0,0|2,0,0]=4 2493 B15R2.283 O=C1OCC(O1)CNc2ccccc2 34a_100000106764_100000073702 [2,0,0,0,0,0|2,0,0]=4 2494 B15R2.283 O=C1OCC(O1)COc2ccccc2 34a_100000210340_100000073702 [2,0,0,0,0,0|1,0,0]=3 2495 B15R2.283 O=C1OCC(O1)COc2cccnc2 34a_100000210849_100000073702 [2,0,0,0,0,0|2,0,0]=4 2496 B15R2.283 O=C1OCC(O1)COc2ccncc2 34a_100000212176_100000073702 [2,0,0,0,0,0|2,0,0]=4 2497 B15R2.283 O=C1OCC(O1)CSc2ccccc2 62a_100000073702_100000041952 [2,0,0,0,0,0|1,1,0]=4 2498 B15R2.283 O=C1OCC(O1)CSc2ccccc2 62a_100000719477_100000073702 [2,0,0,0,0,0|1,1,0]=4 2499 B17R1.6576 C=CC(=O)NC(C)COc1ccccc1OC 1626a_100000743626_100000185746 [0,1,1,0,0,0|2,0,0]=4 2500 B17R1.6576 C=CC(=O)NC(C)COc1ccccc1OC 240690a_100000743626_200121576911 [0,1,1,0,0,0|2,0,0]=4 2501 B17R1.6576 CCC(=O)NC(C)COc1ccccc1OC 11a_100000743626_100000210414 [0,1,1,0,0,0|2,0,0]=4 2502 B17R1.6576 CCC(=O)NC(C)COc1ccccc1OC 1626a_100000743626_100000210414 [0,1,1,0,0,0|2,0,0]=4 2503 B17R1.6576 CCC(=O)NC(C)COc1ccccc1OC 240690a_100000743626_100000210414 [0,1,1,0,0,0|2,0,0]=4 2504 B17R1.6576 CCC(=O)NC(C)COc1ccccc1OC 527a_100000743626_100000210414 [0,1,1,0,0,0|2,0,0]=4 2505 B17R1.6576 CNC(=O)NC(C)COc1ccccc1OC 2708a_100000743626_106832991635 [0,1,1,0,0,0|1,0,0]=3 2506 B17R1.6576 CNC(=O)NC(C)COc1ccccc1OC 2708a_100102657272_100000743626 [0,1,1,0,0,0|1,0,0]=3 2507 B17R1.6576 CNC(=O)NC(C)COc1ccccc1OC 273464a_100000743626_100102657272 [0,1,1,0,0,0|1,0,0]=3 2508 B17R1.6576 CNC(=O)NC(C)COc1ccccc1OC 273464a_100102657272_100000743626 [0,1,1,0,0,0|1,0,0]=3 2509 B17R1.6576 CNC(=O)NC(C)COc1ccccc1OC 512a_100000743626_100102657272 [0,1,1,0,0,0|1,0,0]=3 2510 B17R1.6576 CNC(=O)NC(C)COc1ccccc1OC 512a_106832991638_100000743626 [0,1,1,0,0,0|1,0,0]=3 2511 B17R1.6576 COc1ccccc1OCC(C)NC(=O)CO 240690a_100000743626_100000210174 [0,1,1,0,0,0|2,0,0]=4 2512 B17R1.6576 COc1ccccc1OCC(C)NC(=O)CO 527a_100000743626_100000210174 [0,1,1,0,0,0|2,0,0]=4 2513 B17R1.747 CCOc1ccccc1OCCCCC(=O)C 34a_100000211404_100009817362 [0,1,1,0,0,0|2,0,0]=4 2514 B17R1.747 CCOc1ccccc1OCCCCC(=O)C 7a_100000211404_100000735457 [0,1,1,0,0,0|2,0,0]=4 2515 B17R1.747 CCOc1ccccc1OCCCOC(=O)C 34a_100000211404_100000042594 [0,1,1,0,0,0|2,0,0]=4 2516 B17R1.747 CCOc1ccccc1OCCCOC(=O)C 7a_100000211404_100000042594 [0,1,1,0,0,0|2,0,0]=4 2517 B17R1.747 CCOc1ccccc1OCCCSC(=O)C 34a_100000211404_100000038929 [0,1,1,0,0,0|2,0,0]=4 2518 B17R1.747 CCOc1ccccc1OCCCSC(=O)C 7a_100000211404_100000038929 [0,1,1,0,0,0|2,0,0]=4 2519 B17R1.747 CCOc1ccccc1OCCNCC(=O)O 269956a_100016091260_100000764113 [0,1,1,0,0,0|2,0,0]=4 2520 B17R1.747 COCc1ccccc1OCCCCC(=O)C 34a_100011488565_100009817362 [0,1,1,0,0,0|2,0,0]=4 2521 B17R1.747 COCc1ccccc1OCCCCC(=O)C 7a_100011488565_100000735457 [0,1,1,0,0,0|2,0,0]=4 2522 B17R1.747 COCc1ccccc1OCCCOC(=O)C 34a_100011488565_100000042594 [0,1,1,0,0,0|2,0,0]=4 2523 B17R1.747 COCc1ccccc1OCCCOC(=O)C 7a_100011488565_100000042594 [0,1,1,0,0,0|2,0,0]=4 2524 B17R1.747 COCc1ccccc1OCCCSC(=O)C 34a_100011488565_100000038929 [0,1,1,0,0,0|2,0,0]=4 2525 B17R1.747 COCc1ccccc1OCCCSC(=O)C 7a_100011488565_100000038929 [0,1,1,0,0,0|2,0,0]=4 2526 B17R1.1420 C#CC(=O)CCCCOc1ccccc1OC 1458a_100000211873_200011219331 [0,1,1,0,0,0|2,0,0]=4 2527 B17R1.1420 C=CC(=O)CCCCOc1ccccc1OC 1458a_100000185746_200011219331 [0,1,1,0,0,0|2,0,0]=4 2528 B17R1.1420 C=CC(=O)NCCCOc1ccccc1OC 1626a_100000752037_100000185746 [0,1,1,0,0,0|1,0,0]=3 2529 B17R1.1420 C=CC(=O)NCCCOc1ccccc1OC 240690a_100000752037_200121576911 [0,1,1,0,0,0|1,0,0]=3 2530 B17R1.1420 CCC(=O)CCCCOc1ccccc1OC 1458a_100000210414_200011219331 [0,1,1,0,0,0|2,0,0]=4 2531 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 11a_100000752037_100000210414 [0,1,1,0,0,0|1,0,0]=3 2532 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 1626a_100000752037_100000210414 [0,1,1,0,0,0|1,0,0]=3 2533 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 240690a_100000752037_100000210414 [0,1,1,0,0,0|1,0,0]=3 2534 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 527a_100000752037_100000210414 [0,1,1,0,0,0|1,0,0]=3 2535 B17R1.1420 CCc1ccccc1OCCCCC(=O)OC 34a_100000210936_100000204269 [0,1,1,0,0,0|2,0,0]=4 2536 B17R1.1420 CCc1ccccc1OCCCCC(=O)OC 7a_100000210936_100000204269 [0,1,1,0,0,0|2,0,0]=4 2537 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 2708a_100000752037_106832991635 [0,1,1,0,0,0|1,0,0]=3 2538 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 2708a_100102657272_100000752037 [0,1,1,0,0,0|1,0,0]=3 2539 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 273464a_100000752037_100102657272 [0,1,1,0,0,0|1,0,0]=3 2540 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 273464a_100102657272_100000752037 [0,1,1,0,0,0|1,0,0]=3 2541 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 512a_100000752037_100102657272 [0,1,1,0,0,0|1,0,0]=3 2542 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 512a_106832991638_100000752037 [0,1,1,0,0,0|1,0,0]=3 2543 B17R1.1420 CNc1ccccc1OCCCCC(=O)OC 34a_100000033821_100000204269 [0,1,1,0,0,0|2,0,0]=4 2544 B17R1.1420 COC(=O)CCCCNc1ccccc1OC 34a_100000210025_100000204269 [0,1,1,0,0,0|2,0,0]=4 2545 B17R1.1420 COC(=O)CCCCOc1ccccc1OC 34a_100000210385_100000204269 [0,1,1,0,0,0|1,0,0]=3 2546 B17R1.1420 COC(=O)CCCCOc1ccccc1SC 34a_100011216402_100000204269 [0,1,1,0,0,0|1,1,0]=4 2547 B17R1.1420 COC(=O)CCCCOc1cccnc1OC 34a_100000698397_100000204269 [0,1,1,0,0,0|2,0,0]=4 2548 B17R1.1420 COC(=O)CCCCOc1cccnc1OC 7a_100000698397_100000204269 [0,1,1,0,0,0|2,0,0]=4 2549 B17R1.1420 COC(=O)CCCCOc1cnccc1OC 34a_100000101186_100000204269 [0,1,1,0,0,0|2,0,0]=4 2550 B17R1.1420 COC(=O)CCCCOc1ncccc1OC 34a_100025773188_100000204269 [0,1,1,0,0,0|2,0,0]=4 2551 B17R1.1420 COC(=O)CCCCSc1ccccc1OC 62a_100000204269_100000210334 [0,1,1,0,0,0|1,1,0]=4 2552 B17R1.1420 COC(=O)CCCCSc1ccccc1OC 62a_100000210334_100000204269 [0,1,1,0,0,0|1,1,0]=4 2553 B17R1.1420 COC(=O)CNCCOc1ccccc1OC 2230a_100000683763_100000747449 [0,1,1,0,0,0|2,0,0]=4 2554 B17R1.1420 COC(=O)CNCCOc1ccccc1OC 34a_100000683763_100000747449 [0,1,1,0,0,0|2,0,0]=4 2555 B17R1.1420 COC(=O)COCCOc1ccccc1OC 34a_100000210385_100000090808 [0,1,1,0,0,0|2,0,0]=4 2556 B17R1.1420 COC(=O)CSCCOc1ccccc1OC 62a_100000188471_100000747449 [0,1,1,0,0,0|2,0,0]=4 2557 B17R1.1420 COC(=O)CSCCOc1ccccc1OC 62a_100000747449_100000188471 [0,1,1,0,0,0|2,0,0]=4 2558 B17R1.1420 COC(=O)NCCOCc1ccccc1OC 34a_100000757965_100000210004 [0,1,1,0,0,0|2,0,0]=4 2559 B17R1.1420 COc1ccccc1OCCCCC(=O)CO 1458a_100000210174_200011219331 [0,1,1,0,0,0|1,0,0]=3 2560 B17R1.1420 COc1ccccc1OCCCNC(=O)CO 240690a_100000752037_100000210174 [0,1,1,0,0,0|0,0,0]=2 2561 B17R1.1420 COc1ccccc1OCCCNC(=O)CO 527a_100000752037_100000210174 [0,1,1,0,0,0|0,0,0]=2 2562 B17R1.1420 COc1ccccc1OCCCNC(C)CO 34a_100000752037_100012180447 [0,1,1,0,0,0|1,0,1]=4 2563 B17R1.1420 COc1ccccc1OCCCN[C@H](C)CO 2230a_100000737577_100011259231 [0,1,1,0,0,0|1,0,1]=4 2564 B17R1.1420 N#Cc1ccccc1OCCCNC(=O)CO 240690a_100011220211_100000210174 [0,1,1,0,0,0|2,0,0]=4 2565 B17R1.1420 N#Cc1ccccc1OCCCNC(=O)CO 527a_100011220211_100000210174 [0,1,1,0,0,0|2,0,0]=4 2566 B17R1.1421 COc1ccccc1OCC(C)CSC(=O)C 34a_100000210385_200000116872 [0,1,1,0,0,0|2,0,0]=4 2567 B17R1.1421 COc1ccccc1OCC(O)COC(=O)C 34a_100000210385_200000139349 [0,1,1,0,0,0|2,0,0]=4 2568 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 11a_100000752054_100015343762 [0,1,1,0,0,0|1,0,0]=3 2569 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 1626a_100000752054_100015343762 [0,1,1,0,0,0|1,0,0]=3 2570 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 240690a_100000752054_100015343762 [0,1,1,0,0,0|1,0,0]=3 2571 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 527a_100000752054_100103153847 [0,1,1,0,0,0|1,0,0]=3 2572 B17R1.1422 COc1ccccc1OCCN[C@@H](C)C(=O)O 269956a_100000743915_100000188471 [0,1,1,0,0,0|2,0,0]=4 2573 B17R1.4171 COc1ccccc1OCCN(C)CC(=O)O 269956a_100000746989_100000188471 [0,1,1,0,0,0|2,0,0]=4 2574 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)Br 34a_100009816560_100009817362 [0,1,1,0,0,0|2,0,0]=4 2575 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)Br 7a_100009816560_100000735457 [0,1,1,0,0,0|2,0,0]=4 2576 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)C 34a_100011216497_100009817362 [0,1,1,0,0,0|2,0,0]=4 2577 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)C 7a_100011216497_100000735457 [0,1,1,0,0,0|2,0,0]=4 2578 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)Cl 34a_100000101779_100009817362 [0,1,1,0,0,0|2,0,0]=4 2579 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)Cl 7a_100000101779_100000735457 [0,1,1,0,0,0|2,0,0]=4 2580 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)F 34a_100000034962_100009817362 [0,1,1,0,0,0|2,0,0]=4 2581 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)F 7a_100000034962_100000735457 [0,1,1,0,0,0|2,0,0]=4 2582 B17R1.4712 COc1ccc(cc1OCCCCC(=O)C)N 34a_100000211920_100009817362 [0,1,1,0,0,0|2,0,0]=4 2583 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)Br 34a_100009816560_100000042594 [0,1,1,0,0,0|2,0,0]=4 2584 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)Br 7a_100009816560_100000042594 [0,1,1,0,0,0|2,0,0]=4 2585 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)C 34a_100011216497_100000042594 [0,1,1,0,0,0|2,0,0]=4 2586 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)C 7a_100011216497_100000042594 [0,1,1,0,0,0|2,0,0]=4 2587 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)Cl 34a_100000101779_100000042594 [0,1,1,0,0,0|2,0,0]=4 2588 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)Cl 7a_100000101779_100000042594 [0,1,1,0,0,0|2,0,0]=4 2589 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)F 34a_100000034962_100000042594 [0,1,1,0,0,0|2,0,0]=4 2590 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)F 7a_100000034962_100000042594 [0,1,1,0,0,0|2,0,0]=4 2591 B17R1.4712 COc1ccc(cc1OCCCOC(=O)C)N 34a_100000211920_100000042594 [0,1,1,0,0,0|2,0,0]=4 2592 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)Br 34a_100009816560_100000038929 [0,1,1,0,0,0|2,0,0]=4 2593 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)Br 7a_100009816560_100000038929 [0,1,1,0,0,0|2,0,0]=4 2594 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)C 34a_100011216497_100000038929 [0,1,1,0,0,0|2,0,0]=4 2595 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)C 7a_100011216497_100000038929 [0,1,1,0,0,0|2,0,0]=4 2596 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)Cl 34a_100000101779_100000038929 [0,1,1,0,0,0|2,0,0]=4 2597 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)Cl 7a_100000101779_100000038929 [0,1,1,0,0,0|2,0,0]=4 2598 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)F 34a_100000034962_100000038929 [0,1,1,0,0,0|2,0,0]=4 2599 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)F 7a_100000034962_100000038929 [0,1,1,0,0,0|2,0,0]=4 2600 B17R1.4712 COc1ccc(cc1OCCCSC(=O)C)N 34a_100000211920_100000038929 [0,1,1,0,0,0|2,0,0]=4 2601 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)Br 34a_100000694246_100009817362 [0,1,1,0,0,0|2,0,0]=4 2602 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)Br 7a_100000694246_100000735457 [0,1,1,0,0,0|2,0,0]=4 2603 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)C 34a_100000186466_100009817362 [0,1,1,0,0,0|2,0,0]=4 2604 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)Cl 34a_100000033002_100009817362 [0,1,1,0,0,0|2,0,0]=4 2605 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)F 34a_100000036057_100009817362 [0,1,1,0,0,0|2,0,0]=4 2606 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)F 7a_100000036057_100000735457 [0,1,1,0,0,0|2,0,0]=4 2607 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)I 34a_100000049635_100009817362 [0,1,1,0,0,0|2,0,0]=4 2608 B17R1.5310 COc1cc(ccc1OCCCCC(=O)C)N 34a_100000726020_100009817362 [0,1,1,0,0,0|2,0,0]=4 2609 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)Br 34a_100000694246_100000042594 [0,1,1,0,0,0|2,0,0]=4 2610 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)Br 7a_100000694246_100000042594 [0,1,1,0,0,0|2,0,0]=4 2611 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)C 34a_100000186466_100000042594 [0,1,1,0,0,0|2,0,0]=4 2612 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)Cl 34a_100000033002_100000042594 [0,1,1,0,0,0|2,0,0]=4 2613 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)F 34a_100000036057_100000042594 [0,1,1,0,0,0|2,0,0]=4 2614 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)F 7a_100000036057_100000042594 [0,1,1,0,0,0|2,0,0]=4 2615 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)I 34a_100000049635_100000042594 [0,1,1,0,0,0|2,0,0]=4 2616 B17R1.5310 COc1cc(ccc1OCCCOC(=O)C)N 34a_100000726020_100000042594 [0,1,1,0,0,0|2,0,0]=4 2617 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)Br 34a_100000694246_100000038929 [0,1,1,0,0,0|2,0,0]=4 2618 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)Br 7a_100000694246_100000038929 [0,1,1,0,0,0|2,0,0]=4 2619 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)C 34a_100000186466_100000038929 [0,1,1,0,0,0|2,0,0]=4 2620 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)Cl 34a_100000033002_100000038929 [0,1,1,0,0,0|2,0,0]=4 2621 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)F 34a_100000036057_100000038929 [0,1,1,0,0,0|2,0,0]=4 2622 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)F 7a_100000036057_100000038929 [0,1,1,0,0,0|2,0,0]=4 2623 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)I 34a_100000049635_100000038929 [0,1,1,0,0,0|2,0,0]=4 2624 B17R1.5310 COc1cc(ccc1OCCCSC(=O)C)N 34a_100000726020_100000038929 [0,1,1,0,0,0|2,0,0]=4 2625 B17R1.5310 COc1cc(ccc1OCCNCC(=O)O)C 269956a_100016091260_100011259456 [0,1,1,0,0,0|2,0,0]=4 2626 B17R1.7390 COc1c(cccc1OCCCCC(=O)C)Br 34a_100010234590_100009817362 [0,1,1,0,0,0|2,0,0]=4 2627 B17R1.7390 COc1c(cccc1OCCCCC(=O)C)Cl 34a_200009886253_100009817362 [0,1,1,0,0,0|2,0,0]=4 2628 B17R1.7390 COc1c(cccc1OCCCCC(=O)C)Cl 7a_200009886253_100000735457 [0,1,1,0,0,0|2,0,0]=4 2629 B17R1.7390 COc1c(cccc1OCCCOC(=O)C)Br 34a_100010234590_100000042594 [0,1,1,0,0,0|2,0,0]=4 2630 B17R1.7390 COc1c(cccc1OCCCOC(=O)C)Cl 34a_200009886253_100000042594 [0,1,1,0,0,0|2,0,0]=4 2631 B17R1.7390 COc1c(cccc1OCCCOC(=O)C)Cl 7a_200009886253_100000042594 [0,1,1,0,0,0|2,0,0]=4 2632 B17R1.7390 COc1c(cccc1OCCCSC(=O)C)Br 34a_100010234590_100000038929 [0,1,1,0,0,0|2,0,0]=4 2633 B17R1.7390 COc1c(cccc1OCCCSC(=O)C)Cl 34a_200009886253_100000038929 [0,1,1,0,0,0|2,0,0]=4 2634 B17R1.7390 COc1c(cccc1OCCCSC(=O)C)Cl 7a_200009886253_100000038929 [0,1,1,0,0,0|2,0,0]=4 2635 B17R1.27006 COc1ccccc1OCCCNS(=O)(=O)C 40a_100000752037_100000738038 [0,1,1,0,0,0|1,0,1]=4 2636 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)Br 34a_100000686866_100009817362 [0,1,1,0,0,0|2,0,0]=4 2637 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)C 34a_100011219253_100009817362 [0,1,1,0,0,0|2,0,0]=4 2638 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)C 7a_100011219253_100000735457 [0,1,1,0,0,0|2,0,0]=4 2639 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)Cl 34a_100009851661_100009817362 [0,1,1,0,0,0|2,0,0]=4 2640 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)Cl 7a_100009851661_100000735457 [0,1,1,0,0,0|2,0,0]=4 2641 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)F 34a_100000036725_100009817362 [0,1,1,0,0,0|2,0,0]=4 2642 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)F 7a_100000036725_100000735457 [0,1,1,0,0,0|2,0,0]=4 2643 B17R1.28458 COc1cccc(c1OCCCCC(=O)C)N 34a_100000123586_100009817362 [0,1,1,0,0,0|2,0,0]=4 2644 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)Br 34a_100000686866_100000042594 [0,1,1,0,0,0|2,0,0]=4 2645 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)C 34a_100011219253_100000042594 [0,1,1,0,0,0|2,0,0]=4 2646 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)C 7a_100011219253_100000042594 [0,1,1,0,0,0|2,0,0]=4 2647 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)Cl 34a_100009851661_100000042594 [0,1,1,0,0,0|2,0,0]=4 2648 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)Cl 7a_100009851661_100000042594 [0,1,1,0,0,0|2,0,0]=4 2649 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)F 34a_100000036725_100000042594 [0,1,1,0,0,0|2,0,0]=4 2650 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)F 7a_100000036725_100000042594 [0,1,1,0,0,0|2,0,0]=4 2651 B17R1.28458 COc1cccc(c1OCCCOC(=O)C)N 34a_100000123586_100000042594 [0,1,1,0,0,0|2,0,0]=4 2652 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)Br 34a_100000686866_100000038929 [0,1,1,0,0,0|2,0,0]=4 2653 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)C 34a_100011219253_100000038929 [0,1,1,0,0,0|2,0,0]=4 2654 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)C 7a_100011219253_100000038929 [0,1,1,0,0,0|2,0,0]=4 2655 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)Cl 34a_100009851661_100000038929 [0,1,1,0,0,0|2,0,0]=4 2656 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)Cl 7a_100009851661_100000038929 [0,1,1,0,0,0|2,0,0]=4 2657 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)F 34a_100000036725_100000038929 [0,1,1,0,0,0|2,0,0]=4 2658 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)F 7a_100000036725_100000038929 [0,1,1,0,0,0|2,0,0]=4 2659 B17R1.28458 COc1cccc(c1OCCCSC(=O)C)N 34a_100000123586_100000038929 [0,1,1,0,0,0|2,0,0]=4 2660 B17R1.347 C/C=C/c1ccccc1OCCCC(=O)NC 34a_200000189419_100000741757 [0,1,1,0,0,0|2,0,0]=4 2661 B17R1.347 C/C=C/c1ccccc1OCCCC(=O)NC 7a_200000189419_100000741757 [0,1,1,0,0,0|2,0,0]=4 2662 B17R1.347 C/C=C/c1ccccc1OCCOC(=O)NC 34a_200000189419_200011997002 [0,1,1,0,0,0|1,0,0]=3 2663 B17R1.347 C/C=C/c1ccccc1OCCOC(=O)NC 7a_200000189419_200011997002 [0,1,1,0,0,0|1,0,0]=3 2664 B17R1.347 C=CC(=O)OCCOc1ccccc1COC 34a_100011488565_100009813456 [0,1,1,0,0,0|1,0,1]=4 2665 B17R1.347 C=CC(=O)OCCOc1ccccc1COC 7a_100011488565_100009813456 [0,1,1,0,0,0|1,0,1]=4 2666 B17R1.347 C=CC(=O)OCCOc1ccccc1OCC 34a_100000211404_100009813456 [0,1,1,0,0,0|1,0,1]=4 2667 B17R1.347 C=CC(=O)OCCOc1ccccc1OCC 7a_100000211404_100009813456 [0,1,1,0,0,0|1,0,1]=4 2668 B17R1.347 C=CCc1ccccc1OCCOC(=O)NC 34a_100000211836_200011997002 [0,1,1,0,0,0|1,0,1]=4 2669 B17R1.347 C=CCc1ccccc1OCCOC(=O)NC 7a_100000211836_200011997002 [0,1,1,0,0,0|1,0,1]=4 2670 B17R1.347 CCCc1ccccc1NCCOC(=O)NC 34a_100000737634_200011997002 [0,1,1,0,0,0|2,0,0]=4 2671 B17R1.347 CCCc1ccccc1NCCOC(=O)NC 7a_100000737634_200011997002 [0,1,1,0,0,0|2,0,0]=4 2672 B17R1.347 CCCc1ccccc1OCCCC(=O)NC 34a_100011217252_100000741757 [0,1,1,0,0,0|2,0,0]=4 2673 B17R1.347 CCCc1ccccc1OCCCC(=O)NC 7a_100011217252_100000741757 [0,1,1,0,0,0|2,0,0]=4 2674 B17R1.347 CCCc1ccccc1OCCOC(=O)NC 34a_100011217252_200011997002 [0,1,1,0,0,0|1,0,0]=3 2675 B17R1.347 CCCc1ccccc1OCCOC(=O)NC 7a_100011217252_200011997002 [0,1,1,0,0,0|1,0,0]=3 2676 B17R1.347 CCNc1ccccc1OCCCC(=O)NC 34a_103624766699_100000741757 [0,1,1,0,0,0|2,0,0]=4 2677 B17R1.347 CCNc1ccccc1OCCCC(=O)NC 7a_103624766699_100000741757 [0,1,1,0,0,0|2,0,0]=4 2678 B17R1.347 CCNc1ccccc1OCCOC(=O)NC 34a_103624766699_200011997002 [0,1,1,0,0,0|1,0,0]=3 2679 B17R1.347 CCNc1ccccc1OCCOC(=O)NC 7a_103624766699_200011997002 [0,1,1,0,0,0|1,0,0]=3 2680 B17R1.347 CCNc1ccccc1SCCOC(=O)NC 62a_114873767003_200011997002 [0,1,1,0,0,0|1,1,0]=4 2681 B17R1.347 CCNc1ccccc1SCCOC(=O)NC 62a_200011997002_114873767003 [0,1,1,0,0,0|1,1,0]=4 2682 B17R1.347 CCOc1ccccc1CCCNC(=O)NC 2708a_100102657272_106744479500 [0,1,1,0,0,0|2,0,0]=4 2683 B17R1.347 CCOc1ccccc1CCCNC(=O)NC 2708a_106744479500_106832991635 [0,1,1,0,0,0|2,0,0]=4 2684 B17R1.347 CCOc1ccccc1CCCNC(=O)NC 273464a_100102657272_106744479500 [0,1,1,0,0,0|2,0,0]=4 2685 B17R1.347 CCOc1ccccc1CCCNC(=O)NC 273464a_106744479500_100102657272 [0,1,1,0,0,0|2,0,0]=4 2686 B17R1.347 CCOc1ccccc1CCCNC(=O)NC 512a_106744479500_100102657272 [0,1,1,0,0,0|2,0,0]=4 2687 B17R1.347 CCOc1ccccc1CCCNC(=O)NC 512a_106832991638_106744479500 [0,1,1,0,0,0|2,0,0]=4 2688 B17R1.347 CCOc1ccccc1NCCCC(=O)NC 34a_100000211218_100000741757 [0,1,1,0,0,0|2,0,0]=4 2689 B17R1.347 CCOc1ccccc1NCCOC(=O)NC 34a_100000211218_200011997002 [0,1,1,0,0,0|1,0,0]=3 2690 B17R1.347 CCOc1ccccc1OCCCC(=O)CC 1458a_100000182834_100000210202 [0,1,1,0,0,0|2,0,0]=4 2691 B17R1.347 CCOc1ccccc1OCCCC(=O)NC 11a_106832991635_100000182834 [0,1,1,0,0,0|1,0,0]=3 2692 B17R1.347 CCOc1ccccc1OCCCC(=O)NC 1626a_100102657272_100000182834 [0,1,1,0,0,0|1,0,0]=3 2693 B17R1.347 CCOc1ccccc1OCCCC(=O)NC 240690a_100102657272_100000182834 [0,1,1,0,0,0|1,0,0]=3 2694 B17R1.347 CCOc1ccccc1OCCCC(=O)NC 34a_100000211404_100000741757 [0,1,1,0,0,0|1,0,0]=3 2695 B17R1.347 CCOc1ccccc1OCCCC(=O)NC 527a_100102657272_100000182834 [0,1,1,0,0,0|1,0,0]=3 2696 B17R1.347 CCOc1ccccc1OCCCC(=O)NC 7a_100000211404_100000741757 [0,1,1,0,0,0|1,0,0]=3 2697 B17R1.347 CCOc1ccccc1OCCCC(=O)OC 34a_100000211404_100000742333 [0,1,1,0,0,0|2,0,0]=4 2698 B17R1.347 CCOc1ccccc1OCCCC(=O)OC 7a_100000211404_100011218270 [0,1,1,0,0,0|2,0,0]=4 2699 B17R1.347 CCOc1ccccc1OCCNC(=O)CC 11a_100011200955_100000210414 [0,1,1,0,0,0|2,0,0]=4 2700 B17R1.347 CCOc1ccccc1OCCNC(=O)CC 1626a_100011200955_100000210414 [0,1,1,0,0,0|2,0,0]=4 2701 B17R1.347 CCOc1ccccc1OCCNC(=O)CC 240690a_100011200955_100000210414 [0,1,1,0,0,0|2,0,0]=4 2702 B17R1.347 CCOc1ccccc1OCCNC(=O)CC 527a_100011200955_100000210414 [0,1,1,0,0,0|2,0,0]=4 2703 B17R1.347 CCOc1ccccc1OCCNC(=O)NC 2708a_100011200955_106832991635 [0,1,1,0,0,0|1,0,0]=3 2704 B17R1.347 CCOc1ccccc1OCCNC(=O)NC 2708a_100102657272_100011200955 [0,1,1,0,0,0|1,0,0]=3 2705 B17R1.347 CCOc1ccccc1OCCNC(=O)NC 273464a_100011200955_100102657272 [0,1,1,0,0,0|1,0,0]=3 2706 B17R1.347 CCOc1ccccc1OCCNC(=O)NC 273464a_100102657272_100011200955 [0,1,1,0,0,0|1,0,0]=3 2707 B17R1.347 CCOc1ccccc1OCCNC(=O)NC 512a_100011200955_100102657272 [0,1,1,0,0,0|1,0,0]=3 2708 B17R1.347 CCOc1ccccc1OCCNC(=O)NC 512a_106832991638_100011200955 [0,1,1,0,0,0|1,0,0]=3 2709 B17R1.347 CCOc1ccccc1OCCOC(=O)NC 34a_100000211404_200011997002 [0,1,1,0,0,0|0,0,0]=2 2710 B17R1.347 CCOc1ccccc1OCCOC(=O)NC 7a_100000211404_200011997002 [0,1,1,0,0,0|0,0,0]=2 2711 B17R1.347 CCOc1ccccc1SCCCC(=O)NC 62a_100000230754_100000741757 [0,1,1,0,0,0|1,1,0]=4 2712 B17R1.347 CCOc1ccccc1SCCCC(=O)NC 62a_100000741757_100000230754 [0,1,1,0,0,0|1,1,0]=4 2713 B17R1.347 CCOc1ccccc1SCCOC(=O)NC 62a_100000230754_200011997002 [0,1,1,0,0,0|0,1,0]=3 2714 B17R1.347 CCOc1ccccc1SCCOC(=O)NC 62a_200011997002_100000230754 [0,1,1,0,0,0|0,1,0]=3 2715 B17R1.347 CCOc1cccnc1SCCOC(=O)NC 62a_100011597540_200011997002 [0,1,1,0,0,0|1,1,0]=4 2716 B17R1.347 CCOc1cccnc1SCCOC(=O)NC 62a_200011997002_100011597540 [0,1,1,0,0,0|1,1,0]=4 2717 B17R1.347 CCOc1ncccc1OCCCC(=O)NC 34a_100011998697_100000741757 [0,1,1,0,0,0|2,0,0]=4 2718 B17R1.347 CCOc1ncccc1OCCOC(=O)NC 34a_100011998697_200011997002 [0,1,1,0,0,0|1,0,0]=3 2719 B17R1.347 CCOc1ncccc1SCCOC(=O)NC 62a_100011465154_200011997002 [0,1,1,0,0,0|1,1,0]=4 2720 B17R1.347 CCOc1ncccc1SCCOC(=O)NC 62a_200011997002_100011465154 [0,1,1,0,0,0|1,1,0]=4 2721 B17R1.347 CCSc1ccccc1NCCOC(=O)NC 34a_100011223125_200011997002 [0,1,1,0,0,0|1,1,0]=4 2722 B17R1.347 CCSc1ccccc1SCCOC(=O)NC 62a_100000230856_200011997002 [0,1,1,0,0,0|0,2,0]=4 2723 B17R1.347 CCSc1ccccc1SCCOC(=O)NC 62a_200011997002_100000230856 [0,1,1,0,0,0|0,2,0]=4 2724 B17R1.347 CNC(=O)CCCOc1ccccc1CCBr 34a_100000722297_100000741757 [0,1,1,0,0,0|2,0,0]=4 2725 B17R1.347 CNC(=O)CCCOc1ccccc1CCBr 7a_100000722297_100000741757 [0,1,1,0,0,0|2,0,0]=4 2726 B17R1.347 CNC(=O)CCCOc1ccccc1CCN 34a_100011207237_100000741757 [0,1,1,0,0,0|2,0,0]=4 2727 B17R1.347 CNC(=O)CCCOc1ccccc1CCO 34a_100000719421_100000741757 [0,1,1,0,0,0|2,0,0]=4 2728 B17R1.347 CNC(=O)CCCOc1ccccc1CCO 7a_100000719421_100000741757 [0,1,1,0,0,0|2,0,0]=4 2729 B17R1.347 CNC(=O)CCCOc1ccccc1COC 34a_100011488565_100000741757 [0,1,1,0,0,0|1,0,0]=3 2730 B17R1.347 CNC(=O)CCCOc1ccccc1COC 7a_100011488565_100000741757 [0,1,1,0,0,0|1,0,0]=3 2731 B17R1.347 CNC(=O)CCCSc1ccccc1COC 62a_100000741757_100011493684 [0,1,1,0,0,0|1,1,0]=4 2732 B17R1.347 CNC(=O)CCCSc1ccccc1COC 62a_100011493684_100000741757 [0,1,1,0,0,0|1,1,0]=4 2733 B17R1.347 CNC(=O)OCCNc1ccccc1CCO 34a_100011215289_200011997002 [0,1,1,0,0,0|2,0,0]=4 2734 B17R1.347 CNC(=O)OCCOc1ccccc1CC#N 34a_100000043107_200011997002 [0,1,1,0,0,0|1,0,1]=4 2735 B17R1.347 CNC(=O)OCCOc1ccccc1CC#N 7a_100000043107_200011997002 [0,1,1,0,0,0|1,0,1]=4 2736 B17R1.347 CNC(=O)OCCOc1ccccc1CCBr 34a_100000722297_200011997002 [0,1,1,0,0,0|1,0,0]=3 2737 B17R1.347 CNC(=O)OCCOc1ccccc1CCBr 7a_100000722297_200011997002 [0,1,1,0,0,0|1,0,0]=3 2738 B17R1.347 CNC(=O)OCCOc1ccccc1CCN 34a_100011207237_200011997002 [0,1,1,0,0,0|1,0,0]=3 2739 B17R1.347 CNC(=O)OCCOc1ccccc1CCO 34a_100000719421_200011997002 [0,1,1,0,0,0|1,0,0]=3 2740 B17R1.347 CNC(=O)OCCOc1ccccc1CCO 7a_100000719421_200011997002 [0,1,1,0,0,0|1,0,0]=3 2741 B17R1.347 CNC(=O)OCCOc1ccccc1COC 34a_100011488565_200011997002 [0,1,1,0,0,0|0,0,0]=2 2742 B17R1.347 CNC(=O)OCCOc1ccccc1COC 7a_100011488565_200011997002 [0,1,1,0,0,0|0,0,0]=2 2743 B17R1.347 CNC(=O)OCCSc1ccccc1CCN 62a_100000747383_200011997002 [0,1,1,0,0,0|1,1,0]=4 2744 B17R1.347 CNC(=O)OCCSc1ccccc1CCN 62a_200011997002_100000747383 [0,1,1,0,0,0|1,1,0]=4 2745 B17R1.347 CNC(=O)OCCSc1ccccc1CCO 62a_100000731337_200011997002 [0,1,1,0,0,0|1,1,0]=4 2746 B17R1.347 CNC(=O)OCCSc1ccccc1CCO 62a_200011997002_100000731337 [0,1,1,0,0,0|1,1,0]=4 2747 B17R1.347 CNC(=O)OCCSc1ccccc1COC 62a_100011493684_200011997002 [0,1,1,0,0,0|0,1,0]=3 2748 B17R1.347 CNC(=O)OCCSc1ccccc1COC 62a_200011997002_100011493684 [0,1,1,0,0,0|0,1,0]=3 2749 B17R1.347 CNC(=O)OCCSc1ccccc1CSC 62a_100000148299_200011997002 [0,1,1,0,0,0|0,2,0]=4 2750 B17R1.347 CNC(=O)OCCSc1ccccc1CSC 62a_200011997002_100000148299 [0,1,1,0,0,0|0,2,0]=4 2751 B17R1.347 CNCc1ccccc1OCCCC(=O)NC 34a_100015189988_100000741757 [0,1,1,0,0,0|2,0,0]=4 2752 B17R1.347 CNCc1ccccc1OCCOC(=O)NC 34a_100015189988_200011997002 [0,1,1,0,0,0|1,0,0]=3 2753 B17R1.347 CNCc1ccccc1SCCOC(=O)NC 62a_100000184654_200011997002 [0,1,1,0,0,0|1,1,0]=4 2754 B17R1.347 CNCc1ccccc1SCCOC(=O)NC 62a_200011997002_100000184654 [0,1,1,0,0,0|1,1,0]=4 2755 B17R1.347 COCc1ccccc1OCCCC(=O)OC 34a_100011488565_100000742333 [0,1,1,0,0,0|2,0,0]=4 2756 B17R1.347 COCc1ccccc1OCCCC(=O)OC 7a_100011488565_100011218270 [0,1,1,0,0,0|2,0,0]=4 2757 B17R1.1661 CC#CC(=O)CCCOc1ccccc1OC 1458a_100000763181_100011259231 [0,1,1,0,0,0|2,0,0]=4 2758 B17R1.1661 CC=CC(=O)CCCOc1ccccc1OC 1458a_100000210699_100011259231 [0,1,1,0,0,0|2,0,0]=4 2759 B17R1.1661 CC=CC(=O)NCCOc1ccccc1OC 11a_100000683763_100000210699 [0,1,1,0,0,0|2,0,0]=4 2760 B17R1.1661 CC=CC(=O)NCCOc1ccccc1OC 1626a_100000683763_100000210699 [0,1,1,0,0,0|2,0,0]=4 2761 B17R1.1661 CC=CC(=O)NCCOc1ccccc1OC 240690a_100000683763_100000210699 [0,1,1,0,0,0|2,0,0]=4 2762 B17R1.1661 CCCC(=O)CCCOc1ccccc1OC 1458a_100000211992_100011259231 [0,1,1,0,0,0|2,0,0]=4 2763 B17R1.1661 CCCC(=O)NCCOc1ccccc1OC 11a_100000683763_100000211992 [0,1,1,0,0,0|2,0,0]=4 2764 B17R1.1661 CCCC(=O)NCCOc1ccccc1OC 1626a_100000683763_100000211992 [0,1,1,0,0,0|2,0,0]=4 2765 B17R1.1661 CCCC(=O)NCCOc1ccccc1OC 240690a_100000683763_100000211992 [0,1,1,0,0,0|2,0,0]=4 2766 B17R1.1661 CCCC(=O)NCCOc1ccccc1OC 527a_100000683763_100000211992 [0,1,1,0,0,0|2,0,0]=4 2767 B17R1.1661 CCNC(=O)NCCOc1ccccc1OC 2708a_100000683763_100015525214 [0,1,1,0,0,0|1,0,0]=3 2768 B17R1.1661 CCNC(=O)NCCOc1ccccc1OC 2708a_100015525214_100000683763 [0,1,1,0,0,0|1,0,0]=3 2769 B17R1.1661 CCNC(=O)NCCOc1ccccc1OC 273464a_100000683763_100015525214 [0,1,1,0,0,0|1,0,0]=3 2770 B17R1.1661 CCNC(=O)NCCOc1ccccc1OC 273464a_100015525214_100000683763 [0,1,1,0,0,0|1,0,0]=3 2771 B17R1.1661 CCNC(=O)NCCOc1ccccc1OC 512a_100000683763_100015525214 [0,1,1,0,0,0|1,0,0]=3 2772 B17R1.1661 CCNC(=O)NCCOc1ccccc1OC 512a_100015525214_100000683763 [0,1,1,0,0,0|1,0,0]=3 2773 B17R1.1661 CCNC(=O)NCCOc1ccccc1SC 2708a_100011893647_100015525214 [0,1,1,0,0,0|1,1,0]=4 2774 B17R1.1661 CCNC(=O)NCCOc1ccccc1SC 2708a_100015525214_100011893647 [0,1,1,0,0,0|1,1,0]=4 2775 B17R1.1661 CCNC(=O)NCCOc1ccccc1SC 273464a_100011893647_100015525214 [0,1,1,0,0,0|1,1,0]=4 2776 B17R1.1661 CCNC(=O)NCCOc1ccccc1SC 273464a_100015525214_100011893647 [0,1,1,0,0,0|1,1,0]=4 2777 B17R1.1661 CCNC(=O)NCCOc1ccccc1SC 512a_100011893647_100015525214 [0,1,1,0,0,0|1,1,0]=4 2778 B17R1.1661 CCNC(=O)NCCOc1ccccc1SC 512a_100015525214_100011893647 [0,1,1,0,0,0|1,1,0]=4 2779 B17R1.1661 CCOC(=O)CCCOc1ccccc1OC 34a_100000210385_100009991533 [0,1,1,0,0,0|2,0,0]=4 2780 B17R1.1661 CNNC(=O)NCCOc1ccccc1OC 273464a_100000683763_100016993582 [0,1,1,0,0,0|1,0,0]=3 2781 B17R1.1661 CNNC(=O)NCCOc1ccccc1OC 512a_100000683763_100016993582 [0,1,1,0,0,0|1,0,0]=3 2782 B17R1.1661 CNNC(=O)NCCOc1ccccc1OC 512a_100016993582_100000683763 [0,1,1,0,0,0|1,0,0]=3 2783 B17R1.1661 CNNC(=O)NCCOc1ccccc1SC 273464a_100011893647_100016993582 [0,1,1,0,0,0|1,1,0]=4 2784 B17R1.1661 CNNC(=O)NCCOc1ccccc1SC 512a_100011893647_100016993582 [0,1,1,0,0,0|1,1,0]=4 2785 B17R1.1661 CNNC(=O)NCCOc1ccccc1SC 512a_100016993582_100011893647 [0,1,1,0,0,0|1,1,0]=4 2786 B17R1.1661 COCC(=O)CCCOc1ccccc1OC 1458a_100000210968_100011259231 [0,1,1,0,0,0|2,0,0]=4 2787 B17R1.1661 COCC(=O)NCCOc1ccccc1OC 11a_100000683763_100000210968 [0,1,1,0,0,0|2,0,0]=4 2788 B17R1.1661 COCC(=O)NCCOc1ccccc1OC 1626a_100000683763_100000210968 [0,1,1,0,0,0|2,0,0]=4 2789 B17R1.1661 COCC(=O)NCCOc1ccccc1OC 240690a_100000683763_100000210968 [0,1,1,0,0,0|2,0,0]=4 2790 B17R1.1661 COCC(=O)NCCOc1ccccc1OC 527a_100000683763_100000210968 [0,1,1,0,0,0|2,0,0]=4 2791 B17R1.1661 COc1ccccc1OCCCC(=O)CCO 1458a_100011216618_100011259231 [0,1,1,0,0,0|2,0,0]=4 2792 B17R1.1661 COc1ccccc1OCCCC(=O)CSC 1458a_100000184570_100011259231 [0,1,1,0,0,0|2,0,0]=4 2793 B17R1.1661 COc1ccccc1OCCNC(=O)CCO 240690a_100000683763_100011216618 [0,1,1,0,0,0|2,0,0]=4 2794 B17R1.1661 COc1ccccc1OCCNC(=O)CSC 11a_100000683763_100000184570 [0,1,1,0,0,0|2,0,0]=4 2795 B17R1.1661 COc1ccccc1OCCNC(=O)CSC 1626a_100000683763_100000184570 [0,1,1,0,0,0|2,0,0]=4 2796 B17R1.1661 COc1ccccc1OCCNC(=O)CSC 240690a_100000683763_100000184570 [0,1,1,0,0,0|2,0,0]=4 2797 B17R1.1661 COc1ccccc1OCCNC(=O)CSC 527a_100000683763_100000184570 [0,1,1,0,0,0|2,0,0]=4 2798 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)Br 34a_100009816560_100009813456 [0,1,1,0,0,0|1,0,1]=4 2799 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)Br 7a_100009816560_100009813456 [0,1,1,0,0,0|1,0,1]=4 2800 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)C 34a_100011216497_100009813456 [0,1,1,0,0,0|1,0,1]=4 2801 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)C 7a_100011216497_100009813456 [0,1,1,0,0,0|1,0,1]=4 2802 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)Cl 34a_100000101779_100009813456 [0,1,1,0,0,0|1,0,1]=4 2803 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)Cl 7a_100000101779_100009813456 [0,1,1,0,0,0|1,0,1]=4 2804 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)F 34a_100000034962_100009813456 [0,1,1,0,0,0|1,0,1]=4 2805 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)F 7a_100000034962_100009813456 [0,1,1,0,0,0|1,0,1]=4 2806 B17R1.4633 C=CC(=O)OCCOc1cc(ccc1OC)N 34a_100000211920_100009813456 [0,1,1,0,0,0|1,0,1]=4 2807 B17R1.4633 CCc1ccc(cc1NCCOC(=O)NC)Br 34a_100012354963_200011997002 [0,1,1,0,0,0|2,0,0]=4 2808 B17R1.4633 CCc1ccc(cc1NCCOC(=O)NC)Br 7a_100012354963_200011997002 [0,1,1,0,0,0|2,0,0]=4 2809 B17R1.4633 CCc1ccc(cc1NCCOC(=O)NC)Cl 34a_200012281948_200011997002 [0,1,1,0,0,0|2,0,0]=4 2810 B17R1.4633 CCc1ccc(cc1NCCOC(=O)NC)Cl 7a_200012281948_200011997002 [0,1,1,0,0,0|2,0,0]=4 2811 B17R1.4633 CNC(=O)CCCNc1cc(ccc1OC)Br 34a_100000743470_100000741757 [0,1,1,0,0,0|2,0,0]=4 2812 B17R1.4633 CNC(=O)CCCNc1cc(ccc1OC)C 2230a_100000210980_100000741757 [0,1,1,0,0,0|2,0,0]=4 2813 B17R1.4633 CNC(=O)CCCNc1cc(ccc1OC)C 34a_100000210980_100000741757 [0,1,1,0,0,0|2,0,0]=4 2814 B17R1.4633 CNC(=O)CCCNc1cc(ccc1OC)Cl 34a_100000182114_100000741757 [0,1,1,0,0,0|2,0,0]=4 2815 B17R1.4633 CNC(=O)CCCNc1cc(ccc1OC)F 34a_100000757179_100000741757 [0,1,1,0,0,0|2,0,0]=4 2816 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)Br 34a_100009816560_100000741757 [0,1,1,0,0,0|1,0,0]=3 2817 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)Br 7a_100009816560_100000741757 [0,1,1,0,0,0|1,0,0]=3 2818 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)C 34a_100011216497_100000741757 [0,1,1,0,0,0|1,0,0]=3 2819 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)C 7a_100011216497_100000741757 [0,1,1,0,0,0|1,0,0]=3 2820 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)Cl 34a_100000101779_100000741757 [0,1,1,0,0,0|1,0,0]=3 2821 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)Cl 7a_100000101779_100000741757 [0,1,1,0,0,0|1,0,0]=3 2822 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)F 34a_100000034962_100000741757 [0,1,1,0,0,0|1,0,0]=3 2823 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)F 7a_100000034962_100000741757 [0,1,1,0,0,0|1,0,0]=3 2824 B17R1.4633 CNC(=O)CCCOc1cc(ccc1OC)N 34a_100000211920_100000741757 [0,1,1,0,0,0|1,0,0]=3 2825 B17R1.4633 CNC(=O)CCCOc1cc(cnc1OC)Br 34a_100010135713_100000741757 [0,1,1,0,0,0|2,0,0]=4 2826 B17R1.4633 CNC(=O)CCCOc1cc(ncc1OC)Br 34a_100010264082_100000741757 [0,1,1,0,0,0|2,0,0]=4 2827 B17R1.4633 CNC(=O)CCCOc1cc(ncc1OC)Cl 34a_100009849459_100000741757 [0,1,1,0,0,0|2,0,0]=4 2828 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)Br 62a_100000741757_100012351588 [0,1,1,0,0,0|1,1,0]=4 2829 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)Br 62a_100012351588_100000741757 [0,1,1,0,0,0|1,1,0]=4 2830 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)C 62a_100000186399_100000741757 [0,1,1,0,0,0|1,1,0]=4 2831 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)C 62a_100000741757_100000186399 [0,1,1,0,0,0|1,1,0]=4 2832 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)Cl 62a_100000741757_100011215930 [0,1,1,0,0,0|1,1,0]=4 2833 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)Cl 62a_100011215930_100000741757 [0,1,1,0,0,0|1,1,0]=4 2834 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)F 62a_100000171694_100000741757 [0,1,1,0,0,0|1,1,0]=4 2835 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)F 62a_100000741757_100000171694 [0,1,1,0,0,0|1,1,0]=4 2836 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)N 62a_100000741757_100011356947 [0,1,1,0,0,0|1,1,0]=4 2837 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)N 62a_100011356947_100000741757 [0,1,1,0,0,0|1,1,0]=4 2838 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)O 62a_100000741757_100010234764 [0,1,1,0,0,0|1,1,0]=4 2839 B17R1.4633 CNC(=O)CCCSc1cc(ccc1OC)O 62a_100010234764_100000741757 [0,1,1,0,0,0|1,1,0]=4 2840 B17R1.4633 CNC(=O)OCCNc1cc(ccc1OC)Br 34a_100000743470_200011997002 [0,1,1,0,0,0|1,0,0]=3 2841 B17R1.4633 CNC(=O)OCCNc1cc(ccc1OC)C 34a_100000210980_200011997002 [0,1,1,0,0,0|1,0,0]=3 2842 B17R1.4633 CNC(=O)OCCNc1cc(ccc1OC)Cl 34a_100000182114_200011997002 [0,1,1,0,0,0|1,0,0]=3 2843 B17R1.4633 CNC(=O)OCCNc1cc(ccc1OC)F 34a_100000757179_200011997002 [0,1,1,0,0,0|1,0,0]=3 2844 B17R1.4633 CNC(=O)OCCNc1cc(ccc1SC)Cl 34a_100000745667_200011997002 [0,1,1,0,0,0|1,1,0]=4 2845 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)Br 34a_100011934713_200011997002 [0,1,1,0,0,0|2,0,0]=4 2846 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)Br 7a_100011934713_200011997002 [0,1,1,0,0,0|2,0,0]=4 2847 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)C 34a_100011640519_200011997002 [0,1,1,0,0,0|2,0,0]=4 2848 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)C 7a_100011640519_200011997002 [0,1,1,0,0,0|2,0,0]=4 2849 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)Cl 34a_100000688488_200011997002 [0,1,1,0,0,0|2,0,0]=4 2850 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)Cl 7a_100000688488_200011997002 [0,1,1,0,0,0|2,0,0]=4 2851 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)F 34a_100012185923_200011997002 [0,1,1,0,0,0|2,0,0]=4 2852 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)F 7a_100012185923_200011997002 [0,1,1,0,0,0|2,0,0]=4 2853 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)N 34a_100000094571_200011997002 [0,1,1,0,0,0|2,0,0]=4 2854 B17R1.4633 CNC(=O)OCCOc1cc(ccc1C#N)N 7a_100000094571_200011997002 [0,1,1,0,0,0|2,0,0]=4 2855 B17R1.4633 CNC(=O)OCCOc1cc(ccc1CO)Br 34a_100000071718_200011997002 [0,1,1,0,0,0|2,0,0]=4 2856 B17R1.4633 CNC(=O)OCCOc1cc(ccc1CO)Br 7a_100000071718_200011997002 [0,1,1,0,0,0|2,0,0]=4 2857 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)Br 34a_100009816560_200011997002 [0,1,1,0,0,0|0,0,0]=2 2858 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)Br 7a_100009816560_200011997002 [0,1,1,0,0,0|0,0,0]=2 2859 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)C 34a_100011216497_200011997002 [0,1,1,0,0,0|0,0,0]=2 2860 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)C 7a_100011216497_200011997002 [0,1,1,0,0,0|0,0,0]=2 2861 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)Cl 34a_100000101779_200011997002 [0,1,1,0,0,0|0,0,0]=2 2862 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)Cl 7a_100000101779_200011997002 [0,1,1,0,0,0|0,0,0]=2 2863 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)F 34a_100000034962_200011997002 [0,1,1,0,0,0|0,0,0]=2 2864 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)F 7a_100000034962_200011997002 [0,1,1,0,0,0|0,0,0]=2 2865 B17R1.4633 CNC(=O)OCCOc1cc(ccc1OC)N 34a_100000211920_200011997002 [0,1,1,0,0,0|0,0,0]=2 2866 B17R1.4633 CNC(=O)OCCOc1cc(cnc1OC)Br 34a_100010135713_200011997002 [0,1,1,0,0,0|1,0,0]=3 2867 B17R1.4633 CNC(=O)OCCOc1cc(ncc1OC)Br 34a_100010264082_200011997002 [0,1,1,0,0,0|1,0,0]=3 2868 B17R1.4633 CNC(=O)OCCOc1cc(ncc1OC)Cl 34a_100009849459_200011997002 [0,1,1,0,0,0|1,0,0]=3 2869 B17R1.4633 CNC(=O)OCCSc1cc(=O)[nH]cc1OC 62a_100121573661_200011997002 [0,1,1,0,0,0|1,1,0]=4 2870 B17R1.4633 CNC(=O)OCCSc1cc(=O)[nH]cc1OC 62a_200011997002_100121573661 [0,1,1,0,0,0|1,1,0]=4 2871 B17R1.4633 CNC(=O)OCCSc1cc(ccc1NC)C 62a_100000221369_200011997002 [0,1,1,0,0,0|1,1,0]=4 2872 B17R1.4633 CNC(=O)OCCSc1cc(ccc1NC)C 62a_200011997002_100000221369 [0,1,1,0,0,0|1,1,0]=4 2873 B17R1.4633 CNC(=O)OCCSc1cc(ccc1NC)F 62a_100011246292_200011997002 [0,1,1,0,0,0|1,1,0]=4 2874 B17R1.4633 CNC(=O)OCCSc1cc(ccc1NC)F 62a_200011997002_100011246292 [0,1,1,0,0,0|1,1,0]=4 2875 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)Br 62a_100012351588_200011997002 [0,1,1,0,0,0|0,1,0]=3 2876 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)Br 62a_200011997002_100012351588 [0,1,1,0,0,0|0,1,0]=3 2877 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)C 62a_100000186399_200011997002 [0,1,1,0,0,0|0,1,0]=3 2878 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)C 62a_200011997002_100000186399 [0,1,1,0,0,0|0,1,0]=3 2879 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)Cl 62a_100011215930_200011997002 [0,1,1,0,0,0|0,1,0]=3 2880 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)Cl 62a_200011997002_100011215930 [0,1,1,0,0,0|0,1,0]=3 2881 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)F 62a_100000171694_200011997002 [0,1,1,0,0,0|0,1,0]=3 2882 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)F 62a_200011997002_100000171694 [0,1,1,0,0,0|0,1,0]=3 2883 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)N 62a_100011356947_200011997002 [0,1,1,0,0,0|0,1,0]=3 2884 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)N 62a_200011997002_100011356947 [0,1,1,0,0,0|0,1,0]=3 2885 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)O 62a_100010234764_200011997002 [0,1,1,0,0,0|0,1,0]=3 2886 B17R1.4633 CNC(=O)OCCSc1cc(ccc1OC)O 62a_200011997002_100010234764 [0,1,1,0,0,0|0,1,0]=3 2887 B17R1.4633 CNC(=O)OCCSc1cc(ccc1SC)C 62a_200010201864_200011997002 [0,1,1,0,0,0|0,2,0]=4 2888 B17R1.4633 CNC(=O)OCCSc1cc(ccc1SC)C 62a_200011997002_200010201864 [0,1,1,0,0,0|0,2,0]=4 2889 B17R1.4633 CNC(=O)OCCSc1cc(ccc1SC)F 62a_100009817003_200011997002 [0,1,1,0,0,0|0,2,0]=4 2890 B17R1.4633 CNC(=O)OCCSc1cc(ccc1SC)F 62a_200011997002_100009817003 [0,1,1,0,0,0|0,2,0]=4 2891 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)Br 62a_100009814608_200011997002 [0,1,1,0,0,0|1,1,0]=4 2892 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)Br 62a_200011997002_100009814608 [0,1,1,0,0,0|1,1,0]=4 2893 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)C 62a_100012353929_200011997002 [0,1,1,0,0,0|1,1,0]=4 2894 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)C 62a_200011997002_100012353929 [0,1,1,0,0,0|1,1,0]=4 2895 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)F 62a_100009828472_200011997002 [0,1,1,0,0,0|1,1,0]=4 2896 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)F 62a_200011997002_100009828472 [0,1,1,0,0,0|1,1,0]=4 2897 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)N 62a_100012351452_200011997002 [0,1,1,0,0,0|1,1,0]=4 2898 B17R1.4633 CNC(=O)OCCSc1cc(cnc1OC)N 62a_200011997002_100012351452 [0,1,1,0,0,0|1,1,0]=4 2899 B17R1.4633 CNC(=O)OCCSc1cc(ncc1OC)C 62a_100010109759_200011997002 [0,1,1,0,0,0|1,1,0]=4 2900 B17R1.4633 CNC(=O)OCCSc1cc(ncc1OC)C 62a_200011997002_100010109759 [0,1,1,0,0,0|1,1,0]=4 2901 B17R1.4633 CNC(=O)OCCSc1nc(ccc1OC)C 62a_100009820875_200011997002 [0,1,1,0,0,0|1,1,0]=4 2902 B17R1.4633 CNC(=O)OCCSc1nc(ccc1OC)C 62a_200011997002_100009820875 [0,1,1,0,0,0|1,1,0]=4 2903 B17R1.4633 CNC(=O)OCCSc1nc(ccc1OC)N 62a_100010172607_200011997002 [0,1,1,0,0,0|1,1,0]=4 2904 B17R1.4633 CNC(=O)OCCSc1nc(ccc1OC)N 62a_200011997002_100010172607 [0,1,1,0,0,0|1,1,0]=4 2905 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)Br 34a_100009816560_100000742333 [0,1,1,0,0,0|2,0,0]=4 2906 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)Br 7a_100009816560_100011218270 [0,1,1,0,0,0|2,0,0]=4 2907 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)C 34a_100011216497_100000742333 [0,1,1,0,0,0|2,0,0]=4 2908 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)C 7a_100011216497_100011218270 [0,1,1,0,0,0|2,0,0]=4 2909 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)Cl 34a_100000101779_100000742333 [0,1,1,0,0,0|2,0,0]=4 2910 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)Cl 7a_100000101779_100011218270 [0,1,1,0,0,0|2,0,0]=4 2911 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)F 34a_100000034962_100000742333 [0,1,1,0,0,0|2,0,0]=4 2912 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)F 7a_100000034962_100011218270 [0,1,1,0,0,0|2,0,0]=4 2913 B17R1.4633 COC(=O)CCCOc1cc(ccc1OC)N 34a_100000211920_100000742333 [0,1,1,0,0,0|2,0,0]=4 2914 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)Br 34a_100000694246_100009813456 [0,1,1,0,0,0|1,0,1]=4 2915 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)Br 7a_100000694246_100009813456 [0,1,1,0,0,0|1,0,1]=4 2916 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)C 34a_100000186466_100009813456 [0,1,1,0,0,0|1,0,1]=4 2917 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)Cl 34a_100000033002_100009813456 [0,1,1,0,0,0|1,0,1]=4 2918 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)F 34a_100000036057_100009813456 [0,1,1,0,0,0|1,0,1]=4 2919 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)F 7a_100000036057_100009813456 [0,1,1,0,0,0|1,0,1]=4 2920 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)I 34a_100000049635_100009813456 [0,1,1,0,0,0|1,0,1]=4 2921 B17R1.5319 C=CC(=O)OCCOc1ccc(cc1OC)N 34a_100000726020_100009813456 [0,1,1,0,0,0|1,0,1]=4 2922 B17R1.5319 CCc1cc(ccc1NCCOC(=O)NC)Br 34a_100000686106_200011997002 [0,1,1,0,0,0|2,0,0]=4 2923 B17R1.5319 CCc1cc(ccc1NCCOC(=O)NC)Br 7a_100000686106_200011997002 [0,1,1,0,0,0|2,0,0]=4 2924 B17R1.5319 CCc1cc(ccc1NCCOC(=O)NC)Cl 34a_100012017146_200011997002 [0,1,1,0,0,0|2,0,0]=4 2925 B17R1.5319 CCc1cc(ccc1NCCOC(=O)NC)Cl 7a_100012017146_200011997002 [0,1,1,0,0,0|2,0,0]=4 2926 B17R1.5319 CCc1cc(ccc1NCCOC(=O)NC)I 34a_100000014069_200011997002 [0,1,1,0,0,0|2,0,0]=4 2927 B17R1.5319 CCc1cc(ccc1NCCOC(=O)NC)I 7a_100000014069_200011997002 [0,1,1,0,0,0|2,0,0]=4 2928 B17R1.5319 CCc1cc(ccc1OCCCC(=O)NC)Br 34a_100012338938_100000741757 [0,1,1,0,0,0|2,0,0]=4 2929 B17R1.5319 CCc1cc(ccc1OCCCC(=O)NC)Br 7a_100012338938_100000741757 [0,1,1,0,0,0|2,0,0]=4 2930 B17R1.5319 CCc1cc(ccc1OCCCC(=O)NC)C 34a_100009844793_100000741757 [0,1,1,0,0,0|2,0,0]=4 2931 B17R1.5319 CCc1cc(ccc1OCCCC(=O)NC)C 7a_100009844793_100000741757 [0,1,1,0,0,0|2,0,0]=4 2932 B17R1.5319 CCc1cc(ccc1OCCCC(=O)NC)F 34a_200000035566_100000741757 [0,1,1,0,0,0|2,0,0]=4 2933 B17R1.5319 CCc1cc(ccc1OCCCC(=O)NC)F 7a_200000035566_100000741757 [0,1,1,0,0,0|2,0,0]=4 2934 B17R1.5319 CCc1cc(ccc1OCCOC(=O)NC)Br 34a_100012338938_200011997002 [0,1,1,0,0,0|1,0,0]=3 2935 B17R1.5319 CCc1cc(ccc1OCCOC(=O)NC)Br 7a_100012338938_200011997002 [0,1,1,0,0,0|1,0,0]=3 2936 B17R1.5319 CCc1cc(ccc1OCCOC(=O)NC)C 34a_100009844793_200011997002 [0,1,1,0,0,0|1,0,0]=3 2937 B17R1.5319 CCc1cc(ccc1OCCOC(=O)NC)C 7a_100009844793_200011997002 [0,1,1,0,0,0|1,0,0]=3 2938 B17R1.5319 CCc1cc(ccc1OCCOC(=O)NC)F 34a_200000035566_200011997002 [0,1,1,0,0,0|1,0,0]=3 2939 B17R1.5319 CCc1cc(ccc1OCCOC(=O)NC)F 7a_200000035566_200011997002 [0,1,1,0,0,0|1,0,0]=3 2940 B17R1.5319 CCc1cc(ccc1SCCOC(=O)NC)Br 62a_100011216195_200011997002 [0,1,1,0,0,0|1,1,0]=4 2941 B17R1.5319 CCc1cc(ccc1SCCOC(=O)NC)Br 62a_200011997002_100011216195 [0,1,1,0,0,0|1,1,0]=4 2942 B17R1.5319 CCc1cc(ccc1SCCOC(=O)NC)N 62a_100010109747_200011997002 [0,1,1,0,0,0|1,1,0]=4 2943 B17R1.5319 CCc1cc(ccc1SCCOC(=O)NC)N 62a_200011997002_100010109747 [0,1,1,0,0,0|1,1,0]=4 2944 B17R1.5319 CCc1nc(ccc1OCCOC(=O)NC)C 34a_100000718140_200011997002 [0,1,1,0,0,0|2,0,0]=4 2945 B17R1.5319 CCc1nc(ccc1OCCOC(=O)NC)C 7a_100000718140_200011997002 [0,1,1,0,0,0|2,0,0]=4 2946 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)Br 34a_100011279103_100000741757 [0,1,1,0,0,0|2,0,0]=4 2947 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)C 2230a_100000746441_100000741757 [0,1,1,0,0,0|2,0,0]=4 2948 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)C 34a_100000746441_100000741757 [0,1,1,0,0,0|2,0,0]=4 2949 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)Cl 34a_100000707585_100000741757 [0,1,1,0,0,0|2,0,0]=4 2950 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)F 34a_100000737216_100000741757 [0,1,1,0,0,0|2,0,0]=4 2951 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)I 34a_100015196925_100000741757 [0,1,1,0,0,0|2,0,0]=4 2952 B17R1.5319 CNC(=O)CCCNc1ccc(cc1OC)O 34a_100015326901_100000741757 [0,1,1,0,0,0|2,0,0]=4 2953 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)Br 34a_100000694246_100000741757 [0,1,1,0,0,0|1,0,0]=3 2954 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)Br 7a_100000694246_100000741757 [0,1,1,0,0,0|1,0,0]=3 2955 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)C 34a_100000186466_100000741757 [0,1,1,0,0,0|1,0,0]=3 2956 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)Cl 34a_100000033002_100000741757 [0,1,1,0,0,0|1,0,0]=3 2957 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)F 34a_100000036057_100000741757 [0,1,1,0,0,0|1,0,0]=3 2958 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)F 7a_100000036057_100000741757 [0,1,1,0,0,0|1,0,0]=3 2959 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)I 34a_100000049635_100000741757 [0,1,1,0,0,0|1,0,0]=3 2960 B17R1.5319 CNC(=O)CCCOc1ccc(cc1OC)N 34a_100000726020_100000741757 [0,1,1,0,0,0|1,0,0]=3 2961 B17R1.5319 CNC(=O)CCCOc1ccc(nc1OC)Br 34a_100010893133_100000741757 [0,1,1,0,0,0|2,0,0]=4 2962 B17R1.5319 CNC(=O)CCCOc1ncc(cc1OC)Cl 34a_200009845368_100000741757 [0,1,1,0,0,0|2,0,0]=4 2963 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)Br 62a_100000741757_100010245111 [0,1,1,0,0,0|1,1,0]=4 2964 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)Br 62a_100010245111_100000741757 [0,1,1,0,0,0|1,1,0]=4 2965 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)C 62a_100000741757_100010200004 [0,1,1,0,0,0|1,1,0]=4 2966 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)C 62a_100010200004_100000741757 [0,1,1,0,0,0|1,1,0]=4 2967 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)Cl 62a_100000050115_100000741757 [0,1,1,0,0,0|1,1,0]=4 2968 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)Cl 62a_100000741757_100000050115 [0,1,1,0,0,0|1,1,0]=4 2969 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)F 62a_100000741757_100000757151 [0,1,1,0,0,0|1,1,0]=4 2970 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)F 62a_100000757151_100000741757 [0,1,1,0,0,0|1,1,0]=4 2971 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)N 62a_100000741757_100000765947 [0,1,1,0,0,0|1,1,0]=4 2972 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)N 62a_100000765947_100000741757 [0,1,1,0,0,0|1,1,0]=4 2973 B17R1.5319 CNC(=O)CCCSc1ccc(cc1OC)O 62a_100000741757_100011827694 [0,1,1,0,0,0|1,1,0]=4 2974 B17R1.5319 CNC(=O)OCCNc1ccc(cc1OC)Br 34a_100011279103_200011997002 [0,1,1,0,0,0|1,0,0]=3 2975 B17R1.5319 CNC(=O)OCCNc1ccc(cc1OC)C 34a_100000746441_200011997002 [0,1,1,0,0,0|1,0,0]=3 2976 B17R1.5319 CNC(=O)OCCNc1ccc(cc1OC)Cl 34a_100000707585_200011997002 [0,1,1,0,0,0|1,0,0]=3 2977 B17R1.5319 CNC(=O)OCCNc1ccc(cc1OC)F 34a_100000737216_200011997002 [0,1,1,0,0,0|1,0,0]=3 2978 B17R1.5319 CNC(=O)OCCNc1ccc(cc1OC)I 34a_100015196925_200011997002 [0,1,1,0,0,0|1,0,0]=3 2979 B17R1.5319 CNC(=O)OCCNc1ccc(cc1OC)O 34a_100015326901_200011997002 [0,1,1,0,0,0|1,0,0]=3 2980 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)Br 34a_100000687585_200011997002 [0,1,1,0,0,0|2,0,0]=4 2981 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)Br 7a_100000687585_200011997002 [0,1,1,0,0,0|2,0,0]=4 2982 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)C 34a_200012180384_200011997002 [0,1,1,0,0,0|2,0,0]=4 2983 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)C 7a_200012180384_200011997002 [0,1,1,0,0,0|2,0,0]=4 2984 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)Cl 34a_100011219380_200011997002 [0,1,1,0,0,0|2,0,0]=4 2985 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)Cl 7a_100011219380_200011997002 [0,1,1,0,0,0|2,0,0]=4 2986 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)F 34a_100011900173_200011997002 [0,1,1,0,0,0|2,0,0]=4 2987 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)F 7a_100011900173_200011997002 [0,1,1,0,0,0|2,0,0]=4 2988 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)I 34a_200000049958_200011997002 [0,1,1,0,0,0|2,0,0]=4 2989 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)I 7a_200000049958_200011997002 [0,1,1,0,0,0|2,0,0]=4 2990 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)N 34a_100011249283_200011997002 [0,1,1,0,0,0|2,0,0]=4 2991 B17R1.5319 CNC(=O)OCCOc1ccc(cc1C#N)N 7a_100011249283_200011997002 [0,1,1,0,0,0|2,0,0]=4 2992 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CBr)F 34a_100010161318_200011997002 [0,1,1,0,0,0|2,0,0]=4 2993 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CBr)F 7a_100010161318_200011997002 [0,1,1,0,0,0|2,0,0]=4 2994 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CN)Br 34a_100000730032_200011997002 [0,1,1,0,0,0|2,0,0]=4 2995 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CN)Cl 34a_100000238540_200011997002 [0,1,1,0,0,0|2,0,0]=4 2996 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)Br 34a_100000184703_200011997002 [0,1,1,0,0,0|2,0,0]=4 2997 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)Br 7a_100000184703_200011997002 [0,1,1,0,0,0|2,0,0]=4 2998 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)C 34a_200011846009_200011997002 [0,1,1,0,0,0|2,0,0]=4 2999 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)C 7a_200011846009_200011997002 [0,1,1,0,0,0|2,0,0]=4 3000 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)Cl 34a_100011218961_200011997002 [0,1,1,0,0,0|2,0,0]=4 3001 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)Cl 7a_100011218961_200011997002 [0,1,1,0,0,0|2,0,0]=4 3002 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)F 34a_100011291448_200011997002 [0,1,1,0,0,0|2,0,0]=4 3003 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)F 7a_100011291448_200011997002 [0,1,1,0,0,0|2,0,0]=4 3004 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)I 34a_100000049520_200011997002 [0,1,1,0,0,0|2,0,0]=4 3005 B17R1.5319 CNC(=O)OCCOc1ccc(cc1CO)I 7a_100000049520_200011997002 [0,1,1,0,0,0|2,0,0]=4 3006 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)Br 34a_100000694246_200011997002 [0,1,1,0,0,0|0,0,0]=2 3007 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)Br 7a_100000694246_200011997002 [0,1,1,0,0,0|0,0,0]=2 3008 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)C 34a_100000186466_200011997002 [0,1,1,0,0,0|0,0,0]=2 3009 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)Cl 34a_100000033002_200011997002 [0,1,1,0,0,0|0,0,0]=2 3010 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)F 34a_100000036057_200011997002 [0,1,1,0,0,0|0,0,0]=2 3011 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)F 7a_100000036057_200011997002 [0,1,1,0,0,0|0,0,0]=2 3012 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)I 34a_100000049635_200011997002 [0,1,1,0,0,0|0,0,0]=2 3013 B17R1.5319 CNC(=O)OCCOc1ccc(cc1OC)N 34a_100000726020_200011997002 [0,1,1,0,0,0|0,0,0]=2 3014 B17R1.5319 CNC(=O)OCCOc1ccc(nc1OC)Br 34a_100010893133_200011997002 [0,1,1,0,0,0|1,0,0]=3 3015 B17R1.5319 CNC(=O)OCCOc1ncc(cc1OC)Cl 34a_200009845368_200011997002 [0,1,1,0,0,0|1,0,0]=3 3016 B17R1.5319 CNC(=O)OCCSc1ccc(cc1NC)F 62a_100020633008_200011997002 [0,1,1,0,0,0|1,1,0]=4 3017 B17R1.5319 CNC(=O)OCCSc1ccc(cc1NC)F 62a_200011997002_100020633008 [0,1,1,0,0,0|1,1,0]=4 3018 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)Br 62a_100010245111_200011997002 [0,1,1,0,0,0|0,1,0]=3 3019 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)Br 62a_200011997002_100010245111 [0,1,1,0,0,0|0,1,0]=3 3020 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)C 62a_100010200004_200011997002 [0,1,1,0,0,0|0,1,0]=3 3021 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)C 62a_200011997002_100010200004 [0,1,1,0,0,0|0,1,0]=3 3022 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)Cl 62a_100000050115_200011997002 [0,1,1,0,0,0|0,1,0]=3 3023 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)Cl 62a_200011997002_100000050115 [0,1,1,0,0,0|0,1,0]=3 3024 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)F 62a_100000757151_200011997002 [0,1,1,0,0,0|0,1,0]=3 3025 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)F 62a_200011997002_100000757151 [0,1,1,0,0,0|0,1,0]=3 3026 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)N 62a_100000765947_200011997002 [0,1,1,0,0,0|0,1,0]=3 3027 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)N 62a_200011997002_100000765947 [0,1,1,0,0,0|0,1,0]=3 3028 B17R1.5319 CNC(=O)OCCSc1ccc(cc1OC)O 62a_200011997002_100011827694 [0,1,1,0,0,0|0,1,0]=3 3029 B17R1.5319 CNC(=O)OCCSc1ccc(cc1SC)C 62a_200010709736_200011997002 [0,1,1,0,0,0|0,2,0]=4 3030 B17R1.5319 CNC(=O)OCCSc1ccc(cc1SC)C 62a_200011997002_200010709736 [0,1,1,0,0,0|0,2,0]=4 3031 B17R1.5319 CNC(=O)OCCSc1ccc(nc1OC)C 62a_100010138632_200011997002 [0,1,1,0,0,0|1,1,0]=4 3032 B17R1.5319 CNC(=O)OCCSc1ccc(nc1OC)C 62a_200011997002_100010138632 [0,1,1,0,0,0|1,1,0]=4 3033 B17R1.5319 CNC(=O)OCCSc1ccc(nc1OC)N 62a_100010187630_200011997002 [0,1,1,0,0,0|1,1,0]=4 3034 B17R1.5319 CNC(=O)OCCSc1ccc(nc1OC)N 62a_200011997002_100010187630 [0,1,1,0,0,0|1,1,0]=4 3035 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)C 62a_100000717771_200011997002 [0,1,1,0,0,0|1,1,0]=4 3036 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)C 62a_200011997002_100000717771 [0,1,1,0,0,0|1,1,0]=4 3037 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)Cl 62a_100010154656_200011997002 [0,1,1,0,0,0|1,1,0]=4 3038 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)Cl 62a_200011997002_100010154656 [0,1,1,0,0,0|1,1,0]=4 3039 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)F 62a_100010135560_200011997002 [0,1,1,0,0,0|1,1,0]=4 3040 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)F 62a_200011997002_100010135560 [0,1,1,0,0,0|1,1,0]=4 3041 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)N 62a_100015506990_200011997002 [0,1,1,0,0,0|1,1,0]=4 3042 B17R1.5319 CNC(=O)OCCSc1cnc(cc1OC)N 62a_200011997002_100015506990 [0,1,1,0,0,0|1,1,0]=4 3043 B17R1.5319 CNC(=O)OCCSc1ncc(cc1OC)C 62a_200011997002_200000118316 [0,1,1,0,0,0|1,1,0]=4 3044 B17R1.5319 CNC(=O)OCCSc1ncc(cc1OC)F 62a_100010136273_200011997002 [0,1,1,0,0,0|1,1,0]=4 3045 B17R1.5319 CNC(=O)OCCSc1ncc(cc1OC)F 62a_200011997002_100009867738 [0,1,1,0,0,0|1,1,0]=4 3046 B17R1.5319 CNC(=O)OCCSc1ncc(cc1OC)N 62a_200010291755_200011997002 [0,1,1,0,0,0|1,1,0]=4 3047 B17R1.5319 CNC(=O)OCCSc1ncc(cc1OC)N 62a_200011997002_100000097218 [0,1,1,0,0,0|1,1,0]=4 3048 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)Br 34a_100000694246_100000742333 [0,1,1,0,0,0|2,0,0]=4 3049 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)Br 7a_100000694246_100011218270 [0,1,1,0,0,0|2,0,0]=4 3050 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)C 34a_100000186466_100000742333 [0,1,1,0,0,0|2,0,0]=4 3051 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)Cl 34a_100000033002_100000742333 [0,1,1,0,0,0|2,0,0]=4 3052 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)F 34a_100000036057_100000742333 [0,1,1,0,0,0|2,0,0]=4 3053 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)F 7a_100000036057_100011218270 [0,1,1,0,0,0|2,0,0]=4 3054 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)I 34a_100000049635_100000742333 [0,1,1,0,0,0|2,0,0]=4 3055 B17R1.5319 COC(=O)CCCOc1ccc(cc1OC)N 34a_100000726020_100000742333 [0,1,1,0,0,0|2,0,0]=4 3056 B17R1.7411 C=CC(=O)OCCOc1cccc(c1OC)Br 34a_100010234590_100009813456 [0,1,1,0,0,0|1,0,1]=4 3057 B17R1.7411 C=CC(=O)OCCOc1cccc(c1OC)Cl 34a_200009886253_100009813456 [0,1,1,0,0,0|1,0,1]=4 3058 B17R1.7411 C=CC(=O)OCCOc1cccc(c1OC)Cl 7a_200009886253_100009813456 [0,1,1,0,0,0|1,0,1]=4 3059 B17R1.7411 CNC(=O)CCCNc1cccc(c1OC)Br 34a_100011935253_100000741757 [0,1,1,0,0,0|2,0,0]=4 3060 B17R1.7411 CNC(=O)CCCNc1cccc(c1OC)C 34a_100012017360_100000741757 [0,1,1,0,0,0|2,0,0]=4 3061 B17R1.7411 CNC(=O)CCCNc1cccc(c1OC)Cl 2230a_100000743799_100000741757 [0,1,1,0,0,0|2,0,0]=4 3062 B17R1.7411 CNC(=O)CCCNc1cccc(c1OC)Cl 34a_100000743799_100000741757 [0,1,1,0,0,0|2,0,0]=4 3063 B17R1.7411 CNC(=O)CCCNc1cccc(c1OC)F 34a_100011215007_100000741757 [0,1,1,0,0,0|2,0,0]=4 3064 B17R1.7411 CNC(=O)CCCOc1cccc(c1OC)Br 34a_100010234590_100000741757 [0,1,1,0,0,0|1,0,0]=3 3065 B17R1.7411 CNC(=O)CCCOc1cccc(c1OC)Cl 34a_200009886253_100000741757 [0,1,1,0,0,0|1,0,0]=3 3066 B17R1.7411 CNC(=O)CCCOc1cccc(c1OC)Cl 7a_200009886253_100000741757 [0,1,1,0,0,0|1,0,0]=3 3067 B17R1.7411 CNC(=O)CCCOc1cccc(c1SC)C 34a_200000099257_100000741757 [0,1,1,0,0,0|1,1,0]=4 3068 B17R1.7411 CNC(=O)CCCOc1cccc(c1SC)C 7a_200000099257_100000741757 [0,1,1,0,0,0|1,1,0]=4 3069 B17R1.7411 CNC(=O)CCCOc1ccnc(c1OC)Cl 34a_100000104430_100000741757 [0,1,1,0,0,0|2,0,0]=4 3070 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)Br 62a_100000741757_100010146560 [0,1,1,0,0,0|1,1,0]=4 3071 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)Br 62a_100010146560_100000741757 [0,1,1,0,0,0|1,1,0]=4 3072 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)C 62a_100000741757_100010141385 [0,1,1,0,0,0|1,1,0]=4 3073 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)C 62a_100010141385_100000741757 [0,1,1,0,0,0|1,1,0]=4 3074 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)Cl 62a_100000741757_100010147678 [0,1,1,0,0,0|1,1,0]=4 3075 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)Cl 62a_100010147678_100000741757 [0,1,1,0,0,0|1,1,0]=4 3076 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)F 62a_100000741757_100009816759 [0,1,1,0,0,0|1,1,0]=4 3077 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)F 62a_100009816759_100000741757 [0,1,1,0,0,0|1,1,0]=4 3078 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)N 62a_100011935253_100000741757 [0,1,1,0,0,0|1,1,0]=4 3079 B17R1.7411 CNC(=O)CCCSc1cccc(c1OC)O 62a_100000741757_100010234590 [0,1,1,0,0,0|1,1,0]=4 3080 B17R1.7411 CNC(=O)OCCNc1cccc(c1OC)Br 34a_100011935253_200011997002 [0,1,1,0,0,0|1,0,0]=3 3081 B17R1.7411 CNC(=O)OCCNc1cccc(c1OC)C 34a_100012017360_200011997002 [0,1,1,0,0,0|1,0,0]=3 3082 B17R1.7411 CNC(=O)OCCNc1cccc(c1OC)Cl 34a_100000743799_200011997002 [0,1,1,0,0,0|1,0,0]=3 3083 B17R1.7411 CNC(=O)OCCNc1cccc(c1OC)F 34a_100011215007_200011997002 [0,1,1,0,0,0|1,0,0]=3 3084 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)Br 34a_100012180507_200011997002 [0,1,1,0,0,0|2,0,0]=4 3085 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)Br 7a_100012180507_200011997002 [0,1,1,0,0,0|2,0,0]=4 3086 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)C 34a_100000079363_200011997002 [0,1,1,0,0,0|2,0,0]=4 3087 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)C 7a_100000079363_200011997002 [0,1,1,0,0,0|2,0,0]=4 3088 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)Cl 34a_100000764475_200011997002 [0,1,1,0,0,0|2,0,0]=4 3089 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)Cl 7a_100000764475_200011997002 [0,1,1,0,0,0|2,0,0]=4 3090 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)F 34a_100000741147_200011997002 [0,1,1,0,0,0|2,0,0]=4 3091 B17R1.7411 CNC(=O)OCCOc1cccc(c1C#N)F 7a_100000741147_200011997002 [0,1,1,0,0,0|2,0,0]=4 3092 B17R1.7411 CNC(=O)OCCOc1cccc(c1CO)C 34a_200009874777_200011997002 [0,1,1,0,0,0|2,0,0]=4 3093 B17R1.7411 CNC(=O)OCCOc1cccc(c1CO)C 7a_200009874777_200011997002 [0,1,1,0,0,0|2,0,0]=4 3094 B17R1.7411 CNC(=O)OCCOc1cccc(c1OC)Br 34a_100010234590_200011997002 [0,1,1,0,0,0|0,0,0]=2 3095 B17R1.7411 CNC(=O)OCCOc1cccc(c1OC)Cl 34a_200009886253_200011997002 [0,1,1,0,0,0|0,0,0]=2 3096 B17R1.7411 CNC(=O)OCCOc1cccc(c1OC)Cl 7a_200009886253_200011997002 [0,1,1,0,0,0|0,0,0]=2 3097 B17R1.7411 CNC(=O)OCCOc1cccc(c1SC)C 34a_200000099257_200011997002 [0,1,1,0,0,0|0,1,0]=3 3098 B17R1.7411 CNC(=O)OCCOc1cccc(c1SC)C 7a_200000099257_200011997002 [0,1,1,0,0,0|0,1,0]=3 3099 B17R1.7411 CNC(=O)OCCOc1ccnc(c1OC)Cl 34a_100000104430_200011997002 [0,1,1,0,0,0|1,0,0]=3 3100 B17R1.7411 CNC(=O)OCCSc1cccc(c1NC)N 62a_100010510394_200011997002 [0,1,1,0,0,0|1,1,0]=4 3101 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)Br 62a_100010146560_200011997002 [0,1,1,0,0,0|0,1,0]=3 3102 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)Br 62a_200011997002_100010146560 [0,1,1,0,0,0|0,1,0]=3 3103 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)C 62a_100010141385_200011997002 [0,1,1,0,0,0|0,1,0]=3 3104 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)C 62a_200011997002_100010141385 [0,1,1,0,0,0|0,1,0]=3 3105 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)Cl 62a_100010147678_200011997002 [0,1,1,0,0,0|0,1,0]=3 3106 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)Cl 62a_200011997002_100010147678 [0,1,1,0,0,0|0,1,0]=3 3107 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)F 62a_100009816759_200011997002 [0,1,1,0,0,0|0,1,0]=3 3108 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)F 62a_200011997002_100009816759 [0,1,1,0,0,0|0,1,0]=3 3109 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)N 62a_100011935253_200011997002 [0,1,1,0,0,0|0,1,0]=3 3110 B17R1.7411 CNC(=O)OCCSc1cccc(c1OC)O 62a_200011997002_100010234590 [0,1,1,0,0,0|0,1,0]=3 3111 B17R1.7411 CNC(=O)OCCSc1cccc(c1SC)F 62a_200010709249_200011997002 [0,1,1,0,0,0|0,2,0]=4 3112 B17R1.7411 CNC(=O)OCCSc1cccc(c1SC)F 62a_200011997002_200010709249 [0,1,1,0,0,0|0,2,0]=4 3113 B17R1.7411 CNC(=O)OCCSc1ccnc(c1OC)C 62a_100000685116_200011997002 [0,1,1,0,0,0|1,1,0]=4 3114 B17R1.7411 CNC(=O)OCCSc1ccnc(c1OC)C 62a_200011997002_100000685116 [0,1,1,0,0,0|1,1,0]=4 3115 B17R1.7411 CNC(=O)OCCSc1ccnc(c1OC)Cl 62a_100010068014_200011997002 [0,1,1,0,0,0|1,1,0]=4 3116 B17R1.7411 CNC(=O)OCCSc1ccnc(c1OC)Cl 62a_200011997002_100010068014 [0,1,1,0,0,0|1,1,0]=4 3117 B17R1.7411 CNC(=O)OCCSc1ccnc(c1OC)N 62a_100009880012_200011997002 [0,1,1,0,0,0|1,1,0]=4 3118 B17R1.7411 CNC(=O)OCCSc1ccnc(c1OC)N 62a_200011997002_100009880012 [0,1,1,0,0,0|1,1,0]=4 3119 B17R1.7411 CNC(=O)OCCSc1cncc(c1OC)N 62a_100012359933_200011997002 [0,1,1,0,0,0|1,1,0]=4 3120 B17R1.7411 CNC(=O)OCCSc1cncc(c1OC)N 62a_200011997002_100012359933 [0,1,1,0,0,0|1,1,0]=4 3121 B17R1.7411 CNC(=O)OCCSc1nccc(c1OC)N 62a_100000104429_200011997002 [0,1,1,0,0,0|1,1,0]=4 3122 B17R1.7411 CNC(=O)OCCSc1nccc(c1OC)N 62a_200011997002_100000104429 [0,1,1,0,0,0|1,1,0]=4 3123 B17R1.7411 CNC(=O)OCCSc1nccc(c1OC)O 62a_200011997002_100000104430 [0,1,1,0,0,0|1,1,0]=4 3124 B17R1.7411 COC(=O)CCCOc1cccc(c1OC)Br 34a_100010234590_100000742333 [0,1,1,0,0,0|2,0,0]=4 3125 B17R1.7411 COC(=O)CCCOc1cccc(c1OC)Cl 34a_200009886253_100000742333 [0,1,1,0,0,0|2,0,0]=4 3126 B17R1.7411 COC(=O)CCCOc1cccc(c1OC)Cl 7a_200009886253_100011218270 [0,1,1,0,0,0|2,0,0]=4 3127 B17R1.24156 C=C(C)c1ccccc1NCCOC(=O)NC 34a_100000037685_200011997002 [0,1,1,0,0,0|2,0,0]=4 3128 B17R1.24156 CNC(=O)CCCOc1ccccc1C(C)C 34a_100000211617_100000741757 [0,1,1,0,0,0|2,0,0]=4 3129 B17R1.24156 CNC(=O)CCCOc1ccccc1C(C)C 7a_100000211617_100000741757 [0,1,1,0,0,0|2,0,0]=4 3130 B17R1.24156 CNC(=O)CCCOc1ccccc1C(C)O 34a_200011232679_100000741757 [0,1,1,0,0,0|2,0,0]=4 3131 B17R1.24156 CNC(=O)CCCOc1ccccc1C(C)O 7a_200011232679_100000741757 [0,1,1,0,0,0|2,0,0]=4 3132 B17R1.24156 CNC(=O)CCCOc1ccccc1[C@@H](C)N 34a_100025703389_100000741757 [0,1,1,0,0,0|2,0,0]=4 3133 B17R1.24156 CNC(=O)NCCOc1ccccc1C(C)C 2708a_100000754683_106832991635 [0,1,1,0,0,0|2,0,0]=4 3134 B17R1.24156 CNC(=O)NCCOc1ccccc1C(C)C 2708a_100102657272_100000754683 [0,1,1,0,0,0|2,0,0]=4 3135 B17R1.24156 CNC(=O)NCCOc1ccccc1C(C)C 273464a_100000754683_100102657272 [0,1,1,0,0,0|2,0,0]=4 3136 B17R1.24156 CNC(=O)NCCOc1ccccc1C(C)C 273464a_100102657272_100000754683 [0,1,1,0,0,0|2,0,0]=4 3137 B17R1.24156 CNC(=O)NCCOc1ccccc1C(C)C 512a_100000754683_100102657272 [0,1,1,0,0,0|2,0,0]=4 3138 B17R1.24156 CNC(=O)NCCOc1ccccc1C(C)C 512a_106832991638_100000754683 [0,1,1,0,0,0|2,0,0]=4 3139 B17R1.24156 CNC(=O)OCCNc1ccccc1C(C)C 34a_100000210643_200011997002 [0,1,1,0,0,0|2,0,0]=4 3140 B17R1.24156 CNC(=O)OCCNc1ccccc1C(C)C 7a_100000210643_200011997002 [0,1,1,0,0,0|2,0,0]=4 3141 B17R1.24156 CNC(=O)OCCOc1ccccc1C(=O)N 34a_100000192804_200011997002 [0,1,1,0,0,0|2,0,0]=4 3142 B17R1.24156 CNC(=O)OCCOc1ccccc1C(=O)N 7a_100000192804_200011997002 [0,1,1,0,0,0|2,0,0]=4 3143 B17R1.24156 CNC(=O)OCCOc1ccccc1C(=O)[O-] 7a_100015234032_200011997002 [0,1,1,0,0,0|2,0,0]=4 3144 B17R1.24156 CNC(=O)OCCOc1ccccc1C(=S)N 7a_100000745089_200011997002 [0,1,1,0,0,0|2,0,0]=4 3145 B17R1.24156 CNC(=O)OCCOc1ccccc1C(C)C 34a_100000211617_200011997002 [0,1,1,0,0,0|1,0,0]=3 3146 B17R1.24156 CNC(=O)OCCOc1ccccc1C(C)C 7a_100000211617_200011997002 [0,1,1,0,0,0|1,0,0]=3 3147 B17R1.24156 CNC(=O)OCCOc1ccccc1C(C)O 34a_200011232679_200011997002 [0,1,1,0,0,0|1,0,0]=3 3148 B17R1.24156 CNC(=O)OCCOc1ccccc1C(C)O 7a_200011232679_200011997002 [0,1,1,0,0,0|1,0,0]=3 3149 B17R1.24156 CNC(=O)OCCOc1ccccc1[C@@H](C)N 34a_100025703389_200011997002 [0,1,1,0,0,0|1,0,0]=3 3150 B17R1.24156 CNC(=O)OCCOc1ccccc1[N+](=O)[O-] 34a_100000186319_200011997002 [0,1,1,0,0,0|2,0,0]=4 3151 B17R1.24156 CNC(=O)OCCOc1ccccc1[N+](=O)[O-] 7a_100000186319_200011997002 [0,1,1,0,0,0|2,0,0]=4 3152 B17R1.24156 CNC(=O)OCCOc1cccnc1C(=O)C 34a_100000087166_200011997002 [0,1,1,0,0,0|2,0,0]=4 3153 B17R1.24156 CNC(=O)OCCOc1cccnc1C(=O)C 7a_100000087166_200011997002 [0,1,1,0,0,0|2,0,0]=4 3154 B17R1.24156 CNC(=O)OCCOc1cccnc1C(C)C 34a_100012183336_200011997002 [0,1,1,0,0,0|2,0,0]=4 3155 B17R1.24156 CNC(=O)OCCOc1cccnc1C(C)C 7a_100012183336_200011997002 [0,1,1,0,0,0|2,0,0]=4 3156 B17R1.24156 CNC(=O)OCCOc1cnccc1C(=O)C 7a_100009872882_200011997002 [0,1,1,0,0,0|2,0,0]=4 3157 B17R1.24156 CNC(=O)OCCSc1ccccc1C(=O)C 62a_100000751169_200011997002 [0,1,1,0,0,0|1,1,0]=4 3158 B17R1.24156 CNC(=O)OCCSc1ccccc1C(C)C 62a_100000708600_200011997002 [0,1,1,0,0,0|1,1,0]=4 3159 B17R1.24156 CNC(=O)OCCSc1ccccc1C(C)C 62a_200011997002_100000708600 [0,1,1,0,0,0|1,1,0]=4 3160 B17R1.24156 CNC(=O)OCCSc1ccccc1C(C)N 62a_100000181357_200011997002 [0,1,1,0,0,0|1,1,0]=4 3161 B17R1.24156 CNC(=O)OCCSc1ccccc1C(C)N 62a_200011997002_100000181357 [0,1,1,0,0,0|1,1,0]=4 3162 B17R1.24156 CNC(=O)OCCSc1ccccc1C(C)O 62a_100000702211_200011997002 [0,1,1,0,0,0|1,1,0]=4 3163 B17R1.24156 CNC(=O)OCCSc1ccccc1C(C)O 62a_200011997002_100000702211 [0,1,1,0,0,0|1,1,0]=4 3164 B17R1.24156 CNC(=O)OCCSc1ccccc1N(C)C 62a_100011290883_200011997002 [0,1,1,0,0,0|1,1,0]=4 3165 B17R1.24156 CNC(=O)OCCSc1ccccc1N(C)C 62a_200011997002_100011290883 [0,1,1,0,0,0|1,1,0]=4 3166 B17R1.24156 CNC(=O)OCCSc1ccccc1S(=O)C 62a_100000734199_200011997002 [0,1,1,0,0,0|0,2,0]=4 3167 B17R1.27008 CCC(=O)N(C)CCOc1ccccc1OC 11a_100000228778_100000210414 [0,1,1,0,0,0|2,0,0]=4 3168 B17R1.27008 CCC(=O)N(C)CCOc1ccccc1OC 1626a_100000228778_100000210414 [0,1,1,0,0,0|2,0,0]=4 3169 B17R1.27008 CCC(=O)N(C)CCOc1ccccc1OC 240690a_100000228778_100000210414 [0,1,1,0,0,0|2,0,0]=4 3170 B17R1.27008 CCC(=O)N(C)CCOc1ccccc1OC 527a_100000228778_100000210414 [0,1,1,0,0,0|2,0,0]=4 3171 B17R1.27008 CCc1ccccc1OCCN(C)C(=O)NC 2708a_100102657272_100015185793 [0,1,1,0,0,0|2,0,0]=4 3172 B17R1.27008 CCc1ccccc1OCCN(C)C(=O)NC 273464a_100102657272_100015185793 [0,1,1,0,0,0|2,0,0]=4 3173 B17R1.27008 CNC(=O)C(=O)CCOc1ccccc1OC 1458a_100011218921_100000188471 [0,1,1,0,0,0|1,0,0]=3 3174 B17R1.27008 CNC(=O)N(C)CCOc1ccccc1OC 2708a_100102657272_100000228778 [0,1,1,0,0,0|1,0,0]=3 3175 B17R1.27008 CNC(=O)N(C)CCOc1ccccc1OC 273464a_100102657272_100000228778 [0,1,1,0,0,0|1,0,0]=3 3176 B17R1.27008 COC(=O)C(C)CCOc1ccccc1OC 34a_100000210385_100000034942 [0,1,1,0,0,0|2,0,0]=4 3177 B17R1.27038 CCc1ccccc1C(=O)CCOC(=O)NC 1458a_100000689120_200011997002 [0,1,1,0,0,0|2,0,0]=4 3178 B17R1.27038 CNC(=O)CCCC(=O)c1ccccc1OC 1458a_100000185835_100000741757 [0,1,1,0,0,0|2,0,0]=4 3179 B17R1.27038 CNC(=O)CCCN(C)c1ccccc1OC 2230a_100000219746_100000741757 [0,1,1,0,0,0|2,0,0]=4 3180 B17R1.27038 CNC(=O)CCCN(C)c1ccccc1OC 269982a_100000219746_100000741757 [0,1,1,0,0,0|2,0,0]=4 3181 B17R1.27038 CNC(=O)CCCN(C)c1ccccc1OC 34a_100000219746_100000741757 [0,1,1,0,0,0|2,0,0]=4 3182 B17R1.27038 CNC(=O)OCCC(=O)c1ccccc1OC 1458a_100000185835_200011997002 [0,1,1,0,0,0|1,0,0]=3 3183 B17R1.27038 CNC(=O)OCCC(=O)c1ccccc1SC 1458a_100000183967_200011997002 [0,1,1,0,0,0|1,1,0]=4 3184 B17R1.27038 CNC(=O)OCCN(C)c1ccccc1OC 269982a_100000219746_200011997002 [0,1,1,0,0,0|1,0,0]=3 3185 B17R1.27038 CNC(=O)OCCN(C)c1ccccc1OC 34a_100000219746_200011997002 [0,1,1,0,0,0|1,0,0]=3 3186 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)Br 34a_100000686866_100009813456 [0,1,1,0,0,0|1,0,1]=4 3187 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)C 34a_100011219253_100009813456 [0,1,1,0,0,0|1,0,1]=4 3188 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)C 7a_100011219253_100009813456 [0,1,1,0,0,0|1,0,1]=4 3189 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)Cl 34a_100009851661_100009813456 [0,1,1,0,0,0|1,0,1]=4 3190 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)Cl 7a_100009851661_100009813456 [0,1,1,0,0,0|1,0,1]=4 3191 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)F 34a_100000036725_100009813456 [0,1,1,0,0,0|1,0,1]=4 3192 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)F 7a_100000036725_100009813456 [0,1,1,0,0,0|1,0,1]=4 3193 B17R1.28353 C=CC(=O)OCCOc1c(cccc1OC)N 34a_100000123586_100009813456 [0,1,1,0,0,0|1,0,1]=4 3194 B17R1.28353 CCc1cccc(c1NCCOC(=O)NC)C 34a_100000210048_200011997002 [0,1,1,0,0,0|2,0,0]=4 3195 B17R1.28353 CCc1cccc(c1NCCOC(=O)NC)C 7a_100000210048_200011997002 [0,1,1,0,0,0|2,0,0]=4 3196 B17R1.28353 CCc1cccc(c1OCCCC(=O)NC)Br 34a_200010001580_100000741757 [0,1,1,0,0,0|2,0,0]=4 3197 B17R1.28353 CCc1cccc(c1OCCCC(=O)NC)Br 7a_200010001580_100000741757 [0,1,1,0,0,0|2,0,0]=4 3198 B17R1.28353 CCc1cccc(c1OCCCC(=O)NC)C 34a_100000034007_100000741757 [0,1,1,0,0,0|2,0,0]=4 3199 B17R1.28353 CCc1cccc(c1OCCCC(=O)NC)C 7a_100000034007_100000741757 [0,1,1,0,0,0|2,0,0]=4 3200 B17R1.28353 CCc1cccc(c1OCCOC(=O)NC)Br 34a_200010001580_200011997002 [0,1,1,0,0,0|1,0,0]=3 3201 B17R1.28353 CCc1cccc(c1OCCOC(=O)NC)Br 7a_200010001580_200011997002 [0,1,1,0,0,0|1,0,0]=3 3202 B17R1.28353 CCc1cccc(c1OCCOC(=O)NC)C 34a_100000034007_200011997002 [0,1,1,0,0,0|1,0,0]=3 3203 B17R1.28353 CCc1cccc(c1OCCOC(=O)NC)C 7a_100000034007_200011997002 [0,1,1,0,0,0|1,0,0]=3 3204 B17R1.28353 CCc1cccc(c1SCCOC(=O)NC)C 62a_100000036235_200011997002 [0,1,1,0,0,0|1,1,0]=4 3205 B17R1.28353 CCc1cccc(c1SCCOC(=O)NC)C 62a_200011997002_100000036235 [0,1,1,0,0,0|1,1,0]=4 3206 B17R1.28353 CCc1occc(=O)c1OCCOC(=O)NC 34a_100000033269_200011997002 [0,1,1,0,0,0|2,0,0]=4 3207 B17R1.28353 CNC(=O)CCCNc1c(cccc1OC)Br 34a_100000708083_100000741757 [0,1,1,0,0,0|2,0,0]=4 3208 B17R1.28353 CNC(=O)CCCNc1c(cccc1OC)C 2230a_100000758225_100000741757 [0,1,1,0,0,0|2,0,0]=4 3209 B17R1.28353 CNC(=O)CCCNc1c(cccc1OC)C 34a_100000758225_100000741757 [0,1,1,0,0,0|2,0,0]=4 3210 B17R1.28353 CNC(=O)CCCNc1c(cccc1OC)Cl 34a_100011309317_100000741757 [0,1,1,0,0,0|2,0,0]=4 3211 B17R1.28353 CNC(=O)CCCNc1c(cccc1OC)F 34a_100000686744_100000741757 [0,1,1,0,0,0|2,0,0]=4 3212 B17R1.28353 CNC(=O)CCCNc1c(cccc1OC)O 34a_100012022766_100000741757 [0,1,1,0,0,0|2,0,0]=4 3213 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)Br 34a_100000686866_100000741757 [0,1,1,0,0,0|1,0,0]=3 3214 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)C 34a_100011219253_100000741757 [0,1,1,0,0,0|1,0,0]=3 3215 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)C 7a_100011219253_100000741757 [0,1,1,0,0,0|1,0,0]=3 3216 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)Cl 34a_100009851661_100000741757 [0,1,1,0,0,0|1,0,0]=3 3217 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)Cl 7a_100009851661_100000741757 [0,1,1,0,0,0|1,0,0]=3 3218 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)F 34a_100000036725_100000741757 [0,1,1,0,0,0|1,0,0]=3 3219 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)F 7a_100000036725_100000741757 [0,1,1,0,0,0|1,0,0]=3 3220 B17R1.28353 CNC(=O)CCCOc1c(cccc1OC)N 34a_100000123586_100000741757 [0,1,1,0,0,0|1,0,0]=3 3221 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)Br 62a_100000741757_100010131421 [0,1,1,0,0,0|1,1,0]=4 3222 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)Br 62a_100010131421_100000741757 [0,1,1,0,0,0|1,1,0]=4 3223 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)C 62a_100000741757_100010191535 [0,1,1,0,0,0|1,1,0]=4 3224 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)C 62a_100010191535_100000741757 [0,1,1,0,0,0|1,1,0]=4 3225 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)F 62a_100000703912_100000741757 [0,1,1,0,0,0|1,1,0]=4 3226 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)F 62a_100000741757_100000703912 [0,1,1,0,0,0|1,1,0]=4 3227 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)N 62a_100000703447_100000741757 [0,1,1,0,0,0|1,1,0]=4 3228 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)N 62a_100000741757_100000703447 [0,1,1,0,0,0|1,1,0]=4 3229 B17R1.28353 CNC(=O)CCCSc1c(cccc1OC)O 62a_100000741757_100010202623 [0,1,1,0,0,0|1,1,0]=4 3230 B17R1.28353 CNC(=O)OCCNc1c(cccc1OC)Br 34a_100000708083_200011997002 [0,1,1,0,0,0|1,0,0]=3 3231 B17R1.28353 CNC(=O)OCCNc1c(cccc1OC)C 34a_100000758225_200011997002 [0,1,1,0,0,0|1,0,0]=3 3232 B17R1.28353 CNC(=O)OCCNc1c(cccc1OC)Cl 34a_100011309317_200011997002 [0,1,1,0,0,0|1,0,0]=3 3233 B17R1.28353 CNC(=O)OCCNc1c(cccc1OC)F 34a_100000686744_200011997002 [0,1,1,0,0,0|1,0,0]=3 3234 B17R1.28353 CNC(=O)OCCNc1c(cccc1OC)O 34a_100012022766_200011997002 [0,1,1,0,0,0|1,0,0]=3 3235 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)Br 34a_100009817103_200011997002 [0,1,1,0,0,0|2,0,0]=4 3236 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)C 34a_100011659161_200011997002 [0,1,1,0,0,0|2,0,0]=4 3237 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)C 7a_100011659161_200011997002 [0,1,1,0,0,0|2,0,0]=4 3238 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)Cl 34a_100009866432_200011997002 [0,1,1,0,0,0|2,0,0]=4 3239 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)Cl 7a_100009866432_200011997002 [0,1,1,0,0,0|2,0,0]=4 3240 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)F 34a_100000117915_200011997002 [0,1,1,0,0,0|2,0,0]=4 3241 B17R1.28353 CNC(=O)OCCOc1c(cccc1C#N)F 7a_100000117915_200011997002 [0,1,1,0,0,0|2,0,0]=4 3242 B17R1.28353 CNC(=O)OCCOc1c(cccc1CN)C 34a_100020639391_200011997002 [0,1,1,0,0,0|2,0,0]=4 3243 B17R1.28353 CNC(=O)OCCOc1c(cccc1CO)F 34a_100011997349_200011997002 [0,1,1,0,0,0|2,0,0]=4 3244 B17R1.28353 CNC(=O)OCCOc1c(cccc1CO)F 7a_100011997349_200011997002 [0,1,1,0,0,0|2,0,0]=4 3245 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)Br 34a_100000686866_200011997002 [0,1,1,0,0,0|0,0,0]=2 3246 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)C 34a_100011219253_200011997002 [0,1,1,0,0,0|0,0,0]=2 3247 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)C 7a_100011219253_200011997002 [0,1,1,0,0,0|0,0,0]=2 3248 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)Cl 34a_100009851661_200011997002 [0,1,1,0,0,0|0,0,0]=2 3249 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)Cl 7a_100009851661_200011997002 [0,1,1,0,0,0|0,0,0]=2 3250 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)F 34a_100000036725_200011997002 [0,1,1,0,0,0|0,0,0]=2 3251 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)F 7a_100000036725_200011997002 [0,1,1,0,0,0|0,0,0]=2 3252 B17R1.28353 CNC(=O)OCCOc1c(cccc1OC)N 34a_100000123586_200011997002 [0,1,1,0,0,0|0,0,0]=2 3253 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)Br 62a_100010131421_200011997002 [0,1,1,0,0,0|0,1,0]=3 3254 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)Br 62a_200011997002_100010131421 [0,1,1,0,0,0|0,1,0]=3 3255 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)C 62a_100010191535_200011997002 [0,1,1,0,0,0|0,1,0]=3 3256 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)C 62a_200011997002_100010191535 [0,1,1,0,0,0|0,1,0]=3 3257 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)F 62a_100000703912_200011997002 [0,1,1,0,0,0|0,1,0]=3 3258 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)F 62a_200011997002_100000703912 [0,1,1,0,0,0|0,1,0]=3 3259 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)N 62a_100000703447_200011997002 [0,1,1,0,0,0|0,1,0]=3 3260 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)N 62a_200011997002_100000703447 [0,1,1,0,0,0|0,1,0]=3 3261 B17R1.28353 CNC(=O)OCCSc1c(cccc1OC)O 62a_200011997002_100010202623 [0,1,1,0,0,0|0,1,0]=3 3262 B17R1.28353 CNC(=O)OCCSc1c(ccnc1Cl)OC 62a_100010154655_200011997002 [0,1,1,0,0,0|1,1,0]=4 3263 B17R1.28353 CNC(=O)OCCSc1c(ccnc1Cl)OC 62a_200011997002_100010154655 [0,1,1,0,0,0|1,1,0]=4 3264 B17R1.28353 CNC(=O)OCCSc1c(ccnc1OC)C 62a_100012353928_200011997002 [0,1,1,0,0,0|1,1,0]=4 3265 B17R1.28353 CNC(=O)OCCSc1c(ccnc1OC)C 62a_200011997002_100012353928 [0,1,1,0,0,0|1,1,0]=4 3266 B17R1.28353 CNC(=O)OCCSc1c(ccnc1OC)N 62a_100010243811_200011997002 [0,1,1,0,0,0|1,1,0]=4 3267 B17R1.28353 CNC(=O)OCCSc1c(ccnc1OC)N 62a_200011997002_100010243811 [0,1,1,0,0,0|1,1,0]=4 3268 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)Br 34a_100000686866_100000742333 [0,1,1,0,0,0|2,0,0]=4 3269 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)C 34a_100011219253_100000742333 [0,1,1,0,0,0|2,0,0]=4 3270 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)C 7a_100011219253_100011218270 [0,1,1,0,0,0|2,0,0]=4 3271 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)Cl 34a_100009851661_100000742333 [0,1,1,0,0,0|2,0,0]=4 3272 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)Cl 7a_100009851661_100011218270 [0,1,1,0,0,0|2,0,0]=4 3273 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)F 34a_100000036725_100000742333 [0,1,1,0,0,0|2,0,0]=4 3274 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)F 7a_100000036725_100011218270 [0,1,1,0,0,0|2,0,0]=4 3275 B17R1.28353 COC(=O)CCCOc1c(cccc1OC)N 34a_100000123586_100000742333 [0,1,1,0,0,0|2,0,0]=4 3276 B17R2.4343 CCOc1ccccc1OCC2CCCO2 7a_100000211404_100000203698 [1,1,0,0,0,0|1,0,1]=4 3277 B17R2.4343 COCc1ccccc1OCC2CCCO2 7a_100011488565_100000203698 [1,1,0,0,0,0|1,0,1]=4 3278 B17R2.9549 COc1ccc(cc1OCC2CCCO2)Br 7a_100009816560_100000203698 [1,1,0,0,0,0|1,0,1]=4 3279 B17R2.9549 COc1ccc(cc1OCC2CCCO2)C 7a_100011216497_100000203698 [1,1,0,0,0,0|1,0,1]=4 3280 B17R2.9549 COc1ccc(cc1OCC2CCCO2)Cl 7a_100000101779_100000203698 [1,1,0,0,0,0|1,0,1]=4 3281 B17R2.9549 COc1ccc(cc1OCC2CCCO2)F 7a_100000034962_100000203698 [1,1,0,0,0,0|1,0,1]=4 3282 B17R2.10450 COc1cc(ccc1OCC2CCCO2)Br 7a_100000694246_100000203698 [1,1,0,0,0,0|1,0,1]=4 3283 B17R2.10450 COc1cc(ccc1OCC2CCCO2)F 7a_100000036057_100000203698 [1,1,0,0,0,0|1,0,1]=4 3284 B17R2.16287 COc1c(cccc1OCC2CCCO2)Cl 7a_200009886253_100000203698 [1,1,0,0,0,0|1,0,1]=4 3285 B17R2.71328 COc1cccc(c1OCC2CCCO2)C 7a_100011219253_100000203698 [1,1,0,0,0,0|1,0,1]=4 3286 B17R2.71328 COc1cccc(c1OCC2CCCO2)Cl 7a_100009851661_100000203698 [1,1,0,0,0,0|1,0,1]=4 3287 B17R2.71328 COc1cccc(c1OCC2CCCO2)F 7a_100000036725_100000203698 [1,1,0,0,0,0|1,0,1]=4 3288 B17R2.3489 Cc1c[n+](ccc1SCC2CNC(=O)O2)[O-] 62a_100000181169_100000074940 [1,1,0,0,0,0|1,1,0]=4 3289 B17R2.3489 Cc1cc(=O)c(co1)OCC2CNC(=O)O2 34a_100000081520_100000181169 [1,1,0,0,0,0|1,0,1]=4 3290 B17R2.3489 Cc1cc(c(cn1)OCC2CNC(=O)O2)Br 34a_100009843476_100000181169 [1,1,0,0,0,0|2,0,0]=4 3291 B17R2.3489 Cc1cc(c(cn1)OCC2CNC(=O)O2)Br 7a_100009843476_100000181169 [1,1,0,0,0,0|2,0,0]=4 3292 B17R2.3489 Cc1cc(c(cn1)OCC2CNC(=O)O2)C 34a_200000068632_100000181169 [1,1,0,0,0,0|1,0,0]=3 3293 B17R2.3489 Cc1cc(c(cn1)OCC2CNC(=O)O2)C 7a_200000068632_100000181169 [1,1,0,0,0,0|1,0,0]=3 3294 B17R2.3489 Cc1cc(c(cn1)OCC2COC(=O)O2)C 34a_200000068632_100000073702 [1,1,0,0,0,0|2,0,0]=4 3295 B17R2.3489 Cc1cc(c(cn1)SCC2CNC(=O)O2)C 62a_100000181169_100009819613 [1,1,0,0,0,0|1,1,0]=4 3296 B17R2.3489 Cc1cc(c(cn1)SCC2CNC(=O)O2)C 62a_100009819613_100000181169 [1,1,0,0,0,0|1,1,0]=4 3297 B17R2.3489 Cc1cc(c(cn1)SCC2CNC(=O)O2)O 62a_100000181169_100011016184 [1,1,0,0,0,0|1,1,0]=4 3298 B17R2.3489 Cc1cc(c(cn1)SCC2CNC(=O)O2)O 62a_100011016184_100000181169 [1,1,0,0,0,0|1,1,0]=4 3299 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)Br 34a_100000211769_100000181169 [1,1,0,0,0,0|1,0,0]=3 3300 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)Br 7a_100000211769_100000181169 [1,1,0,0,0,0|1,0,0]=3 3301 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)Cl 34a_100000210418_100000181169 [1,1,0,0,0,0|1,0,0]=3 3302 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)Cl 7a_100000210418_100000181169 [1,1,0,0,0,0|1,0,0]=3 3303 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)F 34a_100000211637_100000181169 [1,1,0,0,0,0|1,0,0]=3 3304 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)F 7a_100000211637_100000181169 [1,1,0,0,0,0|1,0,0]=3 3305 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)I 34a_100000184554_100000181169 [1,1,0,0,0,0|1,0,0]=3 3306 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)I 7a_100000184554_100000181169 [1,1,0,0,0,0|1,0,0]=3 3307 B17R2.3489 Cc1cc(ccc1NCC2CNC(=O)O2)O 34a_100000756630_100000181169 [1,1,0,0,0,0|1,0,0]=3 3308 B17R2.3489 Cc1cc(ccc1NCC2COC(=O)O2)Br 34a_100000211769_100000073702 [1,1,0,0,0,0|2,0,0]=4 3309 B17R2.3489 Cc1cc(ccc1NCC2COC(=O)O2)Cl 34a_100000210418_100000073702 [1,1,0,0,0,0|2,0,0]=4 3310 B17R2.3489 Cc1cc(ccc1NCC2COC(=O)O2)F 34a_100000211637_100000073702 [1,1,0,0,0,0|2,0,0]=4 3311 B17R2.3489 Cc1cc(ccc1NCC2COC(=O)O2)I 34a_100000184554_100000073702 [1,1,0,0,0,0|2,0,0]=4 3312 B17R2.3489 Cc1cc(ccc1NCC2COC(=O)O2)O 34a_100000756630_100000073702 [1,1,0,0,0,0|2,0,0]=4 3313 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000186361_100000181169 [1,1,0,0,0,0|0,0,0]=2 3314 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000186361_100000181169 [1,1,0,0,0,0|0,0,0]=2 3315 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000211091_100000181169 [1,1,0,0,0,0|0,0,0]=2 3316 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)Cl 7a_100000211091_100000181169 [1,1,0,0,0,0|0,0,0]=2 3317 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)F 34a_100000764316_100000181169 [1,1,0,0,0,0|0,0,0]=2 3318 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)F 7a_100000764316_100000181169 [1,1,0,0,0,0|0,0,0]=2 3319 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)I 34a_100011218673_100000181169 [1,1,0,0,0,0|0,0,0]=2 3320 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)I 7a_100011218673_100000181169 [1,1,0,0,0,0|0,0,0]=2 3321 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)N 34a_100011218179_100000181169 [1,1,0,0,0,0|0,0,0]=2 3322 B17R2.3489 Cc1cc(ccc1OCC2CNC(=O)O2)N 7a_100011218179_100000181169 [1,1,0,0,0,0|0,0,0]=2 3323 B17R2.3489 Cc1cc(ccc1OCC2COC(=O)O2)Br 34a_100000186361_100000073702 [1,1,0,0,0,0|1,0,0]=3 3324 B17R2.3489 Cc1cc(ccc1OCC2COC(=O)O2)Cl 34a_100000211091_100000073702 [1,1,0,0,0,0|1,0,0]=3 3325 B17R2.3489 Cc1cc(ccc1OCC2COC(=O)O2)F 34a_100000764316_100000073702 [1,1,0,0,0,0|1,0,0]=3 3326 B17R2.3489 Cc1cc(ccc1OCC2COC(=O)O2)I 34a_100011218673_100000073702 [1,1,0,0,0,0|1,0,0]=3 3327 B17R2.3489 Cc1cc(ccc1OCC2COC(=O)O2)N 34a_100011218179_100000073702 [1,1,0,0,0,0|1,0,0]=3 3328 B17R2.3489 Cc1cc(ccc1OC[C@@H]2CCC(=O)N2)Br 7a_100000186361_100015189358 [1,1,0,0,0,0|2,0,0]=4 3329 B17R2.3489 Cc1cc(ccc1OC[C@@H]2CCC(=O)N2)Cl 7a_100000211091_100015189358 [1,1,0,0,0,0|2,0,0]=4 3330 B17R2.3489 Cc1cc(ccc1OC[C@@H]2CCC(=O)N2)F 7a_100000764316_100015189358 [1,1,0,0,0,0|2,0,0]=4 3331 B17R2.3489 Cc1cc(ccc1OC[C@@H]2CCC(=O)N2)I 7a_100011218673_100015189358 [1,1,0,0,0,0|2,0,0]=4 3332 B17R2.3489 Cc1cc(ccc1OC[C@@H]2CCC(=O)N2)N 7a_100011218179_100015189358 [1,1,0,0,0,0|2,0,0]=4 3333 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)Br 34a_100000186361_100015307671 [1,1,0,0,0,0|2,0,0]=4 3334 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)Br 7a_100000186361_100015307671 [1,1,0,0,0,0|2,0,0]=4 3335 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)Cl 34a_100000211091_100015307671 [1,1,0,0,0,0|2,0,0]=4 3336 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)Cl 7a_100000211091_100015307671 [1,1,0,0,0,0|2,0,0]=4 3337 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)F 34a_100000764316_100015307671 [1,1,0,0,0,0|2,0,0]=4 3338 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)F 7a_100000764316_100015307671 [1,1,0,0,0,0|2,0,0]=4 3339 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)I 34a_100011218673_100015307671 [1,1,0,0,0,0|2,0,0]=4 3340 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)I 7a_100011218673_100015307671 [1,1,0,0,0,0|2,0,0]=4 3341 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)N 34a_100011218179_100015307671 [1,1,0,0,0,0|2,0,0]=4 3342 B17R2.3489 Cc1cc(ccc1OC[C@H]2COC(=O)N2)N 7a_100011218179_100015307671 [1,1,0,0,0,0|2,0,0]=4 3343 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100000701812 [1,1,0,0,0,0|0,1,0]=3 3344 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000701812_100000181169 [1,1,0,0,0,0|0,1,0]=3 3345 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100011219607 [1,1,0,0,0,0|0,1,0]=3 3346 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100011219607_100000181169 [1,1,0,0,0,0|0,1,0]=3 3347 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100011205405 [1,1,0,0,0,0|0,1,0]=3 3348 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)F 62a_100011205405_100000181169 [1,1,0,0,0,0|0,1,0]=3 3349 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_100000210723 [1,1,0,0,0,0|0,1,0]=3 3350 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000210723_100000181169 [1,1,0,0,0,0|0,1,0]=3 3351 B17R2.3489 Cc1cc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_100000690111 [1,1,0,0,0,0|0,1,0]=3 3352 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)Br 62a_100000073702_100000701812 [1,1,0,0,0,0|1,1,0]=4 3353 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)Br 62a_100000701812_100000073702 [1,1,0,0,0,0|1,1,0]=4 3354 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)Cl 62a_100000073702_100011219607 [1,1,0,0,0,0|1,1,0]=4 3355 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)Cl 62a_100011219607_100000073702 [1,1,0,0,0,0|1,1,0]=4 3356 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)F 62a_100000073702_100011205405 [1,1,0,0,0,0|1,1,0]=4 3357 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)F 62a_100011205405_100000073702 [1,1,0,0,0,0|1,1,0]=4 3358 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)N 62a_100000073702_100000210723 [1,1,0,0,0,0|1,1,0]=4 3359 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)N 62a_100000210723_100000073702 [1,1,0,0,0,0|1,1,0]=4 3360 B17R2.3489 Cc1cc(ccc1SCC2COC(=O)O2)O 62a_100000073702_100000690111 [1,1,0,0,0,0|1,1,0]=4 3361 B17R2.3489 Cc1cc(cnc1OCC2CNC(=O)O2)Br 34a_100000685391_100000181169 [1,1,0,0,0,0|1,0,0]=3 3362 B17R2.3489 Cc1cc(cnc1OCC2COC(=O)O2)Br 34a_100000685391_100000073702 [1,1,0,0,0,0|2,0,0]=4 3363 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)Br 62a_100000181169_100012353652 [1,1,0,0,0,0|1,1,0]=4 3364 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)Br 62a_100012353652_100000181169 [1,1,0,0,0,0|1,1,0]=4 3365 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)F 62a_100000181169_100009817009 [1,1,0,0,0,0|1,1,0]=4 3366 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)F 62a_100009817009_100000181169 [1,1,0,0,0,0|1,1,0]=4 3367 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)N 62a_100000181169_100000761747 [1,1,0,0,0,0|1,1,0]=4 3368 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)N 62a_100000761747_100000181169 [1,1,0,0,0,0|1,1,0]=4 3369 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)O 62a_100000181169_100012000486 [1,1,0,0,0,0|1,1,0]=4 3370 B17R2.3489 Cc1cc(cnc1SCC2CNC(=O)O2)O 62a_100012000486_100000181169 [1,1,0,0,0,0|1,1,0]=4 3371 B17R2.3489 Cc1cc(ncc1OCC2CNC(=O)O2)Cl 34a_100000692680_100000181169 [1,1,0,0,0,0|1,0,0]=3 3372 B17R2.3489 Cc1cc(ncc1OCC2CNC(=O)O2)Cl 7a_100000692680_100000181169 [1,1,0,0,0,0|1,0,0]=3 3373 B17R2.3489 Cc1cc(ncc1OCC2CNC(=O)O2)F 34a_100009856773_100000181169 [1,1,0,0,0,0|1,0,0]=3 3374 B17R2.3489 Cc1cc(ncc1OCC2CNC(=O)O2)F 7a_100009856773_100000181169 [1,1,0,0,0,0|1,0,0]=3 3375 B17R2.3489 Cc1cc(ncc1OCC2COC(=O)O2)Cl 34a_100000692680_100000073702 [1,1,0,0,0,0|2,0,0]=4 3376 B17R2.3489 Cc1cc(ncc1OCC2COC(=O)O2)F 34a_100009856773_100000073702 [1,1,0,0,0,0|2,0,0]=4 3377 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)Br 62a_100000181169_100009816104 [1,1,0,0,0,0|1,1,0]=4 3378 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)Br 62a_100009816104_100000181169 [1,1,0,0,0,0|1,1,0]=4 3379 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010172789 [1,1,0,0,0,0|1,1,0]=4 3380 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)Cl 62a_100010172789_100000181169 [1,1,0,0,0,0|1,1,0]=4 3381 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)F 62a_100000181169_100009820716 [1,1,0,0,0,0|1,1,0]=4 3382 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)F 62a_100009820716_100000181169 [1,1,0,0,0,0|1,1,0]=4 3383 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)N 62a_100000050067_100000181169 [1,1,0,0,0,0|1,1,0]=4 3384 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)N 62a_100000181169_100000050067 [1,1,0,0,0,0|1,1,0]=4 3385 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)O 62a_100000181169_100000766222 [1,1,0,0,0,0|1,1,0]=4 3386 B17R2.3489 Cc1cc(ncc1SCC2CNC(=O)O2)O 62a_100000766222_100000181169 [1,1,0,0,0,0|1,1,0]=4 3387 B17R2.3489 Cc1ccc(c(c1)Br)NCC2CNC(=O)O2 34a_100000210942_100000181169 [1,1,0,0,0,0|2,0,0]=4 3388 B17R2.3489 Cc1ccc(c(c1)Br)OCC2CNC(=O)O2 34a_100000210800_100000181169 [1,1,0,0,0,0|1,0,0]=3 3389 B17R2.3489 Cc1ccc(c(c1)Br)OCC2CNC(=O)O2 7a_100000210800_100000181169 [1,1,0,0,0,0|1,0,0]=3 3390 B17R2.3489 Cc1ccc(c(c1)Br)OCC2COC(=O)O2 34a_100000210800_100000073702 [1,1,0,0,0,0|2,0,0]=4 3391 B17R2.3489 Cc1ccc(c(c1)Br)SCC2CNC(=O)O2 62a_100000181169_100009813563 [1,1,0,0,0,0|1,1,0]=4 3392 B17R2.3489 Cc1ccc(c(c1)Br)SCC2CNC(=O)O2 62a_100009813563_100000181169 [1,1,0,0,0,0|1,1,0]=4 3393 B17R2.3489 Cc1ccc(c(c1)C)NCC2CNC(=O)O2 34a_100000736561_100000181169 [1,1,0,0,0,0|1,0,0]=3 3394 B17R2.3489 Cc1ccc(c(c1)C)NCC2CNC(=O)O2 7a_100000736561_100000181169 [1,1,0,0,0,0|1,0,0]=3 3395 B17R2.3489 Cc1ccc(c(c1)C)NCC2COC(=O)O2 34a_100000736561_100000073702 [1,1,0,0,0,0|2,0,0]=4 3396 B17R2.3489 Cc1ccc(c(c1)C)OCC2CNC(=O)O2 34a_100000211776_100000181169 [1,1,0,0,0,0|0,0,0]=2 3397 B17R2.3489 Cc1ccc(c(c1)C)OCC2CNC(=O)O2 7a_100000211776_100000181169 [1,1,0,0,0,0|0,0,0]=2 3398 B17R2.3489 Cc1ccc(c(c1)C)OCC2COC(=O)O2 34a_100000211776_100000073702 [1,1,0,0,0,0|1,0,0]=3 3399 B17R2.3489 Cc1ccc(c(c1)C)OC[C@@H]2CCC(=O)N2 7a_100000211776_100015189358 [1,1,0,0,0,0|2,0,0]=4 3400 B17R2.3489 Cc1ccc(c(c1)C)OC[C@H]2COC(=O)N2 34a_100000211776_100015307671 [1,1,0,0,0,0|2,0,0]=4 3401 B17R2.3489 Cc1ccc(c(c1)C)OC[C@H]2COC(=O)N2 7a_100000211776_100015307671 [1,1,0,0,0,0|2,0,0]=4 3402 B17R2.3489 Cc1ccc(c(c1)C)SCC2CNC(=O)O2 62a_100000181169_100011217332 [1,1,0,0,0,0|0,1,0]=3 3403 B17R2.3489 Cc1ccc(c(c1)C)SCC2CNC(=O)O2 62a_100011217332_100000181169 [1,1,0,0,0,0|0,1,0]=3 3404 B17R2.3489 Cc1ccc(c(c1)C)SCC2COC(=O)O2 62a_100000073702_100011217332 [1,1,0,0,0,0|1,1,0]=4 3405 B17R2.3489 Cc1ccc(c(c1)C)SCC2COC(=O)O2 62a_100011217332_100000073702 [1,1,0,0,0,0|1,1,0]=4 3406 B17R2.3489 Cc1ccc(c(c1)Cl)NCC2CNC(=O)O2 34a_100000210522_100000181169 [1,1,0,0,0,0|2,0,0]=4 3407 B17R2.3489 Cc1ccc(c(c1)Cl)OCC2CNC(=O)O2 34a_100000749699_100000181169 [1,1,0,0,0,0|1,0,0]=3 3408 B17R2.3489 Cc1ccc(c(c1)Cl)OCC2CNC(=O)O2 7a_100000749699_100000181169 [1,1,0,0,0,0|1,0,0]=3 3409 B17R2.3489 Cc1ccc(c(c1)Cl)OCC2COC(=O)O2 34a_100000749699_100000073702 [1,1,0,0,0,0|2,0,0]=4 3410 B17R2.3489 Cc1ccc(c(c1)Cl)SCC2CNC(=O)O2 62a_100000181169_100011263221 [1,1,0,0,0,0|1,1,0]=4 3411 B17R2.3489 Cc1ccc(c(c1)Cl)SCC2CNC(=O)O2 62a_100011263221_100000181169 [1,1,0,0,0,0|1,1,0]=4 3412 B17R2.3489 Cc1ccc(c(c1)F)NCC2CNC(=O)O2 34a_100000211023_100000181169 [1,1,0,0,0,0|2,0,0]=4 3413 B17R2.3489 Cc1ccc(c(c1)F)OCC2CNC(=O)O2 34a_100011216688_100000181169 [1,1,0,0,0,0|1,0,0]=3 3414 B17R2.3489 Cc1ccc(c(c1)F)OCC2CNC(=O)O2 7a_100011216688_100000181169 [1,1,0,0,0,0|1,0,0]=3 3415 B17R2.3489 Cc1ccc(c(c1)F)OCC2COC(=O)O2 34a_100011216688_100000073702 [1,1,0,0,0,0|2,0,0]=4 3416 B17R2.3489 Cc1ccc(c(c1)F)SCC2CNC(=O)O2 62a_100000181169_100011216119 [1,1,0,0,0,0|1,1,0]=4 3417 B17R2.3489 Cc1ccc(c(c1)F)SCC2CNC(=O)O2 62a_100011216119_100000181169 [1,1,0,0,0,0|1,1,0]=4 3418 B17R2.3489 Cc1ccc(c(c1)I)NCC2CNC(=O)O2 34a_100011356834_100000181169 [1,1,0,0,0,0|2,0,0]=4 3419 B17R2.3489 Cc1ccc(c(c1)I)OCC2CNC(=O)O2 34a_100000765521_100000181169 [1,1,0,0,0,0|1,0,0]=3 3420 B17R2.3489 Cc1ccc(c(c1)I)OCC2CNC(=O)O2 7a_100000765521_100000181169 [1,1,0,0,0,0|1,0,0]=3 3421 B17R2.3489 Cc1ccc(c(c1)I)OCC2COC(=O)O2 34a_100000765521_100000073702 [1,1,0,0,0,0|2,0,0]=4 3422 B17R2.3489 Cc1ccc(c(c1)N)OCC2CNC(=O)O2 34a_100011215204_100000181169 [1,1,0,0,0,0|1,0,0]=3 3423 B17R2.3489 Cc1ccc(c(c1)N)OCC2CNC(=O)O2 7a_100011215204_100000181169 [1,1,0,0,0,0|1,0,0]=3 3424 B17R2.3489 Cc1ccc(c(c1)N)OCC2COC(=O)O2 34a_100011215204_100000073702 [1,1,0,0,0,0|2,0,0]=4 3425 B17R2.3489 Cc1ccc(c(c1)N)SCC2CNC(=O)O2 62a_100000181169_100011216686 [1,1,0,0,0,0|1,1,0]=4 3426 B17R2.3489 Cc1ccc(c(c1)N)SCC2CNC(=O)O2 62a_100011216686_100000181169 [1,1,0,0,0,0|1,1,0]=4 3427 B17R2.3489 Cc1ccc(c(c1)O)NCC2CNC(=O)O2 34a_100000211527_100000181169 [1,1,0,0,0,0|1,0,0]=3 3428 B17R2.3489 Cc1ccc(c(c1)O)NCC2COC(=O)O2 34a_100000211527_100000073702 [1,1,0,0,0,0|2,0,0]=4 3429 B17R2.3489 Cc1ccc(c(c1)O)SCC2CNC(=O)O2 62a_100000181169_100012002257 [1,1,0,0,0,0|0,1,0]=3 3430 B17R2.3489 Cc1ccc(c(c1)O)SCC2CNC(=O)O2 62a_100012002257_100000181169 [1,1,0,0,0,0|0,1,0]=3 3431 B17R2.3489 Cc1ccc(c(c1)O)SCC2COC(=O)O2 62a_100000073702_100012002257 [1,1,0,0,0,0|1,1,0]=4 3432 B17R2.3489 Cc1ccc(c(c1)O)SCC2COC(=O)O2 62a_100012002257_100000073702 [1,1,0,0,0,0|1,1,0]=4 3433 B17R2.3489 Cc1ccc(c(n1)Br)OCC2CNC(=O)O2 34a_100000702858_100000181169 [1,1,0,0,0,0|2,0,0]=4 3434 B17R2.3489 Cc1ccc(c(n1)Br)OCC2CNC(=O)O2 7a_100000702858_100000181169 [1,1,0,0,0,0|2,0,0]=4 3435 B17R2.3489 Cc1ccc(c(n1)C)OCC2CNC(=O)O2 34a_100011218912_100000181169 [1,1,0,0,0,0|1,0,0]=3 3436 B17R2.3489 Cc1ccc(c(n1)C)OCC2CNC(=O)O2 7a_100011218912_100000181169 [1,1,0,0,0,0|1,0,0]=3 3437 B17R2.3489 Cc1ccc(c(n1)C)OCC2COC(=O)O2 34a_100011218912_100000073702 [1,1,0,0,0,0|2,0,0]=4 3438 B17R2.3489 Cc1ccc(c(n1)C)SCC2CNC(=O)O2 62a_100000181169_100009813853 [1,1,0,0,0,0|1,1,0]=4 3439 B17R2.3489 Cc1ccc(c(n1)C)SCC2CNC(=O)O2 62a_100009813853_100000181169 [1,1,0,0,0,0|1,1,0]=4 3440 B17R2.3489 Cc1ccc(c(n1)Cl)OCC2CNC(=O)O2 34a_100000086286_100000181169 [1,1,0,0,0,0|2,0,0]=4 3441 B17R2.3489 Cc1ccc(c(n1)Cl)OCC2CNC(=O)O2 7a_100000086286_100000181169 [1,1,0,0,0,0|2,0,0]=4 3442 B17R2.3489 Cc1ccc(c(n1)F)OCC2CNC(=O)O2 34a_100000079963_100000181169 [1,1,0,0,0,0|2,0,0]=4 3443 B17R2.3489 Cc1ccc(c(n1)F)OCC2CNC(=O)O2 7a_100000079963_100000181169 [1,1,0,0,0,0|2,0,0]=4 3444 B17R2.3489 Cc1ccc(c(n1)I)OCC2CNC(=O)O2 34a_100000023897_100000181169 [1,1,0,0,0,0|2,0,0]=4 3445 B17R2.3489 Cc1ccc(c(n1)I)OCC2CNC(=O)O2 7a_100000023897_100000181169 [1,1,0,0,0,0|2,0,0]=4 3446 B17R2.3489 Cc1ccc(c(n1)N)OCC2CNC(=O)O2 34a_100000694039_100000181169 [1,1,0,0,0,0|2,0,0]=4 3447 B17R2.3489 Cc1ccc(c(n1)N)OCC2CNC(=O)O2 7a_100000694039_100000181169 [1,1,0,0,0,0|2,0,0]=4 3448 B17R2.3489 Cc1ccc(c(n1)O)SCC2CNC(=O)O2 62a_100000181169_100009817604 [1,1,0,0,0,0|1,1,0]=4 3449 B17R2.3489 Cc1ccc(c(n1)O)SCC2CNC(=O)O2 62a_100009817604_100000181169 [1,1,0,0,0,0|1,1,0]=4 3450 B17R2.3489 Cc1cnc(c(c1)Br)OCC2CNC(=O)O2 34a_100000719714_100000181169 [1,1,0,0,0,0|2,0,0]=4 3451 B17R2.3489 Cc1cnc(c(c1)C)SCC2CNC(=O)O2 62a_100000181169_100009864548 [1,1,0,0,0,0|1,1,0]=4 3452 B17R2.3489 Cc1cnc(c(c1)C)SCC2CNC(=O)O2 62a_100009864548_100000181169 [1,1,0,0,0,0|1,1,0]=4 3453 B17R2.3489 Cc1cnc(c(c1)N)OCC2CNC(=O)O2 34a_100012000488_100000181169 [1,1,0,0,0,0|2,0,0]=4 3454 B17R2.3489 Cc1cnc(c(c1)O)SCC2CNC(=O)O2 62a_100000181169_100012000487 [1,1,0,0,0,0|1,1,0]=4 3455 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)Br 34a_100012002022_100000181169 [1,1,0,0,0,0|1,0,0]=3 3456 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)Br 7a_100012002022_100000181169 [1,1,0,0,0,0|1,0,0]=3 3457 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)Cl 34a_100012184626_100000181169 [1,1,0,0,0,0|1,0,0]=3 3458 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)Cl 7a_100012184626_100000181169 [1,1,0,0,0,0|1,0,0]=3 3459 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)F 34a_100009881036_100000181169 [1,1,0,0,0,0|1,0,0]=3 3460 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)F 7a_100009881036_100000181169 [1,1,0,0,0,0|1,0,0]=3 3461 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)I 34a_100010233687_100000181169 [1,1,0,0,0,0|1,0,0]=3 3462 B17R2.3489 Cc1nc(ccc1OCC2CNC(=O)O2)I 7a_100010233687_100000181169 [1,1,0,0,0,0|1,0,0]=3 3463 B17R2.3489 Cc1nc(ccc1OCC2COC(=O)O2)Br 34a_100012002022_100000073702 [1,1,0,0,0,0|2,0,0]=4 3464 B17R2.3489 Cc1nc(ccc1OCC2COC(=O)O2)Cl 34a_100012184626_100000073702 [1,1,0,0,0,0|2,0,0]=4 3465 B17R2.3489 Cc1nc(ccc1OCC2COC(=O)O2)F 34a_100009881036_100000073702 [1,1,0,0,0,0|2,0,0]=4 3466 B17R2.3489 Cc1nc(ccc1OCC2COC(=O)O2)I 34a_100010233687_100000073702 [1,1,0,0,0,0|2,0,0]=4 3467 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)Cl 62a_100000062408_100000181169 [1,1,0,0,0,0|1,1,0]=4 3468 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100000062408 [1,1,0,0,0,0|1,1,0]=4 3469 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100000688911 [1,1,0,0,0,0|1,1,0]=4 3470 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)F 62a_100000688911_100000181169 [1,1,0,0,0,0|1,1,0]=4 3471 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_100000187202 [1,1,0,0,0,0|1,1,0]=4 3472 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)N 62a_100000187202_100000181169 [1,1,0,0,0,0|1,1,0]=4 3473 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_100000691680 [1,1,0,0,0,0|1,1,0]=4 3474 B17R2.3489 Cc1nc(ccc1SCC2CNC(=O)O2)O 62a_100000691680_100000181169 [1,1,0,0,0,0|1,1,0]=4 3475 B17R2.3489 Cc1ncc(c(n1)C)OCC2CNC(=O)O2 34a_100009864123_100000181169 [1,1,0,0,0,0|2,0,0]=4 3476 B17R2.3489 Cc1ncc(c(n1)C)OCC2CNC(=O)O2 7a_100009864123_100000181169 [1,1,0,0,0,0|2,0,0]=4 3477 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000752626_100000181169 [1,1,0,0,0,0|1,0,0]=3 3478 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000752626_100000181169 [1,1,0,0,0,0|1,0,0]=3 3479 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000210500_100000181169 [1,1,0,0,0,0|1,0,0]=3 3480 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)Cl 7a_100000210500_100000181169 [1,1,0,0,0,0|1,0,0]=3 3481 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)F 34a_100000759472_100000181169 [1,1,0,0,0,0|1,0,0]=3 3482 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)F 7a_100000759472_100000181169 [1,1,0,0,0,0|1,0,0]=3 3483 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)I 34a_100000753495_100000181169 [1,1,0,0,0,0|1,0,0]=3 3484 B17R2.3489 Nc1cc(ccc1OCC2CNC(=O)O2)I 7a_100000753495_100000181169 [1,1,0,0,0,0|1,0,0]=3 3485 B17R2.3489 Nc1cc(ccc1OCC2COC(=O)O2)Br 34a_100000752626_100000073702 [1,1,0,0,0,0|2,0,0]=4 3486 B17R2.3489 Nc1cc(ccc1OCC2COC(=O)O2)Cl 34a_100000210500_100000073702 [1,1,0,0,0,0|2,0,0]=4 3487 B17R2.3489 Nc1cc(ccc1OCC2COC(=O)O2)F 34a_100000759472_100000073702 [1,1,0,0,0,0|2,0,0]=4 3488 B17R2.3489 Nc1cc(ccc1OCC2COC(=O)O2)I 34a_100000753495_100000073702 [1,1,0,0,0,0|2,0,0]=4 3489 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100000743836 [1,1,0,0,0,0|1,1,0]=4 3490 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000743836_100000181169 [1,1,0,0,0,0|1,1,0]=4 3491 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100000761886 [1,1,0,0,0,0|1,1,0]=4 3492 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)Cl 62a_100000761886_100000181169 [1,1,0,0,0,0|1,1,0]=4 3493 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100000687223 [1,1,0,0,0,0|1,1,0]=4 3494 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000687223_100000181169 [1,1,0,0,0,0|1,1,0]=4 3495 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_100011999798 [1,1,0,0,0,0|1,1,0]=4 3496 B17R2.3489 Nc1cc(ccc1SCC2CNC(=O)O2)O 62a_100011999798_100000181169 [1,1,0,0,0,0|1,1,0]=4 3497 B17R2.3489 Nc1cc(cnc1OCC2CNC(=O)O2)Br 34a_100000743729_100000181169 [1,1,0,0,0,0|2,0,0]=4 3498 B17R2.3489 Nc1cc(cnc1OCC2CNC(=O)O2)Cl 34a_100011998249_100000181169 [1,1,0,0,0,0|2,0,0]=4 3499 B17R2.3489 Nc1cc(ncc1OCC2CNC(=O)O2)Br 34a_100009819941_100000181169 [1,1,0,0,0,0|2,0,0]=4 3500 B17R2.3489 Nc1cc(ncc1OCC2CNC(=O)O2)Br 7a_100009819941_100000181169 [1,1,0,0,0,0|2,0,0]=4 3501 B17R2.3489 Nc1ccc(c(c1)Br)OCC2CNC(=O)O2 34a_100011534360_100000181169 [1,1,0,0,0,0|1,0,0]=3 3502 B17R2.3489 Nc1ccc(c(c1)Br)OCC2CNC(=O)O2 7a_100011534360_100000181169 [1,1,0,0,0,0|1,0,0]=3 3503 B17R2.3489 Nc1ccc(c(c1)Br)OCC2COC(=O)O2 34a_100011534360_100000073702 [1,1,0,0,0,0|2,0,0]=4 3504 B17R2.3489 Nc1ccc(c(c1)Br)SCC2CNC(=O)O2 62a_100000181169_100000750458 [1,1,0,0,0,0|1,1,0]=4 3505 B17R2.3489 Nc1ccc(c(c1)Br)SCC2CNC(=O)O2 62a_100000750458_100000181169 [1,1,0,0,0,0|1,1,0]=4 3506 B17R2.3489 Nc1ccc(c(c1)Cl)OCC2CNC(=O)O2 34a_100000744943_100000181169 [1,1,0,0,0,0|1,0,0]=3 3507 B17R2.3489 Nc1ccc(c(c1)Cl)OCC2CNC(=O)O2 7a_100000744943_100000181169 [1,1,0,0,0,0|1,0,0]=3 3508 B17R2.3489 Nc1ccc(c(c1)Cl)OCC2COC(=O)O2 34a_100000744943_100000073702 [1,1,0,0,0,0|2,0,0]=4 3509 B17R2.3489 Nc1ccc(c(c1)Cl)SCC2CNC(=O)O2 62a_100000181169_100000761885 [1,1,0,0,0,0|1,1,0]=4 3510 B17R2.3489 Nc1ccc(c(c1)Cl)SCC2CNC(=O)O2 62a_100000761885_100000181169 [1,1,0,0,0,0|1,1,0]=4 3511 B17R2.3489 Nc1ccc(c(c1)F)OCC2CNC(=O)O2 34a_100011220035_100000181169 [1,1,0,0,0,0|1,0,0]=3 3512 B17R2.3489 Nc1ccc(c(c1)F)OCC2CNC(=O)O2 7a_100011220035_100000181169 [1,1,0,0,0,0|1,0,0]=3 3513 B17R2.3489 Nc1ccc(c(c1)F)OCC2COC(=O)O2 34a_100011220035_100000073702 [1,1,0,0,0,0|2,0,0]=4 3514 B17R2.3489 Nc1ccc(c(c1)F)SCC2CNC(=O)O2 62a_100000181169_100011356925 [1,1,0,0,0,0|1,1,0]=4 3515 B17R2.3489 Nc1ccc(c(c1)F)SCC2CNC(=O)O2 62a_100011356925_100000181169 [1,1,0,0,0,0|1,1,0]=4 3516 B17R2.3489 Nc1ccc(c(c1)N)OCC2CNC(=O)O2 34a_100000725306_100000181169 [1,1,0,0,0,0|1,0,0]=3 3517 B17R2.3489 Nc1ccc(c(c1)N)OCC2COC(=O)O2 34a_100000725306_100000073702 [1,1,0,0,0,0|2,0,0]=4 3518 B17R2.3489 Nc1ccc(c(c1)N)SCC2CNC(=O)O2 62a_100000181169_200012175722 [1,1,0,0,0,0|1,1,0]=4 3519 B17R2.3489 Nc1ccc(c(c1)N)SCC2CNC(=O)O2 62a_200012175722_100000181169 [1,1,0,0,0,0|1,1,0]=4 3520 B17R2.3489 Nc1nc(ccc1OCC2CNC(=O)O2)Br 34a_100000685527_100000181169 [1,1,0,0,0,0|2,0,0]=4 3521 B17R2.3489 Nc1nc(ccc1OCC2CNC(=O)O2)Br 7a_100000685527_100000181169 [1,1,0,0,0,0|2,0,0]=4 3522 B17R2.3489 Nc1nc(ccc1OCC2CNC(=O)O2)Cl 34a_100000717809_100000181169 [1,1,0,0,0,0|2,0,0]=4 3523 B17R2.3489 Nc1nc(ccc1OCC2CNC(=O)O2)Cl 7a_100000717809_100000181169 [1,1,0,0,0,0|2,0,0]=4 3524 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Br)Br 34a_100000211012_100000181169 [1,1,0,0,0,0|2,0,0]=4 3525 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Br)Cl 34a_100000752454_100000181169 [1,1,0,0,0,0|2,0,0]=4 3526 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Br)F 34a_100000738039_100000181169 [1,1,0,0,0,0|2,0,0]=4 3527 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Br)O 34a_100012001276_100000181169 [1,1,0,0,0,0|2,0,0]=4 3528 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Cl)Br 34a_100000211467_100000181169 [1,1,0,0,0,0|2,0,0]=4 3529 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Cl)Cl 34a_100000185861_100000181169 [1,1,0,0,0,0|2,0,0]=4 3530 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Cl)F 34a_100000212003_100000181169 [1,1,0,0,0,0|2,0,0]=4 3531 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Cl)I 34a_100011218065_100000181169 [1,1,0,0,0,0|2,0,0]=4 3532 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2Cl)O 34a_100011215599_100000181169 [1,1,0,0,0,0|2,0,0]=4 3533 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2F)Br 34a_100000210722_100000181169 [1,1,0,0,0,0|2,0,0]=4 3534 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2F)Cl 34a_100000211020_100000181169 [1,1,0,0,0,0|2,0,0]=4 3535 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2F)F 34a_100000210720_100000181169 [1,1,0,0,0,0|2,0,0]=4 3536 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2F)I 34a_100011215594_100000181169 [1,1,0,0,0,0|2,0,0]=4 3537 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2F)O 34a_100000759473_100000181169 [1,1,0,0,0,0|2,0,0]=4 3538 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2I)Br 34a_100000187925_100000181169 [1,1,0,0,0,0|2,0,0]=4 3539 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2I)Cl 34a_100000761889_100000181169 [1,1,0,0,0,0|2,0,0]=4 3540 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2I)F 34a_100000760547_100000181169 [1,1,0,0,0,0|2,0,0]=4 3541 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2I)O 34a_100010084370_100000181169 [1,1,0,0,0,0|2,0,0]=4 3542 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2O)Br 34a_100000739049_100000181169 [1,1,0,0,0,0|1,0,0]=3 3543 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2O)Cl 34a_100000185728_100000181169 [1,1,0,0,0,0|1,0,0]=3 3544 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2O)F 34a_100000753323_100000181169 [1,1,0,0,0,0|1,0,0]=3 3545 B17R2.3489 O=C1NCC(O1)CNc2ccc(cc2O)O 34a_100000106777_100000181169 [1,1,0,0,0,0|1,0,0]=3 3546 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)Br 34a_100000188717_100000181169 [1,1,0,0,0,0|1,0,0]=3 3547 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)Br 7a_100000188717_100000181169 [1,1,0,0,0,0|1,0,0]=3 3548 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)Cl 34a_100000211998_100000181169 [1,1,0,0,0,0|1,0,0]=3 3549 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)Cl 7a_100000211998_100000181169 [1,1,0,0,0,0|1,0,0]=3 3550 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)F 34a_100000211999_100000181169 [1,1,0,0,0,0|1,0,0]=3 3551 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)F 7a_100000211999_100000181169 [1,1,0,0,0,0|1,0,0]=3 3552 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)I 34a_100012361655_100000181169 [1,1,0,0,0,0|1,0,0]=3 3553 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Br)I 7a_100012361655_100000181169 [1,1,0,0,0,0|1,0,0]=3 3554 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)Br 34a_100000186472_100000181169 [1,1,0,0,0,0|1,0,0]=3 3555 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)Br 7a_100000186472_100000181169 [1,1,0,0,0,0|1,0,0]=3 3556 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)Cl 34a_100015191787_100000181169 [1,1,0,0,0,0|1,0,0]=3 3557 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)Cl 7a_100015191787_100000181169 [1,1,0,0,0,0|1,0,0]=3 3558 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)F 34a_100000212004_100000181169 [1,1,0,0,0,0|1,0,0]=3 3559 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)F 7a_100000212004_100000181169 [1,1,0,0,0,0|1,0,0]=3 3560 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)I 34a_100012360047_100000181169 [1,1,0,0,0,0|1,0,0]=3 3561 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2Cl)I 7a_100012360047_100000181169 [1,1,0,0,0,0|1,0,0]=3 3562 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)Br 34a_100000185481_100000181169 [1,1,0,0,0,0|1,0,0]=3 3563 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)Br 7a_100000185481_100000181169 [1,1,0,0,0,0|1,0,0]=3 3564 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)Cl 34a_100000230166_100000181169 [1,1,0,0,0,0|1,0,0]=3 3565 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)Cl 7a_100000230166_100000181169 [1,1,0,0,0,0|1,0,0]=3 3566 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)F 34a_100000230127_100000181169 [1,1,0,0,0,0|1,0,0]=3 3567 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)F 7a_100000230127_100000181169 [1,1,0,0,0,0|1,0,0]=3 3568 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)I 34a_100011356965_100000181169 [1,1,0,0,0,0|1,0,0]=3 3569 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2F)I 7a_100011356965_100000181169 [1,1,0,0,0,0|1,0,0]=3 3570 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)Br 34a_100012355227_100000181169 [1,1,0,0,0,0|1,0,0]=3 3571 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)Br 7a_100012355227_100000181169 [1,1,0,0,0,0|1,0,0]=3 3572 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)Cl 34a_100011356953_100000181169 [1,1,0,0,0,0|1,0,0]=3 3573 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)Cl 7a_100011356953_100000181169 [1,1,0,0,0,0|1,0,0]=3 3574 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)F 34a_100012355409_100000181169 [1,1,0,0,0,0|1,0,0]=3 3575 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)F 7a_100012355409_100000181169 [1,1,0,0,0,0|1,0,0]=3 3576 B17R2.3489 O=C1NCC(O1)COc2ccc(cc2I)I 7a_100010001573_100000181169 [1,1,0,0,0,0|1,0,0]=3 3577 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)Br 34a_100009999766_100000181169 [1,1,0,0,0,0|2,0,0]=4 3578 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)Br 7a_100009999766_100000181169 [1,1,0,0,0,0|2,0,0]=4 3579 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)Cl 34a_100010219353_100000181169 [1,1,0,0,0,0|2,0,0]=4 3580 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)Cl 7a_100010219353_100000181169 [1,1,0,0,0,0|2,0,0]=4 3581 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)F 34a_100009887730_100000181169 [1,1,0,0,0,0|2,0,0]=4 3582 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)F 7a_100009887730_100000181169 [1,1,0,0,0,0|2,0,0]=4 3583 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)I 34a_100000725334_100000181169 [1,1,0,0,0,0|2,0,0]=4 3584 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Br)I 7a_100000725334_100000181169 [1,1,0,0,0,0|2,0,0]=4 3585 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Cl)Br 34a_100010246206_100000181169 [1,1,0,0,0,0|2,0,0]=4 3586 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Cl)Br 7a_100010246206_100000181169 [1,1,0,0,0,0|2,0,0]=4 3587 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Cl)Cl 34a_100000101165_100000181169 [1,1,0,0,0,0|2,0,0]=4 3588 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Cl)Cl 7a_100000101165_100000181169 [1,1,0,0,0,0|2,0,0]=4 3589 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Cl)I 34a_100000721234_100000181169 [1,1,0,0,0,0|2,0,0]=4 3590 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2Cl)I 7a_100000721234_100000181169 [1,1,0,0,0,0|2,0,0]=4 3591 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2F)Br 34a_100009819667_100000181169 [1,1,0,0,0,0|2,0,0]=4 3592 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2F)Br 7a_100009819667_100000181169 [1,1,0,0,0,0|2,0,0]=4 3593 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2F)Cl 34a_100009880201_100000181169 [1,1,0,0,0,0|2,0,0]=4 3594 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2F)Cl 7a_100009880201_100000181169 [1,1,0,0,0,0|2,0,0]=4 3595 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2F)F 34a_100000101184_100000181169 [1,1,0,0,0,0|2,0,0]=4 3596 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2F)F 7a_100000101184_100000181169 [1,1,0,0,0,0|2,0,0]=4 3597 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2I)Br 34a_100010253912_100000181169 [1,1,0,0,0,0|2,0,0]=4 3598 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2I)Br 7a_100010253912_100000181169 [1,1,0,0,0,0|2,0,0]=4 3599 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2I)Cl 34a_100000696390_100000181169 [1,1,0,0,0,0|2,0,0]=4 3600 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2I)Cl 7a_100000696390_100000181169 [1,1,0,0,0,0|2,0,0]=4 3601 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2I)F 34a_100010382442_100000181169 [1,1,0,0,0,0|2,0,0]=4 3602 B17R2.3489 O=C1NCC(O1)COc2ccc(nc2I)F 7a_100010382442_100000181169 [1,1,0,0,0,0|2,0,0]=4 3603 B17R2.3489 O=C1NCC(O1)COc2cnc(cc2Cl)Cl 34a_100009868576_100000181169 [1,1,0,0,0,0|2,0,0]=4 3604 B17R2.3489 O=C1NCC(O1)COc2cnc(cc2Cl)Cl 7a_100009868576_100000181169 [1,1,0,0,0,0|2,0,0]=4 3605 B17R2.3489 O=C1NCC(O1)COc2cnc(cc2F)F 34a_100009885687_100000181169 [1,1,0,0,0,0|2,0,0]=4 3606 B17R2.3489 O=C1NCC(O1)COc2cnc(cc2F)F 7a_100009885687_100000181169 [1,1,0,0,0,0|2,0,0]=4 3607 B17R2.3489 O=C1NCC(O1)COc2cnc(cc2I)Cl 34a_100000698892_100000181169 [1,1,0,0,0,0|2,0,0]=4 3608 B17R2.3489 O=C1NCC(O1)COc2cnc(cc2I)Cl 7a_100000698892_100000181169 [1,1,0,0,0,0|2,0,0]=4 3609 B17R2.3489 O=C1NCC(O1)COc2ncc(cc2Br)Br 34a_100000701035_100000181169 [1,1,0,0,0,0|2,0,0]=4 3610 B17R2.3489 O=C1NCC(O1)COc2ncc(cc2Cl)Br 34a_100012339560_100000181169 [1,1,0,0,0,0|2,0,0]=4 3611 B17R2.3489 O=C1NCC(O1)COc2ncc(cc2Cl)F 34a_100009847679_100000181169 [1,1,0,0,0,0|2,0,0]=4 3612 B17R2.3489 O=C1NCC(O1)COc2ncc(cc2F)Cl 34a_100011998252_100000181169 [1,1,0,0,0,0|2,0,0]=4 3613 B17R2.3489 O=C1NCC(O1)COc2ncc(cc2F)F 34a_100012025737_100000181169 [1,1,0,0,0,0|2,0,0]=4 3614 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)Br 62a_100000181169_100011484698 [1,1,0,0,0,0|1,1,0]=4 3615 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)Br 62a_100011484698_100000181169 [1,1,0,0,0,0|1,1,0]=4 3616 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)Cl 62a_100000181169_100011219703 [1,1,0,0,0,0|1,1,0]=4 3617 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)Cl 62a_100011219703_100000181169 [1,1,0,0,0,0|1,1,0]=4 3618 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)F 62a_100000181169_100011217111 [1,1,0,0,0,0|1,1,0]=4 3619 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)F 62a_100011217111_100000181169 [1,1,0,0,0,0|1,1,0]=4 3620 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)O 62a_100000181169_100000701344 [1,1,0,0,0,0|1,1,0]=4 3621 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Br)O 62a_100000701344_100000181169 [1,1,0,0,0,0|1,1,0]=4 3622 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)Br 62a_100000181169_100011216062 [1,1,0,0,0,0|1,1,0]=4 3623 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)Br 62a_100011216062_100000181169 [1,1,0,0,0,0|1,1,0]=4 3624 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)Cl 62a_100000181169_100000699841 [1,1,0,0,0,0|1,1,0]=4 3625 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)Cl 62a_100000699841_100000181169 [1,1,0,0,0,0|1,1,0]=4 3626 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)F 62a_100000181169_100000733362 [1,1,0,0,0,0|1,1,0]=4 3627 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)F 62a_100000733362_100000181169 [1,1,0,0,0,0|1,1,0]=4 3628 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)O 62a_100000047559_100000181169 [1,1,0,0,0,0|1,1,0]=4 3629 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2Cl)O 62a_100000181169_100000047559 [1,1,0,0,0,0|1,1,0]=4 3630 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)Br 62a_100000181169_100009814013 [1,1,0,0,0,0|1,1,0]=4 3631 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)Br 62a_100009814013_100000181169 [1,1,0,0,0,0|1,1,0]=4 3632 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)Cl 62a_100000181169_100011216042 [1,1,0,0,0,0|1,1,0]=4 3633 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)Cl 62a_100011216042_100000181169 [1,1,0,0,0,0|1,1,0]=4 3634 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)F 62a_100000181169_100000750030 [1,1,0,0,0,0|1,1,0]=4 3635 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)F 62a_100000750030_100000181169 [1,1,0,0,0,0|1,1,0]=4 3636 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)O 62a_100000181169_100000755031 [1,1,0,0,0,0|1,1,0]=4 3637 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2F)O 62a_100000755031_100000181169 [1,1,0,0,0,0|1,1,0]=4 3638 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)Br 62a_100000181169_100012344904 [1,1,0,0,0,0|0,1,0]=3 3639 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)Br 62a_100012344904_100000181169 [1,1,0,0,0,0|0,1,0]=3 3640 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)Cl 62a_100000050036_100000181169 [1,1,0,0,0,0|0,1,0]=3 3641 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)Cl 62a_100000181169_100000050036 [1,1,0,0,0,0|0,1,0]=3 3642 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)F 62a_100000181169_100000690578 [1,1,0,0,0,0|0,1,0]=3 3643 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)F 62a_100000690578_100000181169 [1,1,0,0,0,0|0,1,0]=3 3644 B17R2.3489 O=C1NCC(O1)CSc2ccc(cc2O)O 62a_100000181169_100009813921 [1,1,0,0,0,0|0,1,0]=3 3645 B17R2.3489 O=C1NCC(O1)CSc2ncc(cc2O)Br 62a_100000181169_100010210634 [1,1,0,0,0,0|1,1,0]=4 3646 B17R2.3489 O=C1NCC(O1)CSc2ncc(cc2O)Br 62a_100010210634_100000181169 [1,1,0,0,0,0|1,1,0]=4 3647 B17R2.3489 O=C1NCC(O1)CSc2ncc(cc2O)Cl 62a_100000181169_100010233512 [1,1,0,0,0,0|1,1,0]=4 3648 B17R2.3489 O=C1NCC(O1)CSc2ncc(cc2O)Cl 62a_100010233512_100000181169 [1,1,0,0,0,0|1,1,0]=4 3649 B17R2.3489 O=C1NCC(O1)CSc2ncc(cc2O)F 62a_100000181169_100000079967 [1,1,0,0,0,0|1,1,0]=4 3650 B17R2.3489 O=C1NCC(O1)CSc2ncc(cc2O)F 62a_100009820119_100000181169 [1,1,0,0,0,0|1,1,0]=4 3651 B17R2.3489 O=C1OCC(O1)CNc2ccc(cc2O)Br 34a_100000739049_100000073702 [1,1,0,0,0,0|2,0,0]=4 3652 B17R2.3489 O=C1OCC(O1)CNc2ccc(cc2O)Cl 34a_100000185728_100000073702 [1,1,0,0,0,0|2,0,0]=4 3653 B17R2.3489 O=C1OCC(O1)CNc2ccc(cc2O)F 34a_100000753323_100000073702 [1,1,0,0,0,0|2,0,0]=4 3654 B17R2.3489 O=C1OCC(O1)CNc2ccc(cc2O)O 34a_100000106777_100000073702 [1,1,0,0,0,0|2,0,0]=4 3655 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Br)Br 34a_100000188717_100000073702 [1,1,0,0,0,0|2,0,0]=4 3656 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Br)Cl 34a_100000211998_100000073702 [1,1,0,0,0,0|2,0,0]=4 3657 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Br)F 34a_100000211999_100000073702 [1,1,0,0,0,0|2,0,0]=4 3658 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Br)I 34a_100012361655_100000073702 [1,1,0,0,0,0|2,0,0]=4 3659 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Cl)Br 34a_100000186472_100000073702 [1,1,0,0,0,0|2,0,0]=4 3660 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Cl)Cl 34a_100015191787_100000073702 [1,1,0,0,0,0|2,0,0]=4 3661 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Cl)F 34a_100000212004_100000073702 [1,1,0,0,0,0|2,0,0]=4 3662 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2Cl)I 34a_100012360047_100000073702 [1,1,0,0,0,0|2,0,0]=4 3663 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2F)Br 34a_100000185481_100000073702 [1,1,0,0,0,0|2,0,0]=4 3664 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2F)Cl 34a_100000230166_100000073702 [1,1,0,0,0,0|2,0,0]=4 3665 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2F)F 34a_100000230127_100000073702 [1,1,0,0,0,0|2,0,0]=4 3666 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2F)I 34a_100011356965_100000073702 [1,1,0,0,0,0|2,0,0]=4 3667 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2I)Br 34a_100012355227_100000073702 [1,1,0,0,0,0|2,0,0]=4 3668 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2I)Cl 34a_100011356953_100000073702 [1,1,0,0,0,0|2,0,0]=4 3669 B17R2.3489 O=C1OCC(O1)COc2ccc(cc2I)F 34a_100012355409_100000073702 [1,1,0,0,0,0|2,0,0]=4 3670 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)Br 62a_100000073702_100012344904 [1,1,0,0,0,0|1,1,0]=4 3671 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)Br 62a_100012344904_100000073702 [1,1,0,0,0,0|1,1,0]=4 3672 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)Cl 62a_100000050036_100000073702 [1,1,0,0,0,0|1,1,0]=4 3673 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)Cl 62a_100000073702_100000050036 [1,1,0,0,0,0|1,1,0]=4 3674 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)F 62a_100000073702_100000690578 [1,1,0,0,0,0|1,1,0]=4 3675 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)F 62a_100000690578_100000073702 [1,1,0,0,0,0|1,1,0]=4 3676 B17R2.3489 O=C1OCC(O1)CSc2ccc(cc2O)O 62a_100000073702_100009813921 [1,1,0,0,0,0|1,1,0]=4 3677 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2Br 2230a_100020606079_100000181169 [1,1,0,0,0,0|2,0,0]=4 3678 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2Br 269982a_100020606079_100000181169 [1,1,0,0,0,0|2,0,0]=4 3679 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2Br 34a_100020606079_100000181169 [1,1,0,0,0,0|2,0,0]=4 3680 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2Cl 2230a_100000219374_100000181169 [1,1,0,0,0,0|2,0,0]=4 3681 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2Cl 269982a_100000219374_100000181169 [1,1,0,0,0,0|2,0,0]=4 3682 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2Cl 34a_100000219374_100000181169 [1,1,0,0,0,0|2,0,0]=4 3683 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2F 2230a_100000220357_100000181169 [1,1,0,0,0,0|2,0,0]=4 3684 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2F 269982a_100000220357_100000181169 [1,1,0,0,0,0|2,0,0]=4 3685 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2F 34a_100000220357_100000181169 [1,1,0,0,0,0|2,0,0]=4 3686 B17R2.18632 CN(CC1CNC(=O)O1)c2ccccc2O 269982a_100000033821_100000181169 [1,1,0,0,0,0|1,0,0]=3 3687 B17R2.18632 CN(CC1COC(=O)O1)c2ccccc2O 269982a_100000033821_100000073702 [1,1,0,0,0,0|2,0,0]=4 3688 B17R2.18632 Cc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000212026_100000181169 [1,1,0,0,0,0|1,0,0]=3 3689 B17R2.18632 Cc1ccccc1C(=O)CC2COC(=O)O2 1458a_100000212026_100000073702 [1,1,0,0,0,0|2,0,0]=4 3690 B17R2.18632 Cc1ccccc1N(C)CC2CNC(=O)O2 2230a_100000219699_100000181169 [1,1,0,0,0,0|1,0,0]=3 3691 B17R2.18632 Cc1ccccc1N(C)CC2CNC(=O)O2 269982a_100000219699_100000181169 [1,1,0,0,0,0|1,0,0]=3 3692 B17R2.18632 Cc1ccccc1N(C)CC2CNC(=O)O2 34a_100000219699_100000181169 [1,1,0,0,0,0|1,0,0]=3 3693 B17R2.18632 Cc1ccccc1N(C)CC2COC(=O)O2 269982a_100000219699_100000073702 [1,1,0,0,0,0|2,0,0]=4 3694 B17R2.18632 Cc1ccccc1N(C)CC2COC(=O)O2 34a_100000219699_100000073702 [1,1,0,0,0,0|2,0,0]=4 3695 B17R2.18632 O=C1NCC(O1)CC(=O)c2ccccc2Br 1458a_100000188424_100000181169 [1,1,0,0,0,0|2,0,0]=4 3696 B17R2.18632 O=C1NCC(O1)CC(=O)c2ccccc2Cl 1458a_100000185844_100000181169 [1,1,0,0,0,0|2,0,0]=4 3697 B17R2.18632 O=C1NCC(O1)CC(=O)c2ccccc2F 1458a_100000188656_100000181169 [1,1,0,0,0,0|2,0,0]=4 3698 B17R2.18632 O=C1NCC(O1)CC(=O)c2ccccc2I 1458a_100000187884_100000181169 [1,1,0,0,0,0|2,0,0]=4 3699 B17R2.18632 O=C1NCC(O1)CC(=O)c2ccccc2O 1458a_100015234032_100000181169 [1,1,0,0,0,0|1,0,0]=3 3700 B17R2.18632 O=C1NCC(O1)CC(=O)c2ccccc2[O-] 1458a_100009911694_100000181169 [1,1,0,0,0,0|1,0,1]=4 3701 B17R2.18632 O=C1OCC(O1)CC(=O)c2ccccc2O 1458a_100015234032_100000073702 [1,1,0,0,0,0|2,0,0]=4 3702 B17R2.18656 Cc1cc(c(cn1)Br)OCC2CNC(=O)O2 34a_100011016184_100000181169 [1,1,0,0,0,0|2,0,0]=4 3703 B17R2.18656 Cc1cc(c(cn1)C)SCC2CNC(=O)O2 62a_100000181169_100009862788 [1,1,0,0,0,0|1,1,0]=4 3704 B17R2.18656 Cc1cc(c(cn1)C)SCC2CNC(=O)O2 62a_100009862788_100000181169 [1,1,0,0,0,0|1,1,0]=4 3705 B17R2.18656 Cc1cc(c(cn1)O)SCC2CNC(=O)O2 62a_100000181169_100009843476 [1,1,0,0,0,0|1,1,0]=4 3706 B17R2.18656 Cc1cc(c(cn1)O)SCC2CNC(=O)O2 62a_100009843476_100000181169 [1,1,0,0,0,0|1,1,0]=4 3707 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)Br 34a_100000745044_100000181169 [1,1,0,0,0,0|2,0,0]=4 3708 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)C 2230a_100000185781_100000181169 [1,1,0,0,0,0|1,0,0]=3 3709 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)C 34a_100000185781_100000181169 [1,1,0,0,0,0|1,0,0]=3 3710 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)C 7a_100000185781_100000181169 [1,1,0,0,0,0|1,0,0]=3 3711 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)Cl 34a_100011215360_100000181169 [1,1,0,0,0,0|2,0,0]=4 3712 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)F 34a_100000211285_100000181169 [1,1,0,0,0,0|2,0,0]=4 3713 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)I 34a_100011216686_100000181169 [1,1,0,0,0,0|2,0,0]=4 3714 B17R2.18656 Cc1ccc(c(c1)NCC2CNC(=O)O2)O 34a_100011215204_100000181169 [1,1,0,0,0,0|1,0,0]=3 3715 B17R2.18656 Cc1ccc(c(c1)NCC2COC(=O)O2)C 34a_100000185781_100000073702 [1,1,0,0,0,0|2,0,0]=4 3716 B17R2.18656 Cc1ccc(c(c1)NCC2COC(=O)O2)O 34a_100011215204_100000073702 [1,1,0,0,0,0|2,0,0]=4 3717 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)Br 34a_100012002257_100000181169 [1,1,0,0,0,0|1,0,0]=3 3718 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)Br 7a_100012002257_100000181169 [1,1,0,0,0,0|1,0,0]=3 3719 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)C 34a_100000210931_100000181169 [1,1,0,0,0,0|0,0,0]=2 3720 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)C 7a_100000210931_100000181169 [1,1,0,0,0,0|0,0,0]=2 3721 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)Cl 34a_100000211493_100000181169 [1,1,0,0,0,0|1,0,0]=3 3722 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)Cl 7a_100000211493_100000181169 [1,1,0,0,0,0|1,0,0]=3 3723 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)F 34a_100000759540_100000181169 [1,1,0,0,0,0|1,0,0]=3 3724 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)F 7a_100000759540_100000181169 [1,1,0,0,0,0|1,0,0]=3 3725 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)N 34a_100000211527_100000181169 [1,1,0,0,0,0|1,0,0]=3 3726 B17R2.18656 Cc1ccc(c(c1)OCC2CNC(=O)O2)N 7a_100000211527_100000181169 [1,1,0,0,0,0|1,0,0]=3 3727 B17R2.18656 Cc1ccc(c(c1)OCC2COC(=O)O2)Br 34a_100012002257_100000073702 [1,1,0,0,0,0|2,0,0]=4 3728 B17R2.18656 Cc1ccc(c(c1)OCC2COC(=O)O2)C 34a_100000210931_100000073702 [1,1,0,0,0,0|1,0,0]=3 3729 B17R2.18656 Cc1ccc(c(c1)OCC2COC(=O)O2)Cl 34a_100000211493_100000073702 [1,1,0,0,0,0|2,0,0]=4 3730 B17R2.18656 Cc1ccc(c(c1)OCC2COC(=O)O2)F 34a_100000759540_100000073702 [1,1,0,0,0,0|2,0,0]=4 3731 B17R2.18656 Cc1ccc(c(c1)OCC2COC(=O)O2)N 34a_100000211527_100000073702 [1,1,0,0,0,0|2,0,0]=4 3732 B17R2.18656 Cc1ccc(c(c1)OC[C@@H]2CCC(=O)N2)C 7a_100000210931_100015189358 [1,1,0,0,0,0|2,0,0]=4 3733 B17R2.18656 Cc1ccc(c(c1)OC[C@H]2COC(=O)N2)C 34a_100000210931_100015307671 [1,1,0,0,0,0|2,0,0]=4 3734 B17R2.18656 Cc1ccc(c(c1)OC[C@H]2COC(=O)N2)C 7a_100000210931_100015307671 [1,1,0,0,0,0|2,0,0]=4 3735 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)Br 62a_100000181169_100012353751 [1,1,0,0,0,0|1,1,0]=4 3736 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)Br 62a_100012353751_100000181169 [1,1,0,0,0,0|1,1,0]=4 3737 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)C 62a_100000181169_100000210833 [1,1,0,0,0,0|0,1,0]=3 3738 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)C 62a_100000210833_100000181169 [1,1,0,0,0,0|0,1,0]=3 3739 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)Cl 62a_100000181169_100012356289 [1,1,0,0,0,0|1,1,0]=4 3740 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)Cl 62a_100012356289_100000181169 [1,1,0,0,0,0|1,1,0]=4 3741 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)F 62a_100000181169_100000736223 [1,1,0,0,0,0|1,1,0]=4 3742 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)F 62a_100000736223_100000181169 [1,1,0,0,0,0|1,1,0]=4 3743 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)N 62a_100000181169_100011356834 [1,1,0,0,0,0|1,1,0]=4 3744 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)N 62a_100011356834_100000181169 [1,1,0,0,0,0|1,1,0]=4 3745 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)O 62a_100000181169_100000765521 [1,1,0,0,0,0|0,1,0]=3 3746 B17R2.18656 Cc1ccc(c(c1)SCC2CNC(=O)O2)O 62a_100000765521_100000181169 [1,1,0,0,0,0|0,1,0]=3 3747 B17R2.18656 Cc1ccc(c(c1)SCC2COC(=O)O2)C 62a_100000073702_100000210833 [1,1,0,0,0,0|1,1,0]=4 3748 B17R2.18656 Cc1ccc(c(c1)SCC2COC(=O)O2)C 62a_100000210833_100000073702 [1,1,0,0,0,0|1,1,0]=4 3749 B17R2.18656 Cc1ccc(c(c1)SCC2COC(=O)O2)O 62a_100000073702_100000765521 [1,1,0,0,0,0|1,1,0]=4 3750 B17R2.18656 Cc1ccc(c(c1)SCC2COC(=O)O2)O 62a_100000765521_100000073702 [1,1,0,0,0,0|1,1,0]=4 3751 B17R2.18656 Cc1ccc(c(n1)OCC2CNC(=O)O2)Br 34a_100009817604_100000181169 [1,1,0,0,0,0|2,0,0]=4 3752 B17R2.18656 Cc1ccc(c(n1)OCC2CNC(=O)O2)N 34a_100000687486_100000181169 [1,1,0,0,0,0|2,0,0]=4 3753 B17R2.18656 Cc1ccc(c(n1)SCC2CNC(=O)O2)C 62a_100000181169_100009854376 [1,1,0,0,0,0|1,1,0]=4 3754 B17R2.18656 Cc1ccc(c(n1)SCC2CNC(=O)O2)C 62a_100009854376_100000181169 [1,1,0,0,0,0|1,1,0]=4 3755 B17R2.18656 Cc1ccc(c(n1)SCC2CNC(=O)O2)O 62a_100000181169_100000702858 [1,1,0,0,0,0|1,1,0]=4 3756 B17R2.18656 Cc1ccc(c(n1)SCC2CNC(=O)O2)O 62a_100000702858_100000181169 [1,1,0,0,0,0|1,1,0]=4 3757 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)Br 34a_100000741167_100000181169 [1,1,0,0,0,0|1,0,0]=3 3758 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)Br 7a_100000741167_100000181169 [1,1,0,0,0,0|1,0,0]=3 3759 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_100000211374_100000181169 [1,1,0,0,0,0|1,0,0]=3 3760 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)Cl 7a_100000211374_100000181169 [1,1,0,0,0,0|1,0,0]=3 3761 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)F 34a_100000211107_100000181169 [1,1,0,0,0,0|1,0,0]=3 3762 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)F 7a_100000211107_100000181169 [1,1,0,0,0,0|1,0,0]=3 3763 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)I 7a_100000761890_100000181169 [1,1,0,0,0,0|1,0,0]=3 3764 B17R2.18656 Cc1ccc(cc1NCC2CNC(=O)O2)O 34a_100011216113_100000181169 [1,1,0,0,0,0|1,0,0]=3 3765 B17R2.18656 Cc1ccc(cc1NCC2COC(=O)O2)Br 34a_100000741167_100000073702 [1,1,0,0,0,0|2,0,0]=4 3766 B17R2.18656 Cc1ccc(cc1NCC2COC(=O)O2)Cl 34a_100000211374_100000073702 [1,1,0,0,0,0|2,0,0]=4 3767 B17R2.18656 Cc1ccc(cc1NCC2COC(=O)O2)F 34a_100000211107_100000073702 [1,1,0,0,0,0|2,0,0]=4 3768 B17R2.18656 Cc1ccc(cc1NCC2COC(=O)O2)O 34a_100011216113_100000073702 [1,1,0,0,0,0|2,0,0]=4 3769 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)Br 34a_100000685420_100000181169 [1,1,0,0,0,0|0,0,0]=2 3770 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)Br 7a_100000685420_100000181169 [1,1,0,0,0,0|0,0,0]=2 3771 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)Cl 34a_100000756515_100000181169 [1,1,0,0,0,0|0,0,0]=2 3772 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)Cl 7a_100000756515_100000181169 [1,1,0,0,0,0|0,0,0]=2 3773 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)F 34a_100000690566_100000181169 [1,1,0,0,0,0|0,0,0]=2 3774 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)F 7a_100000690566_100000181169 [1,1,0,0,0,0|0,0,0]=2 3775 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)I 7a_100000766334_100000181169 [1,1,0,0,0,0|0,0,0]=2 3776 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)N 34a_100000759471_100000181169 [1,1,0,0,0,0|0,0,0]=2 3777 B17R2.18656 Cc1ccc(cc1OCC2CNC(=O)O2)N 7a_100000759471_100000181169 [1,1,0,0,0,0|0,0,0]=2 3778 B17R2.18656 Cc1ccc(cc1OCC2COC(=O)O2)Br 34a_100000685420_100000073702 [1,1,0,0,0,0|1,0,0]=3 3779 B17R2.18656 Cc1ccc(cc1OCC2COC(=O)O2)Cl 34a_100000756515_100000073702 [1,1,0,0,0,0|1,0,0]=3 3780 B17R2.18656 Cc1ccc(cc1OCC2COC(=O)O2)F 34a_100000690566_100000073702 [1,1,0,0,0,0|1,0,0]=3 3781 B17R2.18656 Cc1ccc(cc1OCC2COC(=O)O2)N 34a_100000759471_100000073702 [1,1,0,0,0,0|1,0,0]=3 3782 B17R2.18656 Cc1ccc(cc1OC[C@@H]2CCC(=O)N2)Br 7a_100000685420_100015189358 [1,1,0,0,0,0|2,0,0]=4 3783 B17R2.18656 Cc1ccc(cc1OC[C@@H]2CCC(=O)N2)Cl 7a_100000756515_100015189358 [1,1,0,0,0,0|2,0,0]=4 3784 B17R2.18656 Cc1ccc(cc1OC[C@@H]2CCC(=O)N2)F 7a_100000690566_100015189358 [1,1,0,0,0,0|2,0,0]=4 3785 B17R2.18656 Cc1ccc(cc1OC[C@@H]2CCC(=O)N2)I 7a_100000766334_100015189358 [1,1,0,0,0,0|2,0,0]=4 3786 B17R2.18656 Cc1ccc(cc1OC[C@@H]2CCC(=O)N2)N 7a_100000759471_100015189358 [1,1,0,0,0,0|2,0,0]=4 3787 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)Br 34a_100000685420_100015307671 [1,1,0,0,0,0|2,0,0]=4 3788 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)Br 7a_100000685420_100015307671 [1,1,0,0,0,0|2,0,0]=4 3789 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)Cl 34a_100000756515_100015307671 [1,1,0,0,0,0|2,0,0]=4 3790 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)Cl 7a_100000756515_100015307671 [1,1,0,0,0,0|2,0,0]=4 3791 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)F 34a_100000690566_100015307671 [1,1,0,0,0,0|2,0,0]=4 3792 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)F 7a_100000690566_100015307671 [1,1,0,0,0,0|2,0,0]=4 3793 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)I 7a_100000766334_100015307671 [1,1,0,0,0,0|2,0,0]=4 3794 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)N 34a_100000759471_100015307671 [1,1,0,0,0,0|2,0,0]=4 3795 B17R2.18656 Cc1ccc(cc1OC[C@H]2COC(=O)N2)N 7a_100000759471_100015307671 [1,1,0,0,0,0|2,0,0]=4 3796 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100011344865 [1,1,0,0,0,0|0,1,0]=3 3797 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100011344865_100000181169 [1,1,0,0,0,0|0,1,0]=3 3798 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100000181169_100011263213 [1,1,0,0,0,0|0,1,0]=3 3799 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100011263213_100000181169 [1,1,0,0,0,0|0,1,0]=3 3800 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100011218078 [1,1,0,0,0,0|0,1,0]=3 3801 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)F 62a_100011218078_100000181169 [1,1,0,0,0,0|0,1,0]=3 3802 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100000736455 [1,1,0,0,0,0|0,1,0]=3 3803 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)N 62a_100000736455_100000181169 [1,1,0,0,0,0|0,1,0]=3 3804 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100011380479 [1,1,0,0,0,0|0,1,0]=3 3805 B17R2.18656 Cc1ccc(cc1SCC2CNC(=O)O2)O 62a_100011380479_100000181169 [1,1,0,0,0,0|0,1,0]=3 3806 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)Br 62a_100000073702_100011344865 [1,1,0,0,0,0|1,1,0]=4 3807 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)Br 62a_100011344865_100000073702 [1,1,0,0,0,0|1,1,0]=4 3808 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)Cl 62a_100000073702_100011263213 [1,1,0,0,0,0|1,1,0]=4 3809 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)Cl 62a_100011263213_100000073702 [1,1,0,0,0,0|1,1,0]=4 3810 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)F 62a_100000073702_100011218078 [1,1,0,0,0,0|1,1,0]=4 3811 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)F 62a_100011218078_100000073702 [1,1,0,0,0,0|1,1,0]=4 3812 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)N 62a_100000073702_100000736455 [1,1,0,0,0,0|1,1,0]=4 3813 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)N 62a_100000736455_100000073702 [1,1,0,0,0,0|1,1,0]=4 3814 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)O 62a_100000073702_100011380479 [1,1,0,0,0,0|1,1,0]=4 3815 B17R2.18656 Cc1ccc(cc1SCC2COC(=O)O2)O 62a_100011380479_100000073702 [1,1,0,0,0,0|1,1,0]=4 3816 B17R2.18656 Cc1ccc(nc1SCC2CNC(=O)O2)N 62a_100000126722_100000181169 [1,1,0,0,0,0|1,1,0]=4 3817 B17R2.18656 Cc1ccc(nc1SCC2CNC(=O)O2)N 62a_100000181169_100000126722 [1,1,0,0,0,0|1,1,0]=4 3818 B17R2.18656 Cc1cnc(c(c1)OCC2CNC(=O)O2)Cl 34a_100012000487_100000181169 [1,1,0,0,0,0|2,0,0]=4 3819 B17R2.18656 Cc1cnc(c(c1)OCC2CNC(=O)O2)Cl 7a_100012000487_100000181169 [1,1,0,0,0,0|2,0,0]=4 3820 B17R2.18656 Cc1cnc(c(c1)OCC2CNC(=O)O2)F 34a_100009849810_100000181169 [1,1,0,0,0,0|2,0,0]=4 3821 B17R2.18656 Cc1cnc(c(c1)OCC2CNC(=O)O2)F 7a_100009849810_100000181169 [1,1,0,0,0,0|2,0,0]=4 3822 B17R2.18656 Cc1cnc(c(c1)SCC2CNC(=O)O2)C 62a_100000181169_100009817436 [1,1,0,0,0,0|1,1,0]=4 3823 B17R2.18656 Cc1cnc(c(c1)SCC2CNC(=O)O2)C 62a_100009817436_100000181169 [1,1,0,0,0,0|1,1,0]=4 3824 B17R2.18656 Cc1cnc(c(c1)SCC2CNC(=O)O2)O 62a_100000181169_100000719714 [1,1,0,0,0,0|1,1,0]=4 3825 B17R2.18656 Cc1cnc(c(c1)SCC2CNC(=O)O2)O 62a_100000719714_100000181169 [1,1,0,0,0,0|1,1,0]=4 3826 B17R2.18656 Cc1cnc(cc1OCC2CNC(=O)O2)Br 34a_100000704368_100000181169 [1,1,0,0,0,0|1,0,0]=3 3827 B17R2.18656 Cc1cnc(cc1OCC2CNC(=O)O2)Br 7a_100000704368_100000181169 [1,1,0,0,0,0|1,0,0]=3 3828 B17R2.18656 Cc1cnc(cc1OCC2COC(=O)O2)Br 34a_100000704368_100000073702 [1,1,0,0,0,0|2,0,0]=4 3829 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100010067628 [1,1,0,0,0,0|1,1,0]=4 3830 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)Br 62a_100010067628_100000181169 [1,1,0,0,0,0|1,1,0]=4 3831 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010068021 [1,1,0,0,0,0|1,1,0]=4 3832 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)Cl 62a_100010068021_100000181169 [1,1,0,0,0,0|1,1,0]=4 3833 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)F 62a_100000049870_100000181169 [1,1,0,0,0,0|1,1,0]=4 3834 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100000049870 [1,1,0,0,0,0|1,1,0]=4 3835 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100009819938 [1,1,0,0,0,0|1,1,0]=4 3836 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)N 62a_100009819938_100000181169 [1,1,0,0,0,0|1,1,0]=4 3837 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100009831917 [1,1,0,0,0,0|1,1,0]=4 3838 B17R2.18656 Cc1cnc(cc1SCC2CNC(=O)O2)O 62a_100009831917_100000181169 [1,1,0,0,0,0|1,1,0]=4 3839 B17R2.18656 Cc1ncc(cc1OCC2CNC(=O)O2)Br 34a_100009864810_100000181169 [1,1,0,0,0,0|1,0,0]=3 3840 B17R2.18656 Cc1ncc(cc1OCC2CNC(=O)O2)Br 7a_100009864810_100000181169 [1,1,0,0,0,0|1,0,0]=3 3841 B17R2.18656 Cc1ncc(cc1OCC2COC(=O)O2)Br 34a_100009864810_100000073702 [1,1,0,0,0,0|2,0,0]=4 3842 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_200010090566 [1,1,0,0,0,0|1,1,0]=4 3843 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)Br 62a_200010090566_100000181169 [1,1,0,0,0,0|1,1,0]=4 3844 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100009860710 [1,1,0,0,0,0|1,1,0]=4 3845 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)F 62a_100009860710_100000181169 [1,1,0,0,0,0|1,1,0]=4 3846 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100011998591 [1,1,0,0,0,0|1,1,0]=4 3847 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)N 62a_100011998591_100000181169 [1,1,0,0,0,0|1,1,0]=4 3848 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100009819603 [1,1,0,0,0,0|1,1,0]=4 3849 B17R2.18656 Cc1ncc(cc1SCC2CNC(=O)O2)O 62a_100009819603_100000181169 [1,1,0,0,0,0|1,1,0]=4 3850 B17R2.18656 Nc1ccc(c(c1)OCC2CNC(=O)O2)Cl 34a_100011934209_100000181169 [1,1,0,0,0,0|1,0,0]=3 3851 B17R2.18656 Nc1ccc(c(c1)OCC2CNC(=O)O2)F 34a_100012017398_100000181169 [1,1,0,0,0,0|1,0,0]=3 3852 B17R2.18656 Nc1ccc(c(c1)OCC2CNC(=O)O2)F 7a_100012017398_100000181169 [1,1,0,0,0,0|1,0,0]=3 3853 B17R2.18656 Nc1ccc(c(c1)OCC2CNC(=O)O2)N 34a_100025717382_100000181169 [1,1,0,0,0,0|1,0,0]=3 3854 B17R2.18656 Nc1ccc(c(c1)OCC2COC(=O)O2)Cl 34a_100011934209_100000073702 [1,1,0,0,0,0|2,0,0]=4 3855 B17R2.18656 Nc1ccc(c(c1)OCC2COC(=O)O2)F 34a_100012017398_100000073702 [1,1,0,0,0,0|2,0,0]=4 3856 B17R2.18656 Nc1ccc(c(c1)OCC2COC(=O)O2)N 34a_100025717382_100000073702 [1,1,0,0,0,0|2,0,0]=4 3857 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)Br 62a_100000181169_100000750459 [1,1,0,0,0,0|1,1,0]=4 3858 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)Br 62a_100000750459_100000181169 [1,1,0,0,0,0|1,1,0]=4 3859 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)Cl 62a_100000181169_100012360549 [1,1,0,0,0,0|1,1,0]=4 3860 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)Cl 62a_100012360549_100000181169 [1,1,0,0,0,0|1,1,0]=4 3861 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)F 62a_100000181169_100000760356 [1,1,0,0,0,0|1,1,0]=4 3862 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)F 62a_100000760356_100000181169 [1,1,0,0,0,0|1,1,0]=4 3863 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)N 62a_100000181169_100011534242 [1,1,0,0,0,0|1,1,0]=4 3864 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)N 62a_100011534242_100000181169 [1,1,0,0,0,0|1,1,0]=4 3865 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)O 62a_100000181169_100011534360 [1,1,0,0,0,0|0,1,0]=3 3866 B17R2.18656 Nc1ccc(c(c1)SCC2CNC(=O)O2)O 62a_100011534360_100000181169 [1,1,0,0,0,0|0,1,0]=3 3867 B17R2.18656 Nc1ccc(c(c1)SCC2COC(=O)O2)O 62a_100000073702_100011534360 [1,1,0,0,0,0|1,1,0]=4 3868 B17R2.18656 Nc1ccc(c(c1)SCC2COC(=O)O2)O 62a_100011534360_100000073702 [1,1,0,0,0,0|1,1,0]=4 3869 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)Br 34a_100000739049_100000181169 [1,1,0,0,0,0|1,0,0]=3 3870 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)Br 7a_100000739049_100000181169 [1,1,0,0,0,0|1,0,0]=3 3871 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)Cl 34a_100000185728_100000181169 [1,1,0,0,0,0|1,0,0]=3 3872 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)Cl 7a_100000185728_100000181169 [1,1,0,0,0,0|1,0,0]=3 3873 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)F 34a_100000753323_100000181169 [1,1,0,0,0,0|1,0,0]=3 3874 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)F 7a_100000753323_100000181169 [1,1,0,0,0,0|1,0,0]=3 3875 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)I 34a_100000057187_100000181169 [1,1,0,0,0,0|1,0,0]=3 3876 B17R2.18656 Nc1ccc(cc1OCC2CNC(=O)O2)I 7a_100000057187_100000181169 [1,1,0,0,0,0|1,0,0]=3 3877 B17R2.18656 Nc1ccc(cc1OCC2COC(=O)O2)Br 34a_100000739049_100000073702 [1,1,0,0,0,0|2,0,0]=4 3878 B17R2.18656 Nc1ccc(cc1OCC2COC(=O)O2)Cl 34a_100000185728_100000073702 [1,1,0,0,0,0|2,0,0]=4 3879 B17R2.18656 Nc1ccc(cc1OCC2COC(=O)O2)F 34a_100000753323_100000073702 [1,1,0,0,0,0|2,0,0]=4 3880 B17R2.18656 Nc1ccc(cc1OCC2COC(=O)O2)I 34a_100000057187_100000073702 [1,1,0,0,0,0|2,0,0]=4 3881 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_100000187925 [1,1,0,0,0,0|1,1,0]=4 3882 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)Br 62a_100000187925_100000181169 [1,1,0,0,0,0|1,1,0]=4 3883 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100000181169_100000761889 [1,1,0,0,0,0|1,1,0]=4 3884 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)Cl 62a_100000761889_100000181169 [1,1,0,0,0,0|1,1,0]=4 3885 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100000760547 [1,1,0,0,0,0|1,1,0]=4 3886 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000760547_100000181169 [1,1,0,0,0,0|1,1,0]=4 3887 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)O 62a_100000181169_100012001276 [1,1,0,0,0,0|1,1,0]=4 3888 B17R2.18656 Nc1ccc(cc1SCC2CNC(=O)O2)O 62a_100012001276_100000181169 [1,1,0,0,0,0|1,1,0]=4 3889 B17R2.18656 Nc1ncc(cc1OCC2CNC(=O)O2)Br 34a_100009819042_100000181169 [1,1,0,0,0,0|2,0,0]=4 3890 B17R2.18656 Nc1ncc(cc1OCC2CNC(=O)O2)Br 7a_100009819042_100000181169 [1,1,0,0,0,0|2,0,0]=4 3891 B17R2.18656 Nc1ncc(cc1OCC2CNC(=O)O2)Cl 34a_100000123674_100000181169 [1,1,0,0,0,0|2,0,0]=4 3892 B17R2.18656 Nc1ncc(cc1OCC2CNC(=O)O2)Cl 7a_100000123674_100000181169 [1,1,0,0,0,0|2,0,0]=4 3893 B17R2.18656 Nc1ncc(cc1OCC2CNC(=O)O2)F 34a_100000094369_100000181169 [1,1,0,0,0,0|2,0,0]=4 3894 B17R2.18656 Nc1ncc(cc1OCC2CNC(=O)O2)F 7a_100000094369_100000181169 [1,1,0,0,0,0|2,0,0]=4 3895 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Br)Br 34a_100000737762_100000181169 [1,1,0,0,0,0|2,0,0]=4 3896 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Br)Cl 34a_100000687073_100000181169 [1,1,0,0,0,0|2,0,0]=4 3897 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Br)F 34a_100000687223_100000181169 [1,1,0,0,0,0|2,0,0]=4 3898 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Br)O 34a_100011999798_100000181169 [1,1,0,0,0,0|2,0,0]=4 3899 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Cl)Br 34a_100000750497_100000181169 [1,1,0,0,0,0|2,0,0]=4 3900 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Cl)Cl 34a_100000184485_100000181169 [1,1,0,0,0,0|2,0,0]=4 3901 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Cl)F 34a_100000751338_100000181169 [1,1,0,0,0,0|2,0,0]=4 3902 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Cl)I 34a_200000761891_100000181169 [1,1,0,0,0,0|2,0,0]=4 3903 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2Cl)O 34a_100011934297_100000181169 [1,1,0,0,0,0|2,0,0]=4 3904 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2F)Br 34a_100000740924_100000181169 [1,1,0,0,0,0|2,0,0]=4 3905 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2F)Cl 34a_100000212115_100000181169 [1,1,0,0,0,0|2,0,0]=4 3906 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2F)F 34a_100000210742_100000181169 [1,1,0,0,0,0|2,0,0]=4 3907 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2F)I 34a_100011464823_100000181169 [1,1,0,0,0,0|2,0,0]=4 3908 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2F)O 34a_100012017239_100000181169 [1,1,0,0,0,0|2,0,0]=4 3909 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2I)Br 34a_100000743836_100000181169 [1,1,0,0,0,0|2,0,0]=4 3910 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2I)Cl 34a_100000761886_100000181169 [1,1,0,0,0,0|2,0,0]=4 3911 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2I)F 34a_100011218093_100000181169 [1,1,0,0,0,0|2,0,0]=4 3912 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2O)Br 34a_100000752626_100000181169 [1,1,0,0,0,0|1,0,0]=3 3913 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2O)Cl 34a_100000210500_100000181169 [1,1,0,0,0,0|1,0,0]=3 3914 B17R2.18656 O=C1NCC(O1)CNc2cc(ccc2O)F 34a_100000759472_100000181169 [1,1,0,0,0,0|1,0,0]=3 3915 B17R2.18656 O=C1NCC(O1)COc2cc(=O)[nH]cc2Cl 34a_100000069390_100000181169 [1,1,0,0,0,0|2,0,0]=4 3916 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)Br 34a_100011220040_100000181169 [1,1,0,0,0,0|1,0,0]=3 3917 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)Br 7a_100011220040_100000181169 [1,1,0,0,0,0|1,0,0]=3 3918 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)Cl 34a_100012339455_100000181169 [1,1,0,0,0,0|1,0,0]=3 3919 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)Cl 7a_100012339455_100000181169 [1,1,0,0,0,0|1,0,0]=3 3920 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)F 34a_100000690578_100000181169 [1,1,0,0,0,0|1,0,0]=3 3921 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)F 7a_100000690578_100000181169 [1,1,0,0,0,0|1,0,0]=3 3922 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)I 34a_100012356990_100000181169 [1,1,0,0,0,0|1,0,0]=3 3923 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Br)I 7a_100012356990_100000181169 [1,1,0,0,0,0|1,0,0]=3 3924 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)Br 34a_100000738945_100000181169 [1,1,0,0,0,0|1,0,0]=3 3925 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)Br 7a_100000738945_100000181169 [1,1,0,0,0,0|1,0,0]=3 3926 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)Cl 34a_100000211422_100000181169 [1,1,0,0,0,0|1,0,0]=3 3927 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)Cl 7a_100000211422_100000181169 [1,1,0,0,0,0|1,0,0]=3 3928 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)F 34a_100000692107_100000181169 [1,1,0,0,0,0|1,0,0]=3 3929 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)F 7a_100000692107_100000181169 [1,1,0,0,0,0|1,0,0]=3 3930 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)I 34a_100011356854_100000181169 [1,1,0,0,0,0|1,0,0]=3 3931 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2Cl)I 7a_100011356854_100000181169 [1,1,0,0,0,0|1,0,0]=3 3932 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)Br 34a_100000686035_100000181169 [1,1,0,0,0,0|1,0,0]=3 3933 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)Br 7a_100000686035_100000181169 [1,1,0,0,0,0|1,0,0]=3 3934 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)Cl 34a_100000757397_100000181169 [1,1,0,0,0,0|1,0,0]=3 3935 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)Cl 7a_100000757397_100000181169 [1,1,0,0,0,0|1,0,0]=3 3936 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)F 34a_100000752141_100000181169 [1,1,0,0,0,0|1,0,0]=3 3937 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)F 7a_100000752141_100000181169 [1,1,0,0,0,0|1,0,0]=3 3938 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)I 34a_100009958187_100000181169 [1,1,0,0,0,0|1,0,0]=3 3939 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2F)I 7a_100009958187_100000181169 [1,1,0,0,0,0|1,0,0]=3 3940 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2I)Br 34a_100012344904_100000181169 [1,1,0,0,0,0|1,0,0]=3 3941 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2I)Br 7a_100012344904_100000181169 [1,1,0,0,0,0|1,0,0]=3 3942 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2I)Cl 34a_100000050036_100000181169 [1,1,0,0,0,0|1,0,0]=3 3943 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2I)Cl 7a_100000050036_100000181169 [1,1,0,0,0,0|1,0,0]=3 3944 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2I)F 34a_100010084537_100000181169 [1,1,0,0,0,0|1,0,0]=3 3945 B17R2.18656 O=C1NCC(O1)COc2cc(ccc2I)F 7a_100010084537_100000181169 [1,1,0,0,0,0|1,0,0]=3 3946 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Br)Cl 34a_100000697010_100000181169 [1,1,0,0,0,0|2,0,0]=4 3947 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Br)Cl 7a_100000697010_100000181169 [1,1,0,0,0,0|2,0,0]=4 3948 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Br)F 34a_100009820119_100000181169 [1,1,0,0,0,0|2,0,0]=4 3949 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Br)F 7a_100009820119_100000181169 [1,1,0,0,0,0|2,0,0]=4 3950 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Cl)Br 34a_100012354860_100000181169 [1,1,0,0,0,0|2,0,0]=4 3951 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Cl)Br 7a_100012354860_100000181169 [1,1,0,0,0,0|2,0,0]=4 3952 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Cl)F 34a_100000079967_100000181169 [1,1,0,0,0,0|2,0,0]=4 3953 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2Cl)F 7a_100000079967_100000181169 [1,1,0,0,0,0|2,0,0]=4 3954 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2F)Br 34a_100009819871_100000181169 [1,1,0,0,0,0|2,0,0]=4 3955 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2F)Br 7a_100009819871_100000181169 [1,1,0,0,0,0|2,0,0]=4 3956 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2F)Cl 34a_100000094372_100000181169 [1,1,0,0,0,0|2,0,0]=4 3957 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2F)Cl 7a_100000094372_100000181169 [1,1,0,0,0,0|2,0,0]=4 3958 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2I)Br 34a_100010210634_100000181169 [1,1,0,0,0,0|2,0,0]=4 3959 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2I)Br 7a_100010210634_100000181169 [1,1,0,0,0,0|2,0,0]=4 3960 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2I)Cl 34a_100010233512_100000181169 [1,1,0,0,0,0|2,0,0]=4 3961 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2I)Cl 7a_100010233512_100000181169 [1,1,0,0,0,0|2,0,0]=4 3962 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2I)F 34a_100015624800_100000181169 [1,1,0,0,0,0|2,0,0]=4 3963 B17R2.18656 O=C1NCC(O1)COc2cc(cnc2I)F 7a_100015624800_100000181169 [1,1,0,0,0,0|2,0,0]=4 3964 B17R2.18656 O=C1NCC(O1)COc2cc(ncc2Br)Br 34a_100010235016_100000181169 [1,1,0,0,0,0|2,0,0]=4 3965 B17R2.18656 O=C1NCC(O1)COc2cc(ncc2Br)Cl 34a_100010173860_100000181169 [1,1,0,0,0,0|2,0,0]=4 3966 B17R2.18656 O=C1NCC(O1)COc2cc(ncc2Cl)Br 34a_100010173861_100000181169 [1,1,0,0,0,0|2,0,0]=4 3967 B17R2.18656 O=C1NCC(O1)COc2cc(ncc2F)Br 34a_100009854642_100000181169 [1,1,0,0,0,0|2,0,0]=4 3968 B17R2.18656 O=C1NCC(O1)COc2cc(ncc2F)Cl 34a_100009851168_100000181169 [1,1,0,0,0,0|2,0,0]=4 3969 B17R2.18656 O=C1NCC(O1)COc2nc(ccc2F)Cl 34a_100010729010_100000181169 [1,1,0,0,0,0|2,0,0]=4 3970 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)Br 62a_100000181169_100011483371 [1,1,0,0,0,0|1,1,0]=4 3971 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)Br 62a_100011483371_100000181169 [1,1,0,0,0,0|1,1,0]=4 3972 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)Cl 62a_100000181169_100012339723 [1,1,0,0,0,0|1,1,0]=4 3973 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)Cl 62a_100012339723_100000181169 [1,1,0,0,0,0|1,1,0]=4 3974 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)F 62a_100000181169_100011217576 [1,1,0,0,0,0|1,1,0]=4 3975 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)F 62a_100011217576_100000181169 [1,1,0,0,0,0|1,1,0]=4 3976 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)O 62a_100000181169_100012339312 [1,1,0,0,0,0|1,1,0]=4 3977 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Br)O 62a_100012339312_100000181169 [1,1,0,0,0,0|1,1,0]=4 3978 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)Br 62a_100000181169_100011772130 [1,1,0,0,0,0|1,1,0]=4 3979 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)Br 62a_100011772130_100000181169 [1,1,0,0,0,0|1,1,0]=4 3980 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)Cl 62a_100000181169_100000707729 [1,1,0,0,0,0|1,1,0]=4 3981 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)Cl 62a_100000707729_100000181169 [1,1,0,0,0,0|1,1,0]=4 3982 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)F 62a_100000181169_100011217299 [1,1,0,0,0,0|1,1,0]=4 3983 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)F 62a_100011217299_100000181169 [1,1,0,0,0,0|1,1,0]=4 3984 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)O 62a_100000049588_100000181169 [1,1,0,0,0,0|1,1,0]=4 3985 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2Cl)O 62a_100000181169_100000049588 [1,1,0,0,0,0|1,1,0]=4 3986 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)Br 62a_100000181169_100011217312 [1,1,0,0,0,0|1,1,0]=4 3987 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)Br 62a_100011217312_100000181169 [1,1,0,0,0,0|1,1,0]=4 3988 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)Cl 62a_100000181169_100011218116 [1,1,0,0,0,0|1,1,0]=4 3989 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)Cl 62a_100011218116_100000181169 [1,1,0,0,0,0|1,1,0]=4 3990 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)F 62a_100000181169_100011219198 [1,1,0,0,0,0|1,1,0]=4 3991 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)F 62a_100011219198_100000181169 [1,1,0,0,0,0|1,1,0]=4 3992 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)O 62a_100000181169_100000693481 [1,1,0,0,0,0|1,1,0]=4 3993 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2F)O 62a_100000693481_100000181169 [1,1,0,0,0,0|1,1,0]=4 3994 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)Br 62a_100000181169_100012355227 [1,1,0,0,0,0|0,1,0]=3 3995 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)Br 62a_100012355227_100000181169 [1,1,0,0,0,0|0,1,0]=3 3996 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)Cl 62a_100000181169_100011356953 [1,1,0,0,0,0|0,1,0]=3 3997 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)Cl 62a_100011356953_100000181169 [1,1,0,0,0,0|0,1,0]=3 3998 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)F 62a_100000181169_100000211999 [1,1,0,0,0,0|0,1,0]=3 3999 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)F 62a_100000211999_100000181169 [1,1,0,0,0,0|0,1,0]=3 4000 B17R2.18656 O=C1NCC(O1)CSc2cc(ccc2O)O 62a_100000181169_100009813629 [1,1,0,0,0,0|0,1,0]=3 4001 B17R2.18656 O=C1NCC(O1)CSc2cc(cnc2O)Br 62a_100000181169_100010197142 [1,1,0,0,0,0|1,1,0]=4 4002 B17R2.18656 O=C1NCC(O1)CSc2cc(cnc2O)Br 62a_100010197142_100000181169 [1,1,0,0,0,0|1,1,0]=4 4003 B17R2.18656 O=C1NCC(O1)CSc2cc(cnc2O)Cl 62a_100000181169_100010188700 [1,1,0,0,0,0|1,1,0]=4 4004 B17R2.18656 O=C1NCC(O1)CSc2cc(cnc2O)Cl 62a_100010188700_100000181169 [1,1,0,0,0,0|1,1,0]=4 4005 B17R2.18656 O=C1NCC(O1)CSc2cc(ncc2O)Cl 62a_100000181169_100000698892 [1,1,0,0,0,0|1,1,0]=4 4006 B17R2.18656 O=C1NCC(O1)CSc2cc(ncc2O)Cl 62a_100000698892_100000181169 [1,1,0,0,0,0|1,1,0]=4 4007 B17R2.18656 O=C1NCC(O1)CSc2nc(ccc2O)Br 62a_100000181169_100010253912 [1,1,0,0,0,0|1,1,0]=4 4008 B17R2.18656 O=C1NCC(O1)CSc2nc(ccc2O)Br 62a_100010253912_100000181169 [1,1,0,0,0,0|1,1,0]=4 4009 B17R2.18656 O=C1NCC(O1)CSc2nc(ccc2O)Cl 62a_100000181169_100000696390 [1,1,0,0,0,0|1,1,0]=4 4010 B17R2.18656 O=C1NCC(O1)CSc2nc(ccc2O)F 62a_100000181169_100010382442 [1,1,0,0,0,0|1,1,0]=4 4011 B17R2.18656 O=C1NCC(O1)CSc2nc(ccc2O)F 62a_100010382442_100000181169 [1,1,0,0,0,0|1,1,0]=4 4012 B17R2.18656 O=C1OCC(O1)CNc2cc(ccc2O)Br 34a_100000752626_100000073702 [1,1,0,0,0,0|2,0,0]=4 4013 B17R2.18656 O=C1OCC(O1)CNc2cc(ccc2O)Cl 34a_100000210500_100000073702 [1,1,0,0,0,0|2,0,0]=4 4014 B17R2.18656 O=C1OCC(O1)CNc2cc(ccc2O)F 34a_100000759472_100000073702 [1,1,0,0,0,0|2,0,0]=4 4015 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Br)Br 34a_100011220040_100000073702 [1,1,0,0,0,0|2,0,0]=4 4016 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Br)Cl 34a_100012339455_100000073702 [1,1,0,0,0,0|2,0,0]=4 4017 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Br)F 34a_100000690578_100000073702 [1,1,0,0,0,0|2,0,0]=4 4018 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Br)I 34a_100012356990_100000073702 [1,1,0,0,0,0|2,0,0]=4 4019 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Cl)Br 34a_100000738945_100000073702 [1,1,0,0,0,0|2,0,0]=4 4020 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Cl)Cl 34a_100000211422_100000073702 [1,1,0,0,0,0|2,0,0]=4 4021 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Cl)F 34a_100000692107_100000073702 [1,1,0,0,0,0|2,0,0]=4 4022 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2Cl)I 34a_100011356854_100000073702 [1,1,0,0,0,0|2,0,0]=4 4023 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2F)Br 34a_100000686035_100000073702 [1,1,0,0,0,0|2,0,0]=4 4024 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2F)Cl 34a_100000757397_100000073702 [1,1,0,0,0,0|2,0,0]=4 4025 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2F)F 34a_100000752141_100000073702 [1,1,0,0,0,0|2,0,0]=4 4026 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2F)I 34a_100009958187_100000073702 [1,1,0,0,0,0|2,0,0]=4 4027 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2I)Br 34a_100012344904_100000073702 [1,1,0,0,0,0|2,0,0]=4 4028 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2I)Cl 34a_100000050036_100000073702 [1,1,0,0,0,0|2,0,0]=4 4029 B17R2.18656 O=C1OCC(O1)COc2cc(ccc2I)F 34a_100010084537_100000073702 [1,1,0,0,0,0|2,0,0]=4 4030 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)Br 62a_100000073702_100012355227 [1,1,0,0,0,0|1,1,0]=4 4031 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)Br 62a_100012355227_100000073702 [1,1,0,0,0,0|1,1,0]=4 4032 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)Cl 62a_100000073702_100011356953 [1,1,0,0,0,0|1,1,0]=4 4033 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)Cl 62a_100011356953_100000073702 [1,1,0,0,0,0|1,1,0]=4 4034 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)F 62a_100000073702_100000211999 [1,1,0,0,0,0|1,1,0]=4 4035 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)F 62a_100000211999_100000073702 [1,1,0,0,0,0|1,1,0]=4 4036 B17R2.18656 O=C1OCC(O1)CSc2cc(ccc2O)O 62a_100000073702_100009813629 [1,1,0,0,0,0|1,1,0]=4 4037 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)Br 34a_100000750434_100000181169 [1,1,0,0,0,0|1,0,0]=3 4038 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)Cl 2230a_100000210441_100000181169 [1,1,0,0,0,0|1,0,0]=3 4039 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)Cl 34a_100000210441_100000181169 [1,1,0,0,0,0|1,0,0]=3 4040 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)Cl 7a_100000210441_100000181169 [1,1,0,0,0,0|1,0,0]=3 4041 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)F 34a_100000745574_100000181169 [1,1,0,0,0,0|1,0,0]=3 4042 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)F 7a_100000745574_100000181169 [1,1,0,0,0,0|1,0,0]=3 4043 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)I 34a_100000761887_100000181169 [1,1,0,0,0,0|1,0,0]=3 4044 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)O 34a_100011216573_100000181169 [1,1,0,0,0,0|1,0,0]=3 4045 B17R2.18663 Cc1c(cccc1NCC2CNC(=O)O2)O 7a_100011216573_100000181169 [1,1,0,0,0,0|1,0,0]=3 4046 B17R2.18663 Cc1c(cccc1NCC2COC(=O)O2)Br 34a_100000750434_100000073702 [1,1,0,0,0,0|2,0,0]=4 4047 B17R2.18663 Cc1c(cccc1NCC2COC(=O)O2)Cl 34a_100000210441_100000073702 [1,1,0,0,0,0|2,0,0]=4 4048 B17R2.18663 Cc1c(cccc1NCC2COC(=O)O2)F 34a_100000745574_100000073702 [1,1,0,0,0,0|2,0,0]=4 4049 B17R2.18663 Cc1c(cccc1NCC2COC(=O)O2)I 34a_100000761887_100000073702 [1,1,0,0,0,0|2,0,0]=4 4050 B17R2.18663 Cc1c(cccc1NCC2COC(=O)O2)O 34a_100011216573_100000073702 [1,1,0,0,0,0|2,0,0]=4 4051 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)Br 34a_100012002258_100000181169 [1,1,0,0,0,0|0,0,0]=2 4052 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)Br 7a_100012002258_100000181169 [1,1,0,0,0,0|0,0,0]=2 4053 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)Cl 34a_100011265684_100000181169 [1,1,0,0,0,0|0,0,0]=2 4054 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)Cl 7a_100011265684_100000181169 [1,1,0,0,0,0|0,0,0]=2 4055 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)F 34a_100011217231_100000181169 [1,1,0,0,0,0|0,0,0]=2 4056 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)F 7a_100011217231_100000181169 [1,1,0,0,0,0|0,0,0]=2 4057 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)N 34a_100011216573_100000181169 [1,1,0,0,0,0|0,0,0]=2 4058 B17R2.18663 Cc1c(cccc1OCC2CNC(=O)O2)N 7a_100011216573_100000181169 [1,1,0,0,0,0|0,0,0]=2 4059 B17R2.18663 Cc1c(cccc1OCC2COC(=O)O2)Br 34a_100012002258_100000073702 [1,1,0,0,0,0|1,0,0]=3 4060 B17R2.18663 Cc1c(cccc1OCC2COC(=O)O2)Cl 34a_100011265684_100000073702 [1,1,0,0,0,0|1,0,0]=3 4061 B17R2.18663 Cc1c(cccc1OCC2COC(=O)O2)F 34a_100011217231_100000073702 [1,1,0,0,0,0|1,0,0]=3 4062 B17R2.18663 Cc1c(cccc1OCC2COC(=O)O2)N 34a_100011216573_100000073702 [1,1,0,0,0,0|1,0,0]=3 4063 B17R2.18663 Cc1c(cccc1OC[C@@H]2CCC(=O)N2)Br 7a_100012002258_100015189358 [1,1,0,0,0,0|2,0,0]=4 4064 B17R2.18663 Cc1c(cccc1OC[C@@H]2CCC(=O)N2)Cl 7a_100011265684_100015189358 [1,1,0,0,0,0|2,0,0]=4 4065 B17R2.18663 Cc1c(cccc1OC[C@@H]2CCC(=O)N2)F 7a_100011217231_100015189358 [1,1,0,0,0,0|2,0,0]=4 4066 B17R2.18663 Cc1c(cccc1OC[C@@H]2CCC(=O)N2)N 7a_100011216573_100015189358 [1,1,0,0,0,0|2,0,0]=4 4067 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)Br 34a_100012002258_100015307671 [1,1,0,0,0,0|2,0,0]=4 4068 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)Br 7a_100012002258_100015307671 [1,1,0,0,0,0|2,0,0]=4 4069 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)Cl 34a_100011265684_100015307671 [1,1,0,0,0,0|2,0,0]=4 4070 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)Cl 7a_100011265684_100015307671 [1,1,0,0,0,0|2,0,0]=4 4071 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)F 34a_100011217231_100015307671 [1,1,0,0,0,0|2,0,0]=4 4072 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)F 7a_100011217231_100015307671 [1,1,0,0,0,0|2,0,0]=4 4073 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)N 34a_100011216573_100015307671 [1,1,0,0,0,0|2,0,0]=4 4074 B17R2.18663 Cc1c(cccc1OC[C@H]2COC(=O)N2)N 7a_100011216573_100015307671 [1,1,0,0,0,0|2,0,0]=4 4075 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)Br 62a_100000181169_100012353703 [1,1,0,0,0,0|0,1,0]=3 4076 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)Br 62a_100012353703_100000181169 [1,1,0,0,0,0|0,1,0]=3 4077 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100000726075 [1,1,0,0,0,0|0,1,0]=3 4078 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100000726075_100000181169 [1,1,0,0,0,0|0,1,0]=3 4079 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100011216893 [1,1,0,0,0,0|0,1,0]=3 4080 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)F 62a_100011216893_100000181169 [1,1,0,0,0,0|0,1,0]=3 4081 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)N 62a_100000181169_100000761887 [1,1,0,0,0,0|0,1,0]=3 4082 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)N 62a_100000761887_100000181169 [1,1,0,0,0,0|0,1,0]=3 4083 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)O 62a_100000181169_100012002258 [1,1,0,0,0,0|0,1,0]=3 4084 B17R2.18663 Cc1c(cccc1SCC2CNC(=O)O2)O 62a_100012002258_100000181169 [1,1,0,0,0,0|0,1,0]=3 4085 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)Br 62a_100000073702_100012353703 [1,1,0,0,0,0|1,1,0]=4 4086 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)Br 62a_100012353703_100000073702 [1,1,0,0,0,0|1,1,0]=4 4087 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)Cl 62a_100000073702_100000726075 [1,1,0,0,0,0|1,1,0]=4 4088 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)Cl 62a_100000726075_100000073702 [1,1,0,0,0,0|1,1,0]=4 4089 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)F 62a_100000073702_100011216893 [1,1,0,0,0,0|1,1,0]=4 4090 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)F 62a_100011216893_100000073702 [1,1,0,0,0,0|1,1,0]=4 4091 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)N 62a_100000073702_100000761887 [1,1,0,0,0,0|1,1,0]=4 4092 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)N 62a_100000761887_100000073702 [1,1,0,0,0,0|1,1,0]=4 4093 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)O 62a_100000073702_100012002258 [1,1,0,0,0,0|1,1,0]=4 4094 B17R2.18663 Cc1c(cccc1SCC2COC(=O)O2)O 62a_100012002258_100000073702 [1,1,0,0,0,0|1,1,0]=4 4095 B17R2.18663 Cc1c(ccnc1Cl)SCC2CNC(=O)O2 62a_100000047055_100000181169 [1,1,0,0,0,0|1,1,0]=4 4096 B17R2.18663 Cc1c(ccnc1Cl)SCC2CNC(=O)O2 62a_100000181169_100000047055 [1,1,0,0,0,0|1,1,0]=4 4097 B17R2.18663 Cc1c(ccnc1F)SCC2CNC(=O)O2 62a_100000181169_100010006593 [1,1,0,0,0,0|1,1,0]=4 4098 B17R2.18663 Cc1c(ccnc1F)SCC2CNC(=O)O2 62a_100010006593_100000181169 [1,1,0,0,0,0|1,1,0]=4 4099 B17R2.18663 Cc1c(ccnc1N)SCC2CNC(=O)O2 62a_100000181169_100009865460 [1,1,0,0,0,0|1,1,0]=4 4100 B17R2.18663 Cc1c(ccnc1N)SCC2CNC(=O)O2 62a_100009865460_100000181169 [1,1,0,0,0,0|1,1,0]=4 4101 B17R2.18663 Cc1c(ccnc1O)SCC2CNC(=O)O2 62a_100000181169_100009858498 [1,1,0,0,0,0|1,1,0]=4 4102 B17R2.18663 Cc1c(ccnc1O)SCC2CNC(=O)O2 62a_100009858498_100000181169 [1,1,0,0,0,0|1,1,0]=4 4103 B17R2.18663 Cc1c(ccnc1OCC2CNC(=O)O2)Br 34a_100009858498_100000181169 [1,1,0,0,0,0|1,0,0]=3 4104 B17R2.18663 Cc1c(ccnc1OCC2COC(=O)O2)Br 34a_100009858498_100000073702 [1,1,0,0,0,0|2,0,0]=4 4105 B17R2.18663 Cc1c(ccnc1SCC2CNC(=O)O2)F 62a_100000181169_100009846374 [1,1,0,0,0,0|1,1,0]=4 4106 B17R2.18663 Cc1c(ccnc1SCC2CNC(=O)O2)F 62a_100009846374_100000181169 [1,1,0,0,0,0|1,1,0]=4 4107 B17R2.18663 Cc1c(ccnc1SCC2CNC(=O)O2)N 62a_100000181169_100000690622 [1,1,0,0,0,0|1,1,0]=4 4108 B17R2.18663 Cc1c(ccnc1SCC2CNC(=O)O2)N 62a_100000690622_100000181169 [1,1,0,0,0,0|1,1,0]=4 4109 B17R2.18663 Cc1c(cncc1SCC2CNC(=O)O2)Br 62a_100000181169_100010109657 [1,1,0,0,0,0|1,1,0]=4 4110 B17R2.18663 Cc1c(cncc1SCC2CNC(=O)O2)Br 62a_100010109657_100000181169 [1,1,0,0,0,0|1,1,0]=4 4111 B17R2.18663 Cc1c(cncc1SCC2CNC(=O)O2)F 62a_100000181169_100009881546 [1,1,0,0,0,0|1,1,0]=4 4112 B17R2.18663 Cc1c(cncc1SCC2CNC(=O)O2)F 62a_100009881546_100000181169 [1,1,0,0,0,0|1,1,0]=4 4113 B17R2.18663 Cc1c(cncc1SCC2CNC(=O)O2)N 62a_100000181169_100011998293 [1,1,0,0,0,0|1,1,0]=4 4114 B17R2.18663 Cc1c(cncc1SCC2CNC(=O)O2)N 62a_100011998293_100000181169 [1,1,0,0,0,0|1,1,0]=4 4115 B17R2.18663 Cc1c(ncnc1OCC2CNC(=O)O2)Cl 34a_100011912821_100000181169 [1,1,0,0,0,0|2,0,0]=4 4116 B17R2.18663 Cc1cccc(c1Br)NCC2CNC(=O)O2 34a_100000684715_100000181169 [1,1,0,0,0,0|2,0,0]=4 4117 B17R2.18663 Cc1cccc(c1Br)OCC2CNC(=O)O2 34a_100000686692_100000181169 [1,1,0,0,0,0|1,0,0]=3 4118 B17R2.18663 Cc1cccc(c1Br)OCC2CNC(=O)O2 7a_100000686692_100000181169 [1,1,0,0,0,0|1,0,0]=3 4119 B17R2.18663 Cc1cccc(c1Br)OCC2COC(=O)O2 34a_100000686692_100000073702 [1,1,0,0,0,0|2,0,0]=4 4120 B17R2.18663 Cc1cccc(c1Br)SCC2CNC(=O)O2 62a_100000181169_100012362457 [1,1,0,0,0,0|1,1,0]=4 4121 B17R2.18663 Cc1cccc(c1Br)SCC2CNC(=O)O2 62a_100012362457_100000181169 [1,1,0,0,0,0|1,1,0]=4 4122 B17R2.18663 Cc1cccc(c1C)NCC2CNC(=O)O2 2230a_100000210026_100000181169 [1,1,0,0,0,0|1,0,0]=3 4123 B17R2.18663 Cc1cccc(c1C)NCC2CNC(=O)O2 34a_100000210026_100000181169 [1,1,0,0,0,0|1,0,0]=3 4124 B17R2.18663 Cc1cccc(c1C)NCC2CNC(=O)O2 7a_100000210026_100000181169 [1,1,0,0,0,0|1,0,0]=3 4125 B17R2.18663 Cc1cccc(c1C)NCC2COC(=O)O2 34a_100000210026_100000073702 [1,1,0,0,0,0|2,0,0]=4 4126 B17R2.18663 Cc1cccc(c1C)OCC2CNC(=O)O2 34a_100000185855_100000181169 [1,1,0,0,0,0|0,0,0]=2 4127 B17R2.18663 Cc1cccc(c1C)OCC2CNC(=O)O2 7a_100000185855_100000181169 [1,1,0,0,0,0|0,0,0]=2 4128 B17R2.18663 Cc1cccc(c1C)OCC2COC(=O)O2 34a_100000185855_100000073702 [1,1,0,0,0,0|1,0,0]=3 4129 B17R2.18663 Cc1cccc(c1C)OC[C@@H]2CCC(=O)N2 7a_100000185855_100015189358 [1,1,0,0,0,0|2,0,0]=4 4130 B17R2.18663 Cc1cccc(c1C)OC[C@H]2COC(=O)N2 34a_100000185855_100015307671 [1,1,0,0,0,0|2,0,0]=4 4131 B17R2.18663 Cc1cccc(c1C)OC[C@H]2COC(=O)N2 7a_100000185855_100015307671 [1,1,0,0,0,0|2,0,0]=4 4132 B17R2.18663 Cc1cccc(c1C)SCC2CNC(=O)O2 62a_100000181169_100011214922 [1,1,0,0,0,0|0,1,0]=3 4133 B17R2.18663 Cc1cccc(c1C)SCC2CNC(=O)O2 62a_100011214922_100000181169 [1,1,0,0,0,0|0,1,0]=3 4134 B17R2.18663 Cc1cccc(c1C)SCC2COC(=O)O2 62a_100000073702_100011214922 [1,1,0,0,0,0|1,1,0]=4 4135 B17R2.18663 Cc1cccc(c1C)SCC2COC(=O)O2 62a_100011214922_100000073702 [1,1,0,0,0,0|1,1,0]=4 4136 B17R2.18663 Cc1cccc(c1Cl)NCC2CNC(=O)O2 34a_100000765562_100000181169 [1,1,0,0,0,0|2,0,0]=4 4137 B17R2.18663 Cc1cccc(c1Cl)NCC2CNC(=O)O2 7a_100000765562_100000181169 [1,1,0,0,0,0|2,0,0]=4 4138 B17R2.18663 Cc1cccc(c1Cl)OCC2CNC(=O)O2 34a_100000695629_100000181169 [1,1,0,0,0,0|1,0,0]=3 4139 B17R2.18663 Cc1cccc(c1Cl)OCC2CNC(=O)O2 7a_100000695629_100000181169 [1,1,0,0,0,0|1,0,0]=3 4140 B17R2.18663 Cc1cccc(c1Cl)OCC2COC(=O)O2 34a_100000695629_100000073702 [1,1,0,0,0,0|2,0,0]=4 4141 B17R2.18663 Cc1cccc(c1Cl)SCC2CNC(=O)O2 62a_100000181169_200012352035 [1,1,0,0,0,0|1,1,0]=4 4142 B17R2.18663 Cc1cccc(c1Cl)SCC2CNC(=O)O2 62a_200012352035_100000181169 [1,1,0,0,0,0|1,1,0]=4 4143 B17R2.18663 Cc1cccc(c1F)NCC2CNC(=O)O2 2230a_100000697159_100000181169 [1,1,0,0,0,0|2,0,0]=4 4144 B17R2.18663 Cc1cccc(c1F)NCC2CNC(=O)O2 34a_100000697159_100000181169 [1,1,0,0,0,0|2,0,0]=4 4145 B17R2.18663 Cc1cccc(c1F)NCC2CNC(=O)O2 7a_100000697159_100000181169 [1,1,0,0,0,0|2,0,0]=4 4146 B17R2.18663 Cc1cccc(c1F)OCC2CNC(=O)O2 34a_100000751311_100000181169 [1,1,0,0,0,0|1,0,0]=3 4147 B17R2.18663 Cc1cccc(c1F)OCC2CNC(=O)O2 7a_100000751311_100000181169 [1,1,0,0,0,0|1,0,0]=3 4148 B17R2.18663 Cc1cccc(c1F)OCC2COC(=O)O2 34a_100000751311_100000073702 [1,1,0,0,0,0|2,0,0]=4 4149 B17R2.18663 Cc1cccc(c1F)SCC2CNC(=O)O2 62a_100000181169_100000717567 [1,1,0,0,0,0|1,1,0]=4 4150 B17R2.18663 Cc1cccc(c1F)SCC2CNC(=O)O2 62a_100000717567_100000181169 [1,1,0,0,0,0|1,1,0]=4 4151 B17R2.18663 Cc1cccc(c1I)NCC2CNC(=O)O2 34a_100000761888_100000181169 [1,1,0,0,0,0|2,0,0]=4 4152 B17R2.18663 Cc1cccc(c1I)OCC2CNC(=O)O2 34a_100010083724_100000181169 [1,1,0,0,0,0|1,0,0]=3 4153 B17R2.18663 Cc1cccc(c1I)OCC2CNC(=O)O2 7a_100010083724_100000181169 [1,1,0,0,0,0|1,0,0]=3 4154 B17R2.18663 Cc1cccc(c1I)OCC2COC(=O)O2 34a_100010083724_100000073702 [1,1,0,0,0,0|2,0,0]=4 4155 B17R2.18663 Cc1cccc(c1N)OCC2CNC(=O)O2 34a_100000743429_100000181169 [1,1,0,0,0,0|1,0,0]=3 4156 B17R2.18663 Cc1cccc(c1N)OCC2CNC(=O)O2 7a_100000743429_100000181169 [1,1,0,0,0,0|1,0,0]=3 4157 B17R2.18663 Cc1cccc(c1N)OCC2COC(=O)O2 34a_100000743429_100000073702 [1,1,0,0,0,0|2,0,0]=4 4158 B17R2.18663 Cc1cccc(c1N)SCC2CNC(=O)O2 62a_100000181169_100011834072 [1,1,0,0,0,0|1,1,0]=4 4159 B17R2.18663 Cc1cccc(c1N)SCC2CNC(=O)O2 62a_100011834072_100000181169 [1,1,0,0,0,0|1,1,0]=4 4160 B17R2.18663 Cc1cccc(c1O)NCC2CNC(=O)O2 34a_100000756359_100000181169 [1,1,0,0,0,0|1,0,0]=3 4161 B17R2.18663 Cc1cccc(c1O)NCC2COC(=O)O2 34a_100000756359_100000073702 [1,1,0,0,0,0|2,0,0]=4 4162 B17R2.18663 Cc1cccc(c1O)SCC2CNC(=O)O2 62a_100000181169_100009817157 [1,1,0,0,0,0|0,1,0]=3 4163 B17R2.18663 Cc1cccc(c1O)SCC2CNC(=O)O2 62a_100009817157_100000181169 [1,1,0,0,0,0|0,1,0]=3 4164 B17R2.18663 Cc1cccc(c1O)SCC2COC(=O)O2 62a_100000073702_100009817157 [1,1,0,0,0,0|1,1,0]=4 4165 B17R2.18663 Cc1cccc(c1O)SCC2COC(=O)O2 62a_100009817157_100000073702 [1,1,0,0,0,0|1,1,0]=4 4166 B17R2.18663 Cc1ccnc(c1Br)OCC2CNC(=O)O2 34a_100012000493_100000181169 [1,1,0,0,0,0|2,0,0]=4 4167 B17R2.18663 Cc1ccnc(c1C)SCC2CNC(=O)O2 62a_100000181169_100009847204 [1,1,0,0,0,0|1,1,0]=4 4168 B17R2.18663 Cc1ccnc(c1C)SCC2CNC(=O)O2 62a_100009847204_100000181169 [1,1,0,0,0,0|1,1,0]=4 4169 B17R2.18663 Cc1ccnc(c1O)SCC2CNC(=O)O2 62a_100000181169_100000696282 [1,1,0,0,0,0|1,1,0]=4 4170 B17R2.18663 Cc1cncc(c1C)SCC2CNC(=O)O2 62a_100000181169_100009864703 [1,1,0,0,0,0|1,1,0]=4 4171 B17R2.18663 Cc1cncc(c1C)SCC2CNC(=O)O2 62a_100009864703_100000181169 [1,1,0,0,0,0|1,1,0]=4 4172 B17R2.18663 Cc1nccc(c1C)SCC2CNC(=O)O2 62a_100000181169_100009846815 [1,1,0,0,0,0|1,1,0]=4 4173 B17R2.18663 Cc1nccc(c1C)SCC2CNC(=O)O2 62a_100009846815_100000181169 [1,1,0,0,0,0|1,1,0]=4 4174 B17R2.18663 Cc1ncnc(c1C)OCC2CNC(=O)O2 34a_100000697798_100000181169 [1,1,0,0,0,0|2,0,0]=4 4175 B17R2.18663 Cn1c(cccc1=O)SCC2CNC(=O)O2 62a_100000181169_100000726605 [1,1,0,0,0,0|1,1,0]=4 4176 B17R2.18663 Cn1c(cccc1=O)SCC2CNC(=O)O2 62a_100000726605_100000181169 [1,1,0,0,0,0|1,1,0]=4 4177 B17R2.18663 Cn1cccc(c1=O)OCC2CNC(=O)O2 34a_100000117616_100000181169 [1,1,0,0,0,0|1,0,1]=4 4178 B17R2.18663 Cn1cccc(c1=O)OCC2CNC(=O)O2 7a_100000117616_100000181169 [1,1,0,0,0,0|1,0,1]=4 4179 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)Br 34a_100011934926_100000181169 [1,1,0,0,0,0|1,0,0]=3 4180 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)Br 7a_100011934926_100000181169 [1,1,0,0,0,0|1,0,0]=3 4181 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)Cl 34a_100012022510_100000181169 [1,1,0,0,0,0|1,0,0]=3 4182 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)Cl 7a_100012022510_100000181169 [1,1,0,0,0,0|1,0,0]=3 4183 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)F 34a_100020591140_100000181169 [1,1,0,0,0,0|1,0,0]=3 4184 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)F 7a_100020591140_100000181169 [1,1,0,0,0,0|1,0,0]=3 4185 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)I 34a_200000049512_100000181169 [1,1,0,0,0,0|1,0,0]=3 4186 B17R2.18663 Nc1c(cccc1OCC2CNC(=O)O2)I 7a_200000049512_100000181169 [1,1,0,0,0,0|1,0,0]=3 4187 B17R2.18663 Nc1c(cccc1OCC2COC(=O)O2)Br 34a_100011934926_100000073702 [1,1,0,0,0,0|2,0,0]=4 4188 B17R2.18663 Nc1c(cccc1OCC2COC(=O)O2)Cl 34a_100012022510_100000073702 [1,1,0,0,0,0|2,0,0]=4 4189 B17R2.18663 Nc1c(cccc1OCC2COC(=O)O2)F 34a_100020591140_100000073702 [1,1,0,0,0,0|2,0,0]=4 4190 B17R2.18663 Nc1c(cccc1OCC2COC(=O)O2)I 34a_200000049512_100000073702 [1,1,0,0,0,0|2,0,0]=4 4191 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)Br 62a_100000181169_100010146558 [1,1,0,0,0,0|1,1,0]=4 4192 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)Br 62a_100010146558_100000181169 [1,1,0,0,0,0|1,1,0]=4 4193 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100000181169_100010190421 [1,1,0,0,0,0|1,1,0]=4 4194 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)Cl 62a_100010190421_100000181169 [1,1,0,0,0,0|1,1,0]=4 4195 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)F 62a_100000042321_100000181169 [1,1,0,0,0,0|1,1,0]=4 4196 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100000042321 [1,1,0,0,0,0|1,1,0]=4 4197 B17R2.18663 Nc1c(cccc1SCC2CNC(=O)O2)O 62a_100000181169_100011934926 [1,1,0,0,0,0|1,1,0]=4 4198 B17R2.18663 Nc1c(ccnc1Cl)OCC2CNC(=O)O2 34a_100000128729_100000181169 [1,1,0,0,0,0|2,0,0]=4 4199 B17R2.18663 Nc1cccc(c1Br)OCC2CNC(=O)O2 34a_100012183704_100000181169 [1,1,0,0,0,0|1,0,0]=3 4200 B17R2.18663 Nc1cccc(c1Br)OCC2CNC(=O)O2 7a_100012183704_100000181169 [1,1,0,0,0,0|1,0,0]=3 4201 B17R2.18663 Nc1cccc(c1Br)OCC2COC(=O)O2 34a_100012183704_100000073702 [1,1,0,0,0,0|2,0,0]=4 4202 B17R2.18663 Nc1cccc(c1Cl)OCC2CNC(=O)O2 34a_100012002038_100000181169 [1,1,0,0,0,0|1,0,0]=3 4203 B17R2.18663 Nc1cccc(c1Cl)OCC2CNC(=O)O2 7a_100012002038_100000181169 [1,1,0,0,0,0|1,0,0]=3 4204 B17R2.18663 Nc1cccc(c1Cl)OCC2COC(=O)O2 34a_100012002038_100000073702 [1,1,0,0,0,0|2,0,0]=4 4205 B17R2.18663 Nc1cccc(c1F)SCC2CNC(=O)O2 62a_100000181169_100011935091 [1,1,0,0,0,0|1,1,0]=4 4206 B17R2.18663 Nc1cccc(c1F)SCC2CNC(=O)O2 62a_100011935091_100000181169 [1,1,0,0,0,0|1,1,0]=4 4207 B17R2.18663 Nc1cccc(c1N)OCC2CNC(=O)O2 34a_100000033209_100000181169 [1,1,0,0,0,0|1,0,0]=3 4208 B17R2.18663 Nc1cccc(c1N)OCC2COC(=O)O2 34a_100000033209_100000073702 [1,1,0,0,0,0|2,0,0]=4 4209 B17R2.18663 Nc1cccc(c1N)SCC2CNC(=O)O2 62a_100015191791_100000181169 [1,1,0,0,0,0|1,1,0]=4 4210 B17R2.18663 Nc1cccc(c1O)SCC2CNC(=O)O2 62a_100000181169_100010084371 [1,1,0,0,0,0|0,1,0]=3 4211 B17R2.18663 Nc1cccc(c1O)SCC2CNC(=O)O2 62a_100011934915_100000181169 [1,1,0,0,0,0|0,1,0]=3 4212 B17R2.18663 Nc1cccc(c1O)SCC2COC(=O)O2 62a_100000073702_100010084371 [1,1,0,0,0,0|1,1,0]=4 4213 B17R2.18663 Nc1cccc(c1O)SCC2COC(=O)O2 62a_100011934915_100000073702 [1,1,0,0,0,0|1,1,0]=4 4214 B17R2.18663 Nc1ccnc(c1Cl)OCC2CNC(=O)O2 34a_200000093555_100000181169 [1,1,0,0,0,0|2,0,0]=4 4215 B17R2.18663 Nc1ccnc(c1O)SCC2CNC(=O)O2 62a_100000181169_100009844647 [1,1,0,0,0,0|1,1,0]=4 4216 B17R2.18663 Nc1cncc(c1O)SCC2CNC(=O)O2 62a_100000181169_100000694263 [1,1,0,0,0,0|1,1,0]=4 4217 B17R2.18663 Nc1cncc(c1O)SCC2CNC(=O)O2 62a_100000694263_100000181169 [1,1,0,0,0,0|1,1,0]=4 4218 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Br)Cl 34a_100000687072_100000181169 [1,1,0,0,0,0|2,0,0]=4 4219 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Br)F 34a_100011934729_100000181169 [1,1,0,0,0,0|2,0,0]=4 4220 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Br)O 34a_100012183704_100000181169 [1,1,0,0,0,0|2,0,0]=4 4221 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Br)O 7a_100012183704_100000181169 [1,1,0,0,0,0|2,0,0]=4 4222 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Cl)Br 34a_100000687075_100000181169 [1,1,0,0,0,0|2,0,0]=4 4223 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Cl)Cl 34a_100000185733_100000181169 [1,1,0,0,0,0|2,0,0]=4 4224 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Cl)F 34a_100000692321_100000181169 [1,1,0,0,0,0|2,0,0]=4 4225 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Cl)O 34a_100012002038_100000181169 [1,1,0,0,0,0|2,0,0]=4 4226 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2Cl)O 7a_100012002038_100000181169 [1,1,0,0,0,0|2,0,0]=4 4227 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2F)Br 2230a_100011935091_100000181169 [1,1,0,0,0,0|2,0,0]=4 4228 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2F)Br 34a_100011935091_100000181169 [1,1,0,0,0,0|2,0,0]=4 4229 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2F)Cl 2230a_100000199060_100000181169 [1,1,0,0,0,0|2,0,0]=4 4230 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2F)Cl 34a_100000199060_100000181169 [1,1,0,0,0,0|2,0,0]=4 4231 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2F)F 34a_100000743855_100000181169 [1,1,0,0,0,0|2,0,0]=4 4232 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2I)Br 34a_100020590159_100000181169 [1,1,0,0,0,0|2,0,0]=4 4233 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2I)Cl 34a_100000049713_100000181169 [1,1,0,0,0,0|2,0,0]=4 4234 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2I)F 34a_100000690935_100000181169 [1,1,0,0,0,0|2,0,0]=4 4235 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2O)Br 34a_100011934915_100000181169 [1,1,0,0,0,0|1,0,0]=3 4236 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2O)Cl 34a_100000754742_100000181169 [1,1,0,0,0,0|1,0,0]=3 4237 B17R2.18663 O=C1NCC(O1)CNc2cccc(c2O)F 34a_100011934987_100000181169 [1,1,0,0,0,0|1,0,0]=3 4238 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)Br 34a_100010187966_100000181169 [1,1,0,0,0,0|1,0,0]=3 4239 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)Br 7a_100010187966_100000181169 [1,1,0,0,0,0|1,0,0]=3 4240 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)Cl 34a_100012348804_100000181169 [1,1,0,0,0,0|1,0,0]=3 4241 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)Cl 7a_100012348804_100000181169 [1,1,0,0,0,0|1,0,0]=3 4242 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)F 34a_100009820682_100000181169 [1,1,0,0,0,0|1,0,0]=3 4243 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)F 7a_100009820682_100000181169 [1,1,0,0,0,0|1,0,0]=3 4244 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)I 34a_100010187914_100000181169 [1,1,0,0,0,0|1,0,0]=3 4245 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Br)I 7a_100010187914_100000181169 [1,1,0,0,0,0|1,0,0]=3 4246 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)Br 34a_100010187913_100000181169 [1,1,0,0,0,0|1,0,0]=3 4247 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)Br 7a_100010187913_100000181169 [1,1,0,0,0,0|1,0,0]=3 4248 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)Cl 34a_100000211076_100000181169 [1,1,0,0,0,0|1,0,0]=3 4249 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)Cl 7a_100000211076_100000181169 [1,1,0,0,0,0|1,0,0]=3 4250 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)F 34a_100000087408_100000181169 [1,1,0,0,0,0|1,0,0]=3 4251 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)F 7a_100000087408_100000181169 [1,1,0,0,0,0|1,0,0]=3 4252 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)I 34a_100000049636_100000181169 [1,1,0,0,0,0|1,0,0]=3 4253 B17R2.18663 O=C1NCC(O1)COc2cccc(c2Cl)I 7a_100000049636_100000181169 [1,1,0,0,0,0|1,0,0]=3 4254 B17R2.18663 O=C1NCC(O1)COc2cccc(c2F)Br 34a_100009817021_100000181169 [1,1,0,0,0,0|1,0,0]=3 4255 B17R2.18663 O=C1NCC(O1)COc2cccc(c2F)Br 7a_100009817021_100000181169 [1,1,0,0,0,0|1,0,0]=3 4256 B17R2.18663 O=C1NCC(O1)COc2cccc(c2F)Cl 34a_100000687438_100000181169 [1,1,0,0,0,0|1,0,0]=3 4257 B17R2.18663 O=C1NCC(O1)COc2cccc(c2F)Cl 7a_100000687438_100000181169 [1,1,0,0,0,0|1,0,0]=3 4258 B17R2.18663 O=C1NCC(O1)COc2cccc(c2F)F 34a_100000751161_100000181169 [1,1,0,0,0,0|1,0,0]=3 4259 B17R2.18663 O=C1NCC(O1)COc2cccc(c2F)F 7a_100000751161_100000181169 [1,1,0,0,0,0|1,0,0]=3 4260 B17R2.18663 O=C1NCC(O1)COc2cccc(c2I)Br 34a_100010187912_100000181169 [1,1,0,0,0,0|1,0,0]=3 4261 B17R2.18663 O=C1NCC(O1)COc2cccc(c2I)Br 7a_100010187912_100000181169 [1,1,0,0,0,0|1,0,0]=3 4262 B17R2.18663 O=C1NCC(O1)COc2cccc(c2I)Cl 34a_100000050174_100000181169 [1,1,0,0,0,0|1,0,0]=3 4263 B17R2.18663 O=C1NCC(O1)COc2cccc(c2I)Cl 7a_100000050174_100000181169 [1,1,0,0,0,0|1,0,0]=3 4264 B17R2.18663 O=C1NCC(O1)COc2cccc(c2I)F 34a_100000690913_100000181169 [1,1,0,0,0,0|1,0,0]=3 4265 B17R2.18663 O=C1NCC(O1)COc2cccc(c2I)F 7a_100000690913_100000181169 [1,1,0,0,0,0|1,0,0]=3 4266 B17R2.18663 O=C1NCC(O1)COc2ccnc(c2Br)Cl 34a_100010136240_100000181169 [1,1,0,0,0,0|2,0,0]=4 4267 B17R2.18663 O=C1NCC(O1)COc2ccnc(c2Cl)Cl 34a_100009860235_100000181169 [1,1,0,0,0,0|2,0,0]=4 4268 B17R2.18663 O=C1NCC(O1)COc2ccnc(c2F)Br 34a_100009876375_100000181169 [1,1,0,0,0,0|2,0,0]=4 4269 B17R2.18663 O=C1NCC(O1)COc2ccnc(c2F)Cl 34a_100009856406_100000181169 [1,1,0,0,0,0|2,0,0]=4 4270 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)Br 62a_100000181169_100010175083 [1,1,0,0,0,0|1,1,0]=4 4271 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)Br 62a_100010175083_100000181169 [1,1,0,0,0,0|1,1,0]=4 4272 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)Cl 62a_100000181169_100014021842 [1,1,0,0,0,0|1,1,0]=4 4273 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)Cl 62a_100014021842_100000181169 [1,1,0,0,0,0|1,1,0]=4 4274 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)F 62a_100000181169_100010202630 [1,1,0,0,0,0|1,1,0]=4 4275 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)F 62a_100010202630_100000181169 [1,1,0,0,0,0|1,1,0]=4 4276 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)O 62a_100000181169_100010187914 [1,1,0,0,0,0|1,1,0]=4 4277 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Br)O 62a_100010187914_100000181169 [1,1,0,0,0,0|1,1,0]=4 4278 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)Br 62a_100000181169_100010142854 [1,1,0,0,0,0|1,1,0]=4 4279 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)Br 62a_100010142854_100000181169 [1,1,0,0,0,0|1,1,0]=4 4280 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)Cl 62a_100000181169_100011215384 [1,1,0,0,0,0|1,1,0]=4 4281 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)Cl 62a_100011215384_100000181169 [1,1,0,0,0,0|1,1,0]=4 4282 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)F 62a_100000181169_200010234923 [1,1,0,0,0,0|1,1,0]=4 4283 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)F 62a_200010234923_100000181169 [1,1,0,0,0,0|1,1,0]=4 4284 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2Cl)O 62a_100000181169_100000049636 [1,1,0,0,0,0|1,1,0]=4 4285 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)Br 62a_100000181169_100000702267 [1,1,0,0,0,0|1,1,0]=4 4286 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)Br 62a_100000702267_100000181169 [1,1,0,0,0,0|1,1,0]=4 4287 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)Cl 62a_100000181169_100011217346 [1,1,0,0,0,0|1,1,0]=4 4288 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)Cl 62a_100011217346_100000181169 [1,1,0,0,0,0|1,1,0]=4 4289 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)F 62a_100000181169_100000694657 [1,1,0,0,0,0|1,1,0]=4 4290 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)F 62a_100000694657_100000181169 [1,1,0,0,0,0|1,1,0]=4 4291 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)O 62a_100000181169_100009817021 [1,1,0,0,0,0|1,1,0]=4 4292 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2F)O 62a_100009817021_100000181169 [1,1,0,0,0,0|1,1,0]=4 4293 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)Br 62a_100000181169_100010084509 [1,1,0,0,0,0|0,1,0]=3 4294 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)Br 62a_100010084509_100000181169 [1,1,0,0,0,0|0,1,0]=3 4295 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)Cl 62a_100000181169_100010202889 [1,1,0,0,0,0|0,1,0]=3 4296 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)Cl 62a_100010202889_100000181169 [1,1,0,0,0,0|0,1,0]=3 4297 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)F 62a_100000181169_100009813666 [1,1,0,0,0,0|0,1,0]=3 4298 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)F 62a_100009813666_100000181169 [1,1,0,0,0,0|0,1,0]=3 4299 B17R2.18663 O=C1NCC(O1)CSc2cccc(c2O)O 62a_100000181169_100009815950 [1,1,0,0,0,0|0,1,0]=3 4300 B17R2.18663 O=C1NCC(O1)CSc2ccnc(c2O)Cl 62a_100000181169_100010067911 [1,1,0,0,0,0|1,1,0]=4 4301 B17R2.18663 O=C1NCC(O1)CSc2nccc(c2O)F 62a_100000181169_100009867227 [1,1,0,0,0,0|1,1,0]=4 4302 B17R2.18663 O=C1OCC(O1)CNc2cccc(c2O)Br 34a_100011934915_100000073702 [1,1,0,0,0,0|2,0,0]=4 4303 B17R2.18663 O=C1OCC(O1)CNc2cccc(c2O)Cl 34a_100000754742_100000073702 [1,1,0,0,0,0|2,0,0]=4 4304 B17R2.18663 O=C1OCC(O1)CNc2cccc(c2O)F 34a_100011934987_100000073702 [1,1,0,0,0,0|2,0,0]=4 4305 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Br)Br 34a_100010187966_100000073702 [1,1,0,0,0,0|2,0,0]=4 4306 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Br)Cl 34a_100012348804_100000073702 [1,1,0,0,0,0|2,0,0]=4 4307 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Br)F 34a_100009820682_100000073702 [1,1,0,0,0,0|2,0,0]=4 4308 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Br)I 34a_100010187914_100000073702 [1,1,0,0,0,0|2,0,0]=4 4309 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Cl)Br 34a_100010187913_100000073702 [1,1,0,0,0,0|2,0,0]=4 4310 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Cl)Cl 34a_100000211076_100000073702 [1,1,0,0,0,0|2,0,0]=4 4311 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Cl)F 34a_100000087408_100000073702 [1,1,0,0,0,0|2,0,0]=4 4312 B17R2.18663 O=C1OCC(O1)COc2cccc(c2Cl)I 34a_100000049636_100000073702 [1,1,0,0,0,0|2,0,0]=4 4313 B17R2.18663 O=C1OCC(O1)COc2cccc(c2F)Br 34a_100009817021_100000073702 [1,1,0,0,0,0|2,0,0]=4 4314 B17R2.18663 O=C1OCC(O1)COc2cccc(c2F)Cl 34a_100000687438_100000073702 [1,1,0,0,0,0|2,0,0]=4 4315 B17R2.18663 O=C1OCC(O1)COc2cccc(c2F)F 34a_100000751161_100000073702 [1,1,0,0,0,0|2,0,0]=4 4316 B17R2.18663 O=C1OCC(O1)COc2cccc(c2I)Br 34a_100010187912_100000073702 [1,1,0,0,0,0|2,0,0]=4 4317 B17R2.18663 O=C1OCC(O1)COc2cccc(c2I)Cl 34a_100000050174_100000073702 [1,1,0,0,0,0|2,0,0]=4 4318 B17R2.18663 O=C1OCC(O1)COc2cccc(c2I)F 34a_100000690913_100000073702 [1,1,0,0,0,0|2,0,0]=4 4319 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)Br 62a_100000073702_100010084509 [1,1,0,0,0,0|1,1,0]=4 4320 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)Br 62a_100010084509_100000073702 [1,1,0,0,0,0|1,1,0]=4 4321 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)Cl 62a_100000073702_100010202889 [1,1,0,0,0,0|1,1,0]=4 4322 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)Cl 62a_100010202889_100000073702 [1,1,0,0,0,0|1,1,0]=4 4323 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)F 62a_100000073702_100009813666 [1,1,0,0,0,0|1,1,0]=4 4324 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)F 62a_100009813666_100000073702 [1,1,0,0,0,0|1,1,0]=4 4325 B17R2.18663 O=C1OCC(O1)CSc2cccc(c2O)O 62a_100000073702_100009815950 [1,1,0,0,0,0|1,1,0]=4 4326 B17R2.146246 Cc1ccc[n+](c1SCC2CNC(=O)O2)[O-] 62a_100000181169_100116209805 [1,1,0,0,0,0|1,1,0]=4 4327 B17R2.146246 Cc1cccc(c1NCC2CNC(=O)O2)Br 34a_100011834072_100000181169 [1,1,0,0,0,0|1,0,0]=3 4328 B17R2.146246 Cc1cccc(c1NCC2CNC(=O)O2)C 34a_100000185769_100000181169 [1,1,0,0,0,0|1,0,0]=3 4329 B17R2.146246 Cc1cccc(c1NCC2CNC(=O)O2)Cl 34a_100000756524_100000181169 [1,1,0,0,0,0|1,0,0]=3 4330 B17R2.146246 Cc1cccc(c1NCC2CNC(=O)O2)F 34a_100000766463_100000181169 [1,1,0,0,0,0|1,0,0]=3 4331 B17R2.146246 Cc1cccc(c1NCC2CNC(=O)O2)O 34a_100000743429_100000181169 [1,1,0,0,0,0|1,0,0]=3 4332 B17R2.146246 Cc1cccc(c1NCC2COC(=O)O2)Br 34a_100011834072_100000073702 [1,1,0,0,0,0|2,0,0]=4 4333 B17R2.146246 Cc1cccc(c1NCC2COC(=O)O2)C 34a_100000185769_100000073702 [1,1,0,0,0,0|2,0,0]=4 4334 B17R2.146246 Cc1cccc(c1NCC2COC(=O)O2)Cl 34a_100000756524_100000073702 [1,1,0,0,0,0|2,0,0]=4 4335 B17R2.146246 Cc1cccc(c1NCC2COC(=O)O2)F 34a_100000766463_100000073702 [1,1,0,0,0,0|2,0,0]=4 4336 B17R2.146246 Cc1cccc(c1NCC2COC(=O)O2)O 34a_100000743429_100000073702 [1,1,0,0,0,0|2,0,0]=4 4337 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)Br 34a_100009817157_100000181169 [1,1,0,0,0,0|0,0,0]=2 4338 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)Br 7a_100009817157_100000181169 [1,1,0,0,0,0|0,0,0]=2 4339 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)C 34a_100000210341_100000181169 [1,1,0,0,0,0|0,0,0]=2 4340 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)C 7a_100000210341_100000181169 [1,1,0,0,0,0|0,0,0]=2 4341 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)Cl 34a_100000033731_100000181169 [1,1,0,0,0,0|0,0,0]=2 4342 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)Cl 7a_100000033731_100000181169 [1,1,0,0,0,0|0,0,0]=2 4343 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)F 34a_100011659162_100000181169 [1,1,0,0,0,0|0,0,0]=2 4344 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)F 7a_100011659162_100000181169 [1,1,0,0,0,0|0,0,0]=2 4345 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)N 34a_100000756359_100000181169 [1,1,0,0,0,0|0,0,0]=2 4346 B17R2.146246 Cc1cccc(c1OCC2CNC(=O)O2)N 7a_100000756359_100000181169 [1,1,0,0,0,0|0,0,0]=2 4347 B17R2.146246 Cc1cccc(c1OCC2COC(=O)O2)Br 34a_100009817157_100000073702 [1,1,0,0,0,0|1,0,0]=3 4348 B17R2.146246 Cc1cccc(c1OCC2COC(=O)O2)C 34a_100000210341_100000073702 [1,1,0,0,0,0|1,0,0]=3 4349 B17R2.146246 Cc1cccc(c1OCC2COC(=O)O2)Cl 34a_100000033731_100000073702 [1,1,0,0,0,0|1,0,0]=3 4350 B17R2.146246 Cc1cccc(c1OCC2COC(=O)O2)F 34a_100011659162_100000073702 [1,1,0,0,0,0|1,0,0]=3 4351 B17R2.146246 Cc1cccc(c1OCC2COC(=O)O2)N 34a_100000756359_100000073702 [1,1,0,0,0,0|1,0,0]=3 4352 B17R2.146246 Cc1cccc(c1OC[C@@H]2CCC(=O)N2)Br 7a_100009817157_100015189358 [1,1,0,0,0,0|2,0,0]=4 4353 B17R2.146246 Cc1cccc(c1OC[C@@H]2CCC(=O)N2)C 7a_100000210341_100015189358 [1,1,0,0,0,0|2,0,0]=4 4354 B17R2.146246 Cc1cccc(c1OC[C@@H]2CCC(=O)N2)Cl 7a_100000033731_100015189358 [1,1,0,0,0,0|2,0,0]=4 4355 B17R2.146246 Cc1cccc(c1OC[C@@H]2CCC(=O)N2)F 7a_100011659162_100015189358 [1,1,0,0,0,0|2,0,0]=4 4356 B17R2.146246 Cc1cccc(c1OC[C@@H]2CCC(=O)N2)N 7a_100000756359_100015189358 [1,1,0,0,0,0|2,0,0]=4 4357 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)Br 34a_100009817157_100015307671 [1,1,0,0,0,0|2,0,0]=4 4358 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)Br 7a_100009817157_100015307671 [1,1,0,0,0,0|2,0,0]=4 4359 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)C 34a_100000210341_100015307671 [1,1,0,0,0,0|2,0,0]=4 4360 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)C 7a_100000210341_100015307671 [1,1,0,0,0,0|2,0,0]=4 4361 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)Cl 34a_100000033731_100015307671 [1,1,0,0,0,0|2,0,0]=4 4362 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)Cl 7a_100000033731_100015307671 [1,1,0,0,0,0|2,0,0]=4 4363 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)F 34a_100011659162_100015307671 [1,1,0,0,0,0|2,0,0]=4 4364 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)F 7a_100011659162_100015307671 [1,1,0,0,0,0|2,0,0]=4 4365 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)N 34a_100000756359_100015307671 [1,1,0,0,0,0|2,0,0]=4 4366 B17R2.146246 Cc1cccc(c1OC[C@H]2COC(=O)N2)N 7a_100000756359_100015307671 [1,1,0,0,0,0|2,0,0]=4 4367 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)Br 62a_100000181169_100010141302 [1,1,0,0,0,0|0,1,0]=3 4368 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)Br 62a_100010141302_100000181169 [1,1,0,0,0,0|0,1,0]=3 4369 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)C 62a_100000033847_100000181169 [1,1,0,0,0,0|0,1,0]=3 4370 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)C 62a_100000181169_100000033847 [1,1,0,0,0,0|0,1,0]=3 4371 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)Cl 62a_100000043165_100000181169 [1,1,0,0,0,0|0,1,0]=3 4372 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)Cl 62a_100000181169_100000043165 [1,1,0,0,0,0|0,1,0]=3 4373 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100011218421 [1,1,0,0,0,0|0,1,0]=3 4374 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)F 62a_100011218421_100000181169 [1,1,0,0,0,0|0,1,0]=3 4375 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)N 62a_100000181169_100000684715 [1,1,0,0,0,0|0,1,0]=3 4376 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)N 62a_100000684715_100000181169 [1,1,0,0,0,0|0,1,0]=3 4377 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)O 62a_100000181169_100000686692 [1,1,0,0,0,0|0,1,0]=3 4378 B17R2.146246 Cc1cccc(c1SCC2CNC(=O)O2)O 62a_100000686692_100000181169 [1,1,0,0,0,0|0,1,0]=3 4379 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)Br 62a_100000073702_100010141302 [1,1,0,0,0,0|1,1,0]=4 4380 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)Br 62a_100010141302_100000073702 [1,1,0,0,0,0|1,1,0]=4 4381 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)C 62a_100000033847_100000073702 [1,1,0,0,0,0|1,1,0]=4 4382 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)C 62a_100000073702_100000033847 [1,1,0,0,0,0|1,1,0]=4 4383 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)Cl 62a_100000043165_100000073702 [1,1,0,0,0,0|1,1,0]=4 4384 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)Cl 62a_100000073702_100000043165 [1,1,0,0,0,0|1,1,0]=4 4385 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)F 62a_100000073702_100011218421 [1,1,0,0,0,0|1,1,0]=4 4386 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)F 62a_100011218421_100000073702 [1,1,0,0,0,0|1,1,0]=4 4387 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)N 62a_100000073702_100000684715 [1,1,0,0,0,0|1,1,0]=4 4388 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)N 62a_100000684715_100000073702 [1,1,0,0,0,0|1,1,0]=4 4389 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)O 62a_100000073702_100000686692 [1,1,0,0,0,0|1,1,0]=4 4390 B17R2.146246 Cc1cccc(c1SCC2COC(=O)O2)O 62a_100000686692_100000073702 [1,1,0,0,0,0|1,1,0]=4 4391 B17R2.146246 Cc1ccnc(c1OCC2CNC(=O)O2)C 34a_100011934651_100000181169 [1,1,0,0,0,0|1,0,0]=3 4392 B17R2.146246 Cc1ccnc(c1OCC2CNC(=O)O2)C 7a_100011934651_100000181169 [1,1,0,0,0,0|1,0,0]=3 4393 B17R2.146246 Cc1ccnc(c1OCC2CNC(=O)O2)Cl 34a_100000696282_100000181169 [1,1,0,0,0,0|1,0,0]=3 4394 B17R2.146246 Cc1ccnc(c1OCC2CNC(=O)O2)Cl 7a_100000696282_100000181169 [1,1,0,0,0,0|1,0,0]=3 4395 B17R2.146246 Cc1ccnc(c1OCC2COC(=O)O2)C 34a_100011934651_100000073702 [1,1,0,0,0,0|2,0,0]=4 4396 B17R2.146246 Cc1ccnc(c1OCC2COC(=O)O2)Cl 34a_100000696282_100000073702 [1,1,0,0,0,0|2,0,0]=4 4397 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)C 62a_100000181169_100012000501 [1,1,0,0,0,0|1,1,0]=4 4398 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)C 62a_100012000501_100000181169 [1,1,0,0,0,0|1,1,0]=4 4399 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)Cl 62a_100000181169_100010248874 [1,1,0,0,0,0|1,1,0]=4 4400 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)Cl 62a_100010248874_100000181169 [1,1,0,0,0,0|1,1,0]=4 4401 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)F 62a_100000181169_100009818256 [1,1,0,0,0,0|1,1,0]=4 4402 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)F 62a_100009818256_100000181169 [1,1,0,0,0,0|1,1,0]=4 4403 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)N 62a_100000181169_100011998619 [1,1,0,0,0,0|1,1,0]=4 4404 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)N 62a_100011998619_100000181169 [1,1,0,0,0,0|1,1,0]=4 4405 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)O 62a_100000181169_100012000493 [1,1,0,0,0,0|1,1,0]=4 4406 B17R2.146246 Cc1ccnc(c1SCC2CNC(=O)O2)O 62a_100012000493_100000181169 [1,1,0,0,0,0|1,1,0]=4 4407 B17R2.146246 Cc1cncc(c1SCC2CNC(=O)O2)C 62a_100000181169_100009817138 [1,1,0,0,0,0|1,1,0]=4 4408 B17R2.146246 Cc1cncc(c1SCC2CNC(=O)O2)C 62a_100009817138_100000181169 [1,1,0,0,0,0|1,1,0]=4 4409 B17R2.146246 Cc1nccc(c1SCC2CNC(=O)O2)N 62a_100000181169_100010243816 [1,1,0,0,0,0|1,1,0]=4 4410 B17R2.146246 Cc1nccc(c1SCC2CNC(=O)O2)N 62a_100010243816_100000181169 [1,1,0,0,0,0|1,1,0]=4 4411 B17R2.146246 Cc1ncnc(c1OCC2CNC(=O)O2)C 34a_100009878406_100000181169 [1,1,0,0,0,0|2,0,0]=4 4412 B17R2.146246 Cc1ncnc(c1OCC2CNC(=O)O2)C 7a_100009878406_100000181169 [1,1,0,0,0,0|2,0,0]=4 4413 B17R2.146246 Cc1occc(=O)c1OCC2CNC(=O)O2 34a_100000031901_100000181169 [1,1,0,0,0,0|1,0,0]=3 4414 B17R2.146246 Cc1occc(=O)c1OCC2COC(=O)O2 34a_100000031901_100000073702 [1,1,0,0,0,0|2,0,0]=4 4415 B17R2.146246 Nc1cccc(c1OCC2CNC(=O)O2)Br 34a_100011934915_100000181169 [1,1,0,0,0,0|1,0,0]=3 4416 B17R2.146246 Nc1cccc(c1OCC2CNC(=O)O2)Cl 34a_100000754742_100000181169 [1,1,0,0,0,0|1,0,0]=3 4417 B17R2.146246 Nc1cccc(c1OCC2CNC(=O)O2)F 34a_100011934987_100000181169 [1,1,0,0,0,0|1,0,0]=3 4418 B17R2.146246 Nc1cccc(c1OCC2CNC(=O)O2)I 34a_100010084371_100000181169 [1,1,0,0,0,0|1,0,0]=3 4419 B17R2.146246 Nc1cccc(c1OCC2CNC(=O)O2)N 34a_200016994477_100000181169 [1,1,0,0,0,0|1,0,0]=3 4420 B17R2.146246 Nc1cccc(c1OCC2COC(=O)O2)Br 34a_100011934915_100000073702 [1,1,0,0,0,0|2,0,0]=4 4421 B17R2.146246 Nc1cccc(c1OCC2COC(=O)O2)Cl 34a_100000754742_100000073702 [1,1,0,0,0,0|2,0,0]=4 4422 B17R2.146246 Nc1cccc(c1OCC2COC(=O)O2)F 34a_100011934987_100000073702 [1,1,0,0,0,0|2,0,0]=4 4423 B17R2.146246 Nc1cccc(c1OCC2COC(=O)O2)I 34a_100010084371_100000073702 [1,1,0,0,0,0|2,0,0]=4 4424 B17R2.146246 Nc1cccc(c1OCC2COC(=O)O2)N 34a_200016994477_100000073702 [1,1,0,0,0,0|2,0,0]=4 4425 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)Br 62a_100000181169_100020590159 [1,1,0,0,0,0|1,1,0]=4 4426 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)Br 62a_100020590159_100000181169 [1,1,0,0,0,0|1,1,0]=4 4427 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)Cl 62a_100000049713_100000181169 [1,1,0,0,0,0|1,1,0]=4 4428 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)Cl 62a_100000181169_100000049713 [1,1,0,0,0,0|1,1,0]=4 4429 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100000690935 [1,1,0,0,0,0|1,1,0]=4 4430 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)F 62a_100000690935_100000181169 [1,1,0,0,0,0|1,1,0]=4 4431 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)O 62a_100000181169_100012183704 [1,1,0,0,0,0|0,1,0]=3 4432 B17R2.146246 Nc1cccc(c1SCC2CNC(=O)O2)O 62a_100012183704_100000181169 [1,1,0,0,0,0|0,1,0]=3 4433 B17R2.146246 Nc1cccc(c1SCC2COC(=O)O2)O 62a_100000073702_100012183704 [1,1,0,0,0,0|1,1,0]=4 4434 B17R2.146246 Nc1cccc(c1SCC2COC(=O)O2)O 62a_100012183704_100000073702 [1,1,0,0,0,0|1,1,0]=4 4435 B17R2.146246 Nc1ccnc(c1OCC2CNC(=O)O2)Cl 34a_100009844647_100000181169 [1,1,0,0,0,0|2,0,0]=4 4436 B17R2.146246 Nc1ccnc(c1OCC2CNC(=O)O2)Cl 7a_100009844647_100000181169 [1,1,0,0,0,0|2,0,0]=4 4437 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Br)Br 34a_100000690995_100000181169 [1,1,0,0,0,0|2,0,0]=4 4438 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Br)Cl 34a_100102946385_100000181169 [1,1,0,0,0,0|2,0,0]=4 4439 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Br)F 34a_100000684712_100000181169 [1,1,0,0,0,0|2,0,0]=4 4440 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Br)O 34a_100011934926_100000181169 [1,1,0,0,0,0|1,0,0]=3 4441 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Cl)Cl 34a_100000210028_100000181169 [1,1,0,0,0,0|2,0,0]=4 4442 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Cl)F 34a_100000760031_100000181169 [1,1,0,0,0,0|2,0,0]=4 4443 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2Cl)O 34a_100012022510_100000181169 [1,1,0,0,0,0|1,0,0]=3 4444 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2F)F 2230a_100000210704_100000181169 [1,1,0,0,0,0|2,0,0]=4 4445 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2F)F 34a_100000210704_100000181169 [1,1,0,0,0,0|2,0,0]=4 4446 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2F)O 34a_100020591140_100000181169 [1,1,0,0,0,0|1,0,0]=3 4447 B17R2.146246 O=C1NCC(O1)CNc2c(cccc2I)F 34a_100000042321_100000181169 [1,1,0,0,0,0|2,0,0]=4 4448 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Br)Br 34a_100000736428_100000181169 [1,1,0,0,0,0|1,0,0]=3 4449 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Br)Br 7a_100000736428_100000181169 [1,1,0,0,0,0|1,0,0]=3 4450 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Br)Cl 34a_100010214474_100000181169 [1,1,0,0,0,0|1,0,0]=3 4451 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Br)Cl 7a_100010214474_100000181169 [1,1,0,0,0,0|1,0,0]=3 4452 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Br)F 34a_100009813666_100000181169 [1,1,0,0,0,0|1,0,0]=3 4453 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Br)F 7a_100009813666_100000181169 [1,1,0,0,0,0|1,0,0]=3 4454 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Cl)Cl 34a_100000211709_100000181169 [1,1,0,0,0,0|1,0,0]=3 4455 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Cl)Cl 7a_100000211709_100000181169 [1,1,0,0,0,0|1,0,0]=3 4456 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Cl)F 34a_100000694953_100000181169 [1,1,0,0,0,0|1,0,0]=3 4457 B17R2.146246 O=C1NCC(O1)COc2c(cccc2Cl)F 7a_100000694953_100000181169 [1,1,0,0,0,0|1,0,0]=3 4458 B17R2.146246 O=C1NCC(O1)COc2c(cccc2F)F 34a_100000230165_100000181169 [1,1,0,0,0,0|1,0,0]=3 4459 B17R2.146246 O=C1NCC(O1)COc2c(cccc2F)F 7a_100000230165_100000181169 [1,1,0,0,0,0|1,0,0]=3 4460 B17R2.146246 O=C1NCC(O1)COc2c(cccc2I)Br 34a_100010084509_100000181169 [1,1,0,0,0,0|1,0,0]=3 4461 B17R2.146246 O=C1NCC(O1)COc2c(cccc2I)Br 7a_100010084509_100000181169 [1,1,0,0,0,0|1,0,0]=3 4462 B17R2.146246 O=C1NCC(O1)COc2c(cccc2I)Cl 34a_100010202889_100000181169 [1,1,0,0,0,0|1,0,0]=3 4463 B17R2.146246 O=C1NCC(O1)COc2c(cccc2I)Cl 7a_100010202889_100000181169 [1,1,0,0,0,0|1,0,0]=3 4464 B17R2.146246 O=C1NCC(O1)COc2c(cccc2I)F 34a_100010186298_100000181169 [1,1,0,0,0,0|1,0,0]=3 4465 B17R2.146246 O=C1NCC(O1)COc2c(cccc2I)F 7a_100010186298_100000181169 [1,1,0,0,0,0|1,0,0]=3 4466 B17R2.146246 O=C1NCC(O1)COc2c(ccnc2Cl)Cl 34a_100000118450_100000181169 [1,1,0,0,0,0|2,0,0]=4 4467 B17R2.146246 O=C1NCC(O1)COc2c(ccnc2Cl)Cl 7a_100000118450_100000181169 [1,1,0,0,0,0|2,0,0]=4 4468 B17R2.146246 O=C1NCC(O1)COc2c(ccnc2Cl)F 34a_100009867227_100000181169 [1,1,0,0,0,0|2,0,0]=4 4469 B17R2.146246 O=C1NCC(O1)COc2c(ccnc2Cl)F 7a_100009867227_100000181169 [1,1,0,0,0,0|2,0,0]=4 4470 B17R2.146246 O=C1NCC(O1)COc2c(ccnc2Cl)I 34a_100010067911_100000181169 [1,1,0,0,0,0|2,0,0]=4 4471 B17R2.146246 O=C1NCC(O1)COc2c(ccnc2Cl)I 7a_100010067911_100000181169 [1,1,0,0,0,0|2,0,0]=4 4472 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)Br 62a_100000181169_100009994525 [1,1,0,0,0,0|1,1,0]=4 4473 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)Br 62a_100009994525_100000181169 [1,1,0,0,0,0|1,1,0]=4 4474 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)Cl 62a_100000181169_100010214488 [1,1,0,0,0,0|1,1,0]=4 4475 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)Cl 62a_100010214488_100000181169 [1,1,0,0,0,0|1,1,0]=4 4476 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)F 62a_100000181169_100011219512 [1,1,0,0,0,0|1,1,0]=4 4477 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)F 62a_100011219512_100000181169 [1,1,0,0,0,0|1,1,0]=4 4478 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)O 62a_100000181169_100010187912 [1,1,0,0,0,0|0,1,0]=3 4479 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Br)O 62a_100010187912_100000181169 [1,1,0,0,0,0|0,1,0]=3 4480 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Cl)Cl 62a_100000034237_100000181169 [1,1,0,0,0,0|1,1,0]=4 4481 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Cl)Cl 62a_100000181169_100000034237 [1,1,0,0,0,0|1,1,0]=4 4482 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Cl)F 62a_100000050007_100000181169 [1,1,0,0,0,0|1,1,0]=4 4483 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Cl)F 62a_100000181169_100000050007 [1,1,0,0,0,0|1,1,0]=4 4484 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2Cl)O 62a_100000181169_100000050174 [1,1,0,0,0,0|0,1,0]=3 4485 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2F)F 62a_100000181169_100000693133 [1,1,0,0,0,0|1,1,0]=4 4486 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2F)F 62a_100000693133_100000181169 [1,1,0,0,0,0|1,1,0]=4 4487 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2F)O 62a_100000181169_100009820682 [1,1,0,0,0,0|0,1,0]=3 4488 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2F)O 62a_100009820682_100000181169 [1,1,0,0,0,0|0,1,0]=3 4489 B17R2.146246 O=C1NCC(O1)CSc2c(cccc2O)O 62a_100000181169_100010205330 [1,1,0,0,0,0|0,1,0]=3 4490 B17R2.146246 O=C1NCC(O1)CSc2c(ccnc2O)O 62a_100000181169_200009817435 [1,1,0,0,0,0|1,1,0]=4 4491 B17R2.146246 O=C1OCC(O1)CNc2c(cccc2Br)O 34a_100011934926_100000073702 [1,1,0,0,0,0|2,0,0]=4 4492 B17R2.146246 O=C1OCC(O1)CNc2c(cccc2Cl)O 34a_100012022510_100000073702 [1,1,0,0,0,0|2,0,0]=4 4493 B17R2.146246 O=C1OCC(O1)CNc2c(cccc2F)O 34a_100020591140_100000073702 [1,1,0,0,0,0|2,0,0]=4 4494 B17R2.146246 O=C1OCC(O1)COc2c(cccc2Br)Br 34a_100000736428_100000073702 [1,1,0,0,0,0|2,0,0]=4 4495 B17R2.146246 O=C1OCC(O1)COc2c(cccc2Br)Cl 34a_100010214474_100000073702 [1,1,0,0,0,0|2,0,0]=4 4496 B17R2.146246 O=C1OCC(O1)COc2c(cccc2Br)F 34a_100009813666_100000073702 [1,1,0,0,0,0|2,0,0]=4 4497 B17R2.146246 O=C1OCC(O1)COc2c(cccc2Cl)Cl 34a_100000211709_100000073702 [1,1,0,0,0,0|2,0,0]=4 4498 B17R2.146246 O=C1OCC(O1)COc2c(cccc2Cl)F 34a_100000694953_100000073702 [1,1,0,0,0,0|2,0,0]=4 4499 B17R2.146246 O=C1OCC(O1)COc2c(cccc2F)F 34a_100000230165_100000073702 [1,1,0,0,0,0|2,0,0]=4 4500 B17R2.146246 O=C1OCC(O1)COc2c(cccc2I)Br 34a_100010084509_100000073702 [1,1,0,0,0,0|2,0,0]=4 4501 B17R2.146246 O=C1OCC(O1)COc2c(cccc2I)Cl 34a_100010202889_100000073702 [1,1,0,0,0,0|2,0,0]=4 4502 B17R2.146246 O=C1OCC(O1)COc2c(cccc2I)F 34a_100010186298_100000073702 [1,1,0,0,0,0|2,0,0]=4 4503 B17R2.146246 O=C1OCC(O1)CSc2c(cccc2Br)O 62a_100000073702_100010187912 [1,1,0,0,0,0|1,1,0]=4 4504 B17R2.146246 O=C1OCC(O1)CSc2c(cccc2Br)O 62a_100010187912_100000073702 [1,1,0,0,0,0|1,1,0]=4 4505 B17R2.146246 O=C1OCC(O1)CSc2c(cccc2Cl)O 62a_100000073702_100000050174 [1,1,0,0,0,0|1,1,0]=4 4506 B17R2.146246 O=C1OCC(O1)CSc2c(cccc2F)O 62a_100000073702_100009820682 [1,1,0,0,0,0|1,1,0]=4 4507 B17R2.146246 O=C1OCC(O1)CSc2c(cccc2F)O 62a_100009820682_100000073702 [1,1,0,0,0,0|1,1,0]=4 4508 B17R2.146246 O=C1OCC(O1)CSc2c(cccc2O)O 62a_100000073702_100010205330 [1,1,0,0,0,0|1,1,0]=4 4509 B17R2.2458 C/C=C/c1ccccc1OC2COC(=O)O2 34a_200000189419_100000032252 [0,1,0,0,1,0|2,0,0]=4 4510 B17R2.2458 CCCc1ccccc1OC2COC(=O)O2 34a_100011217252_100000032252 [0,1,0,0,1,0|2,0,0]=4 4511 B17R2.2458 CCNc1ccccc1OC2COC(=O)O2 34a_103624766699_100000032252 [0,1,0,0,1,0|2,0,0]=4 4512 B17R2.2458 CCOc1ccccc1NC2COC(=O)O2 34a_100000211218_100000032252 [0,1,0,0,1,0|2,0,0]=4 4513 B17R2.2458 CCOc1ccccc1OC2COC(=O)O2 34a_100000211404_100000032252 [0,1,0,0,1,0|1,0,0]=3 4514 B17R2.2458 CCOc1ccccc1SC2COC(=O)O2 62a_100000230754_100000032252 [0,1,0,0,1,0|1,1,0]=4 4515 B17R2.2458 CCOc1ncccc1OC2COC(=O)O2 34a_100011998697_100000032252 [0,1,0,0,1,0|2,0,0]=4 4516 B17R2.2458 CNCc1ccccc1OC2COC(=O)O2 34a_100015189988_100000032252 [0,1,0,0,1,0|2,0,0]=4 4517 B17R2.2458 COCc1ccccc1OC2COC(=O)O2 34a_100011488565_100000032252 [0,1,0,0,1,0|1,0,0]=3 4518 B17R2.2458 COCc1ccccc1SC2COC(=O)O2 62a_100011493684_100000032252 [0,1,0,0,1,0|1,1,0]=4 4519 B17R2.2458 NCCc1ccccc1OC2COC(=O)O2 34a_100011207237_100000032252 [0,1,0,0,1,0|2,0,0]=4 4520 B17R2.2458 O=C1OCC(O1)Oc2ccccc2CCBr 34a_100000722297_100000032252 [0,1,0,0,1,0|2,0,0]=4 4521 B17R2.2458 O=C1OCC(O1)Oc2ccccc2CCO 34a_100000719421_100000032252 [0,1,0,0,1,0|2,0,0]=4 4522 B17R2.2723 COc1ccccc1N(C)C2COC(=O)O2 34a_100000219746_100000032252 [0,1,0,0,1,0|2,0,0]=4 4523 B17R2.3058 COc1c(cccc1CN2CNC(=O)C2)Br 2230a_200000708111_100011470457 [0,1,0,0,1,0|2,0,0]=4 4524 B17R2.3058 COc1c(cccc1CN2CNC(=O)C2)Br 26a_200000708111_100010234590 [0,1,0,0,1,0|2,0,0]=4 4525 B17R2.3058 COc1c(cccc1CN2CNC(=O)C2)C 2230a_200000708111_100012349798 [0,1,0,0,1,0|2,0,0]=4 4526 B17R2.3058 COc1c(cccc1CN2CNC(=O)C2)Cl 26a_200000708111_200009886253 [0,1,0,0,1,0|2,0,0]=4 4527 B17R2.3058 COc1c(cccc1NC2COC(=O)O2)Br 34a_100011935253_100000032252 [0,1,0,0,1,0|2,0,0]=4 4528 B17R2.3058 COc1c(cccc1NC2COC(=O)O2)C 34a_100012017360_100000032252 [0,1,0,0,1,0|2,0,0]=4 4529 B17R2.3058 COc1c(cccc1NC2COC(=O)O2)Cl 34a_100000743799_100000032252 [0,1,0,0,1,0|2,0,0]=4 4530 B17R2.3058 COc1c(cccc1NC2COC(=O)O2)F 34a_100011215007_100000032252 [0,1,0,0,1,0|2,0,0]=4 4531 B17R2.3058 COc1c(cccc1OC2COC(=O)O2)Br 34a_100010234590_100000032252 [0,1,0,0,1,0|1,0,0]=3 4532 B17R2.3058 COc1c(cccc1OC2COC(=O)O2)Cl 34a_200009886253_100000032252 [0,1,0,0,1,0|1,0,0]=3 4533 B17R2.3058 COc1c(cccc1SC2COC(=O)O2)Br 62a_100010146560_100000032252 [0,1,0,0,1,0|1,1,0]=4 4534 B17R2.3058 COc1c(cccc1SC2COC(=O)O2)C 62a_100010141385_100000032252 [0,1,0,0,1,0|1,1,0]=4 4535 B17R2.3058 COc1c(cccc1SC2COC(=O)O2)Cl 62a_100010147678_100000032252 [0,1,0,0,1,0|1,1,0]=4 4536 B17R2.3058 COc1c(cccc1SC2COC(=O)O2)F 62a_100009816759_100000032252 [0,1,0,0,1,0|1,1,0]=4 4537 B17R2.3058 COc1c(cccc1SC2COC(=O)O2)N 62a_100011935253_100000032252 [0,1,0,0,1,0|1,1,0]=4 4538 B17R2.3058 COc1c(ccnc1Cl)OC2COC(=O)O2 34a_100000104430_100000032252 [0,1,0,0,1,0|2,0,0]=4 4539 B17R2.3058 CSc1c(cccc1OC2COC(=O)O2)C 34a_200000099257_100000032252 [0,1,0,0,1,0|1,1,0]=4 4540 B17R2.3266 CC(C)c1ccccc1OC2COC(=O)O2 34a_100000211617_100000032252 [0,1,0,0,1,0|2,0,0]=4 4541 B17R2.3266 CC(O)c1ccccc1OC2COC(=O)O2 34a_200011232679_100000032252 [0,1,0,0,1,0|2,0,0]=4 4542 B17R2.3266 C[C@@H](N)c1ccccc1OC2COC(=O)O2 34a_100025703389_100000032252 [0,1,0,0,1,0|2,0,0]=4 4543 B17R2.9435 COc1ccc(cc1CN2CNC(=O)C2)Br 2230a_200000708111_100000204665 [0,1,0,0,1,0|2,0,0]=4 4544 B17R2.9435 COc1ccc(cc1CN2CNC(=O)C2)Br 26a_200000708111_100009816560 [0,1,0,0,1,0|2,0,0]=4 4545 B17R2.9435 COc1ccc(cc1CN2CNC(=O)C2)C 2230a_200000708111_100000199068 [0,1,0,0,1,0|2,0,0]=4 4546 B17R2.9435 COc1ccc(cc1CN2CNC(=O)C2)Cl 2230a_200000708111_100000209806 [0,1,0,0,1,0|2,0,0]=4 4547 B17R2.9435 COc1ccc(cc1CN2CNC(=O)C2)F 2230a_200000708111_100011830354 [0,1,0,0,1,0|2,0,0]=4 4548 B17R2.9435 COc1ccc(cc1NC2COC(=O)O2)Br 34a_100000743470_100000032252 [0,1,0,0,1,0|2,0,0]=4 4549 B17R2.9435 COc1ccc(cc1NC2COC(=O)O2)C 34a_100000210980_100000032252 [0,1,0,0,1,0|2,0,0]=4 4550 B17R2.9435 COc1ccc(cc1NC2COC(=O)O2)Cl 34a_100000182114_100000032252 [0,1,0,0,1,0|2,0,0]=4 4551 B17R2.9435 COc1ccc(cc1NC2COC(=O)O2)F 34a_100000757179_100000032252 [0,1,0,0,1,0|2,0,0]=4 4552 B17R2.9435 COc1ccc(cc1OC2COC(=O)O2)Br 34a_100009816560_100000032252 [0,1,0,0,1,0|1,0,0]=3 4553 B17R2.9435 COc1ccc(cc1OC2COC(=O)O2)C 34a_100011216497_100000032252 [0,1,0,0,1,0|1,0,0]=3 4554 B17R2.9435 COc1ccc(cc1OC2COC(=O)O2)Cl 34a_100000101779_100000032252 [0,1,0,0,1,0|1,0,0]=3 4555 B17R2.9435 COc1ccc(cc1OC2COC(=O)O2)F 34a_100000034962_100000032252 [0,1,0,0,1,0|1,0,0]=3 4556 B17R2.9435 COc1ccc(cc1OC2COC(=O)O2)N 34a_100000211920_100000032252 [0,1,0,0,1,0|1,0,0]=3 4557 B17R2.9435 COc1ccc(cc1SC2COC(=O)O2)Br 62a_100012351588_100000032252 [0,1,0,0,1,0|1,1,0]=4 4558 B17R2.9435 COc1ccc(cc1SC2COC(=O)O2)C 62a_100000186399_100000032252 [0,1,0,0,1,0|1,1,0]=4 4559 B17R2.9435 COc1ccc(cc1SC2COC(=O)O2)Cl 62a_100011215930_100000032252 [0,1,0,0,1,0|1,1,0]=4 4560 B17R2.9435 COc1ccc(cc1SC2COC(=O)O2)F 62a_100000171694_100000032252 [0,1,0,0,1,0|1,1,0]=4 4561 B17R2.9435 COc1ccc(cc1SC2COC(=O)O2)N 62a_100011356947_100000032252 [0,1,0,0,1,0|1,1,0]=4 4562 B17R2.9435 COc1ccc(cc1SC2COC(=O)O2)O 62a_100010234764_100000032252 [0,1,0,0,1,0|1,1,0]=4 4563 B17R2.9435 COc1cnc(cc1OC2COC(=O)O2)Br 34a_100010264082_100000032252 [0,1,0,0,1,0|2,0,0]=4 4564 B17R2.9435 COc1cnc(cc1OC2COC(=O)O2)Cl 34a_100009849459_100000032252 [0,1,0,0,1,0|2,0,0]=4 4565 B17R2.9435 COc1ncc(cc1OC2COC(=O)O2)Br 34a_100010135713_100000032252 [0,1,0,0,1,0|2,0,0]=4 4566 B17R2.10533 CCc1cc(ccc1OC2COC(=O)O2)Br 34a_100012338938_100000032252 [0,1,0,0,1,0|2,0,0]=4 4567 B17R2.10533 CCc1cc(ccc1OC2COC(=O)O2)C 34a_100009844793_100000032252 [0,1,0,0,1,0|2,0,0]=4 4568 B17R2.10533 CCc1cc(ccc1OC2COC(=O)O2)F 34a_200000035566_100000032252 [0,1,0,0,1,0|2,0,0]=4 4569 B17R2.10533 COc1cc(ccc1CN2CNC(=O)C2)Br 2230a_200000708111_100012359436 [0,1,0,0,1,0|2,0,0]=4 4570 B17R2.10533 COc1cc(ccc1CN2CNC(=O)C2)Br 26a_200000708111_100000694246 [0,1,0,0,1,0|2,0,0]=4 4571 B17R2.10533 COc1cc(ccc1CN2CNC(=O)C2)F 2230a_200000708111_200010171551 [0,1,0,0,1,0|2,0,0]=4 4572 B17R2.10533 COc1cc(ccc1NC2COC(=O)O2)Br 34a_100011279103_100000032252 [0,1,0,0,1,0|2,0,0]=4 4573 B17R2.10533 COc1cc(ccc1NC2COC(=O)O2)C 34a_100000746441_100000032252 [0,1,0,0,1,0|2,0,0]=4 4574 B17R2.10533 COc1cc(ccc1NC2COC(=O)O2)Cl 34a_100000707585_100000032252 [0,1,0,0,1,0|2,0,0]=4 4575 B17R2.10533 COc1cc(ccc1NC2COC(=O)O2)F 34a_100000737216_100000032252 [0,1,0,0,1,0|2,0,0]=4 4576 B17R2.10533 COc1cc(ccc1NC2COC(=O)O2)I 34a_100015196925_100000032252 [0,1,0,0,1,0|2,0,0]=4 4577 B17R2.10533 COc1cc(ccc1NC2COC(=O)O2)O 34a_100015326901_100000032252 [0,1,0,0,1,0|2,0,0]=4 4578 B17R2.10533 COc1cc(ccc1OC2COC(=O)O2)Br 34a_100000694246_100000032252 [0,1,0,0,1,0|1,0,0]=3 4579 B17R2.10533 COc1cc(ccc1OC2COC(=O)O2)C 34a_100000186466_100000032252 [0,1,0,0,1,0|1,0,0]=3 4580 B17R2.10533 COc1cc(ccc1OC2COC(=O)O2)Cl 34a_100000033002_100000032252 [0,1,0,0,1,0|1,0,0]=3 4581 B17R2.10533 COc1cc(ccc1OC2COC(=O)O2)F 34a_100000036057_100000032252 [0,1,0,0,1,0|1,0,0]=3 4582 B17R2.10533 COc1cc(ccc1OC2COC(=O)O2)I 34a_100000049635_100000032252 [0,1,0,0,1,0|1,0,0]=3 4583 B17R2.10533 COc1cc(ccc1OC2COC(=O)O2)N 34a_100000726020_100000032252 [0,1,0,0,1,0|1,0,0]=3 4584 B17R2.10533 COc1cc(ccc1SC2COC(=O)O2)Br 62a_100010245111_100000032252 [0,1,0,0,1,0|1,1,0]=4 4585 B17R2.10533 COc1cc(ccc1SC2COC(=O)O2)C 62a_100010200004_100000032252 [0,1,0,0,1,0|1,1,0]=4 4586 B17R2.10533 COc1cc(ccc1SC2COC(=O)O2)Cl 62a_100000050115_100000032252 [0,1,0,0,1,0|1,1,0]=4 4587 B17R2.10533 COc1cc(ccc1SC2COC(=O)O2)F 62a_100000757151_100000032252 [0,1,0,0,1,0|1,1,0]=4 4588 B17R2.10533 COc1cc(ccc1SC2COC(=O)O2)N 62a_100000765947_100000032252 [0,1,0,0,1,0|1,1,0]=4 4589 B17R2.10533 COc1cc(cnc1OC2COC(=O)O2)Cl 34a_200009845368_100000032252 [0,1,0,0,1,0|2,0,0]=4 4590 B17R2.10533 COc1nc(ccc1OC2COC(=O)O2)Br 34a_100010893133_100000032252 [0,1,0,0,1,0|2,0,0]=4 4591 B17R2.71187 CCc1cccc(c1OC2COC(=O)O2)Br 34a_200010001580_100000032252 [0,1,0,0,1,0|2,0,0]=4 4592 B17R2.71187 CCc1cccc(c1OC2COC(=O)O2)C 34a_100000034007_100000032252 [0,1,0,0,1,0|2,0,0]=4 4593 B17R2.71187 COc1cccc(c1CN2CNC(=O)C2)Br 26a_200000708111_100000686866 [0,1,0,0,1,0|2,0,0]=4 4594 B17R2.71187 COc1cccc(c1CN2CNC(=O)C2)Cl 2230a_200000708111_100012349678 [0,1,0,0,1,0|2,0,0]=4 4595 B17R2.71187 COc1cccc(c1CN2CNC(=O)C2)F 2230a_200000708111_100011216731 [0,1,0,0,1,0|2,0,0]=4 4596 B17R2.71187 COc1cccc(c1NC2COC(=O)O2)Br 34a_100000708083_100000032252 [0,1,0,0,1,0|2,0,0]=4 4597 B17R2.71187 COc1cccc(c1NC2COC(=O)O2)C 34a_100000758225_100000032252 [0,1,0,0,1,0|2,0,0]=4 4598 B17R2.71187 COc1cccc(c1NC2COC(=O)O2)Cl 34a_100011309317_100000032252 [0,1,0,0,1,0|2,0,0]=4 4599 B17R2.71187 COc1cccc(c1NC2COC(=O)O2)F 34a_100000686744_100000032252 [0,1,0,0,1,0|2,0,0]=4 4600 B17R2.71187 COc1cccc(c1NC2COC(=O)O2)O 34a_100012022766_100000032252 [0,1,0,0,1,0|2,0,0]=4 4601 B17R2.71187 COc1cccc(c1OC2COC(=O)O2)Br 34a_100000686866_100000032252 [0,1,0,0,1,0|1,0,0]=3 4602 B17R2.71187 COc1cccc(c1OC2COC(=O)O2)C 34a_100011219253_100000032252 [0,1,0,0,1,0|1,0,0]=3 4603 B17R2.71187 COc1cccc(c1OC2COC(=O)O2)Cl 34a_100009851661_100000032252 [0,1,0,0,1,0|1,0,0]=3 4604 B17R2.71187 COc1cccc(c1OC2COC(=O)O2)F 34a_100000036725_100000032252 [0,1,0,0,1,0|1,0,0]=3 4605 B17R2.71187 COc1cccc(c1OC2COC(=O)O2)N 34a_100000123586_100000032252 [0,1,0,0,1,0|1,0,0]=3 4606 B17R2.71187 COc1cccc(c1SC2COC(=O)O2)Br 62a_100010131421_100000032252 [0,1,0,0,1,0|1,1,0]=4 4607 B17R2.71187 COc1cccc(c1SC2COC(=O)O2)C 62a_100010191535_100000032252 [0,1,0,0,1,0|1,1,0]=4 4608 B17R2.71187 COc1cccc(c1SC2COC(=O)O2)F 62a_100000703912_100000032252 [0,1,0,0,1,0|1,1,0]=4 4609 B17R2.71187 COc1cccc(c1SC2COC(=O)O2)N 62a_100000703447_100000032252 [0,1,0,0,1,0|1,1,0]=4 4610 B17R2.12561 COc1ccccc1C(=O)CC2CC(=O)C2 1458a_100000185835_100009874392 [0,1,0,0,1,0|2,0,0]=4 4611 B17R2.12561 COc1ccccc1N(C)CC2CC(=O)C2 2230a_100000219746_100009874392 [0,1,0,0,1,0|2,0,0]=4 4612 B17R2.12561 COc1ccccc1N(C)CC2CC(=O)C2 269982a_100000219746_100009874392 [0,1,0,0,1,0|2,0,0]=4 4613 B17R2.16276 COc1c(cccc1NCC2CC(=O)C2)Cl 2230a_100000743799_100009874392 [0,1,0,0,1,0|2,0,0]=4 4614 B17R2.16276 COc1c(cccc1OCC2CC(=O)C2)Cl 7a_200009886253_100009874392 [0,1,0,0,1,0|1,0,0]=3 4615 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)Br 62a_100009874392_100010146560 [0,1,0,0,1,0|1,1,0]=4 4616 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)Br 62a_100010146560_100009874392 [0,1,0,0,1,0|1,1,0]=4 4617 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)C 62a_100009874392_100010141385 [0,1,0,0,1,0|1,1,0]=4 4618 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)C 62a_100010141385_100009874392 [0,1,0,0,1,0|1,1,0]=4 4619 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)Cl 62a_100009874392_100010147678 [0,1,0,0,1,0|1,1,0]=4 4620 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)Cl 62a_100010147678_100009874392 [0,1,0,0,1,0|1,1,0]=4 4621 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)F 62a_100009816759_100009874392 [0,1,0,0,1,0|1,1,0]=4 4622 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)F 62a_100009874392_100009816759 [0,1,0,0,1,0|1,1,0]=4 4623 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)N 62a_100011935253_100009874392 [0,1,0,0,1,0|1,1,0]=4 4624 B17R2.16276 COc1c(cccc1SCC2CC(=O)C2)O 62a_100009874392_100010234590 [0,1,0,0,1,0|1,1,0]=4 4625 B17R2.16276 CSc1c(cccc1OCC2CC(=O)C2)C 7a_200000099257_100009874392 [0,1,0,0,1,0|1,1,0]=4 4626 B17R2.25851 CC(C)c1ccccc1OCC2CC(=O)C2 7a_100000211617_100009874392 [0,1,0,0,1,0|2,0,0]=4 4627 B17R2.25851 CC(O)c1ccccc1OCC2CC(=O)C2 7a_200011232679_100009874392 [0,1,0,0,1,0|2,0,0]=4 4628 B17R2.29495 C/C=C/c1ccccc1OCC2CC(=O)C2 7a_200000189419_100009874392 [0,1,0,0,1,0|2,0,0]=4 4629 B17R2.29495 CCCc1ccccc1OCC2CC(=O)C2 7a_100011217252_100009874392 [0,1,0,0,1,0|2,0,0]=4 4630 B17R2.29495 CCNc1ccccc1OCC2CC(=O)C2 7a_103624766699_100009874392 [0,1,0,0,1,0|2,0,0]=4 4631 B17R2.29495 CCOc1ccccc1OCC2CC(=O)C2 7a_100000211404_100009874392 [0,1,0,0,1,0|1,0,0]=3 4632 B17R2.29495 CCOc1ccccc1SCC2CC(=O)C2 62a_100000230754_100009874392 [0,1,0,0,1,0|1,1,0]=4 4633 B17R2.29495 CCOc1ccccc1SCC2CC(=O)C2 62a_100009874392_100000230754 [0,1,0,0,1,0|1,1,0]=4 4634 B17R2.29495 COCc1ccccc1OCC2CC(=O)C2 7a_100011488565_100009874392 [0,1,0,0,1,0|1,0,0]=3 4635 B17R2.29495 COCc1ccccc1SCC2CC(=O)C2 62a_100009874392_100011493684 [0,1,0,0,1,0|1,1,0]=4 4636 B17R2.29495 COCc1ccccc1SCC2CC(=O)C2 62a_100011493684_100009874392 [0,1,0,0,1,0|1,1,0]=4 4637 B17R2.29495 O=C1CC(C1)COc2ccccc2CCBr 7a_100000722297_100009874392 [0,1,0,0,1,0|2,0,0]=4 4638 B17R2.29495 O=C1CC(C1)COc2ccccc2CCO 7a_100000719421_100009874392 [0,1,0,0,1,0|2,0,0]=4 4639 B17R2.410650 COc1ccc(cc1NCC2CC(=O)C2)C 2230a_100000210980_100009874392 [0,1,0,0,1,0|2,0,0]=4 4640 B17R2.410650 COc1ccc(cc1OCC2CC(=O)C2)Br 7a_100009816560_100009874392 [0,1,0,0,1,0|1,0,0]=3 4641 B17R2.410650 COc1ccc(cc1OCC2CC(=O)C2)C 7a_100011216497_100009874392 [0,1,0,0,1,0|1,0,0]=3 4642 B17R2.410650 COc1ccc(cc1OCC2CC(=O)C2)Cl 7a_100000101779_100009874392 [0,1,0,0,1,0|1,0,0]=3 4643 B17R2.410650 COc1ccc(cc1OCC2CC(=O)C2)F 7a_100000034962_100009874392 [0,1,0,0,1,0|1,0,0]=3 4644 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)Br 62a_100009874392_100012351588 [0,1,0,0,1,0|1,1,0]=4 4645 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)Br 62a_100012351588_100009874392 [0,1,0,0,1,0|1,1,0]=4 4646 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)C 62a_100000186399_100009874392 [0,1,0,0,1,0|1,1,0]=4 4647 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)C 62a_100009874392_100000186399 [0,1,0,0,1,0|1,1,0]=4 4648 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)Cl 62a_100009874392_100011215930 [0,1,0,0,1,0|1,1,0]=4 4649 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)Cl 62a_100011215930_100009874392 [0,1,0,0,1,0|1,1,0]=4 4650 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)F 62a_100000171694_100009874392 [0,1,0,0,1,0|1,1,0]=4 4651 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)F 62a_100009874392_100000171694 [0,1,0,0,1,0|1,1,0]=4 4652 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)N 62a_100009874392_100011356947 [0,1,0,0,1,0|1,1,0]=4 4653 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)N 62a_100011356947_100009874392 [0,1,0,0,1,0|1,1,0]=4 4654 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)O 62a_100009874392_100010234764 [0,1,0,0,1,0|1,1,0]=4 4655 B17R2.410650 COc1ccc(cc1SCC2CC(=O)C2)O 62a_100010234764_100009874392 [0,1,0,0,1,0|1,1,0]=4 4656 B17R2.417202 CCc1cc(ccc1OCC2CC(=O)C2)Br 7a_100012338938_100009874392 [0,1,0,0,1,0|2,0,0]=4 4657 B17R2.417202 CCc1cc(ccc1OCC2CC(=O)C2)C 7a_100009844793_100009874392 [0,1,0,0,1,0|2,0,0]=4 4658 B17R2.417202 CCc1cc(ccc1OCC2CC(=O)C2)F 7a_200000035566_100009874392 [0,1,0,0,1,0|2,0,0]=4 4659 B17R2.417202 COc1cc(ccc1NCC2CC(=O)C2)C 2230a_100000746441_100009874392 [0,1,0,0,1,0|2,0,0]=4 4660 B17R2.417202 COc1cc(ccc1OCC2CC(=O)C2)Br 7a_100000694246_100009874392 [0,1,0,0,1,0|1,0,0]=3 4661 B17R2.417202 COc1cc(ccc1OCC2CC(=O)C2)F 7a_100000036057_100009874392 [0,1,0,0,1,0|1,0,0]=3 4662 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)Br 62a_100009874392_100010245111 [0,1,0,0,1,0|1,1,0]=4 4663 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)Br 62a_100010245111_100009874392 [0,1,0,0,1,0|1,1,0]=4 4664 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)C 62a_100009874392_100010200004 [0,1,0,0,1,0|1,1,0]=4 4665 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)C 62a_100010200004_100009874392 [0,1,0,0,1,0|1,1,0]=4 4666 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)Cl 62a_100000050115_100009874392 [0,1,0,0,1,0|1,1,0]=4 4667 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)Cl 62a_100009874392_100000050115 [0,1,0,0,1,0|1,1,0]=4 4668 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)F 62a_100000757151_100009874392 [0,1,0,0,1,0|1,1,0]=4 4669 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)F 62a_100009874392_100000757151 [0,1,0,0,1,0|1,1,0]=4 4670 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)N 62a_100000765947_100009874392 [0,1,0,0,1,0|1,1,0]=4 4671 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)N 62a_100009874392_100000765947 [0,1,0,0,1,0|1,1,0]=4 4672 B17R2.417202 COc1cc(ccc1SCC2CC(=O)C2)O 62a_100009874392_100011827694 [0,1,0,0,1,0|1,1,0]=4 4673 B17R2.424413 CCc1cccc(c1OCC2CC(=O)C2)Br 7a_200010001580_100009874392 [0,1,0,0,1,0|2,0,0]=4 4674 B17R2.424413 CCc1cccc(c1OCC2CC(=O)C2)C 7a_100000034007_100009874392 [0,1,0,0,1,0|2,0,0]=4 4675 B17R2.424413 COc1cccc(c1NCC2CC(=O)C2)C 2230a_100000758225_100009874392 [0,1,0,0,1,0|2,0,0]=4 4676 B17R2.424413 COc1cccc(c1OCC2CC(=O)C2)C 7a_100011219253_100009874392 [0,1,0,0,1,0|1,0,0]=3 4677 B17R2.424413 COc1cccc(c1OCC2CC(=O)C2)Cl 7a_100009851661_100009874392 [0,1,0,0,1,0|1,0,0]=3 4678 B17R2.424413 COc1cccc(c1OCC2CC(=O)C2)F 7a_100000036725_100009874392 [0,1,0,0,1,0|1,0,0]=3 4679 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)Br 62a_100009874392_100010131421 [0,1,0,0,1,0|1,1,0]=4 4680 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)Br 62a_100010131421_100009874392 [0,1,0,0,1,0|1,1,0]=4 4681 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)C 62a_100009874392_100010191535 [0,1,0,0,1,0|1,1,0]=4 4682 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)C 62a_100010191535_100009874392 [0,1,0,0,1,0|1,1,0]=4 4683 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)F 62a_100000703912_100009874392 [0,1,0,0,1,0|1,1,0]=4 4684 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)F 62a_100009874392_100000703912 [0,1,0,0,1,0|1,1,0]=4 4685 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)N 62a_100000703447_100009874392 [0,1,0,0,1,0|1,1,0]=4 4686 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)N 62a_100009874392_100000703447 [0,1,0,0,1,0|1,1,0]=4 4687 B17R2.424413 COc1cccc(c1SCC2CC(=O)C2)O 62a_100009874392_100010202623 [0,1,0,0,1,0|1,1,0]=4 4688 B19R2.3398 COc1ccccc1CCC(=O)C2CNC(=O)C2 1458a_100000747279_100011713687 [0,1,0,0,0,1|2,0,0]=4 4689 B19R2.3398 COc1ccccc1CCC(=O)C2CNC(=O)N2 1458a_100000033324_100011713687 [0,1,0,0,0,1|2,0,0]=4 4690 B19R2.3398 COc1ccccc1CCC(=O)[C@@H]2CCC(=O)O2 1458a_100009814974_100011713687 [0,1,0,0,0,1|2,0,0]=4 4691 B19R2.3398 COc1ccccc1OCC(=O)N2CNC(=O)C2 11a_200000708111_100000182946 [0,1,0,0,0,1|2,0,0]=4 4692 B19R2.3398 COc1ccccc1OCC(=O)N2CNC(=O)C2 1626a_200000708111_100000182946 [0,1,0,0,0,1|2,0,0]=4 4693 B19R2.3398 COc1ccccc1OCC(=O)N2CNC(=O)C2 240690a_200000708111_100000182946 [0,1,0,0,0,1|2,0,0]=4 4694 B19R2.3398 COc1ccccc1OCC(=O)N2CNC(=O)C2 527a_200000708111_100000182946 [0,1,0,0,0,1|2,0,0]=4 4695 B19R2.3401 COc1ccccc1CC(=O)CC2CNC(=O)O2 1458a_100000211604_100000181169 [0,1,0,0,0,1|1,0,0]=3 4696 B19R2.3401 COc1ccccc1CC(=O)CC2COC(=O)O2 1458a_100000211604_100000073702 [0,1,0,0,0,1|2,0,0]=4 4697 B19R2.3401 COc1ccccc1CN(C)CC2CNC(=O)O2 2230a_100000184376_100000181169 [0,1,0,0,0,1|1,0,0]=3 4698 B19R2.3401 COc1ccccc1CN(C)CC2CNC(=O)O2 269982a_100000184376_100000181169 [0,1,0,0,0,1|1,0,0]=3 4699 B19R2.3401 COc1ccccc1CN(C)CC2COC(=O)O2 269982a_100000184376_100000073702 [0,1,0,0,0,1|2,0,0]=4 4700 B19R2.9463 CCOc1ccccc1CCNC2COC(=O)O2 34a_100000750806_100000032252 [0,1,0,0,0,1|2,0,0]=4 4701 B19R2.9463 CCOc1ccccc1CCOC2COC(=O)O2 34a_100011754905_100000032252 [0,1,0,0,0,1|2,0,0]=4 4702 B19R2.9463 CCOc1ccccc1CNCC2CNC(=O)C2 207a_100016993742_100000169843 [0,1,0,0,0,1|2,0,0]=4 4703 B19R2.9463 CCOc1ccccc1COCC2CNC(=O)O2 34a_100000708577_100000181169 [0,1,0,0,0,1|0,0,0]=2 4704 B19R2.9463 CCOc1ccccc1COCC2CNC(=O)O2 7a_100000708577_100000181169 [0,1,0,0,0,1|0,0,0]=2 4705 B19R2.9463 CCOc1ccccc1COCC2COC(=O)O2 34a_100000708577_100000073702 [0,1,0,0,0,1|1,0,0]=3 4706 B19R2.9463 CCOc1ccccc1COC[C@@H]2CCC(=O)N2 7a_100000708577_100015189358 [0,1,0,0,0,1|2,0,0]=4 4707 B19R2.9463 CCOc1ccccc1COC[C@H]2COC(=O)N2 34a_100000708577_100015307671 [0,1,0,0,0,1|2,0,0]=4 4708 B19R2.9463 CCOc1ccccc1COC[C@H]2COC(=O)N2 7a_100000708577_100015307671 [0,1,0,0,0,1|2,0,0]=4 4709 B19R2.9463 CCOc1ccccc1OCCC2COS(=O)O2 7a_100000211404_100009840081 [0,1,0,0,0,1|2,0,0]=4 4710 B19R2.9463 CCOc1ccccc1OCCN2CNC(=O)C2 2230a_200000708111_100000764113 [0,1,0,0,0,1|2,0,0]=4 4711 B19R2.9463 COCc1ccccc1OCCC2COS(=O)O2 7a_100011488565_100009840081 [0,1,0,0,0,1|2,0,0]=4 4712 B19R2.13839 COc1ccccc1C(=O)COC2CNC(=O)C2 34a_100000690082_100000195505 [0,1,0,0,0,1|2,0,0]=4 4713 B19R2.13839 COc1ccccc1C(=O)CSC2COC(=O)O2 62a_100000195505_100000032252 [0,1,0,0,0,1|2,0,0]=4 4714 B19R2.13839 COc1ccccc1C(=O)NCC2CNC(=O)C2 11a_100016993742_100000185835 [0,1,0,0,0,1|2,0,0]=4 4715 B19R2.13839 COc1ccccc1C(=O)NCC2CNC(=O)C2 1626a_100016993742_100000185835 [0,1,0,0,0,1|2,0,0]=4 4716 B19R2.13839 COc1ccccc1C(=O)NCC2CNC(=O)C2 240690a_100016993742_100000185835 [0,1,0,0,0,1|2,0,0]=4 4717 B19R2.13839 COc1ccccc1C(=O)NCC2CNC(=O)C2 527a_100016993742_100000185835 [0,1,0,0,0,1|2,0,0]=4 4718 B19R2.13839 COc1ccccc1C(C)NCC2CNC(=O)C2 269862a_100016993742_100000173324 [0,1,0,0,0,1|2,0,0]=4 4719 B19R2.13839 COc1ccccc1C(C)NCC2CNC(=O)O2 2230a_100000185323_100000181169 [0,1,0,0,0,1|1,0,0]=3 4720 B19R2.13839 COc1ccccc1C(C)OCC2CNC(=O)O2 7a_100000742714_100000181169 [0,1,0,0,0,1|0,0,0]=2 4721 B19R2.13839 COc1ccccc1C(C)OC[C@@H]2CCC(=O)N2 7a_100000742714_100015189358 [0,1,0,0,0,1|2,0,0]=4 4722 B19R2.13839 COc1ccccc1C(C)OC[C@H]2COC(=O)N2 7a_100000742714_100015307671 [0,1,0,0,0,1|2,0,0]=4 4723 B19R2.13839 COc1ccccc1C(N)COC2COC(=O)O2 34a_100000756845_100000032252 [0,1,0,0,0,1|2,0,0]=4 4724 B19R2.19150 CCc1ccc(cc1COCC2CNC(=O)O2)Br 34a_100010766240_100000181169 [0,1,0,0,0,1|1,0,0]=3 4725 B19R2.19150 CCc1ccc(cc1COCC2CNC(=O)O2)Br 7a_100010766240_100000181169 [0,1,0,0,0,1|1,0,0]=3 4726 B19R2.19150 CCc1ccc(cc1COCC2COC(=O)O2)Br 34a_100010766240_100000073702 [0,1,0,0,0,1|2,0,0]=4 4727 B19R2.19150 COc1ccc(cc1CCNC2COC(=O)O2)Br 34a_100000763266_100000032252 [0,1,0,0,0,1|2,0,0]=4 4728 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)Br 207a_100016993742_100000170026 [0,1,0,0,0,1|2,0,0]=4 4729 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)Br 2230a_100016993742_100000204665 [0,1,0,0,0,1|2,0,0]=4 4730 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)Br 34a_100016993742_100000204665 [0,1,0,0,0,1|2,0,0]=4 4731 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)C 207a_100016993742_100000203738 [0,1,0,0,0,1|2,0,0]=4 4732 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)C 2230a_100016993742_100000199068 [0,1,0,0,0,1|2,0,0]=4 4733 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)C 34a_100016993742_100000199068 [0,1,0,0,0,1|2,0,0]=4 4734 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)Cl 207a_100016993742_100000188328 [0,1,0,0,0,1|2,0,0]=4 4735 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)Cl 2230a_100016993742_100000209806 [0,1,0,0,0,1|2,0,0]=4 4736 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)Cl 34a_100016993742_100000209806 [0,1,0,0,0,1|2,0,0]=4 4737 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)F 207a_100016993742_100000722865 [0,1,0,0,0,1|2,0,0]=4 4738 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)F 2230a_100016993742_100011830354 [0,1,0,0,0,1|2,0,0]=4 4739 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)F 34a_100016993742_100011830354 [0,1,0,0,0,1|2,0,0]=4 4740 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)I 207a_100016993742_100011266407 [0,1,0,0,0,1|2,0,0]=4 4741 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)C2)O 207a_100016993742_100000067581 [0,1,0,0,0,1|2,0,0]=4 4742 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)O2)Br 34a_100000690498_100000181169 [0,1,0,0,0,1|1,0,0]=3 4743 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)O2)Cl 2230a_100000740580_100000181169 [0,1,0,0,0,1|1,0,0]=3 4744 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)O2)Cl 34a_100000740580_100000181169 [0,1,0,0,0,1|1,0,0]=3 4745 B19R2.19150 COc1ccc(cc1CNCC2CNC(=O)O2)F 34a_100011199032_100000181169 [0,1,0,0,0,1|1,0,0]=3 4746 B19R2.19150 COc1ccc(cc1CNCC2COC(=O)O2)Br 34a_100000690498_100000073702 [0,1,0,0,0,1|2,0,0]=4 4747 B19R2.19150 COc1ccc(cc1CNCC2COC(=O)O2)Cl 34a_100000740580_100000073702 [0,1,0,0,0,1|2,0,0]=4 4748 B19R2.19150 COc1ccc(cc1CNCC2COC(=O)O2)F 34a_100011199032_100000073702 [0,1,0,0,0,1|2,0,0]=4 4749 B19R2.19150 COc1ccc(cc1COCC2CCC(=O)N2)Br 34a_100000737831_100000204665 [0,1,0,0,0,1|2,0,0]=4 4750 B19R2.19150 COc1ccc(cc1COCC2CCC(=O)N2)C 34a_100000737831_100000199068 [0,1,0,0,0,1|2,0,0]=4 4751 B19R2.19150 COc1ccc(cc1COCC2CCC(=O)N2)Cl 34a_100000737831_100000209806 [0,1,0,0,0,1|2,0,0]=4 4752 B19R2.19150 COc1ccc(cc1COCC2CCC(=O)N2)F 34a_100000737831_100011830354 [0,1,0,0,0,1|2,0,0]=4 4753 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)C2)Br 34a_100016041077_100000204665 [0,1,0,0,0,1|1,0,0]=3 4754 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)C2)C 34a_100016041077_100000199068 [0,1,0,0,0,1|1,0,0]=3 4755 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)C2)Cl 34a_100016041077_100000209806 [0,1,0,0,0,1|1,0,0]=3 4756 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)C2)F 34a_100016041077_100011830354 [0,1,0,0,0,1|1,0,0]=3 4757 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)Br 34a_100000204679_100000181169 [0,1,0,0,0,1|0,0,0]=2 4758 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)Br 34a_100011315639_100000204665 [0,1,0,0,0,1|0,0,0]=2 4759 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)Br 7a_100000204679_100000181169 [0,1,0,0,0,1|0,0,0]=2 4760 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)C 34a_100011315639_100000199068 [0,1,0,0,0,1|0,0,0]=2 4761 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)C 34a_200000246444_100000181169 [0,1,0,0,0,1|0,0,0]=2 4762 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)C 7a_200000246444_100000181169 [0,1,0,0,0,1|0,0,0]=2 4763 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)Cl 34a_100011315639_100000209806 [0,1,0,0,0,1|0,0,0]=2 4764 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)F 34a_100011266440_100000181169 [0,1,0,0,0,1|0,0,0]=2 4765 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)F 34a_100011315639_100011830354 [0,1,0,0,0,1|0,0,0]=2 4766 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)F 7a_100011266440_100000181169 [0,1,0,0,0,1|0,0,0]=2 4767 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)I 34a_200137411115_100000181169 [0,1,0,0,0,1|0,0,0]=2 4768 B19R2.19150 COc1ccc(cc1COCC2CNC(=O)O2)I 7a_200137411115_100000181169 [0,1,0,0,0,1|0,0,0]=2 4769 B19R2.19150 COc1ccc(cc1COCC2COC(=O)O2)Br 34a_100000204679_100000073702 [0,1,0,0,0,1|1,0,0]=3 4770 B19R2.19150 COc1ccc(cc1COCC2COC(=O)O2)C 34a_200000246444_100000073702 [0,1,0,0,0,1|1,0,0]=3 4771 B19R2.19150 COc1ccc(cc1COCC2COC(=O)O2)F 34a_100011266440_100000073702 [0,1,0,0,0,1|1,0,0]=3 4772 B19R2.19150 COc1ccc(cc1COCC2COC(=O)O2)I 34a_200137411115_100000073702 [0,1,0,0,0,1|1,0,0]=3 4773 B19R2.19150 COc1ccc(cc1COC[C@@H]2CCC(=O)N2)Br 7a_100000204679_100015189358 [0,1,0,0,0,1|2,0,0]=4 4774 B19R2.19150 COc1ccc(cc1COC[C@@H]2CCC(=O)N2)C 7a_200000246444_100015189358 [0,1,0,0,0,1|2,0,0]=4 4775 B19R2.19150 COc1ccc(cc1COC[C@@H]2CCC(=O)N2)F 7a_100011266440_100015189358 [0,1,0,0,0,1|2,0,0]=4 4776 B19R2.19150 COc1ccc(cc1COC[C@@H]2CCC(=O)N2)I 7a_200137411115_100015189358 [0,1,0,0,0,1|2,0,0]=4 4777 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)Br 34a_100000204679_100015307671 [0,1,0,0,0,1|2,0,0]=4 4778 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)Br 7a_100000204679_100015307671 [0,1,0,0,0,1|2,0,0]=4 4779 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)C 34a_200000246444_100015307671 [0,1,0,0,0,1|2,0,0]=4 4780 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)C 7a_200000246444_100015307671 [0,1,0,0,0,1|2,0,0]=4 4781 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)F 34a_100011266440_100015307671 [0,1,0,0,0,1|2,0,0]=4 4782 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)F 7a_100011266440_100015307671 [0,1,0,0,0,1|2,0,0]=4 4783 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)I 34a_200137411115_100015307671 [0,1,0,0,0,1|2,0,0]=4 4784 B19R2.19150 COc1ccc(cc1COC[C@H]2COC(=O)N2)I 7a_200137411115_100015307671 [0,1,0,0,0,1|2,0,0]=4 4785 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)Br 62a_100000181169_100000204665 [0,1,0,0,0,1|0,1,0]=3 4786 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)Br 62a_100000204665_100000181169 [0,1,0,0,0,1|0,1,0]=3 4787 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)C 62a_100000181169_100000199068 [0,1,0,0,0,1|0,1,0]=3 4788 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)C 62a_100000199068_100000181169 [0,1,0,0,0,1|0,1,0]=3 4789 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)Cl 62a_100000181169_100000209806 [0,1,0,0,0,1|0,1,0]=3 4790 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)Cl 62a_100000209806_100000181169 [0,1,0,0,0,1|0,1,0]=3 4791 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)F 62a_100000181169_100011830354 [0,1,0,0,0,1|0,1,0]=3 4792 B19R2.19150 COc1ccc(cc1CSCC2CNC(=O)O2)F 62a_100011830354_100000181169 [0,1,0,0,0,1|0,1,0]=3 4793 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)Br 62a_100000073702_100000204665 [0,1,0,0,0,1|1,1,0]=4 4794 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)Br 62a_100000204665_100000073702 [0,1,0,0,0,1|1,1,0]=4 4795 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)C 62a_100000073702_100000199068 [0,1,0,0,0,1|1,1,0]=4 4796 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)C 62a_100000199068_100000073702 [0,1,0,0,0,1|1,1,0]=4 4797 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)Cl 62a_100000073702_100000209806 [0,1,0,0,0,1|1,1,0]=4 4798 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)Cl 62a_100000209806_100000073702 [0,1,0,0,0,1|1,1,0]=4 4799 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)F 62a_100000073702_100011830354 [0,1,0,0,0,1|1,1,0]=4 4800 B19R2.19150 COc1ccc(cc1CSCC2COC(=O)O2)F 62a_100011830354_100000073702 [0,1,0,0,0,1|1,1,0]=4 4801 B19R2.19150 COc1ccc(cc1OCCC2COS(=O)O2)Br 7a_100009816560_100009840081 [0,1,0,0,0,1|2,0,0]=4 4802 B19R2.19150 COc1ccc(cc1OCCC2COS(=O)O2)C 7a_100011216497_100009840081 [0,1,0,0,0,1|2,0,0]=4 4803 B19R2.19150 COc1ccc(cc1OCCC2COS(=O)O2)Cl 7a_100000101779_100009840081 [0,1,0,0,0,1|2,0,0]=4 4804 B19R2.19150 COc1ccc(cc1OCCC2COS(=O)O2)F 7a_100000034962_100009840081 [0,1,0,0,0,1|2,0,0]=4 4805 B19R2.19150 COc1ncc(cc1COCC2CNC(=O)C2)Br 34a_100016041077_100010065838 [0,1,0,0,0,1|2,0,0]=4 4806 B19R2.19150 COc1ncc(cc1COCC2CNC(=O)O2)Br 34a_100000695684_100000181169 [0,1,0,0,0,1|1,0,0]=3 4807 B19R2.19150 COc1ncc(cc1COCC2CNC(=O)O2)Br 34a_100011315639_100010065838 [0,1,0,0,0,1|1,0,0]=3 4808 B19R2.19150 COc1ncc(cc1COCC2CNC(=O)O2)F 34a_100011997213_100000181169 [0,1,0,0,0,1|1,0,0]=3 4809 B19R2.19150 COc1ncc(cc1COCC2COC(=O)O2)Br 34a_100000695684_100000073702 [0,1,0,0,0,1|2,0,0]=4 4810 B19R2.19150 COc1ncc(cc1COCC2COC(=O)O2)F 34a_100011997213_100000073702 [0,1,0,0,0,1|2,0,0]=4 4811 B19R2.19150 COc1ncc(cc1CSCC2CNC(=O)O2)Br 62a_100000181169_100010065838 [0,1,0,0,0,1|1,1,0]=4 4812 B19R2.19150 COc1ncc(cc1CSCC2CNC(=O)O2)Br 62a_100010065838_100000181169 [0,1,0,0,0,1|1,1,0]=4 4813 B19R2.19150 N#Cc1ccc(cc1COCC2CNC(=O)O2)Br 34a_100011315639_100000718229 [0,1,0,0,0,1|2,0,0]=4 4814 B19R2.19150 N#Cc1ccc(cc1COCC2CNC(=O)O2)F 34a_100011315639_100000759424 [0,1,0,0,0,1|2,0,0]=4 4815 B19R2.19150 N#Cc1ccc(cc1COCC2CNC(=O)O2)F 34a_200011935090_100000181169 [0,1,0,0,0,1|2,0,0]=4 4816 B19R2.19150 N#Cc1ccc(cc1COCC2CNC(=O)O2)F 7a_200011935090_100000181169 [0,1,0,0,0,1|2,0,0]=4 4817 B19R2.19150 O=Cc1ccc(cc1COCC2CNC(=O)O2)F 34a_100011315639_100010132768 [0,1,0,0,0,1|2,0,0]=4 4818 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)Br 207a_100016993742_100000697075 [0,1,0,0,0,1|2,0,0]=4 4819 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)Br 2230a_100016993742_100012359436 [0,1,0,0,0,1|2,0,0]=4 4820 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)Br 34a_100016993742_100012359436 [0,1,0,0,0,1|2,0,0]=4 4821 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)C 207a_100016993742_100000689369 [0,1,0,0,0,1|2,0,0]=4 4822 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)Cl 207a_100016993742_100000235374 [0,1,0,0,0,1|2,0,0]=4 4823 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)F 207a_100016993742_100000042785 [0,1,0,0,0,1|2,0,0]=4 4824 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)F 2230a_100016993742_200010171551 [0,1,0,0,0,1|2,0,0]=4 4825 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)F 34a_100016993742_200010171551 [0,1,0,0,0,1|2,0,0]=4 4826 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)C2)I 207a_100016993742_100010290300 [0,1,0,0,0,1|2,0,0]=4 4827 B19R2.22086 COc1cc(ccc1CNCC2CNC(=O)O2)F 34a_100000062129_100000181169 [0,1,0,0,0,1|1,0,0]=3 4828 B19R2.22086 COc1cc(ccc1CNCC2COC(=O)O2)F 34a_100000062129_100000073702 [0,1,0,0,0,1|2,0,0]=4 4829 B19R2.22086 COc1cc(ccc1COCC2CCC(=O)N2)Br 34a_100000737831_100012359436 [0,1,0,0,0,1|2,0,0]=4 4830 B19R2.22086 COc1cc(ccc1COCC2CCC(=O)N2)F 34a_100000737831_200010171551 [0,1,0,0,0,1|2,0,0]=4 4831 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)C2)Br 34a_100016041077_100012359436 [0,1,0,0,0,1|1,0,0]=3 4832 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)C2)F 34a_100016041077_200010171551 [0,1,0,0,0,1|1,0,0]=3 4833 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)Br 34a_100011277633_100000181169 [0,1,0,0,0,1|0,0,0]=2 4834 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)Br 34a_100011315639_100012359436 [0,1,0,0,0,1|0,0,0]=2 4835 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)Br 7a_100011277633_100000181169 [0,1,0,0,0,1|0,0,0]=2 4836 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)C 34a_200012017176_100000181169 [0,1,0,0,0,1|0,0,0]=2 4837 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)C 7a_200012017176_100000181169 [0,1,0,0,0,1|0,0,0]=2 4838 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)Cl 34a_200011215853_100000181169 [0,1,0,0,0,1|0,0,0]=2 4839 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)Cl 7a_200011215853_100000181169 [0,1,0,0,0,1|0,0,0]=2 4840 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)F 34a_100000117171_100000181169 [0,1,0,0,0,1|0,0,0]=2 4841 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)F 34a_100011315639_200010171551 [0,1,0,0,0,1|0,0,0]=2 4842 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)F 7a_100000117171_100000181169 [0,1,0,0,0,1|0,0,0]=2 4843 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)I 34a_100010233823_100000181169 [0,1,0,0,0,1|0,0,0]=2 4844 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)I 7a_100010233823_100000181169 [0,1,0,0,0,1|0,0,0]=2 4845 B19R2.22086 COc1cc(ccc1COCC2CNC(=O)O2)N 34a_100012183141_100000181169 [0,1,0,0,0,1|0,0,0]=2 4846 B19R2.22086 COc1cc(ccc1COCC2COC(=O)O2)Br 34a_100011277633_100000073702 [0,1,0,0,0,1|1,0,0]=3 4847 B19R2.22086 COc1cc(ccc1COCC2COC(=O)O2)C 34a_200012017176_100000073702 [0,1,0,0,0,1|1,0,0]=3 4848 B19R2.22086 COc1cc(ccc1COCC2COC(=O)O2)Cl 34a_200011215853_100000073702 [0,1,0,0,0,1|1,0,0]=3 4849 B19R2.22086 COc1cc(ccc1COCC2COC(=O)O2)F 34a_100000117171_100000073702 [0,1,0,0,0,1|1,0,0]=3 4850 B19R2.22086 COc1cc(ccc1COCC2COC(=O)O2)I 34a_100010233823_100000073702 [0,1,0,0,0,1|1,0,0]=3 4851 B19R2.22086 COc1cc(ccc1COCC2COC(=O)O2)N 34a_100012183141_100000073702 [0,1,0,0,0,1|1,0,0]=3 4852 B19R2.22086 COc1cc(ccc1COC[C@@H]2CCC(=O)N2)Br 7a_100011277633_100015189358 [0,1,0,0,0,1|2,0,0]=4 4853 B19R2.22086 COc1cc(ccc1COC[C@@H]2CCC(=O)N2)C 7a_200012017176_100015189358 [0,1,0,0,0,1|2,0,0]=4 4854 B19R2.22086 COc1cc(ccc1COC[C@@H]2CCC(=O)N2)Cl 7a_200011215853_100015189358 [0,1,0,0,0,1|2,0,0]=4 4855 B19R2.22086 COc1cc(ccc1COC[C@@H]2CCC(=O)N2)F 7a_100000117171_100015189358 [0,1,0,0,0,1|2,0,0]=4 4856 B19R2.22086 COc1cc(ccc1COC[C@@H]2CCC(=O)N2)I 7a_100010233823_100015189358 [0,1,0,0,0,1|2,0,0]=4 4857 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)Br 34a_100011277633_100015307671 [0,1,0,0,0,1|2,0,0]=4 4858 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)Br 7a_100011277633_100015307671 [0,1,0,0,0,1|2,0,0]=4 4859 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)C 34a_200012017176_100015307671 [0,1,0,0,0,1|2,0,0]=4 4860 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)C 7a_200012017176_100015307671 [0,1,0,0,0,1|2,0,0]=4 4861 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)Cl 34a_200011215853_100015307671 [0,1,0,0,0,1|2,0,0]=4 4862 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)Cl 7a_200011215853_100015307671 [0,1,0,0,0,1|2,0,0]=4 4863 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)F 34a_100000117171_100015307671 [0,1,0,0,0,1|2,0,0]=4 4864 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)F 7a_100000117171_100015307671 [0,1,0,0,0,1|2,0,0]=4 4865 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)I 34a_100010233823_100015307671 [0,1,0,0,0,1|2,0,0]=4 4866 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)I 7a_100010233823_100015307671 [0,1,0,0,0,1|2,0,0]=4 4867 B19R2.22086 COc1cc(ccc1COC[C@H]2COC(=O)N2)N 34a_100012183141_100015307671 [0,1,0,0,0,1|2,0,0]=4 4868 B19R2.22086 COc1cc(ccc1CSCC2CNC(=O)O2)Br 62a_100000181169_100012359436 [0,1,0,0,0,1|0,1,0]=3 4869 B19R2.22086 COc1cc(ccc1CSCC2CNC(=O)O2)Br 62a_100012359436_100000181169 [0,1,0,0,0,1|0,1,0]=3 4870 B19R2.22086 COc1cc(ccc1CSCC2CNC(=O)O2)F 62a_100000181169_200010171551 [0,1,0,0,0,1|0,1,0]=3 4871 B19R2.22086 COc1cc(ccc1CSCC2CNC(=O)O2)F 62a_200010171551_100000181169 [0,1,0,0,0,1|0,1,0]=3 4872 B19R2.22086 COc1cc(ccc1CSCC2COC(=O)O2)Br 62a_100000073702_100012359436 [0,1,0,0,0,1|1,1,0]=4 4873 B19R2.22086 COc1cc(ccc1CSCC2COC(=O)O2)Br 62a_100012359436_100000073702 [0,1,0,0,0,1|1,1,0]=4 4874 B19R2.22086 COc1cc(ccc1CSCC2COC(=O)O2)F 62a_100000073702_200010171551 [0,1,0,0,0,1|1,1,0]=4 4875 B19R2.22086 COc1cc(ccc1CSCC2COC(=O)O2)F 62a_200010171551_100000073702 [0,1,0,0,0,1|1,1,0]=4 4876 B19R2.22086 COc1cc(ccc1OCCC2COS(=O)O2)Br 7a_100000694246_100009840081 [0,1,0,0,0,1|2,0,0]=4 4877 B19R2.22086 COc1cc(ccc1OCCC2COS(=O)O2)F 7a_100000036057_100009840081 [0,1,0,0,0,1|2,0,0]=4 4878 B19R2.22086 COc1cc(ccc1OCCN2CNC(=O)C2)C 2230a_200000708111_100011259456 [0,1,0,0,0,1|2,0,0]=4 4879 B19R2.22086 COc1cc(cnc1COCC2CNC(=O)O2)Br 34a_200010246159_100000181169 [0,1,0,0,0,1|1,0,0]=3 4880 B19R2.22086 COc1cc(cnc1COCC2CNC(=O)O2)Br 7a_200010246159_100000181169 [0,1,0,0,0,1|1,0,0]=3 4881 B19R2.22086 COc1cc(cnc1COCC2COC(=O)O2)Br 34a_200010246159_100000073702 [0,1,0,0,0,1|2,0,0]=4 4882 B19R2.22086 COc1cc(ncc1COCC2CNC(=O)O2)Cl 34a_100010714672_100000181169 [0,1,0,0,0,1|1,0,0]=3 4883 B19R2.22086 COc1cc(ncc1COCC2COC(=O)O2)Cl 34a_100010714672_100000073702 [0,1,0,0,0,1|2,0,0]=4 4884 B19R2.22086 COc1nc(ccc1CNCC2CNC(=O)O2)Cl 2230a_100015687481_100000181169 [0,1,0,0,0,1|2,0,0]=4 4885 B19R2.22086 COc1nc(ccc1CNCC2CNC(=O)O2)Cl 34a_100015687481_100000181169 [0,1,0,0,0,1|2,0,0]=4 4886 B19R2.22086 COc1nc(ccc1COCC2CNC(=O)C2)Br 34a_100016041077_100016029037 [0,1,0,0,0,1|2,0,0]=4 4887 B19R2.22086 COc1nc(ccc1COCC2CNC(=O)O2)Br 34a_100010988397_100000181169 [0,1,0,0,0,1|1,0,0]=3 4888 B19R2.22086 COc1nc(ccc1COCC2CNC(=O)O2)Br 34a_100011315639_100016029037 [0,1,0,0,0,1|1,0,0]=3 4889 B19R2.22086 COc1nc(ccc1COCC2CNC(=O)O2)Cl 34a_200009869906_100000181169 [0,1,0,0,0,1|1,0,0]=3 4890 B19R2.22086 COc1nc(ccc1COCC2COC(=O)O2)Br 34a_100010988397_100000073702 [0,1,0,0,0,1|2,0,0]=4 4891 B19R2.22086 COc1nc(ccc1COCC2COC(=O)O2)Cl 34a_200009869906_100000073702 [0,1,0,0,0,1|2,0,0]=4 4892 B19R2.22086 COc1nc(ccc1CSCC2CNC(=O)O2)Br 62a_100000181169_100016029037 [0,1,0,0,0,1|1,1,0]=4 4893 B19R2.22086 COc1nc(ccc1CSCC2CNC(=O)O2)Br 62a_100016029037_100000181169 [0,1,0,0,0,1|1,1,0]=4 4894 B19R2.22086 COc1nc(ncc1COCC2CNC(=O)O2)Cl 34a_200011024631_100000181169 [0,1,0,0,0,1|2,0,0]=4 4895 B19R2.22086 N#Cc1cc(ccc1COCC2CNC(=O)O2)Br 34a_100011315639_100000687761 [0,1,0,0,0,1|2,0,0]=4 4896 B19R2.22086 N#Cc1cc(ccc1COCC2CNC(=O)O2)Cl 34a_100011315639_100000702095 [0,1,0,0,0,1|2,0,0]=4 4897 B19R2.22086 N#Cc1cc(ccc1COCC2CNC(=O)O2)F 34a_100011315639_100000751460 [0,1,0,0,0,1|2,0,0]=4 4898 B19R2.22086 O=Cc1cc(ccc1COCC2CNC(=O)O2)F 34a_100011315639_100010132769 [0,1,0,0,0,1|2,0,0]=4 4899 B19R2.29002 COc1ccccc1CCNC2CC(=O)N(C2)C 2230a_100000748898_100011713687 [0,1,0,0,0,1|2,0,0]=4 4900 B19R2.29002 COc1ccccc1CCNC2CC(=O)N(C2)C 270004a_100000748898_100011713418 [0,1,0,0,0,1|2,0,0]=4 4901 B19R2.29002 COc1ccccc1CCNC2CC(=O)N(C2)C 34a_100000748898_100011713687 [0,1,0,0,0,1|2,0,0]=4 4902 B19R2.29002 COc1ccccc1COCC2CC(=O)N(C2)C 34a_100015185614_100000210004 [0,1,0,0,0,1|1,0,0]=3 4903 B19R2.29002 COc1ncccc1COCC2CC(=O)N(C2)C 34a_100015185614_100020631285 [0,1,0,0,0,1|2,0,0]=4 4904 B19R2.29002 CSc1ccccc1COCC2CC(=O)N(C2)C 34a_100015185614_100000699184 [0,1,0,0,0,1|1,1,0]=4 4905 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)Br 207a_100016993742_100000692592 [0,1,0,0,0,1|2,0,0]=4 4906 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)Br 2230a_100016993742_100011470457 [0,1,0,0,0,1|2,0,0]=4 4907 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)Br 34a_100016993742_100011470457 [0,1,0,0,0,1|2,0,0]=4 4908 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)C 207a_100016993742_100011361485 [0,1,0,0,0,1|2,0,0]=4 4909 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)C 2230a_100016993742_100012349798 [0,1,0,0,0,1|2,0,0]=4 4910 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)C 34a_100016993742_100012349798 [0,1,0,0,0,1|2,0,0]=4 4911 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)Cl 207a_100016993742_100011466644 [0,1,0,0,0,1|2,0,0]=4 4912 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)C2)F 207a_100016993742_100011830294 [0,1,0,0,0,1|2,0,0]=4 4913 B19R2.38595 COc1c(cccc1CNCC2CNC(=O)O2)F 34a_100137345168_100000181169 [0,1,0,0,0,1|1,0,0]=3 4914 B19R2.38595 COc1c(cccc1CNCC2COC(=O)O2)F 34a_100137345168_100000073702 [0,1,0,0,0,1|2,0,0]=4 4915 B19R2.38595 COc1c(cccc1COCC2CCC(=O)N2)Br 34a_100000737831_100011470457 [0,1,0,0,0,1|2,0,0]=4 4916 B19R2.38595 COc1c(cccc1COCC2CCC(=O)N2)C 34a_100000737831_100012349798 [0,1,0,0,0,1|2,0,0]=4 4917 B19R2.38595 COc1c(cccc1COCC2CNC(=O)C2)Br 34a_100016041077_100011470457 [0,1,0,0,0,1|1,0,0]=3 4918 B19R2.38595 COc1c(cccc1COCC2CNC(=O)C2)C 34a_100016041077_100012349798 [0,1,0,0,0,1|1,0,0]=3 4919 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)Br 34a_100000704359_100000181169 [0,1,0,0,0,1|0,0,0]=2 4920 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)Br 34a_100011315639_100011470457 [0,1,0,0,0,1|0,0,0]=2 4921 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)Br 7a_100000704359_100000181169 [0,1,0,0,0,1|0,0,0]=2 4922 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)C 34a_100011315639_100012349798 [0,1,0,0,0,1|0,0,0]=2 4923 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)C 34a_100012184769_100000181169 [0,1,0,0,0,1|0,0,0]=2 4924 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)C 7a_100012184769_100000181169 [0,1,0,0,0,1|0,0,0]=2 4925 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)F 34a_100011830279_100000181169 [0,1,0,0,0,1|0,0,0]=2 4926 B19R2.38595 COc1c(cccc1COCC2CNC(=O)O2)F 7a_100011830279_100000181169 [0,1,0,0,0,1|0,0,0]=2 4927 B19R2.38595 COc1c(cccc1COCC2COC(=O)O2)Br 34a_100000704359_100000073702 [0,1,0,0,0,1|1,0,0]=3 4928 B19R2.38595 COc1c(cccc1COCC2COC(=O)O2)C 34a_100012184769_100000073702 [0,1,0,0,0,1|1,0,0]=3 4929 B19R2.38595 COc1c(cccc1COCC2COC(=O)O2)F 34a_100011830279_100000073702 [0,1,0,0,0,1|1,0,0]=3 4930 B19R2.38595 COc1c(cccc1COC[C@@H]2CCC(=O)N2)Br 7a_100000704359_100015189358 [0,1,0,0,0,1|2,0,0]=4 4931 B19R2.38595 COc1c(cccc1COC[C@@H]2CCC(=O)N2)C 7a_100012184769_100015189358 [0,1,0,0,0,1|2,0,0]=4 4932 B19R2.38595 COc1c(cccc1COC[C@@H]2CCC(=O)N2)F 7a_100011830279_100015189358 [0,1,0,0,0,1|2,0,0]=4 4933 B19R2.38595 COc1c(cccc1COC[C@H]2COC(=O)N2)Br 34a_100000704359_100015307671 [0,1,0,0,0,1|2,0,0]=4 4934 B19R2.38595 COc1c(cccc1COC[C@H]2COC(=O)N2)Br 7a_100000704359_100015307671 [0,1,0,0,0,1|2,0,0]=4 4935 B19R2.38595 COc1c(cccc1COC[C@H]2COC(=O)N2)C 34a_100012184769_100015307671 [0,1,0,0,0,1|2,0,0]=4 4936 B19R2.38595 COc1c(cccc1COC[C@H]2COC(=O)N2)C 7a_100012184769_100015307671 [0,1,0,0,0,1|2,0,0]=4 4937 B19R2.38595 COc1c(cccc1COC[C@H]2COC(=O)N2)F 34a_100011830279_100015307671 [0,1,0,0,0,1|2,0,0]=4 4938 B19R2.38595 COc1c(cccc1COC[C@H]2COC(=O)N2)F 7a_100011830279_100015307671 [0,1,0,0,0,1|2,0,0]=4 4939 B19R2.38595 COc1c(cccc1CSCC2CNC(=O)O2)Br 62a_100000181169_100011470457 [0,1,0,0,0,1|0,1,0]=3 4940 B19R2.38595 COc1c(cccc1CSCC2CNC(=O)O2)Br 62a_100011470457_100000181169 [0,1,0,0,0,1|0,1,0]=3 4941 B19R2.38595 COc1c(cccc1CSCC2CNC(=O)O2)C 62a_100000181169_100012349798 [0,1,0,0,0,1|0,1,0]=3 4942 B19R2.38595 COc1c(cccc1CSCC2CNC(=O)O2)C 62a_100012349798_100000181169 [0,1,0,0,0,1|0,1,0]=3 4943 B19R2.38595 COc1c(cccc1CSCC2COC(=O)O2)Br 62a_100000073702_100011470457 [0,1,0,0,0,1|1,1,0]=4 4944 B19R2.38595 COc1c(cccc1CSCC2COC(=O)O2)Br 62a_100011470457_100000073702 [0,1,0,0,0,1|1,1,0]=4 4945 B19R2.38595 COc1c(cccc1CSCC2COC(=O)O2)C 62a_100000073702_100012349798 [0,1,0,0,0,1|1,1,0]=4 4946 B19R2.38595 COc1c(cccc1CSCC2COC(=O)O2)C 62a_100012349798_100000073702 [0,1,0,0,0,1|1,1,0]=4 4947 B19R2.38595 COc1c(cccc1OCCC2COS(=O)O2)Cl 7a_200009886253_100009840081 [0,1,0,0,0,1|2,0,0]=4 4948 B19R2.38595 COc1c(ccnc1COCC2CNC(=O)C2)Cl 34a_100016041077_100015371371 [0,1,0,0,0,1|2,0,0]=4 4949 B19R2.38595 COc1c(ccnc1COCC2CNC(=O)O2)Cl 34a_100009869429_100000181169 [0,1,0,0,0,1|1,0,0]=3 4950 B19R2.38595 COc1c(ccnc1COCC2CNC(=O)O2)Cl 34a_100011315639_100015371371 [0,1,0,0,0,1|1,0,0]=3 4951 B19R2.38595 COc1c(ccnc1COCC2COC(=O)O2)Cl 34a_100009869429_100000073702 [0,1,0,0,0,1|2,0,0]=4 4952 B19R2.38595 COc1c(ccnc1CSCC2CNC(=O)O2)Cl 62a_100000181169_100015371371 [0,1,0,0,0,1|1,1,0]=4 4953 B19R2.38595 COc1c(ccnc1CSCC2CNC(=O)O2)Cl 62a_100015371371_100000181169 [0,1,0,0,0,1|1,1,0]=4 4954 B19R2.38595 N#Cc1c(cccc1COCC2CNC(=O)O2)Br 34a_100011315639_200010145453 [0,1,0,0,0,1|2,0,0]=4 4955 B19R2.38595 N#Cc1c(cccc1COCC2CNC(=O)O2)F 34a_100011315639_100000707650 [0,1,0,0,0,1|2,0,0]=4 4956 B19R2.45066 CC(C)c1cccnc1COCC2CNC(=O)O2 34a_100011315639_200134614246 [0,1,0,0,0,1|2,0,0]=4 4957 B19R2.45066 CC(C)c1cccnc1COCC2CNC(=O)O2 34a_200009878718_100000181169 [0,1,0,0,0,1|2,0,0]=4 4958 B19R2.45066 O=C1NCC(O1)COCc2ccccc2B(O)O 34a_100011315639_100009814197 [0,1,0,0,0,1|2,0,0]=4 4959 B19R2.45066 O=C1NCC(O1)COCc2ccccc2[N+](=O)[O-] 34a_100011315639_100000181388 [0,1,0,0,0,1|2,0,0]=4 4960 B19R2.45066 O=C1NCC(O1)COCc2ccccc2[N+](=O)[O-] 7a_100011218404_100000181169 [0,1,0,0,0,1|2,0,0]=4 4961 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)Br 207a_100016993742_100009814803 [0,1,0,0,0,1|2,0,0]=4 4962 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)C 207a_100016993742_100000050978 [0,1,0,0,0,1|2,0,0]=4 4963 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)Cl 207a_100016993742_100000757644 [0,1,0,0,0,1|2,0,0]=4 4964 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)Cl 2230a_100016993742_100012349678 [0,1,0,0,0,1|2,0,0]=4 4965 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)Cl 34a_100016993742_100012349678 [0,1,0,0,0,1|2,0,0]=4 4966 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)F 207a_100016993742_100011216730 [0,1,0,0,0,1|2,0,0]=4 4967 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)F 2230a_100016993742_100011216731 [0,1,0,0,0,1|2,0,0]=4 4968 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)C2)F 34a_100016993742_100011216731 [0,1,0,0,0,1|2,0,0]=4 4969 B19R2.191186 COc1cccc(c1CNCC2CNC(=O)O2)F 34a_100016992011_100000181169 [0,1,0,0,0,1|1,0,0]=3 4970 B19R2.191186 COc1cccc(c1CNCC2COC(=O)O2)F 34a_100016992011_100000073702 [0,1,0,0,0,1|2,0,0]=4 4971 B19R2.191186 COc1cccc(c1COCC2CCC(=O)N2)Cl 34a_100000737831_100012349678 [0,1,0,0,0,1|2,0,0]=4 4972 B19R2.191186 COc1cccc(c1COCC2CCC(=O)N2)F 34a_100000737831_100011216731 [0,1,0,0,0,1|2,0,0]=4 4973 B19R2.191186 COc1cccc(c1COCC2CNC(=O)C2)Cl 34a_100016041077_100012349678 [0,1,0,0,0,1|1,0,0]=3 4974 B19R2.191186 COc1cccc(c1COCC2CNC(=O)C2)F 34a_100016041077_100011216731 [0,1,0,0,0,1|1,0,0]=3 4975 B19R2.191186 COc1cccc(c1COCC2CNC(=O)O2)Cl 34a_100011315639_100012349678 [0,1,0,0,0,1|0,0,0]=2 4976 B19R2.191186 COc1cccc(c1COCC2CNC(=O)O2)F 34a_100011216733_100000181169 [0,1,0,0,0,1|0,0,0]=2 4977 B19R2.191186 COc1cccc(c1COCC2CNC(=O)O2)F 34a_100011315639_100011216731 [0,1,0,0,0,1|0,0,0]=2 4978 B19R2.191186 COc1cccc(c1COCC2CNC(=O)O2)F 7a_100011216733_100000181169 [0,1,0,0,0,1|0,0,0]=2 4979 B19R2.191186 COc1cccc(c1COCC2COC(=O)O2)F 34a_100011216733_100000073702 [0,1,0,0,0,1|1,0,0]=3 4980 B19R2.191186 COc1cccc(c1COC[C@@H]2CCC(=O)N2)F 7a_100011216733_100015189358 [0,1,0,0,0,1|2,0,0]=4 4981 B19R2.191186 COc1cccc(c1COC[C@H]2COC(=O)N2)F 34a_100011216733_100015307671 [0,1,0,0,0,1|2,0,0]=4 4982 B19R2.191186 COc1cccc(c1COC[C@H]2COC(=O)N2)F 7a_100011216733_100015307671 [0,1,0,0,0,1|2,0,0]=4 4983 B19R2.191186 COc1cccc(c1CSCC2CNC(=O)O2)Cl 62a_100000181169_100012349678 [0,1,0,0,0,1|0,1,0]=3 4984 B19R2.191186 COc1cccc(c1CSCC2CNC(=O)O2)Cl 62a_100012349678_100000181169 [0,1,0,0,0,1|0,1,0]=3 4985 B19R2.191186 COc1cccc(c1CSCC2CNC(=O)O2)F 62a_100000181169_100011216731 [0,1,0,0,0,1|0,1,0]=3 4986 B19R2.191186 COc1cccc(c1CSCC2CNC(=O)O2)F 62a_100011216731_100000181169 [0,1,0,0,0,1|0,1,0]=3 4987 B19R2.191186 COc1cccc(c1CSCC2COC(=O)O2)Cl 62a_100000073702_100012349678 [0,1,0,0,0,1|1,1,0]=4 4988 B19R2.191186 COc1cccc(c1CSCC2COC(=O)O2)Cl 62a_100012349678_100000073702 [0,1,0,0,0,1|1,1,0]=4 4989 B19R2.191186 COc1cccc(c1CSCC2COC(=O)O2)F 62a_100000073702_100011216731 [0,1,0,0,0,1|1,1,0]=4 4990 B19R2.191186 COc1cccc(c1CSCC2COC(=O)O2)F 62a_100011216731_100000073702 [0,1,0,0,0,1|1,1,0]=4 4991 B19R2.191186 COc1cccc(c1OCCC2COS(=O)O2)C 7a_100011219253_100009840081 [0,1,0,0,0,1|2,0,0]=4 4992 B19R2.191186 COc1cccc(c1OCCC2COS(=O)O2)Cl 7a_100009851661_100009840081 [0,1,0,0,0,1|2,0,0]=4 4993 B19R2.191186 COc1cccc(c1OCCC2COS(=O)O2)F 7a_100000036725_100009840081 [0,1,0,0,0,1|2,0,0]=4 4994 B19R2.191186 N#Cc1cccc(c1COCC2CNC(=O)O2)Br 34a_100011315639_100010145454 [0,1,0,0,0,1|2,0,0]=4 4995 B19R2.191186 N#Cc1cccc(c1COCC2CNC(=O)O2)Cl 34a_100011315639_100010254528 [0,1,0,0,0,1|2,0,0]=4 4996 B19R2.191186 N#Cc1cccc(c1COCC2CNC(=O)O2)F 34a_100011315639_100010254529 [0,1,0,0,0,1|2,0,0]=4 4997 B19R2.191186 O=Cc1cccc(c1COCC2CNC(=O)O2)F 34a_100011315639_100010132767 [0,1,0,0,0,1|2,0,0]=4 4998 B19R2.3403 CCN(CC1CNC(=O)O1)c2ccccc2OC 2230a_100020603010_100000181169 [0,2,0,0,0,0|1,0,0]=3 4999 B19R2.3403 CCN(CC1CNC(=O)O1)c2ccccc2OC 269982a_100020603010_100000181169 [0,2,0,0,0,0|1,0,0]=3 5000 B19R2.3403 CCN(CC1COC(=O)O1)c2ccccc2OC 269982a_100020603010_100000073702 [0,2,0,0,0,0|2,0,0]=4 5001 B19R2.9483 CCOc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000211144_100000181169 [0,2,0,0,0,0|1,0,0]=3 5002 B19R2.9483 CCOc1ccccc1C(=O)CC2COC(=O)O2 1458a_100000211144_100000073702 [0,2,0,0,0,0|2,0,0]=4 5003 B19R2.9483 CCSc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000195471_100000181169 [0,2,0,0,0,0|1,1,0]=4 5004 B19R2.9483 COCc1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000737999_100000181169 [0,2,0,0,0,0|1,0,0]=3 5005 B19R2.9483 COCc1ccccc1C(=O)CC2COC(=O)O2 1458a_100000737999_100000073702 [0,2,0,0,0,0|2,0,0]=4 5006 B19R2.19367 CCc1ccc(cc1C(=O)CC2CNC(=O)O2)Br 1458a_100012343961_100000181169 [0,2,0,0,0,0|2,0,0]=4 5007 B19R2.19367 COc1ccc(cc1C(=O)CC2CNC(=O)O2)Br 1458a_100000188853_100000181169 [0,2,0,0,0,0|1,0,0]=3 5008 B19R2.19367 COc1ccc(cc1C(=O)CC2CNC(=O)O2)C 1458a_100000204667_100000181169 [0,2,0,0,0,0|1,0,0]=3 5009 B19R2.19367 COc1ccc(cc1C(=O)CC2CNC(=O)O2)Cl 1458a_100000211409_100000181169 [0,2,0,0,0,0|1,0,0]=3 5010 B19R2.19367 COc1ccc(cc1C(=O)CC2CNC(=O)O2)F 1458a_100000735445_100000181169 [0,2,0,0,0,0|1,0,0]=3 5011 B19R2.19367 COc1ccc(cc1C(=O)CC2CNC(=O)O2)I 1458a_100000230898_100000181169 [0,2,0,0,0,0|1,0,0]=3 5012 B19R2.19367 COc1ccc(cc1C(=O)CC2CNC(=O)O2)O 1458a_200000100057_100000181169 [0,2,0,0,0,0|1,0,0]=3 5013 B19R2.19367 COc1ccc(cc1C(=O)CC2COC(=O)O2)Br 1458a_100000188853_100000073702 [0,2,0,0,0,0|2,0,0]=4 5014 B19R2.19367 COc1ccc(cc1C(=O)CC2COC(=O)O2)C 1458a_100000204667_100000073702 [0,2,0,0,0,0|2,0,0]=4 5015 B19R2.19367 COc1ccc(cc1C(=O)CC2COC(=O)O2)Cl 1458a_100000211409_100000073702 [0,2,0,0,0,0|2,0,0]=4 5016 B19R2.19367 COc1ccc(cc1C(=O)CC2COC(=O)O2)F 1458a_100000735445_100000073702 [0,2,0,0,0,0|2,0,0]=4 5017 B19R2.19367 COc1ccc(cc1C(=O)CC2COC(=O)O2)I 1458a_100000230898_100000073702 [0,2,0,0,0,0|2,0,0]=4 5018 B19R2.19367 COc1ccc(cc1C(=O)CC2COC(=O)O2)O 1458a_200000100057_100000073702 [0,2,0,0,0,0|2,0,0]=4 5019 B19R2.21811 CCc1cc(ccc1C(=O)CC2CNC(=O)O2)Br 1458a_200012349896_100000181169 [0,2,0,0,0,0|2,0,0]=4 5020 B19R2.21811 COc1cc(ccc1C(=O)CC2CNC(=O)O2)Br 1458a_100000748230_100000181169 [0,2,0,0,0,0|1,0,0]=3 5021 B19R2.21811 COc1cc(ccc1C(=O)CC2CNC(=O)O2)C 1458a_100000217210_100000181169 [0,2,0,0,0,0|1,0,0]=3 5022 B19R2.21811 COc1cc(ccc1C(=O)CC2CNC(=O)O2)Cl 1458a_100000217211_100000181169 [0,2,0,0,0,0|1,0,0]=3 5023 B19R2.21811 COc1cc(ccc1C(=O)CC2CNC(=O)O2)F 1458a_100000239970_100000181169 [0,2,0,0,0,0|1,0,0]=3 5024 B19R2.21811 COc1cc(ccc1C(=O)CC2CNC(=O)O2)I 1458a_100012353712_100000181169 [0,2,0,0,0,0|1,0,0]=3 5025 B19R2.21811 COc1cc(ccc1C(=O)CC2COC(=O)O2)Br 1458a_100000748230_100000073702 [0,2,0,0,0,0|2,0,0]=4 5026 B19R2.21811 COc1cc(ccc1C(=O)CC2COC(=O)O2)C 1458a_100000217210_100000073702 [0,2,0,0,0,0|2,0,0]=4 5027 B19R2.21811 COc1cc(ccc1C(=O)CC2COC(=O)O2)Cl 1458a_100000217211_100000073702 [0,2,0,0,0,0|2,0,0]=4 5028 B19R2.21811 COc1cc(ccc1C(=O)CC2COC(=O)O2)F 1458a_100000239970_100000073702 [0,2,0,0,0,0|2,0,0]=4 5029 B19R2.21811 COc1cc(ccc1C(=O)CC2COC(=O)O2)I 1458a_100012353712_100000073702 [0,2,0,0,0,0|2,0,0]=4 5030 B19R2.21811 COc1cc(ccc1N(C)CC2CNC(=O)O2)Cl 2230a_100000061351_100000181169 [0,2,0,0,0,0|1,0,0]=3 5031 B19R2.21811 COc1cc(ccc1N(C)CC2CNC(=O)O2)Cl 269982a_100000061351_100000181169 [0,2,0,0,0,0|1,0,0]=3 5032 B19R2.21811 COc1cc(ccc1N(C)CC2CNC(=O)O2)Cl 34a_100000061351_100000181169 [0,2,0,0,0,0|1,0,0]=3 5033 B19R2.21811 COc1cc(ccc1N(C)CC2CNC(=O)O2)F 2230a_100020633920_100000181169 [0,2,0,0,0,0|1,0,0]=3 5034 B19R2.21811 COc1cc(ccc1N(C)CC2CNC(=O)O2)F 269982a_100020633920_100000181169 [0,2,0,0,0,0|1,0,0]=3 5035 B19R2.21811 COc1cc(ccc1N(C)CC2CNC(=O)O2)F 34a_100020633920_100000181169 [0,2,0,0,0,0|1,0,0]=3 5036 B19R2.21811 COc1cc(ccc1N(C)CC2COC(=O)O2)Cl 269982a_100000061351_100000073702 [0,2,0,0,0,0|2,0,0]=4 5037 B19R2.21811 COc1cc(ccc1N(C)CC2COC(=O)O2)Cl 34a_100000061351_100000073702 [0,2,0,0,0,0|2,0,0]=4 5038 B19R2.21811 COc1cc(ccc1N(C)CC2COC(=O)O2)F 269982a_100020633920_100000073702 [0,2,0,0,0,0|2,0,0]=4 5039 B19R2.21811 COc1cc(ccc1N(C)CC2COC(=O)O2)F 34a_100020633920_100000073702 [0,2,0,0,0,0|2,0,0]=4 5040 B19R2.34740 CCc1c(cccc1C(=O)CC2CNC(=O)O2)Br 1458a_100010125490_100000181169 [0,2,0,0,0,0|2,0,0]=4 5041 B19R2.34740 COc1c(cccc1C(=O)CC2CNC(=O)O2)Br 1458a_100000689802_100000181169 [0,2,0,0,0,0|1,0,0]=3 5042 B19R2.34740 COc1c(cccc1C(=O)CC2CNC(=O)O2)C 1458a_100000187929_100000181169 [0,2,0,0,0,0|1,0,0]=3 5043 B19R2.34740 COc1c(cccc1C(=O)CC2CNC(=O)O2)Cl 1458a_100011934004_100000181169 [0,2,0,0,0,0|1,0,0]=3 5044 B19R2.34740 COc1c(cccc1C(=O)CC2CNC(=O)O2)F 1458a_100011218433_100000181169 [0,2,0,0,0,0|1,0,0]=3 5045 B19R2.34740 COc1c(cccc1C(=O)CC2CNC(=O)O2)O 1458a_100000080799_100000181169 [0,2,0,0,0,0|1,0,0]=3 5046 B19R2.34740 COc1c(cccc1C(=O)CC2COC(=O)O2)Br 1458a_100000689802_100000073702 [0,2,0,0,0,0|2,0,0]=4 5047 B19R2.34740 COc1c(cccc1C(=O)CC2COC(=O)O2)C 1458a_100000187929_100000073702 [0,2,0,0,0,0|2,0,0]=4 5048 B19R2.34740 COc1c(cccc1C(=O)CC2COC(=O)O2)Cl 1458a_100011934004_100000073702 [0,2,0,0,0,0|2,0,0]=4 5049 B19R2.34740 COc1c(cccc1C(=O)CC2COC(=O)O2)F 1458a_100011218433_100000073702 [0,2,0,0,0,0|2,0,0]=4 5050 B19R2.34740 COc1c(cccc1C(=O)CC2COC(=O)O2)O 1458a_100000080799_100000073702 [0,2,0,0,0,0|2,0,0]=4 5051 B19R2.44986 CC(C)c1ccccc1C(=O)CC2CNC(=O)O2 1458a_100011941426_100000181169 [0,2,0,0,0,0|2,0,0]=4 5052 B19R2.44986 CC(C)c1ccccc1N(C)CC2CNC(=O)O2 2230a_106256037369_100000181169 [0,2,0,0,0,0|2,0,0]=4 5053 B19R2.44986 CC(C)c1ccccc1N(C)CC2CNC(=O)O2 269982a_106256037369_100000181169 [0,2,0,0,0,0|2,0,0]=4 5054 B19R2.44986 CC(C)c1ccccc1N(C)CC2CNC(=O)O2 34a_106256037369_100000181169 [0,2,0,0,0,0|2,0,0]=4 5055 B19R2.44986 CN(C)c1ccccc1C(=O)CC2CNC(=O)O2 1458a_100011218752_100000181169 [0,2,0,0,0,0|2,0,0]=4 5056 B19R2.44986 CS(=O)c1ccccc1C(=O)CC2CNC(=O)O2 1458a_100000204632_100000181169 [0,2,0,0,0,0|1,1,0]=4 5057 B19R2.191465 COc1cccc(c1C(=O)CC2CNC(=O)O2)Br 1458a_100011593405_100000181169 [0,2,0,0,0,0|1,0,0]=3 5058 B19R2.191465 COc1cccc(c1C(=O)CC2CNC(=O)O2)C 1458a_100000066212_100000181169 [0,2,0,0,0,0|1,0,0]=3 5059 B19R2.191465 COc1cccc(c1C(=O)CC2CNC(=O)O2)Cl 1458a_100000743539_100000181169 [0,2,0,0,0,0|1,0,0]=3 5060 B19R2.191465 COc1cccc(c1C(=O)CC2CNC(=O)O2)F 1458a_100000759380_100000181169 [0,2,0,0,0,0|1,0,0]=3 5061 B19R2.191465 COc1cccc(c1C(=O)CC2CNC(=O)O2)I 1458a_100010179659_100000181169 [0,2,0,0,0,0|1,0,0]=3 5062 B19R2.191465 COc1cccc(c1C(=O)CC2CNC(=O)O2)O 1458a_100000043310_100000181169 [0,2,0,0,0,0|1,0,0]=3 5063 B19R2.191465 COc1cccc(c1C(=O)CC2COC(=O)O2)Br 1458a_100011593405_100000073702 [0,2,0,0,0,0|2,0,0]=4 5064 B19R2.191465 COc1cccc(c1C(=O)CC2COC(=O)O2)C 1458a_100000066212_100000073702 [0,2,0,0,0,0|2,0,0]=4 5065 B19R2.191465 COc1cccc(c1C(=O)CC2COC(=O)O2)Cl 1458a_100000743539_100000073702 [0,2,0,0,0,0|2,0,0]=4 5066 B19R2.191465 COc1cccc(c1C(=O)CC2COC(=O)O2)F 1458a_100000759380_100000073702 [0,2,0,0,0,0|2,0,0]=4 5067 B19R2.191465 COc1cccc(c1C(=O)CC2COC(=O)O2)I 1458a_100010179659_100000073702 [0,2,0,0,0,0|2,0,0]=4 5068 B19R2.191465 COc1cccc(c1C(=O)CC2COC(=O)O2)O 1458a_100000043310_100000073702 [0,2,0,0,0,0|2,0,0]=4 5069 B19R2.11299 C#CCOc1ccccc1NCC2CNC(=O)O2 34a_100000707309_100000181169 [0,2,0,0,0,0|1,0,0]=3 5070 B19R2.11299 C#CCOc1ccccc1NCC2COC(=O)O2 34a_100000707309_100000073702 [0,2,0,0,0,0|2,0,0]=4 5071 B19R2.11299 C=CCOc1ccccc1OCC2CNC(=O)O2 34a_200011262142_100000181169 [0,2,0,0,0,0|0,0,0]=2 5072 B19R2.11299 C=CCOc1ccccc1OCC2CNC(=O)O2 7a_200011262142_100000181169 [0,2,0,0,0,0|0,0,0]=2 5073 B19R2.11299 C=CCOc1ccccc1OCC2COC(=O)O2 34a_200011262142_100000073702 [0,2,0,0,0,0|1,0,0]=3 5074 B19R2.11299 C=CCOc1ccccc1OC[C@@H]2CCC(=O)N2 7a_200011262142_100015189358 [0,2,0,0,0,0|2,0,0]=4 5075 B19R2.11299 C=CCOc1ccccc1OC[C@H]2COC(=O)N2 34a_200011262142_100015307671 [0,2,0,0,0,0|2,0,0]=4 5076 B19R2.11299 C=CCOc1ccccc1OC[C@H]2COC(=O)N2 7a_200011262142_100015307671 [0,2,0,0,0,0|2,0,0]=4 5077 B19R2.11299 C=CCSc1ccccc1NCC2CNC(=O)O2 2230a_100000198565_100000181169 [0,2,0,0,0,0|1,1,0]=4 5078 B19R2.11299 C=CCSc1ccccc1NCC2CNC(=O)O2 7a_100000198565_100000181169 [0,2,0,0,0,0|1,1,0]=4 5079 B19R2.11299 CCCCc1ccccc1NCC2CNC(=O)O2 2230a_200011217597_100000181169 [0,2,0,0,0,0|2,0,0]=4 5080 B19R2.11299 CCCCc1ccccc1NCC2CNC(=O)O2 34a_200011217597_100000181169 [0,2,0,0,0,0|2,0,0]=4 5081 B19R2.11299 CCCCc1ccccc1NCC2CNC(=O)O2 7a_200011217597_100000181169 [0,2,0,0,0,0|2,0,0]=4 5082 B19R2.11299 CCCOc1ccccc1NCC2CNC(=O)C2 27a_100016993742_100000174042 [0,2,0,0,0,0|2,0,0]=4 5083 B19R2.11299 CCCOc1ccccc1NCC2CNC(=O)O2 34a_100000683936_100000181169 [0,2,0,0,0,0|1,0,0]=3 5084 B19R2.11299 CCCOc1ccccc1NCC2COC(=O)O2 34a_100000683936_100000073702 [0,2,0,0,0,0|2,0,0]=4 5085 B19R2.11299 CCCOc1ccccc1OCC2CNC(=O)O2 34a_100000180214_100000181169 [0,2,0,0,0,0|0,0,0]=2 5086 B19R2.11299 CCCOc1ccccc1OCC2CNC(=O)O2 7a_100000180214_100000181169 [0,2,0,0,0,0|0,0,0]=2 5087 B19R2.11299 CCCOc1ccccc1OCC2COC(=O)O2 34a_100000180214_100000073702 [0,2,0,0,0,0|1,0,0]=3 5088 B19R2.11299 CCCOc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000180214_100015189358 [0,2,0,0,0,0|2,0,0]=4 5089 B19R2.11299 CCCOc1ccccc1OC[C@H]2COC(=O)N2 34a_100000180214_100015307671 [0,2,0,0,0,0|2,0,0]=4 5090 B19R2.11299 CCCOc1ccccc1OC[C@H]2COC(=O)N2 7a_100000180214_100015307671 [0,2,0,0,0,0|2,0,0]=4 5091 B19R2.11299 CCCOc1ccccc1SCC2CNC(=O)O2 62a_100000174042_100000181169 [0,2,0,0,0,0|0,1,0]=3 5092 B19R2.11299 CCCOc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000174042 [0,2,0,0,0,0|0,1,0]=3 5093 B19R2.11299 CCCOc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000174042 [0,2,0,0,0,0|1,1,0]=4 5094 B19R2.11299 CCCOc1ccccc1SCC2COC(=O)O2 62a_100000174042_100000073702 [0,2,0,0,0,0|1,1,0]=4 5095 B19R2.11299 CCCOc1ncccc1SCC2CNC(=O)O2 62a_100000181169_200011465209 [0,2,0,0,0,0|1,1,0]=4 5096 B19R2.11299 CCCOc1ncccc1SCC2CNC(=O)O2 62a_200011465209_100000181169 [0,2,0,0,0,0|1,1,0]=4 5097 B19R2.11299 CCCSc1ccccc1NCC2CNC(=O)O2 34a_100015184514_100000181169 [0,2,0,0,0,0|1,1,0]=4 5098 B19R2.11299 CCCSc1ccccc1NCC2CNC(=O)O2 7a_100015184514_100000181169 [0,2,0,0,0,0|1,1,0]=4 5099 B19R2.11299 CCOCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_200011493690 [0,2,0,0,0,0|0,1,0]=3 5100 B19R2.11299 CCOCc1ccccc1SCC2CNC(=O)O2 62a_200011493690_100000181169 [0,2,0,0,0,0|0,1,0]=3 5101 B19R2.11299 CCOCc1ccccc1SCC2COC(=O)O2 62a_100000073702_200011493690 [0,2,0,0,0,0|1,1,0]=4 5102 B19R2.11299 CCOCc1ccccc1SCC2COC(=O)O2 62a_200011493690_100000073702 [0,2,0,0,0,0|1,1,0]=4 5103 B19R2.11299 CCSCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_200000173030 [0,2,0,0,0,0|0,2,0]=4 5104 B19R2.11299 CCSCc1ccccc1SCC2CNC(=O)O2 62a_200000173030_100000181169 [0,2,0,0,0,0|0,2,0]=4 5105 B19R2.11299 COCCc1ccccc1OCC2CNC(=O)O2 34a_100000722730_100000181169 [0,2,0,0,0,0|0,0,0]=2 5106 B19R2.11299 COCCc1ccccc1OCC2CNC(=O)O2 7a_100000722730_100000181169 [0,2,0,0,0,0|0,0,0]=2 5107 B19R2.11299 COCCc1ccccc1OCC2COC(=O)O2 34a_100000722730_100000073702 [0,2,0,0,0,0|1,0,0]=3 5108 B19R2.11299 COCCc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000722730_100015189358 [0,2,0,0,0,0|2,0,0]=4 5109 B19R2.11299 COCCc1ccccc1OC[C@H]2COC(=O)N2 34a_100000722730_100015307671 [0,2,0,0,0,0|2,0,0]=4 5110 B19R2.11299 COCCc1ccccc1OC[C@H]2COC(=O)N2 7a_100000722730_100015307671 [0,2,0,0,0,0|2,0,0]=4 5111 B19R2.11299 COCOc1ccccc1SCC2CNC(=O)O2 62a_100000181169_200000230759 [0,2,0,0,0,0|0,1,0]=3 5112 B19R2.11299 COCOc1ccccc1SCC2CNC(=O)O2 62a_200000230759_100000181169 [0,2,0,0,0,0|0,1,0]=3 5113 B19R2.11299 COCOc1ccccc1SCC2COC(=O)O2 62a_100000073702_200000230759 [0,2,0,0,0,0|1,1,0]=4 5114 B19R2.11299 COCOc1ccccc1SCC2COC(=O)O2 62a_200000230759_100000073702 [0,2,0,0,0,0|1,1,0]=4 5115 B19R2.11299 COCOc1cccnc1SCC2CNC(=O)O2 62a_100000181169_100011935308 [0,2,0,0,0,0|1,1,0]=4 5116 B19R2.11299 COCOc1cccnc1SCC2CNC(=O)O2 62a_100011935308_100000181169 [0,2,0,0,0,0|1,1,0]=4 5117 B19R2.11299 N#CCOc1ccccc1SCC2CNC(=O)O2 62a_100000181169_200000173881 [0,2,0,0,0,0|0,1,0]=3 5118 B19R2.11299 N#CCOc1ccccc1SCC2CNC(=O)O2 62a_200000173881_100000181169 [0,2,0,0,0,0|0,1,0]=3 5119 B19R2.11299 N#CCOc1ccccc1SCC2COC(=O)O2 62a_100000073702_200000173881 [0,2,0,0,0,0|1,1,0]=4 5120 B19R2.11299 N#CCOc1ccccc1SCC2COC(=O)O2 62a_200000173881_100000073702 [0,2,0,0,0,0|1,1,0]=4 5121 B19R2.11299 NCCOc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000744007 [0,2,0,0,0,0|0,1,0]=3 5122 B19R2.11299 NCCOc1ccccc1SCC2CNC(=O)O2 62a_100000744007_100000181169 [0,2,0,0,0,0|0,1,0]=3 5123 B19R2.11299 NCCOc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000744007 [0,2,0,0,0,0|1,1,0]=4 5124 B19R2.11299 NCCOc1ccccc1SCC2COC(=O)O2 62a_100000744007_100000073702 [0,2,0,0,0,0|1,1,0]=4 5125 B19R2.11299 O=C1CC[C@H](N1)COc2ccccc2OCCO 7a_100000181789_100015189358 [0,2,0,0,0,0|2,0,0]=4 5126 B19R2.11299 O=C1NCC(O1)CNc2ccccc2OCCF 34a_100012000959_100000181169 [0,2,0,0,0,0|1,0,0]=3 5127 B19R2.11299 O=C1NCC(O1)CNc2ccccc2OCCO 34a_100132302172_100000181169 [0,2,0,0,0,0|1,0,0]=3 5128 B19R2.11299 O=C1NCC(O1)COc2ccccc2OCCO 34a_100000181789_100000181169 [0,2,0,0,0,0|0,0,0]=2 5129 B19R2.11299 O=C1NCC(O1)COc2ccccc2OCCO 7a_100000181789_100000181169 [0,2,0,0,0,0|0,0,0]=2 5130 B19R2.11299 O=C1NCC(O1)CSc2ccccc2C#CCO 62a_100000181169_100009814404 [0,2,0,0,0,0|1,1,0]=4 5131 B19R2.11299 O=C1NCC(O1)CSc2ccccc2C#CCO 62a_100009814404_100000181169 [0,2,0,0,0,0|1,1,0]=4 5132 B19R2.11299 O=C1NCC(O1)CSc2ccccc2CCCO 62a_100000181169_100000699526 [0,2,0,0,0,0|1,1,0]=4 5133 B19R2.11299 O=C1NCC(O1)CSc2ccccc2CCCO 62a_100000699526_100000181169 [0,2,0,0,0,0|1,1,0]=4 5134 B19R2.11299 O=C1NCC(O1)CSc2ccccc2OCCO 62a_100000181169_100000230753 [0,2,0,0,0,0|0,1,0]=3 5135 B19R2.11299 O=C1NCC(O1)CSc2ccccc2OCCO 62a_100000230753_100000181169 [0,2,0,0,0,0|0,1,0]=3 5136 B19R2.11299 O=C1NCC(O1)CSc2ccccc2SCCO 62a_100000181169_200000230852 [0,2,0,0,0,0|0,2,0]=4 5137 B19R2.11299 O=C1NCC(O1)CSc2ccccc2SCCO 62a_200000230852_100000181169 [0,2,0,0,0,0|0,2,0]=4 5138 B19R2.11299 O=C1NCC(O1)CSc2ncccc2OCCF 62a_100000181169_100012814765 [0,2,0,0,0,0|1,1,0]=4 5139 B19R2.11299 O=C1NCC(O1)CSc2ncccc2OCCF 62a_100012814765_100000181169 [0,2,0,0,0,0|1,1,0]=4 5140 B19R2.11299 O=C1N[C@H](CO1)COc2ccccc2OCCO 34a_100000181789_100015307671 [0,2,0,0,0,0|2,0,0]=4 5141 B19R2.11299 O=C1N[C@H](CO1)COc2ccccc2OCCO 7a_100000181789_100015307671 [0,2,0,0,0,0|2,0,0]=4 5142 B19R2.11299 O=C1OCC(O1)CNc2ccccc2OCCF 34a_100012000959_100000073702 [0,2,0,0,0,0|2,0,0]=4 5143 B19R2.11299 O=C1OCC(O1)CNc2ccccc2OCCO 34a_100132302172_100000073702 [0,2,0,0,0,0|2,0,0]=4 5144 B19R2.11299 O=C1OCC(O1)COc2ccccc2OCCO 34a_100000181789_100000073702 [0,2,0,0,0,0|1,0,0]=3 5145 B19R2.11299 O=C1OCC(O1)CSc2ccccc2OCCO 62a_100000073702_100000230753 [0,2,0,0,0,0|1,1,0]=4 5146 B19R2.11299 O=C1OCC(O1)CSc2ccccc2OCCO 62a_100000230753_100000073702 [0,2,0,0,0,0|1,1,0]=4 5147 B19R2.11299 O=CCCc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011713448 [0,2,0,0,0,0|1,1,0]=4 5148 B19R2.11299 O=CCCc1ccccc1SCC2CNC(=O)O2 62a_100011713448_100000181169 [0,2,0,0,0,0|1,1,0]=4 5149 B19R2.12763 CC(=NO)c1ccccc1OCC2CNC(=O)O2 34a_100000164216_100000181169 [0,2,0,0,0,0|1,0,0]=3 5150 B19R2.12763 CC(=NO)c1ccccc1OCC2COC(=O)O2 34a_100000164216_100000073702 [0,2,0,0,0,0|2,0,0]=4 5151 B19R2.12763 CC(C#N)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_200010232107 [0,2,0,0,0,0|1,1,0]=4 5152 B19R2.12763 CC(C#N)c1ccccc1SCC2CNC(=O)O2 62a_200010232107_100000181169 [0,2,0,0,0,0|1,1,0]=4 5153 B19R2.12763 CCC(=O)c1ccccc1OCC2CNC(=O)O2 7a_100000184720_100000181169 [0,2,0,0,0,0|1,0,0]=3 5154 B19R2.12763 CCC(C)c1ccccc1NCC2CNC(=O)O2 2230a_200000211393_100000181169 [0,2,0,0,0,0|2,0,0]=4 5155 B19R2.12763 CCC(C)c1ccccc1NCC2CNC(=O)O2 7a_200000211393_100000181169 [0,2,0,0,0,0|2,0,0]=4 5156 B19R2.12763 CCC(C)c1ccccc1OCC2CNC(=O)O2 7a_100000211618_100000181169 [0,2,0,0,0,0|1,0,0]=3 5157 B19R2.12763 CNC(=O)c1ccccc1NCC2CNC(=O)O2 34a_100000185696_100000181169 [0,2,0,0,0,0|2,0,0]=4 5158 B19R2.12763 CNC(=O)c1ccccc1OCC2CNC(=O)O2 34a_100000185920_100000181169 [0,2,0,0,0,0|1,0,0]=3 5159 B19R2.12763 CNC(=O)c1ccccc1OCC2CNC(=O)O2 7a_100000185920_100000181169 [0,2,0,0,0,0|1,0,0]=3 5160 B19R2.12763 CNC(=O)c1ccccc1OCC2COC(=O)O2 34a_100000185920_100000073702 [0,2,0,0,0,0|2,0,0]=4 5161 B19R2.12763 CNC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000155073_100000181169 [0,2,0,0,0,0|1,1,0]=4 5162 B19R2.12763 CNC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000155073 [0,2,0,0,0,0|1,1,0]=4 5163 B19R2.12763 CNC(=O)c1ncccc1OCC2CNC(=O)O2 34a_100011376092_100000181169 [0,2,0,0,0,0|2,0,0]=4 5164 B19R2.12763 CNC(=O)c1ncccc1OCC2CNC(=O)O2 7a_100011376092_100000181169 [0,2,0,0,0,0|2,0,0]=4 5165 B19R2.12763 CNC(C)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000692418 [0,2,0,0,0,0|1,1,0]=4 5166 B19R2.12763 CNC(C)c1ccccc1SCC2CNC(=O)O2 62a_100000692418_100000181169 [0,2,0,0,0,0|1,1,0]=4 5167 B19R2.12763 COC(=O)c1ccccc1OCC2CNC(=O)O2 7a_100000150335_100000181169 [0,2,0,0,0,0|0,0,0]=2 5168 B19R2.12763 COC(=O)c1ccccc1OC[C@@H]2CCC(=O)N2 7a_100000150335_100015189358 [0,2,0,0,0,0|2,0,0]=4 5169 B19R2.12763 COC(=O)c1ccccc1OC[C@H]2COC(=O)N2 7a_100000150335_100015307671 [0,2,0,0,0,0|2,0,0]=4 5170 B19R2.12763 COC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000148710_100000181169 [0,2,0,0,0,0|0,1,0]=3 5171 B19R2.12763 COC(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000148710 [0,2,0,0,0,0|0,1,0]=3 5172 B19R2.12763 COC(=O)c1ccccc1SCC2COC(=O)O2 62a_100000073702_100000148710 [0,2,0,0,0,0|1,1,0]=4 5173 B19R2.12763 COC(=O)c1ccccc1SCC2COC(=O)O2 62a_100000148710_100000073702 [0,2,0,0,0,0|1,1,0]=4 5174 B19R2.12763 COC(=O)c1cccnc1SCC2CNC(=O)O2 62a_100000181169_100000150852 [0,2,0,0,0,0|1,1,0]=4 5175 B19R2.12763 COC(=O)c1cccnc1SCC2CNC(=O)O2 62a_100011587185_100000181169 [0,2,0,0,0,0|1,1,0]=4 5176 B19R2.12763 COC(=O)c1ccncc1SCC2CNC(=O)O2 62a_100000181169_100010008606 [0,2,0,0,0,0|1,1,0]=4 5177 B19R2.12763 COC(=O)c1ccncc1SCC2CNC(=O)O2 62a_100010008606_100000181169 [0,2,0,0,0,0|1,1,0]=4 5178 B19R2.12763 COC(=O)c1cnccc1SCC2CNC(=O)O2 62a_100000181169_100020629055 [0,2,0,0,0,0|1,1,0]=4 5179 B19R2.12763 COC(=O)c1cnccc1SCC2CNC(=O)O2 62a_100020629055_100000181169 [0,2,0,0,0,0|1,1,0]=4 5180 B19R2.12763 COC(=O)c1ncccc1OCC2CNC(=O)O2 34a_100000744052_100000181169 [0,2,0,0,0,0|1,0,0]=3 5181 B19R2.12763 COC(=O)c1ncccc1OCC2CNC(=O)O2 7a_100000744052_100000181169 [0,2,0,0,0,0|1,0,0]=3 5182 B19R2.12763 COC(=O)c1ncccc1OCC2COC(=O)O2 34a_100000744052_100000073702 [0,2,0,0,0,0|2,0,0]=4 5183 B19R2.12763 COC(=O)c1ncccc1SCC2CNC(=O)O2 62a_100000181169_100011935214 [0,2,0,0,0,0|1,1,0]=4 5184 B19R2.12763 COC(=O)c1ncccc1SCC2CNC(=O)O2 62a_100011935214_100000181169 [0,2,0,0,0,0|1,1,0]=4 5185 B19R2.12763 CO[C@@H](C)c1ncccc1SCC2CNC(=O)O2 62a_100000181169_106256553109 [0,2,0,0,0,0|1,1,0]=4 5186 B19R2.12763 CO[C@@H](C)c1ncccc1SCC2CNC(=O)O2 62a_106256553109_100000181169 [0,2,0,0,0,0|1,1,0]=4 5187 B19R2.12763 NCC(O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011236429 [0,2,0,0,0,0|1,1,0]=4 5188 B19R2.12763 NCC(O)c1ccccc1SCC2CNC(=O)O2 62a_100011236429_100000181169 [0,2,0,0,0,0|1,1,0]=4 5189 B19R2.12763 NNC(=O)c1ccccc1OCC2CNC(=O)O2 34a_100000186518_100000181169 [0,2,0,0,0,0|2,0,0]=4 5190 B19R2.12763 N[C@H](CO)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100161155918 [0,2,0,0,0,0|1,1,0]=4 5191 B19R2.12763 N[C@H](CO)c1ccccc1SCC2CNC(=O)O2 62a_100161155918_100000181169 [0,2,0,0,0,0|1,1,0]=4 5192 B19R2.12763 O=C1NCC(O1)COc2ccccc2C(=O)CBr 7a_100000188908_100000181169 [0,2,0,0,0,0|1,0,0]=3 5193 B19R2.12763 O=C1NCC(O1)COc2ccccc2C(=O)NO 34a_100000188472_100000181169 [0,2,0,0,0,0|2,0,0]=4 5194 B19R2.12763 O=C1NCC(O1)CSc2ccccc2C(=O)O[Na] 62a_100000181169_114855342371 [0,2,0,0,0,0|1,1,0]=4 5195 B19R2.44945 CC(=O)Cc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011350739 [0,2,0,0,0,0|1,1,0]=4 5196 B19R2.44945 CC(=O)Cc1ccccc1SCC2CNC(=O)O2 62a_100011350739_100000181169 [0,2,0,0,0,0|1,1,0]=4 5197 B19R2.44945 CC(=O)Nc1ccccc1NCC2CNC(=O)O2 34a_100011193560_100000181169 [0,2,0,0,0,0|2,0,0]=4 5198 B19R2.44945 CC(=O)Nc1ccccc1OCC2CNC(=O)O2 34a_100000185124_100000181169 [0,2,0,0,0,0|1,0,0]=3 5199 B19R2.44945 CC(=O)Nc1ccccc1OCC2CNC(=O)O2 7a_100000185124_100000181169 [0,2,0,0,0,0|1,0,0]=3 5200 B19R2.44945 CC(=O)Nc1ccccc1OCC2COC(=O)O2 34a_100000185124_100000073702 [0,2,0,0,0,0|2,0,0]=4 5201 B19R2.44945 CC(=O)Nc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000153524 [0,2,0,0,0,0|1,1,0]=4 5202 B19R2.44945 CC(=O)Nc1ncccc1OCC2CNC(=O)O2 34a_200000022013_100000181169 [0,2,0,0,0,0|2,0,0]=4 5203 B19R2.44945 CC(=O)Nc1ncccc1OCC2CNC(=O)O2 7a_200000022013_100000181169 [0,2,0,0,0,0|2,0,0]=4 5204 B19R2.44945 CC(=O)Oc1ccccc1SCC2CNC(=O)O2 62a_100000051690_100000181169 [0,2,0,0,0,0|0,1,0]=3 5205 B19R2.44945 CC(=O)Oc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000051690 [0,2,0,0,0,0|0,1,0]=3 5206 B19R2.44945 CC(=O)Oc1ccccc1SCC2COC(=O)O2 62a_100000051690_100000073702 [0,2,0,0,0,0|1,1,0]=4 5207 B19R2.44945 CC(=O)Oc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000051690 [0,2,0,0,0,0|1,1,0]=4 5208 B19R2.44945 CC(=O)Oc1cccnc1SCC2CNC(=O)O2 62a_100000181169_200009815371 [0,2,0,0,0,0|1,1,0]=4 5209 B19R2.44945 CC(=O)Oc1cccnc1SCC2CNC(=O)O2 62a_200009815371_100000181169 [0,2,0,0,0,0|1,1,0]=4 5210 B19R2.44945 CC(C)Nc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000219599 [0,2,0,0,0,0|1,1,0]=4 5211 B19R2.44945 CC(C)Nc1ccccc1SCC2CNC(=O)O2 62a_100000219599_100000181169 [0,2,0,0,0,0|1,1,0]=4 5212 B19R2.44945 CC(C)Oc1ccccc1NCC2CNC(=O)O2 2230a_100000739276_100000181169 [0,2,0,0,0,0|1,0,0]=3 5213 B19R2.44945 CC(C)Oc1ccccc1NCC2CNC(=O)O2 34a_100000739276_100000181169 [0,2,0,0,0,0|1,0,0]=3 5214 B19R2.44945 CC(C)Oc1ccccc1NCC2COC(=O)O2 34a_100000739276_100000073702 [0,2,0,0,0,0|2,0,0]=4 5215 B19R2.44945 CC(C)Oc1ccccc1OCC2CNC(=O)O2 34a_100011218612_100000181169 [0,2,0,0,0,0|0,0,0]=2 5216 B19R2.44945 CC(C)Oc1ccccc1OCC2CNC(=O)O2 7a_100011218612_100000181169 [0,2,0,0,0,0|0,0,0]=2 5217 B19R2.44945 CC(C)Oc1ccccc1OCC2COC(=O)O2 34a_100011218612_100000073702 [0,2,0,0,0,0|1,0,0]=3 5218 B19R2.44945 CC(C)Oc1ccccc1OC[C@@H]2CCC(=O)N2 7a_100011218612_100015189358 [0,2,0,0,0,0|2,0,0]=4 5219 B19R2.44945 CC(C)Oc1ccccc1OC[C@H]2COC(=O)N2 34a_100011218612_100015307671 [0,2,0,0,0,0|2,0,0]=4 5220 B19R2.44945 CC(C)Oc1ccccc1OC[C@H]2COC(=O)N2 7a_100011218612_100015307671 [0,2,0,0,0,0|2,0,0]=4 5221 B19R2.44945 CC(C)Oc1ccccc1SCC2CNC(=O)O2 62a_100000173919_100000181169 [0,2,0,0,0,0|0,1,0]=3 5222 B19R2.44945 CC(C)Oc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000173919 [0,2,0,0,0,0|0,1,0]=3 5223 B19R2.44945 CC(C)Oc1ccccc1SCC2COC(=O)O2 62a_100000073702_100000173919 [0,2,0,0,0,0|1,1,0]=4 5224 B19R2.44945 CC(C)Oc1ccccc1SCC2COC(=O)O2 62a_100000173919_100000073702 [0,2,0,0,0,0|1,1,0]=4 5225 B19R2.44945 CC(C)Oc1ncccc1SCC2CNC(=O)O2 62a_100000181169_200011465186 [0,2,0,0,0,0|1,1,0]=4 5226 B19R2.44945 CC(C)Oc1ncccc1SCC2CNC(=O)O2 62a_200011465186_100000181169 [0,2,0,0,0,0|1,1,0]=4 5227 B19R2.44945 CC(C)Sc1ccccc1NCC2CNC(=O)O2 2230a_100000688217_100000181169 [0,2,0,0,0,0|1,1,0]=4 5228 B19R2.44945 CC(C)Sc1ccccc1NCC2CNC(=O)O2 34a_100000688217_100000181169 [0,2,0,0,0,0|1,1,0]=4 5229 B19R2.44945 CN(C)Cc1ccccc1SCC2CNC(=O)O2 62a_100000174758_100000181169 [0,2,0,0,0,0|1,1,0]=4 5230 B19R2.44945 CN(C)Cc1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000174758 [0,2,0,0,0,0|1,1,0]=4 5231 B19R2.44945 NC(=S)Nc1ccccc1OCC2CNC(=O)O2 7a_200000011649_100000181169 [0,2,0,0,0,0|1,0,1]=4 5232 B19R2.44945 O=C1CC[C@H](N1)COc2ccccc2OC(F)F 7a_100000752575_100015189358 [0,2,0,0,0,0|2,0,0]=4 5233 B19R2.44945 O=C1NCC(O1)CNc2ccccc2OC(F)F 2230a_100000182466_100000181169 [0,2,0,0,0,0|1,0,0]=3 5234 B19R2.44945 O=C1NCC(O1)CNc2ccccc2OC(F)F 34a_100000182466_100000181169 [0,2,0,0,0,0|1,0,0]=3 5235 B19R2.44945 O=C1NCC(O1)COc2ccccc2OC(F)F 34a_100000752575_100000181169 [0,2,0,0,0,0|0,0,0]=2 5236 B19R2.44945 O=C1NCC(O1)COc2ccccc2OC(F)F 7a_100000752575_100000181169 [0,2,0,0,0,0|0,0,0]=2 5237 B19R2.44945 O=C1NCC(O1)CSc2ccccc2OC(F)F 62a_100000181169_100011263859 [0,2,0,0,0,0|0,1,0]=3 5238 B19R2.44945 O=C1NCC(O1)CSc2ccccc2OC(F)F 62a_100011263859_100000181169 [0,2,0,0,0,0|0,1,0]=3 5239 B19R2.44945 O=C1NCC(O1)CSc2ncccc2OC(F)F 62a_100000181169_100000697348 [0,2,0,0,0,0|1,1,0]=4 5240 B19R2.44945 O=C1NCC(O1)CSc2ncccc2OC(F)F 62a_100000697348_100000181169 [0,2,0,0,0,0|1,1,0]=4 5241 B19R2.44945 O=C1N[C@H](CO1)COc2ccccc2OC(F)F 34a_100000752575_100015307671 [0,2,0,0,0,0|2,0,0]=4 5242 B19R2.44945 O=C1N[C@H](CO1)COc2ccccc2OC(F)F 7a_100000752575_100015307671 [0,2,0,0,0,0|2,0,0]=4 5243 B19R2.44945 O=C1OCC(O1)CNc2ccccc2OC(F)F 34a_100000182466_100000073702 [0,2,0,0,0,0|2,0,0]=4 5244 B19R2.44945 O=C1OCC(O1)COc2ccccc2OC(F)F 34a_100000752575_100000073702 [0,2,0,0,0,0|1,0,0]=3 5245 B19R2.44945 O=C1OCC(O1)CSc2ccccc2OC(F)F 62a_100000073702_100011263859 [0,2,0,0,0,0|1,1,0]=4 5246 B19R2.44945 O=C1OCC(O1)CSc2ccccc2OC(F)F 62a_100011263859_100000073702 [0,2,0,0,0,0|1,1,0]=4 5247 B19R2.47169 CCOc1ccc(cc1NCC2CNC(=O)O2)Br 2230a_100000751366_100000181169 [0,2,0,0,0,0|1,0,0]=3 5248 B19R2.47169 CCOc1ccc(cc1NCC2CNC(=O)O2)Br 34a_100000751366_100000181169 [0,2,0,0,0,0|1,0,0]=3 5249 B19R2.47169 CCOc1ccc(cc1NCC2CNC(=O)O2)C 2230a_100011202655_100000181169 [0,2,0,0,0,0|1,0,0]=3 5250 B19R2.47169 CCOc1ccc(cc1NCC2CNC(=O)O2)C 34a_100011202655_100000181169 [0,2,0,0,0,0|1,0,0]=3 5251 B19R2.47169 CCOc1ccc(cc1NCC2CNC(=O)O2)Cl 2230a_100000742605_100000181169 [0,2,0,0,0,0|1,0,0]=3 5252 B19R2.47169 CCOc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_100000742605_100000181169 [0,2,0,0,0,0|1,0,0]=3 5253 B19R2.47169 CCOc1ccc(cc1NCC2COC(=O)O2)Br 34a_100000751366_100000073702 [0,2,0,0,0,0|2,0,0]=4 5254 B19R2.47169 CCOc1ccc(cc1NCC2COC(=O)O2)C 34a_100011202655_100000073702 [0,2,0,0,0,0|2,0,0]=4 5255 B19R2.47169 CCOc1ccc(cc1NCC2COC(=O)O2)Cl 34a_100000742605_100000073702 [0,2,0,0,0,0|2,0,0]=4 5256 B19R2.47169 CCOc1ccc(cc1SCC2CNC(=O)O2)C 62a_100000181169_200000230997 [0,2,0,0,0,0|0,1,0]=3 5257 B19R2.47169 CCOc1ccc(cc1SCC2CNC(=O)O2)C 62a_200000230997_100000181169 [0,2,0,0,0,0|0,1,0]=3 5258 B19R2.47169 CCOc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000171695_100000181169 [0,2,0,0,0,0|0,1,0]=3 5259 B19R2.47169 CCOc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100000171695 [0,2,0,0,0,0|0,1,0]=3 5260 B19R2.47169 CCOc1ccc(cc1SCC2COC(=O)O2)C 62a_100000073702_200000230997 [0,2,0,0,0,0|1,1,0]=4 5261 B19R2.47169 CCOc1ccc(cc1SCC2COC(=O)O2)C 62a_200000230997_100000073702 [0,2,0,0,0,0|1,1,0]=4 5262 B19R2.47169 CCOc1ccc(cc1SCC2COC(=O)O2)F 62a_100000073702_100000171695 [0,2,0,0,0,0|1,1,0]=4 5263 B19R2.47169 CCOc1ccc(cc1SCC2COC(=O)O2)F 62a_100000171695_100000073702 [0,2,0,0,0,0|1,1,0]=4 5264 B19R2.47169 CCOc1ncc(cc1SCC2CNC(=O)O2)Br 62a_100000181169_200010177599 [0,2,0,0,0,0|1,1,0]=4 5265 B19R2.47169 CCOc1ncc(cc1SCC2CNC(=O)O2)Br 62a_200010177599_100000181169 [0,2,0,0,0,0|1,1,0]=4 5266 B19R2.47169 CCSc1ccc(cc1NCC2CNC(=O)O2)Cl 34a_100000752208_100000181169 [0,2,0,0,0,0|1,1,0]=4 5267 B19R2.47169 CNCc1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_200011192132 [0,2,0,0,0,0|1,1,0]=4 5268 B19R2.47169 CNCc1ccc(cc1SCC2CNC(=O)O2)F 62a_200011192132_100000181169 [0,2,0,0,0,0|1,1,0]=4 5269 B19R2.47169 COCc1ccc(cc1NCC2CNC(=O)O2)Br 34a_100013084866_100000181169 [0,2,0,0,0,0|1,0,0]=3 5270 B19R2.47169 COCc1ccc(cc1NCC2CNC(=O)O2)Br 7a_100013084866_100000181169 [0,2,0,0,0,0|1,0,0]=3 5271 B19R2.47169 COCc1ccc(cc1NCC2COC(=O)O2)Br 34a_100013084866_100000073702 [0,2,0,0,0,0|2,0,0]=4 5272 B19R2.85619 C=CCc1cccc(c1OCC2CNC(=O)O2)C 34a_200011218211_100000181169 [0,2,0,0,0,0|1,0,1]=4 5273 B19R2.85619 C=CCc1cccc(c1OCC2CNC(=O)O2)C 7a_200011218211_100000181169 [0,2,0,0,0,0|1,0,1]=4 5274 B19R2.85619 CCOc1cccc(c1NCC2CNC(=O)O2)Br 34a_200103155331_100000181169 [0,2,0,0,0,0|1,0,0]=3 5275 B19R2.85619 CCOc1cccc(c1NCC2CNC(=O)O2)Cl 34a_100012284057_100000181169 [0,2,0,0,0,0|1,0,0]=3 5276 B19R2.85619 CCOc1cccc(c1NCC2COC(=O)O2)Br 34a_200103155331_100000073702 [0,2,0,0,0,0|2,0,0]=4 5277 B19R2.85619 CCOc1cccc(c1NCC2COC(=O)O2)Cl 34a_100012284057_100000073702 [0,2,0,0,0,0|2,0,0]=4 5278 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)Br 2230a_100000688918_100000181169 [0,2,0,0,0,0|1,0,0]=3 5279 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)Br 34a_100000688918_100000181169 [0,2,0,0,0,0|1,0,0]=3 5280 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)C 2230a_100000742043_100000181169 [0,2,0,0,0,0|1,0,0]=3 5281 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)C 34a_100000742043_100000181169 [0,2,0,0,0,0|1,0,0]=3 5282 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)Cl 34a_100000687649_100000181169 [0,2,0,0,0,0|1,0,0]=3 5283 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)F 2230a_100000741351_100000181169 [0,2,0,0,0,0|1,0,0]=3 5284 B19R2.115166 CCOc1cc(ccc1NCC2CNC(=O)O2)F 34a_100000741351_100000181169 [0,2,0,0,0,0|1,0,0]=3 5285 B19R2.115166 CCOc1cc(ccc1NCC2COC(=O)O2)Br 34a_100000688918_100000073702 [0,2,0,0,0,0|2,0,0]=4 5286 B19R2.115166 CCOc1cc(ccc1NCC2COC(=O)O2)C 34a_100000742043_100000073702 [0,2,0,0,0,0|2,0,0]=4 5287 B19R2.115166 CCOc1cc(ccc1NCC2COC(=O)O2)Cl 34a_100000687649_100000073702 [0,2,0,0,0,0|2,0,0]=4 5288 B19R2.115166 CCOc1cc(ccc1NCC2COC(=O)O2)F 34a_100000741351_100000073702 [0,2,0,0,0,0|2,0,0]=4 5289 B19R2.115166 CCOc1cc(ccc1OCC2CNC(=O)O2)C 34a_200000034294_100000181169 [0,2,0,0,0,0|0,0,0]=2 5290 B19R2.115166 CCOc1cc(ccc1OCC2CNC(=O)O2)C 7a_200000034294_100000181169 [0,2,0,0,0,0|0,0,0]=2 5291 B19R2.115166 CCOc1cc(ccc1OCC2COC(=O)O2)C 34a_200000034294_100000073702 [0,2,0,0,0,0|1,0,0]=3 5292 B19R2.115166 CCOc1cc(ccc1OC[C@@H]2CCC(=O)N2)C 7a_200000034294_100015189358 [0,2,0,0,0,0|2,0,0]=4 5293 B19R2.115166 CCOc1cc(ccc1OC[C@H]2COC(=O)N2)C 34a_200000034294_100015307671 [0,2,0,0,0,0|2,0,0]=4 5294 B19R2.115166 CCOc1cc(ccc1OC[C@H]2COC(=O)N2)C 7a_200000034294_100015307671 [0,2,0,0,0,0|2,0,0]=4 5295 B19R2.115166 CCOc1cc(ccc1SCC2CNC(=O)O2)C 62a_100000181169_200010713166 [0,2,0,0,0,0|0,1,0]=3 5296 B19R2.115166 CCOc1cc(ccc1SCC2CNC(=O)O2)C 62a_200010713166_100000181169 [0,2,0,0,0,0|0,1,0]=3 5297 B19R2.115166 CCOc1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_200012340411 [0,2,0,0,0,0|0,1,0]=3 5298 B19R2.115166 CCOc1cc(ccc1SCC2CNC(=O)O2)F 62a_200012340411_100000181169 [0,2,0,0,0,0|0,1,0]=3 5299 B19R2.115166 CCOc1cc(ccc1SCC2CNC(=O)O2)N 62a_100000181169_200016990551 [0,2,0,0,0,0|0,1,0]=3 5300 B19R2.115166 CCOc1cc(ccc1SCC2CNC(=O)O2)N 62a_200016990551_100000181169 [0,2,0,0,0,0|0,1,0]=3 5301 B19R2.115166 CCOc1cc(ccc1SCC2COC(=O)O2)C 62a_100000073702_200010713166 [0,2,0,0,0,0|1,1,0]=4 5302 B19R2.115166 CCOc1cc(ccc1SCC2COC(=O)O2)C 62a_200010713166_100000073702 [0,2,0,0,0,0|1,1,0]=4 5303 B19R2.115166 CCOc1cc(ccc1SCC2COC(=O)O2)F 62a_100000073702_200012340411 [0,2,0,0,0,0|1,1,0]=4 5304 B19R2.115166 CCOc1cc(ccc1SCC2COC(=O)O2)F 62a_200012340411_100000073702 [0,2,0,0,0,0|1,1,0]=4 5305 B19R2.115166 CCOc1cc(ccc1SCC2COC(=O)O2)N 62a_100000073702_200016990551 [0,2,0,0,0,0|1,1,0]=4 5306 B19R2.115166 CCOc1cc(ccc1SCC2COC(=O)O2)N 62a_200016990551_100000073702 [0,2,0,0,0,0|1,1,0]=4 5307 B19R2.115166 CNCc1cc(ccc1OCC2CNC(=O)O2)Br 34a_100011602694_100000181169 [0,2,0,0,0,0|1,0,0]=3 5308 B19R2.115166 CNCc1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000712467_100000181169 [0,2,0,0,0,0|1,0,0]=3 5309 B19R2.115166 CNCc1cc(ccc1OCC2CNC(=O)O2)F 34a_114855342409_100000181169 [0,2,0,0,0,0|1,0,0]=3 5310 B19R2.115166 CNCc1cc(ccc1OCC2COC(=O)O2)Br 34a_100011602694_100000073702 [0,2,0,0,0,0|2,0,0]=4 5311 B19R2.115166 CNCc1cc(ccc1OCC2COC(=O)O2)Cl 34a_100000712467_100000073702 [0,2,0,0,0,0|2,0,0]=4 5312 B19R2.115166 CNCc1cc(ccc1OCC2COC(=O)O2)F 34a_114855342409_100000073702 [0,2,0,0,0,0|2,0,0]=4 5313 B19R2.115166 COCc1cc(ccc1OCC2CNC(=O)O2)F 34a_100135391359_100000181169 [0,2,0,0,0,0|0,0,0]=2 5314 B19R2.115166 COCc1cc(ccc1OCC2CNC(=O)O2)F 7a_100135391359_100000181169 [0,2,0,0,0,0|0,0,0]=2 5315 B19R2.115166 COCc1cc(ccc1OCC2COC(=O)O2)F 34a_100135391359_100000073702 [0,2,0,0,0,0|1,0,0]=3 5316 B19R2.115166 COCc1cc(ccc1OC[C@@H]2CCC(=O)N2)F 7a_100135391359_100015189358 [0,2,0,0,0,0|2,0,0]=4 5317 B19R2.115166 COCc1cc(ccc1OC[C@H]2COC(=O)N2)F 34a_100135391359_100015307671 [0,2,0,0,0,0|2,0,0]=4 5318 B19R2.115166 COCc1cc(ccc1OC[C@H]2COC(=O)N2)F 7a_100135391359_100015307671 [0,2,0,0,0,0|2,0,0]=4 5319 B19R2.761124 CCOc1c(cccc1NCC2CNC(=O)O2)Cl 2230a_100000744310_100000181169 [0,2,0,0,0,0|1,0,0]=3 5320 B19R2.761124 CCOc1c(cccc1NCC2CNC(=O)O2)Cl 34a_100000744310_100000181169 [0,2,0,0,0,0|1,0,0]=3 5321 B19R2.761124 CCOc1c(cccc1NCC2COC(=O)O2)Cl 34a_100000744310_100000073702 [0,2,0,0,0,0|2,0,0]=4 5322 B19R2.761124 CCOc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100010232518 [0,2,0,0,0,0|0,1,0]=3 5323 B19R2.761124 CCOc1c(cccc1SCC2CNC(=O)O2)F 62a_100010232518_100000181169 [0,2,0,0,0,0|0,1,0]=3 5324 B19R2.761124 CCOc1c(cccc1SCC2COC(=O)O2)F 62a_100000073702_100010232518 [0,2,0,0,0,0|1,1,0]=4 5325 B19R2.761124 CCOc1c(cccc1SCC2COC(=O)O2)F 62a_100010232518_100000073702 [0,2,0,0,0,0|1,1,0]=4 5326 B19R2.761124 CNCc1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_106744473292 [0,2,0,0,0,0|1,1,0]=4 5327 B19R2.761124 CNCc1c(cccc1SCC2CNC(=O)O2)F 62a_106744473292_100000181169 [0,2,0,0,0,0|1,1,0]=4 5328 B19R2.30472 CCc1ccc(c(c1)NCC2CNC(=O)O2)OC 2230a_100012035449_100000181169 [0,2,0,0,0,0|1,0,0]=3 5329 B19R2.30472 CCc1ccc(c(c1)NCC2CNC(=O)O2)OC 34a_100012035449_100000181169 [0,2,0,0,0,0|1,0,0]=3 5330 B19R2.30472 CCc1ccc(c(c1)NCC2COC(=O)O2)OC 34a_100012035449_100000073702 [0,2,0,0,0,0|2,0,0]=4 5331 B19R2.30472 CCc1ccc(c(c1)OCC2CNC(=O)O2)OC 34a_100009844796_100000181169 [0,2,0,0,0,0|0,0,0]=2 5332 B19R2.30472 CCc1ccc(c(c1)OCC2CNC(=O)O2)OC 7a_100009844796_100000181169 [0,2,0,0,0,0|0,0,0]=2 5333 B19R2.30472 CCc1ccc(c(c1)OCC2COC(=O)O2)OC 34a_100009844796_100000073702 [0,2,0,0,0,0|1,0,0]=3 5334 B19R2.30472 CCc1ccc(c(c1)OC[C@@H]2CCC(=O)N2)OC 7a_100009844796_100015189358 [0,2,0,0,0,0|2,0,0]=4 5335 B19R2.30472 CCc1ccc(c(c1)OC[C@H]2COC(=O)N2)OC 34a_100009844796_100015307671 [0,2,0,0,0,0|2,0,0]=4 5336 B19R2.30472 CCc1ccc(c(c1)OC[C@H]2COC(=O)N2)OC 7a_100009844796_100015307671 [0,2,0,0,0,0|2,0,0]=4 5337 B19R2.30472 CCc1ccc(c(c1)SCC2CNC(=O)O2)OC 62a_100000181169_100010062400 [0,2,0,0,0,0|0,1,0]=3 5338 B19R2.30472 CCc1ccc(c(c1)SCC2CNC(=O)O2)OC 62a_100010062400_100000181169 [0,2,0,0,0,0|0,1,0]=3 5339 B19R2.30472 CCc1ccc(c(c1)SCC2COC(=O)O2)OC 62a_100000073702_100010062400 [0,2,0,0,0,0|1,1,0]=4 5340 B19R2.30472 CCc1ccc(c(c1)SCC2COC(=O)O2)OC 62a_100010062400_100000073702 [0,2,0,0,0,0|1,1,0]=4 5341 B19R2.30472 CNc1ccc(c(c1)SCC2CNC(=O)O2)OC 62a_100000181169_114948341033 [0,2,0,0,0,0|0,1,0]=3 5342 B19R2.30472 CNc1ccc(c(c1)SCC2CNC(=O)O2)OC 62a_114948341033_100000181169 [0,2,0,0,0,0|0,1,0]=3 5343 B19R2.30472 CNc1ccc(c(c1)SCC2COC(=O)O2)OC 62a_100000073702_114948341033 [0,2,0,0,0,0|1,1,0]=4 5344 B19R2.30472 CNc1ccc(c(c1)SCC2COC(=O)O2)OC 62a_114948341033_100000073702 [0,2,0,0,0,0|1,1,0]=4 5345 B19R2.30472 CNc1ccc(cc1SCC2CNC(=O)O2)C#N 62a_100000181169_200020994358 [0,2,0,0,0,0|1,1,0]=4 5346 B19R2.30472 CNc1ccc(cc1SCC2CNC(=O)O2)C=O 62a_100000181169_200010290468 [0,2,0,0,0,0|1,1,0]=4 5347 B19R2.30472 CNc1ccc(cc1SCC2CNC(=O)O2)C=O 62a_200010290468_100000181169 [0,2,0,0,0,0|1,1,0]=4 5348 B19R2.30472 COc1cc(c(nn1)OC)OCC2CNC(=O)O2 34a_200010760773_100000181169 [0,2,0,0,0,0|2,0,0]=4 5349 B19R2.30472 COc1ccc(c(c1)NCC2CNC(=O)O2)OC 2230a_100000184736_100000181169 [0,2,0,0,0,0|1,0,0]=3 5350 B19R2.30472 COc1ccc(c(c1)NCC2CNC(=O)O2)OC 34a_100000184736_100000181169 [0,2,0,0,0,0|1,0,0]=3 5351 B19R2.30472 COc1ccc(c(c1)NCC2COC(=O)O2)OC 34a_100000184736_100000073702 [0,2,0,0,0,0|2,0,0]=4 5352 B19R2.30472 COc1ccc(c(c1)OCC2CNC(=O)O2)C#N 34a_100011999188_100000181169 [0,2,0,0,0,0|2,0,0]=4 5353 B19R2.30472 COc1ccc(c(c1)OCC2CNC(=O)O2)C#N 7a_100011999188_100000181169 [0,2,0,0,0,0|2,0,0]=4 5354 B19R2.30472 COc1ccc(c(c1)OCC2CNC(=O)O2)N=O 34a_200010658452_100000181169 [0,2,0,0,0,0|2,0,0]=4 5355 B19R2.30472 COc1ccc(c(c1)OCC2CNC(=O)O2)N=O 7a_200010658452_100000181169 [0,2,0,0,0,0|2,0,0]=4 5356 B19R2.30472 COc1ccc(c(c1)OCC2CNC(=O)O2)OC 34a_100000074795_100000181169 [0,2,0,0,0,0|0,0,0]=2 5357 B19R2.30472 COc1ccc(c(c1)OCC2COC(=O)O2)OC 34a_100000074795_100000073702 [0,2,0,0,0,0|1,0,0]=3 5358 B19R2.30472 COc1ccc(c(c1)OC[C@H]2COC(=O)N2)OC 34a_100000074795_100015307671 [0,2,0,0,0,0|2,0,0]=4 5359 B19R2.30472 COc1ccc(c(c1)SCC2CNC(=O)O2)OC 62a_100000181169_100011215452 [0,2,0,0,0,0|0,1,0]=3 5360 B19R2.30472 COc1ccc(c(c1)SCC2CNC(=O)O2)OC 62a_100011215452_100000181169 [0,2,0,0,0,0|0,1,0]=3 5361 B19R2.30472 COc1ccc(c(c1)SCC2COC(=O)O2)OC 62a_100000073702_100011215452 [0,2,0,0,0,0|1,1,0]=4 5362 B19R2.30472 COc1ccc(c(c1)SCC2COC(=O)O2)OC 62a_100011215452_100000073702 [0,2,0,0,0,0|1,1,0]=4 5363 B19R2.30472 COc1ccc(cc1NCC2CNC(=O)O2)C#N 34a_100000747721_100000181169 [0,2,0,0,0,0|1,0,0]=3 5364 B19R2.30472 COc1ccc(cc1NCC2CNC(=O)O2)C#N 7a_100000747721_100000181169 [0,2,0,0,0,0|1,0,0]=3 5365 B19R2.30472 COc1ccc(cc1NCC2CNC(=O)O2)CO 2230a_100011269841_100000181169 [0,2,0,0,0,0|1,0,0]=3 5366 B19R2.30472 COc1ccc(cc1NCC2CNC(=O)O2)CO 34a_100011269841_100000181169 [0,2,0,0,0,0|1,0,0]=3 5367 B19R2.30472 COc1ccc(cc1NCC2COC(=O)O2)C#N 34a_100000747721_100000073702 [0,2,0,0,0,0|2,0,0]=4 5368 B19R2.30472 COc1ccc(cc1NCC2COC(=O)O2)CO 34a_100011269841_100000073702 [0,2,0,0,0,0|2,0,0]=4 5369 B19R2.30472 COc1ccc(cc1OCC2CNC(=O)O2)C#N 34a_100000188611_100000181169 [0,2,0,0,0,0|0,0,0]=2 5370 B19R2.30472 COc1ccc(cc1OCC2CNC(=O)O2)C#N 7a_100000188611_100000181169 [0,2,0,0,0,0|0,0,0]=2 5371 B19R2.30472 COc1ccc(cc1OCC2CNC(=O)O2)CN 34a_100000740000_100000181169 [0,2,0,0,0,0|0,0,0]=2 5372 B19R2.30472 COc1ccc(cc1OCC2CNC(=O)O2)CO 34a_100011215239_100000181169 [0,2,0,0,0,0|0,0,0]=2 5373 B19R2.30472 COc1ccc(cc1OCC2COC(=O)O2)C#N 34a_100000188611_100000073702 [0,2,0,0,0,0|1,0,0]=3 5374 B19R2.30472 COc1ccc(cc1OCC2COC(=O)O2)CN 34a_100000740000_100000073702 [0,2,0,0,0,0|1,0,0]=3 5375 B19R2.30472 COc1ccc(cc1OCC2COC(=O)O2)CO 34a_100011215239_100000073702 [0,2,0,0,0,0|1,0,0]=3 5376 B19R2.30472 COc1ccc(cc1OC[C@@H]2CCC(=O)N2)C#N 7a_100000188611_100015189358 [0,2,0,0,0,0|2,0,0]=4 5377 B19R2.30472 COc1ccc(cc1OC[C@H]2COC(=O)N2)C#N 34a_100000188611_100015307671 [0,2,0,0,0,0|2,0,0]=4 5378 B19R2.30472 COc1ccc(cc1OC[C@H]2COC(=O)N2)C#N 7a_100000188611_100015307671 [0,2,0,0,0,0|2,0,0]=4 5379 B19R2.30472 COc1ccc(cc1OC[C@H]2COC(=O)N2)CN 34a_100000740000_100015307671 [0,2,0,0,0,0|2,0,0]=4 5380 B19R2.30472 COc1ccc(cc1OC[C@H]2COC(=O)N2)CO 34a_100011215239_100015307671 [0,2,0,0,0,0|2,0,0]=4 5381 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)C#N 62a_100000181169_100000188253 [0,2,0,0,0,0|0,1,0]=3 5382 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)C=O 62a_100000173361_100000181169 [0,2,0,0,0,0|0,1,0]=3 5383 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)C=O 62a_100000181169_100000173361 [0,2,0,0,0,0|0,1,0]=3 5384 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)CN 62a_100000181169_100159240714 [0,2,0,0,0,0|0,1,0]=3 5385 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)CN 62a_100159240714_100000181169 [0,2,0,0,0,0|0,1,0]=3 5386 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)CO 62a_100000181169_100000246451 [0,2,0,0,0,0|0,1,0]=3 5387 B19R2.30472 COc1ccc(cc1SCC2CNC(=O)O2)CO 62a_100000246451_100000181169 [0,2,0,0,0,0|0,1,0]=3 5388 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)C#N 62a_100000073702_100000188253 [0,2,0,0,0,0|1,1,0]=4 5389 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)C=O 62a_100000073702_100000173361 [0,2,0,0,0,0|1,1,0]=4 5390 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)C=O 62a_100000173361_100000073702 [0,2,0,0,0,0|1,1,0]=4 5391 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)CN 62a_100000073702_100159240714 [0,2,0,0,0,0|1,1,0]=4 5392 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)CN 62a_100159240714_100000073702 [0,2,0,0,0,0|1,1,0]=4 5393 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)CO 62a_100000073702_100000246451 [0,2,0,0,0,0|1,1,0]=4 5394 B19R2.30472 COc1ccc(cc1SCC2COC(=O)O2)CO 62a_100000246451_100000073702 [0,2,0,0,0,0|1,1,0]=4 5395 B19R2.30472 COc1ccc(nc1SCC2CNC(=O)O2)C=O 62a_100000181169_100010174741 [0,2,0,0,0,0|1,1,0]=4 5396 B19R2.30472 COc1ccc(nc1SCC2CNC(=O)O2)C=O 62a_100010174741_100000181169 [0,2,0,0,0,0|1,1,0]=4 5397 B19R2.30472 COc1ccc(nc1SCC2CNC(=O)O2)CO 62a_100000181169_100009842956 [0,2,0,0,0,0|1,1,0]=4 5398 B19R2.30472 COc1ccc(nc1SCC2CNC(=O)O2)CO 62a_100009842956_100000181169 [0,2,0,0,0,0|1,1,0]=4 5399 B19R2.30472 COc1cnc(cc1SCC2CNC(=O)O2)C=O 62a_100000181169_100010893078 [0,2,0,0,0,0|1,1,0]=4 5400 B19R2.30472 COc1cnc(cc1SCC2CNC(=O)O2)C=O 62a_100010893078_100000181169 [0,2,0,0,0,0|1,1,0]=4 5401 B19R2.30472 COc1ncc(cc1SCC2CNC(=O)O2)C=O 62a_100000181169_200010064893 [0,2,0,0,0,0|1,1,0]=4 5402 B19R2.30472 COc1ncc(cc1SCC2CNC(=O)O2)C=O 62a_200010064893_100000181169 [0,2,0,0,0,0|1,1,0]=4 5403 B19R2.30472 O=C1NCC(O1)COc2cc(ccc2CO)CO 34a_200010669990_100000181169 [0,2,0,0,0,0|2,0,0]=4 5404 B19R2.37521 CNc1c(cc(cc1SCC2CNC(=O)O2)F)N 62a_100000181169_114929179422 [0,2,0,0,0,0|1,1,0]=4 5405 B19R2.37521 CNc1c(cc(cc1SCC2CNC(=O)O2)F)N 62a_114929179422_100000181169 [0,2,0,0,0,0|1,1,0]=4 5406 B19R2.37521 COc1c(cc(cc1NCC2CNC(=O)O2)Br)F 34a_200010245146_100000181169 [0,2,0,0,0,0|1,0,0]=3 5407 B19R2.37521 COc1c(cc(cc1NCC2CNC(=O)O2)C)F 34a_100009958095_100000181169 [0,2,0,0,0,0|1,0,0]=3 5408 B19R2.37521 COc1c(cc(cc1NCC2CNC(=O)O2)Cl)Br 34a_100000243884_100000181169 [0,2,0,0,0,0|1,0,0]=3 5409 B19R2.37521 COc1c(cc(cc1NCC2CNC(=O)O2)Cl)Cl 34a_100009871722_100000181169 [0,2,0,0,0,0|1,0,0]=3 5410 B19R2.37521 COc1c(cc(cc1NCC2CNC(=O)O2)F)Br 34a_100011190657_100000181169 [0,2,0,0,0,0|1,0,0]=3 5411 B19R2.37521 COc1c(cc(cc1NCC2CNC(=O)O2)F)F 34a_100000061580_100000181169 [0,2,0,0,0,0|1,0,0]=3 5412 B19R2.37521 COc1c(cc(cc1NCC2COC(=O)O2)Br)F 34a_200010245146_100000073702 [0,2,0,0,0,0|2,0,0]=4 5413 B19R2.37521 COc1c(cc(cc1NCC2COC(=O)O2)C)F 34a_100009958095_100000073702 [0,2,0,0,0,0|2,0,0]=4 5414 B19R2.37521 COc1c(cc(cc1NCC2COC(=O)O2)Cl)Br 34a_100000243884_100000073702 [0,2,0,0,0,0|2,0,0]=4 5415 B19R2.37521 COc1c(cc(cc1NCC2COC(=O)O2)Cl)Cl 34a_100009871722_100000073702 [0,2,0,0,0,0|2,0,0]=4 5416 B19R2.37521 COc1c(cc(cc1NCC2COC(=O)O2)F)Br 34a_100011190657_100000073702 [0,2,0,0,0,0|2,0,0]=4 5417 B19R2.37521 COc1c(cc(cc1NCC2COC(=O)O2)F)F 34a_100000061580_100000073702 [0,2,0,0,0,0|2,0,0]=4 5418 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)Br)N 62a_100000181169_100015658936 [0,2,0,0,0,0|0,1,0]=3 5419 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)Br)N 62a_100015658936_100000181169 [0,2,0,0,0,0|0,1,0]=3 5420 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)C)F 62a_100000181169_200010713180 [0,2,0,0,0,0|0,1,0]=3 5421 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)C)F 62a_200010713180_100000181169 [0,2,0,0,0,0|0,1,0]=3 5422 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)F)F 62a_100000181169_100009813607 [0,2,0,0,0,0|0,1,0]=3 5423 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)F)F 62a_100009813607_100000181169 [0,2,0,0,0,0|0,1,0]=3 5424 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)F)N 62a_100000181169_100011190657 [0,2,0,0,0,0|0,1,0]=3 5425 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)F)N 62a_100011190657_100000181169 [0,2,0,0,0,0|0,1,0]=3 5426 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)N)C 62a_100000181169_100010071304 [0,2,0,0,0,0|0,1,0]=3 5427 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)N)C 62a_100010071304_100000181169 [0,2,0,0,0,0|0,1,0]=3 5428 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)N)F 62a_100000181169_200009816006 [0,2,0,0,0,0|0,1,0]=3 5429 B19R2.37521 COc1c(cc(cc1SCC2CNC(=O)O2)N)F 62a_200009816006_100000181169 [0,2,0,0,0,0|0,1,0]=3 5430 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)Br)N 62a_100000073702_100015658936 [0,2,0,0,0,0|1,1,0]=4 5431 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)Br)N 62a_100015658936_100000073702 [0,2,0,0,0,0|1,1,0]=4 5432 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)C)F 62a_100000073702_200010713180 [0,2,0,0,0,0|1,1,0]=4 5433 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)C)F 62a_200010713180_100000073702 [0,2,0,0,0,0|1,1,0]=4 5434 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)F)F 62a_100000073702_100009813607 [0,2,0,0,0,0|1,1,0]=4 5435 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)F)F 62a_100009813607_100000073702 [0,2,0,0,0,0|1,1,0]=4 5436 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)F)N 62a_100000073702_100011190657 [0,2,0,0,0,0|1,1,0]=4 5437 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)F)N 62a_100011190657_100000073702 [0,2,0,0,0,0|1,1,0]=4 5438 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)N)C 62a_100000073702_100010071304 [0,2,0,0,0,0|1,1,0]=4 5439 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)N)C 62a_100010071304_100000073702 [0,2,0,0,0,0|1,1,0]=4 5440 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)N)F 62a_100000073702_200009816006 [0,2,0,0,0,0|1,1,0]=4 5441 B19R2.37521 COc1c(cc(cc1SCC2COC(=O)O2)N)F 62a_200009816006_100000073702 [0,2,0,0,0,0|1,1,0]=4 5442 B19R2.37521 CSc1c(cc(cc1SCC2CNC(=O)O2)C)F 62a_100000181169_202125771776 [0,2,0,0,0,0|0,2,0]=4 5443 B19R2.37521 CSc1c(cc(cc1SCC2CNC(=O)O2)C)F 62a_202125771776_100000181169 [0,2,0,0,0,0|0,2,0]=4 5444 B19R2.37521 Cc1cc(c(c(c1)OCC2CNC(=O)O2)C#N)C 34a_100010659394_100000181169 [0,2,0,0,0,0|2,0,0]=4 5445 B19R2.37521 Cc1cc(c(c(c1)OCC2CNC(=O)O2)C#N)C 7a_100010659394_100000181169 [0,2,0,0,0,0|2,0,0]=4 5446 B19R2.37521 N#Cc1c(cc(cc1OCC2CNC(=O)O2)Br)F 34a_200011156622_100000181169 [0,2,0,0,0,0|2,0,0]=4 5447 B19R2.37521 N#Cc1c(cc(cc1OCC2CNC(=O)O2)Br)F 7a_200011156622_100000181169 [0,2,0,0,0,0|2,0,0]=4 5448 B19R2.45048 CC(=O)c1ccc(cc1OCC2CNC(=O)O2)Br 7a_100000188348_100000181169 [0,2,0,0,0,0|1,0,0]=3 5449 B19R2.45048 CC(=O)c1ccc(cc1OCC2CNC(=O)O2)C 34a_100000234885_100000181169 [0,2,0,0,0,0|1,0,0]=3 5450 B19R2.45048 CC(=O)c1ccc(cc1OCC2CNC(=O)O2)C 7a_100000234885_100000181169 [0,2,0,0,0,0|1,0,0]=3 5451 B19R2.45048 CC(=O)c1ccc(cc1OCC2CNC(=O)O2)Cl 34a_100000061402_100000181169 [0,2,0,0,0,0|1,0,0]=3 5452 B19R2.45048 CC(=O)c1ccc(cc1OCC2CNC(=O)O2)Cl 7a_100000061402_100000181169 [0,2,0,0,0,0|1,0,0]=3 5453 B19R2.45048 CC(=O)c1ccc(cc1OCC2CNC(=O)O2)F 7a_100011215782_100000181169 [0,2,0,0,0,0|1,0,0]=3 5454 B19R2.45048 CC(=O)c1ccc(cc1OCC2COC(=O)O2)C 34a_100000234885_100000073702 [0,2,0,0,0,0|2,0,0]=4 5455 B19R2.45048 CC(=O)c1ccc(cc1OCC2COC(=O)O2)Cl 34a_100000061402_100000073702 [0,2,0,0,0,0|2,0,0]=4 5456 B19R2.45048 CC(=O)c1ccc(cc1SCC2CNC(=O)O2)C 62a_100000181169_100012353930 [0,2,0,0,0,0|1,1,0]=4 5457 B19R2.45048 CC(=O)c1ccc(cc1SCC2CNC(=O)O2)C 62a_100012353930_100000181169 [0,2,0,0,0,0|1,1,0]=4 5458 B19R2.45048 CC(=O)c1ccc(cc1SCC2CNC(=O)O2)F 62a_100000686192_100000181169 [0,2,0,0,0,0|1,1,0]=4 5459 B19R2.45048 CC(=O)c1ccc(cc1SCC2CNC(=O)O2)O 62a_100012340537_100000181169 [0,2,0,0,0,0|1,1,0]=4 5460 B19R2.45048 CC(C)c1ccc(cc1NCC2CNC(=O)O2)F 2230a_100012283353_100000181169 [0,2,0,0,0,0|2,0,0]=4 5461 B19R2.45048 CC(C)c1ccc(cc1NCC2CNC(=O)O2)F 34a_100012283353_100000181169 [0,2,0,0,0,0|2,0,0]=4 5462 B19R2.45048 CC(C)c1ccc(cc1NCC2CNC(=O)O2)F 7a_100012283353_100000181169 [0,2,0,0,0,0|2,0,0]=4 5463 B19R2.45048 CN(C)c1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100012349029 [0,2,0,0,0,0|1,1,0]=4 5464 B19R2.45048 CN(C)c1ccc(cc1SCC2CNC(=O)O2)F 62a_100012349029_100000181169 [0,2,0,0,0,0|1,1,0]=4 5465 B19R2.45048 CN(C)c1ccc(cc1SCC2CNC(=O)O2)N 62a_100000181169_100011534197 [0,2,0,0,0,0|1,1,0]=4 5466 B19R2.45048 CN(C)c1ccc(cc1SCC2CNC(=O)O2)N 62a_100011534197_100000181169 [0,2,0,0,0,0|1,1,0]=4 5467 B19R2.45048 C[C@@H](N)c1ccc(cc1SCC2CNC(=O)O2)F 62a_100000181169_100025704064 [0,2,0,0,0,0|1,1,0]=4 5468 B19R2.45048 C[C@@H](N)c1ccc(cc1SCC2CNC(=O)O2)F 62a_100025704064_100000181169 [0,2,0,0,0,0|1,1,0]=4 5469 B19R2.45048 Cc1ccc(c(c1)OCC2CNC(=O)O2)C(=O)N 34a_100000192831_100000181169 [0,2,0,0,0,0|2,0,0]=4 5470 B19R2.45048 Cc1ccc(c(c1)OCC2CNC(=O)O2)C(=O)N 7a_100000192831_100000181169 [0,2,0,0,0,0|2,0,0]=4 5471 B19R2.45048 Cc1ccc(c(c1)OCC2CNC(=O)O2)C(C)C 34a_100000185798_100000181169 [0,2,0,0,0,0|1,0,0]=3 5472 B19R2.45048 Cc1ccc(c(c1)OCC2CNC(=O)O2)C(C)C 7a_100000185798_100000181169 [0,2,0,0,0,0|1,0,0]=3 5473 B19R2.45048 Cc1ccc(c(c1)OCC2CNC(=O)O2)[N+](=O)[O-] 34a_100000195450_100000181169 [0,2,0,0,0,0|2,0,0]=4 5474 B19R2.45048 Cc1ccc(c(c1)OCC2CNC(=O)O2)[N+](=O)[O-] 7a_100000195450_100000181169 [0,2,0,0,0,0|2,0,0]=4 5475 B19R2.45048 Cc1ccc(c(c1)OCC2COC(=O)O2)C(C)C 34a_100000185798_100000073702 [0,2,0,0,0,0|2,0,0]=4 5476 B19R2.45048 Cc1ccc(c(c1)SCC2CNC(=O)O2)N(C)C 62a_100000181169_100012353700 [0,2,0,0,0,0|1,1,0]=4 5477 B19R2.45048 Cc1ccc(c(c1)SCC2CNC(=O)O2)N(C)C 62a_100012353700_100000181169 [0,2,0,0,0,0|1,1,0]=4 5478 B19R2.45048 NC(=O)c1ccc(cc1OCC2CNC(=O)O2)Br 34a_100011550861_100000181169 [0,2,0,0,0,0|2,0,0]=4 5479 B19R2.45048 NC(=O)c1ccc(cc1OCC2CNC(=O)O2)Br 7a_100011550861_100000181169 [0,2,0,0,0,0|2,0,0]=4 5480 B19R2.45048 NC(=O)c1ccc(cc1OCC2CNC(=O)O2)Cl 34a_100000192836_100000181169 [0,2,0,0,0,0|2,0,0]=4 5481 B19R2.45048 NC(=O)c1ccc(cc1OCC2CNC(=O)O2)Cl 7a_100000192836_100000181169 [0,2,0,0,0,0|2,0,0]=4 5482 B19R2.45048 NC(=O)c1ccc(cc1OCC2CNC(=O)O2)N 34a_100000223280_100000181169 [0,2,0,0,0,0|2,0,0]=4 5483 B19R2.45048 NC(=O)c1ccc(cc1OCC2CNC(=O)O2)N 7a_100000223280_100000181169 [0,2,0,0,0,0|2,0,0]=4 5484 B19R2.45048 O=C1NCC(O1)COc2cc(ccc2[N+](=O)[O-])Br 7a_100011934350_100000181169 [0,2,0,0,0,0|2,0,0]=4 5485 B19R2.45048 O=C1NCC(O1)COc2cc(ccc2[N+](=O)[O-])Cl 34a_100000746067_100000181169 [0,2,0,0,0,0|2,0,0]=4 5486 B19R2.45048 O=C1NCC(O1)COc2cc(ccc2[N+](=O)[O-])Cl 7a_100000746067_100000181169 [0,2,0,0,0,0|2,0,0]=4 5487 B19R2.45048 O=C1NCC(O1)COc2cc(ccc2[N+](=O)[O-])F 34a_100000210785_100000181169 [0,2,0,0,0,0|2,0,0]=4 5488 B19R2.45048 O=C1NCC(O1)COc2cc(ccc2[N+](=O)[O-])F 7a_100000210785_100000181169 [0,2,0,0,0,0|2,0,0]=4 5489 B19R2.45048 O=C1NCC(O1)COc2cc(ccc2[N+](=O)[O-])I 7a_100000072657_100000181169 [0,2,0,0,0,0|2,0,0]=4 5490 B19R2.193727 CCc1cc(c(cc1NCC2CNC(=O)O2)F)F 2230a_200013084838_100000181169 [0,2,0,0,0,0|2,0,0]=4 5491 B19R2.193727 CCc1cc(c(cc1NCC2CNC(=O)O2)F)F 34a_200013084838_100000181169 [0,2,0,0,0,0|2,0,0]=4 5492 B19R2.193727 CCc1cc(c(cc1NCC2CNC(=O)O2)F)F 7a_200013084838_100000181169 [0,2,0,0,0,0|2,0,0]=4 5493 B19R2.193727 CCc1cc(c(cc1SCC2CNC(=O)O2)F)O 62a_100000181169_100011156610 [0,2,0,0,0,0|1,1,0]=4 5494 B19R2.193727 CCc1cc(c(cc1SCC2CNC(=O)O2)F)O 62a_100011156610_100000181169 [0,2,0,0,0,0|1,1,0]=4 5495 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Br)Cl 2230a_100010380671_100000181169 [0,2,0,0,0,0|1,0,0]=3 5496 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Br)Cl 34a_100010380671_100000181169 [0,2,0,0,0,0|1,0,0]=3 5497 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Br)F 2230a_100012361397_100000181169 [0,2,0,0,0,0|1,0,0]=3 5498 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Br)F 34a_100012361397_100000181169 [0,2,0,0,0,0|1,0,0]=3 5499 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Br)F 7a_100012361397_100000181169 [0,2,0,0,0,0|1,0,0]=3 5500 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)C)Br 2230a_100010141321_100000181169 [0,2,0,0,0,0|1,0,0]=3 5501 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)C)Br 34a_100010141321_100000181169 [0,2,0,0,0,0|1,0,0]=3 5502 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)C)Cl 2230a_100000211396_100000181169 [0,2,0,0,0,0|1,0,0]=3 5503 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)C)Cl 34a_100000211396_100000181169 [0,2,0,0,0,0|1,0,0]=3 5504 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Cl)Br 2230a_100010212225_100000181169 [0,2,0,0,0,0|1,0,0]=3 5505 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Cl)Br 34a_100010212225_100000181169 [0,2,0,0,0,0|1,0,0]=3 5506 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Cl)C 2230a_100009868623_100000181169 [0,2,0,0,0,0|1,0,0]=3 5507 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Cl)C 34a_100009868623_100000181169 [0,2,0,0,0,0|1,0,0]=3 5508 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Cl)F 2230a_100012186795_100000181169 [0,2,0,0,0,0|1,0,0]=3 5509 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)Cl)F 34a_100012186795_100000181169 [0,2,0,0,0,0|1,0,0]=3 5510 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)F)Br 2230a_100012766639_100000181169 [0,2,0,0,0,0|1,0,0]=3 5511 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)F)Br 34a_100012766639_100000181169 [0,2,0,0,0,0|1,0,0]=3 5512 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)F)F 2230a_100000732608_100000181169 [0,2,0,0,0,0|1,0,0]=3 5513 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)F)F 34a_100000732608_100000181169 [0,2,0,0,0,0|1,0,0]=3 5514 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)F)F 7a_100000732608_100000181169 [0,2,0,0,0,0|1,0,0]=3 5515 B19R2.193727 COc1cc(c(cc1NCC2CNC(=O)O2)I)Cl 34a_100011011177_100000181169 [0,2,0,0,0,0|1,0,0]=3 5516 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)Br)Cl 34a_100010380671_100000073702 [0,2,0,0,0,0|2,0,0]=4 5517 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)Br)F 34a_100012361397_100000073702 [0,2,0,0,0,0|2,0,0]=4 5518 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)C)Br 34a_100010141321_100000073702 [0,2,0,0,0,0|2,0,0]=4 5519 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)C)Cl 34a_100000211396_100000073702 [0,2,0,0,0,0|2,0,0]=4 5520 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)Cl)Br 34a_100010212225_100000073702 [0,2,0,0,0,0|2,0,0]=4 5521 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)Cl)C 34a_100009868623_100000073702 [0,2,0,0,0,0|2,0,0]=4 5522 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)Cl)F 34a_100012186795_100000073702 [0,2,0,0,0,0|2,0,0]=4 5523 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)F)Br 34a_100012766639_100000073702 [0,2,0,0,0,0|2,0,0]=4 5524 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)F)F 34a_100000732608_100000073702 [0,2,0,0,0,0|2,0,0]=4 5525 B19R2.193727 COc1cc(c(cc1NCC2COC(=O)O2)I)Cl 34a_100011011177_100000073702 [0,2,0,0,0,0|2,0,0]=4 5526 B19R2.193727 COc1cc(c(cc1OCC2CNC(=O)O2)F)Br 34a_100010189133_100000181169 [0,2,0,0,0,0|0,0,0]=2 5527 B19R2.193727 COc1cc(c(cc1OCC2CNC(=O)O2)F)Br 7a_100010189133_100000181169 [0,2,0,0,0,0|0,0,0]=2 5528 B19R2.193727 COc1cc(c(cc1OCC2COC(=O)O2)F)Br 34a_100010189133_100000073702 [0,2,0,0,0,0|1,0,0]=3 5529 B19R2.193727 COc1cc(c(cc1OC[C@@H]2CCC(=O)N2)F)Br 7a_100010189133_100015189358 [0,2,0,0,0,0|2,0,0]=4 5530 B19R2.193727 COc1cc(c(cc1OC[C@H]2COC(=O)N2)F)Br 34a_100010189133_100015307671 [0,2,0,0,0,0|2,0,0]=4 5531 B19R2.193727 COc1cc(c(cc1OC[C@H]2COC(=O)N2)F)Br 7a_100010189133_100015307671 [0,2,0,0,0,0|2,0,0]=4 5532 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)C)F 62a_100000181169_100010201977 [0,2,0,0,0,0|0,1,0]=3 5533 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)C)F 62a_100010201977_100000181169 [0,2,0,0,0,0|0,1,0]=3 5534 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)C)N 62a_100000181169_100010232211 [0,2,0,0,0,0|0,1,0]=3 5535 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)C)N 62a_100010232211_100000181169 [0,2,0,0,0,0|0,1,0]=3 5536 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)F)F 62a_100000181169_100009813744 [0,2,0,0,0,0|0,1,0]=3 5537 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)F)F 62a_100009813744_100000181169 [0,2,0,0,0,0|0,1,0]=3 5538 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)N)C 62a_100000181169_106657271712 [0,2,0,0,0,0|0,1,0]=3 5539 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)N)C 62a_106657271712_100000181169 [0,2,0,0,0,0|0,1,0]=3 5540 B19R2.193727 COc1cc(c(cc1SCC2CNC(=O)O2)N)N 62a_100012769537_100000181169 [0,2,0,0,0,0|0,1,0]=3 5541 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)C)F 62a_100000073702_100010201977 [0,2,0,0,0,0|1,1,0]=4 5542 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)C)F 62a_100010201977_100000073702 [0,2,0,0,0,0|1,1,0]=4 5543 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)C)N 62a_100000073702_100010232211 [0,2,0,0,0,0|1,1,0]=4 5544 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)C)N 62a_100010232211_100000073702 [0,2,0,0,0,0|1,1,0]=4 5545 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)F)F 62a_100000073702_100009813744 [0,2,0,0,0,0|1,1,0]=4 5546 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)F)F 62a_100009813744_100000073702 [0,2,0,0,0,0|1,1,0]=4 5547 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)N)C 62a_100000073702_106657271712 [0,2,0,0,0,0|1,1,0]=4 5548 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)N)C 62a_106657271712_100000073702 [0,2,0,0,0,0|1,1,0]=4 5549 B19R2.193727 COc1cc(c(cc1SCC2COC(=O)O2)N)N 62a_100012769537_100000073702 [0,2,0,0,0,0|1,1,0]=4 5550 B19R2.193727 N#Cc1cc(c(cc1OCC2CNC(=O)O2)Br)F 34a_200010827376_100000181169 [0,2,0,0,0,0|2,0,0]=4 5551 B19R2.193727 N#Cc1cc(c(cc1OCC2CNC(=O)O2)Br)F 7a_200010827376_100000181169 [0,2,0,0,0,0|2,0,0]=4 5552 B19R2.193727 N#Cc1cc(c(cc1OCC2CNC(=O)O2)F)Cl 34a_200014338297_100000181169 [0,2,0,0,0,0|2,0,0]=4 5553 B19R2.193727 N#Cc1cc(c(cc1OCC2CNC(=O)O2)F)Cl 7a_200014338297_100000181169 [0,2,0,0,0,0|2,0,0]=4 5554 B19R2.193727 N#Cc1cc(c(cc1OCC2CNC(=O)O2)F)F 34a_100000062209_100000181169 [0,2,0,0,0,0|2,0,0]=4 5555 B19R2.193727 N#Cc1cc(c(cc1OCC2CNC(=O)O2)F)F 7a_100000062209_100000181169 [0,2,0,0,0,0|2,0,0]=4 5556 B19R2.195914 COc1ccc(c(c1NCC2CNC(=O)O2)F)F 34a_100000061648_100000181169 [0,2,0,0,0,0|1,0,0]=3 5557 B19R2.195914 COc1ccc(c(c1NCC2COC(=O)O2)F)F 34a_100000061648_100000073702 [0,2,0,0,0,0|2,0,0]=4 5558 B19R2.195914 COc1ccc(c(c1OCC2CNC(=O)O2)F)F 34a_100000062125_100000181169 [0,2,0,0,0,0|0,0,0]=2 5559 B19R2.195914 COc1ccc(c(c1OCC2CNC(=O)O2)F)F 7a_100000062125_100000181169 [0,2,0,0,0,0|0,0,0]=2 5560 B19R2.195914 COc1ccc(c(c1OCC2COC(=O)O2)F)F 34a_100000062125_100000073702 [0,2,0,0,0,0|1,0,0]=3 5561 B19R2.195914 COc1ccc(c(c1OC[C@@H]2CCC(=O)N2)F)F 7a_100000062125_100015189358 [0,2,0,0,0,0|2,0,0]=4 5562 B19R2.195914 COc1ccc(c(c1OC[C@H]2COC(=O)N2)F)F 34a_100000062125_100015307671 [0,2,0,0,0,0|2,0,0]=4 5563 B19R2.195914 COc1ccc(c(c1OC[C@H]2COC(=O)N2)F)F 7a_100000062125_100015307671 [0,2,0,0,0,0|2,0,0]=4 5564 B19R2.195914 COc1ccc(c(c1SCC2CNC(=O)O2)F)F 62a_100000181169_100010204329 [0,2,0,0,0,0|0,1,0]=3 5565 B19R2.195914 COc1ccc(c(c1SCC2CNC(=O)O2)F)F 62a_100010204329_100000181169 [0,2,0,0,0,0|0,1,0]=3 5566 B19R2.195914 COc1ccc(c(c1SCC2COC(=O)O2)F)F 62a_100000073702_100010204329 [0,2,0,0,0,0|1,1,0]=4 5567 B19R2.195914 COc1ccc(c(c1SCC2COC(=O)O2)F)F 62a_100010204329_100000073702 [0,2,0,0,0,0|1,1,0]=4 5568 B19R2.195914 N#Cc1ccc(c(c1OCC2CNC(=O)O2)Br)F 34a_100010128267_100000181169 [0,2,0,0,0,0|2,0,0]=4 5569 B19R2.195914 N#Cc1ccc(c(c1OCC2CNC(=O)O2)Br)F 7a_100010128267_100000181169 [0,2,0,0,0,0|2,0,0]=4 5570 B19R2.195914 N#Cc1ccc(c(c1OCC2CNC(=O)O2)Cl)Cl 34a_200010827036_100000181169 [0,2,0,0,0,0|2,0,0]=4 5571 B19R2.195914 N#Cc1ccc(c(c1OCC2CNC(=O)O2)Cl)Cl 7a_200010827036_100000181169 [0,2,0,0,0,0|2,0,0]=4 5572 B19R2.195914 N#Cc1ccc(c(c1OCC2CNC(=O)O2)F)F 34a_200000080570_100000181169 [0,2,0,0,0,0|2,0,0]=4 5573 B19R2.195914 N#Cc1ccc(c(c1OCC2CNC(=O)O2)F)F 7a_200000080570_100000181169 [0,2,0,0,0,0|2,0,0]=4 5574 B19R2.8323 CCc1cc(cc(c1NCC2CNC(=O)O2)Br)Br 34a_200012361292_100000181169 [0,2,0,0,0,0|2,0,0]=4 5575 B19R2.8323 CCc1cc(cc(c1NCC2CNC(=O)O2)Br)Br 7a_200012361292_100000181169 [0,2,0,0,0,0|2,0,0]=4 5576 B19R2.8323 CCc1cc(cc(c1NCC2CNC(=O)O2)C)Br 2230a_200000186424_100000181169 [0,2,0,0,0,0|2,0,0]=4 5577 B19R2.8323 CCc1cc(cc(c1NCC2CNC(=O)O2)C)Br 34a_200000186424_100000181169 [0,2,0,0,0,0|2,0,0]=4 5578 B19R2.8323 CCc1cc(cc(c1NCC2CNC(=O)O2)C)Br 7a_200000186424_100000181169 [0,2,0,0,0,0|2,0,0]=4 5579 B19R2.8323 CCc1cc(cc(c1OCC2CNC(=O)O2)C)Br 34a_100010659108_100000181169 [0,2,0,0,0,0|1,0,0]=3 5580 B19R2.8323 CCc1cc(cc(c1OCC2CNC(=O)O2)C)Br 7a_100010659108_100000181169 [0,2,0,0,0,0|1,0,0]=3 5581 B19R2.8323 CCc1cc(cc(c1OCC2COC(=O)O2)C)Br 34a_100010659108_100000073702 [0,2,0,0,0,0|2,0,0]=4 5582 B19R2.8323 COc1cc(cc(c1NCC2CNC(=O)O2)Br)Br 34a_100010253907_100000181169 [0,2,0,0,0,0|1,0,0]=3 5583 B19R2.8323 COc1cc(cc(c1NCC2CNC(=O)O2)Br)Cl 34a_200010138668_100000181169 [0,2,0,0,0,0|1,0,0]=3 5584 B19R2.8323 COc1cc(cc(c1NCC2CNC(=O)O2)Br)F 34a_100011004115_100000181169 [0,2,0,0,0,0|1,0,0]=3 5585 B19R2.8323 COc1cc(cc(c1NCC2CNC(=O)O2)C)Br 34a_100000741850_100000181169 [0,2,0,0,0,0|1,0,0]=3 5586 B19R2.8323 COc1cc(cc(c1NCC2CNC(=O)O2)Cl)Cl 34a_100009955935_100000181169 [0,2,0,0,0,0|1,0,0]=3 5587 B19R2.8323 COc1cc(cc(c1NCC2COC(=O)O2)Br)Br 34a_100010253907_100000073702 [0,2,0,0,0,0|2,0,0]=4 5588 B19R2.8323 COc1cc(cc(c1NCC2COC(=O)O2)Br)Cl 34a_200010138668_100000073702 [0,2,0,0,0,0|2,0,0]=4 5589 B19R2.8323 COc1cc(cc(c1NCC2COC(=O)O2)Br)F 34a_100011004115_100000073702 [0,2,0,0,0,0|2,0,0]=4 5590 B19R2.8323 COc1cc(cc(c1NCC2COC(=O)O2)C)Br 34a_100000741850_100000073702 [0,2,0,0,0,0|2,0,0]=4 5591 B19R2.8323 COc1cc(cc(c1NCC2COC(=O)O2)Cl)Cl 34a_100009955935_100000073702 [0,2,0,0,0,0|2,0,0]=4 5592 B19R2.8323 COc1cc(cc(c1OCC2CNC(=O)O2)Br)F 34a_200010391102_100000181169 [0,2,0,0,0,0|0,0,0]=2 5593 B19R2.8323 COc1cc(cc(c1OCC2CNC(=O)O2)Br)F 7a_200010391102_100000181169 [0,2,0,0,0,0|0,0,0]=2 5594 B19R2.8323 COc1cc(cc(c1OCC2COC(=O)O2)Br)F 34a_200010391102_100000073702 [0,2,0,0,0,0|1,0,0]=3 5595 B19R2.8323 COc1cc(cc(c1OC[C@@H]2CCC(=O)N2)Br)F 7a_200010391102_100015189358 [0,2,0,0,0,0|2,0,0]=4 5596 B19R2.8323 COc1cc(cc(c1OC[C@H]2COC(=O)N2)Br)F 34a_200010391102_100015307671 [0,2,0,0,0,0|2,0,0]=4 5597 B19R2.8323 COc1cc(cc(c1OC[C@H]2COC(=O)N2)Br)F 7a_200010391102_100015307671 [0,2,0,0,0,0|2,0,0]=4 5598 B19R2.8323 COc1cc(cc(c1SCC2CNC(=O)O2)Br)Cl 62a_100000181169_100025705407 [0,2,0,0,0,0|0,1,0]=3 5599 B19R2.8323 COc1cc(cc(c1SCC2CNC(=O)O2)Br)Cl 62a_100025705407_100000181169 [0,2,0,0,0,0|0,1,0]=3 5600 B19R2.8323 COc1cc(cc(c1SCC2CNC(=O)O2)Cl)Cl 62a_100000181169_100010292537 [0,2,0,0,0,0|0,1,0]=3 5601 B19R2.8323 COc1cc(cc(c1SCC2CNC(=O)O2)Cl)Cl 62a_100010292537_100000181169 [0,2,0,0,0,0|0,1,0]=3 5602 B19R2.8323 COc1cc(cc(c1SCC2CNC(=O)O2)F)Br 62a_100000181169_100010713143 [0,2,0,0,0,0|0,1,0]=3 5603 B19R2.8323 COc1cc(cc(c1SCC2CNC(=O)O2)F)Br 62a_100010713143_100000181169 [0,2,0,0,0,0|0,1,0]=3 5604 B19R2.8323 COc1cc(cc(c1SCC2COC(=O)O2)Br)Cl 62a_100000073702_100025705407 [0,2,0,0,0,0|1,1,0]=4 5605 B19R2.8323 COc1cc(cc(c1SCC2COC(=O)O2)Br)Cl 62a_100025705407_100000073702 [0,2,0,0,0,0|1,1,0]=4 5606 B19R2.8323 COc1cc(cc(c1SCC2COC(=O)O2)Cl)Cl 62a_100000073702_100010292537 [0,2,0,0,0,0|1,1,0]=4 5607 B19R2.8323 COc1cc(cc(c1SCC2COC(=O)O2)Cl)Cl 62a_100010292537_100000073702 [0,2,0,0,0,0|1,1,0]=4 5608 B19R2.8323 COc1cc(cc(c1SCC2COC(=O)O2)F)Br 62a_100000073702_100010713143 [0,2,0,0,0,0|1,1,0]=4 5609 B19R2.8323 COc1cc(cc(c1SCC2COC(=O)O2)F)Br 62a_100010713143_100000073702 [0,2,0,0,0,0|1,1,0]=4 5610 B19R2.8323 Cc1cc(cc(c1OCC2CNC(=O)O2)C#N)Br 34a_100010195408_100000181169 [0,2,0,0,0,0|2,0,0]=4 5611 B19R2.8323 Cc1cc(cc(c1OCC2CNC(=O)O2)C#N)Br 7a_100010195408_100000181169 [0,2,0,0,0,0|2,0,0]=4 5612 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)Br)Br 34a_100009814147_100000181169 [0,2,0,0,0,0|2,0,0]=4 5613 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)Br)Br 7a_100009814147_100000181169 [0,2,0,0,0,0|2,0,0]=4 5614 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)Br)F 34a_100010674538_100000181169 [0,2,0,0,0,0|2,0,0]=4 5615 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)Br)F 7a_100010674538_100000181169 [0,2,0,0,0,0|2,0,0]=4 5616 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)Cl)Br 34a_100010218075_100000181169 [0,2,0,0,0,0|2,0,0]=4 5617 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)Cl)Br 7a_100010218075_100000181169 [0,2,0,0,0,0|2,0,0]=4 5618 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)F)F 34a_100000068412_100000181169 [0,2,0,0,0,0|2,0,0]=4 5619 B19R2.8323 N#Cc1cc(cc(c1OCC2CNC(=O)O2)F)F 7a_100000068412_100000181169 [0,2,0,0,0,0|2,0,0]=4 5620 B19R2.8323 O=C1NCC(O1)COc2c(cc(cc2CBr)Br)Br 34a_200009814416_100000181169 [0,2,0,0,0,0|2,0,0]=4 5621 B19R2.8323 O=C1NCC(O1)COc2c(cc(cc2CBr)Br)Br 7a_200009814416_100000181169 [0,2,0,0,0,0|2,0,0]=4 5622 B19R2.8323 O=C1NCC(O1)COc2c(cc(cc2CO)Cl)Br 34a_100009812756_100000181169 [0,2,0,0,0,0|2,0,0]=4 5623 B19R2.8323 O=C1NCC(O1)COc2c(cc(cc2CO)Cl)Br 7a_100009812756_100000181169 [0,2,0,0,0,0|2,0,0]=4 5624 B19R2.38690 COc1c(cc[n+](c1C)[O-])SCC2CNC(=O)O2 62a_100000181169_100000067051 [0,2,0,0,0,0|1,1,0]=4 5625 B19R2.38690 COc1c(ccc(c1Br)F)NCC2CNC(=O)O2 2230a_102516457224_100000181169 [0,2,0,0,0,0|1,0,0]=3 5626 B19R2.38690 COc1c(ccc(c1Br)F)NCC2CNC(=O)O2 34a_102516457224_100000181169 [0,2,0,0,0,0|1,0,0]=3 5627 B19R2.38690 COc1c(ccc(c1Br)F)NCC2COC(=O)O2 34a_102516457224_100000073702 [0,2,0,0,0,0|2,0,0]=4 5628 B19R2.38690 COc1c(ccc(c1F)Br)NCC2CNC(=O)O2 2230a_100010734149_100000181169 [0,2,0,0,0,0|1,0,0]=3 5629 B19R2.38690 COc1c(ccc(c1F)Br)NCC2CNC(=O)O2 34a_100010734149_100000181169 [0,2,0,0,0,0|1,0,0]=3 5630 B19R2.38690 COc1c(ccc(c1F)Br)NCC2COC(=O)O2 34a_100010734149_100000073702 [0,2,0,0,0,0|2,0,0]=4 5631 B19R2.38690 COc1c(ccc(c1F)C)SCC2CNC(=O)O2 62a_100000181169_100010081143 [0,2,0,0,0,0|0,1,0]=3 5632 B19R2.38690 COc1c(ccc(c1F)C)SCC2CNC(=O)O2 62a_100010081143_100000181169 [0,2,0,0,0,0|0,1,0]=3 5633 B19R2.38690 COc1c(ccc(c1F)C)SCC2COC(=O)O2 62a_100000073702_100010081143 [0,2,0,0,0,0|1,1,0]=4 5634 B19R2.38690 COc1c(ccc(c1F)C)SCC2COC(=O)O2 62a_100010081143_100000073702 [0,2,0,0,0,0|1,1,0]=4 5635 B19R2.38690 COc1c(ccc(c1F)F)NCC2CNC(=O)O2 2230a_100011695293_100000181169 [0,2,0,0,0,0|1,0,0]=3 5636 B19R2.38690 COc1c(ccc(c1F)F)NCC2CNC(=O)O2 34a_100011695293_100000181169 [0,2,0,0,0,0|1,0,0]=3 5637 B19R2.38690 COc1c(ccc(c1F)F)NCC2COC(=O)O2 34a_100011695293_100000073702 [0,2,0,0,0,0|2,0,0]=4 5638 B19R2.38690 COc1c(ccc(c1F)F)SCC2CNC(=O)O2 62a_100000181169_100010223324 [0,2,0,0,0,0|0,1,0]=3 5639 B19R2.38690 COc1c(ccc(c1F)F)SCC2CNC(=O)O2 62a_100010223324_100000181169 [0,2,0,0,0,0|0,1,0]=3 5640 B19R2.38690 COc1c(ccc(c1F)F)SCC2COC(=O)O2 62a_100000073702_100010223324 [0,2,0,0,0,0|1,1,0]=4 5641 B19R2.38690 COc1c(ccc(c1F)F)SCC2COC(=O)O2 62a_100010223324_100000073702 [0,2,0,0,0,0|1,1,0]=4 5642 B19R2.38690 COc1c(ccc(c1O)F)SCC2CNC(=O)O2 62a_100000181169_200010167157 [0,2,0,0,0,0|0,1,0]=3 5643 B19R2.38690 COc1c(ccc(c1O)F)SCC2COC(=O)O2 62a_100000073702_200010167157 [0,2,0,0,0,0|1,1,0]=4 5644 B19R2.38690 CSc1c(ccc(c1F)C)SCC2CNC(=O)O2 62a_100000181169_200134762213 [0,2,0,0,0,0|0,2,0]=4 5645 B19R2.38690 CSc1c(ccc(c1F)C)SCC2CNC(=O)O2 62a_200134762213_100000181169 [0,2,0,0,0,0|0,2,0]=4 5646 B19R2.38690 N#Cc1c(ccc(c1Br)Cl)OCC2CNC(=O)O2 34a_100015534069_100000181169 [0,2,0,0,0,0|2,0,0]=4 5647 B19R2.38690 N#Cc1c(ccc(c1Br)Cl)OCC2CNC(=O)O2 7a_100015534069_100000181169 [0,2,0,0,0,0|2,0,0]=4 5648 B19R2.45043 C=C(C)c1cc(ccc1NCC2CNC(=O)O2)F 34a_100009961556_100000181169 [0,2,0,0,0,0|2,0,0]=4 5649 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000212127_100000181169 [0,2,0,0,0,0|1,0,0]=3 5650 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000212127_100000181169 [0,2,0,0,0,0|1,0,0]=3 5651 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)C 34a_100000195442_100000181169 [0,2,0,0,0,0|1,0,0]=3 5652 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)C 7a_100000195442_100000181169 [0,2,0,0,0,0|1,0,0]=3 5653 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000185566_100000181169 [0,2,0,0,0,0|1,0,0]=3 5654 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)Cl 7a_100000185566_100000181169 [0,2,0,0,0,0|1,0,0]=3 5655 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)F 7a_100000182812_100000181169 [0,2,0,0,0,0|1,0,0]=3 5656 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)I 7a_100010712555_100000181169 [0,2,0,0,0,0|1,0,0]=3 5657 B19R2.45043 CC(=O)c1cc(ccc1OCC2CNC(=O)O2)N 34a_100011218865_100000181169 [0,2,0,0,0,0|1,0,0]=3 5658 B19R2.45043 CC(=O)c1cc(ccc1OCC2COC(=O)O2)Br 34a_100000212127_100000073702 [0,2,0,0,0,0|2,0,0]=4 5659 B19R2.45043 CC(=O)c1cc(ccc1OCC2COC(=O)O2)C 34a_100000195442_100000073702 [0,2,0,0,0,0|2,0,0]=4 5660 B19R2.45043 CC(=O)c1cc(ccc1OCC2COC(=O)O2)Cl 34a_100000185566_100000073702 [0,2,0,0,0,0|2,0,0]=4 5661 B19R2.45043 CC(=O)c1cc(ccc1OCC2COC(=O)O2)N 34a_100011218865_100000073702 [0,2,0,0,0,0|2,0,0]=4 5662 B19R2.45043 CC(=O)c1cc(ccc1SCC2CNC(=O)O2)Br 62a_100012349576_100000181169 [0,2,0,0,0,0|1,1,0]=4 5663 B19R2.45043 CC(=O)c1cc(ccc1SCC2CNC(=O)O2)C 62a_100000181169_100012361225 [0,2,0,0,0,0|1,1,0]=4 5664 B19R2.45043 CC(=O)c1cc(ccc1SCC2CNC(=O)O2)C 62a_100012361225_100000181169 [0,2,0,0,0,0|1,1,0]=4 5665 B19R2.45043 CC(=O)c1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100010200798 [0,2,0,0,0,0|1,1,0]=4 5666 B19R2.45043 CC(=O)c1cc(ccc1SCC2CNC(=O)O2)F 62a_100012353695_100000181169 [0,2,0,0,0,0|1,1,0]=4 5667 B19R2.45043 CC(=O)c1cc(ccc1SCC2CNC(=O)O2)N 62a_100012349454_100000181169 [0,2,0,0,0,0|1,1,0]=4 5668 B19R2.45043 CC(C)c1cc(ccc1NCC2CNC(=O)O2)Br 2230a_100000694223_100000181169 [0,2,0,0,0,0|2,0,0]=4 5669 B19R2.45043 CC(C)c1cc(ccc1NCC2CNC(=O)O2)Br 34a_100000694223_100000181169 [0,2,0,0,0,0|2,0,0]=4 5670 B19R2.45043 CC(C)c1cc(ccc1NCC2CNC(=O)O2)Br 7a_100000694223_100000181169 [0,2,0,0,0,0|2,0,0]=4 5671 B19R2.45043 CC(C)c1cc(ccc1NCC2CNC(=O)O2)F 2230a_100011941472_100000181169 [0,2,0,0,0,0|2,0,0]=4 5672 B19R2.45043 CC(C)c1cc(ccc1NCC2CNC(=O)O2)F 34a_100011941472_100000181169 [0,2,0,0,0,0|2,0,0]=4 5673 B19R2.45043 CC(C)c1cc(ccc1NCC2CNC(=O)O2)F 7a_100011941472_100000181169 [0,2,0,0,0,0|2,0,0]=4 5674 B19R2.45043 CC(C)c1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000691460_100000181169 [0,2,0,0,0,0|1,0,0]=3 5675 B19R2.45043 CC(C)c1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000691460_100000181169 [0,2,0,0,0,0|1,0,0]=3 5676 B19R2.45043 CC(C)c1cc(ccc1OCC2COC(=O)O2)Br 34a_100000691460_100000073702 [0,2,0,0,0,0|2,0,0]=4 5677 B19R2.45043 CC(C)c1cc(ccc1SCC2CNC(=O)O2)Br 62a_100000181169_100010244561 [0,2,0,0,0,0|1,1,0]=4 5678 B19R2.45043 CC(C)c1cc(ccc1SCC2CNC(=O)O2)Br 62a_100010244561_100000181169 [0,2,0,0,0,0|1,1,0]=4 5679 B19R2.45043 CC(N)c1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100012343209 [0,2,0,0,0,0|1,1,0]=4 5680 B19R2.45043 CC(N)c1cc(ccc1SCC2CNC(=O)O2)F 62a_100012343209_100000181169 [0,2,0,0,0,0|1,1,0]=4 5681 B19R2.45043 CC(O)c1cc(ccc1OCC2CNC(=O)O2)F 34a_200011305312_100000181169 [0,2,0,0,0,0|1,0,0]=3 5682 B19R2.45043 CC(O)c1cc(ccc1OCC2CNC(=O)O2)F 7a_200011305312_100000181169 [0,2,0,0,0,0|1,0,0]=3 5683 B19R2.45043 CC(O)c1cc(ccc1OCC2COC(=O)O2)F 34a_200011305312_100000073702 [0,2,0,0,0,0|2,0,0]=4 5684 B19R2.45043 CN(C)c1cc(ccc1SCC2CNC(=O)O2)O 62a_100000181169_200010083878 [0,2,0,0,0,0|1,1,0]=4 5685 B19R2.45043 C[C@@H](N)c1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100011853016_100000181169 [0,2,0,0,0,0|1,0,0]=3 5686 B19R2.45043 C[C@@H](N)c1cc(ccc1OCC2CNC(=O)O2)Cl 7a_100011853016_100000181169 [0,2,0,0,0,0|1,0,0]=3 5687 B19R2.45043 C[C@@H](N)c1cc(ccc1OCC2COC(=O)O2)Cl 34a_100011853016_100000073702 [0,2,0,0,0,0|2,0,0]=4 5688 B19R2.45043 C[C@H](N)c1cc(ccc1OCC2CNC(=O)O2)F 34a_100160469477_100000181169 [0,2,0,0,0,0|1,0,0]=3 5689 B19R2.45043 C[C@H](N)c1cc(ccc1OCC2CNC(=O)O2)F 7a_100160469477_100000181169 [0,2,0,0,0,0|1,0,0]=3 5690 B19R2.45043 C[C@H](N)c1cc(ccc1OCC2COC(=O)O2)F 34a_100160469477_100000073702 [0,2,0,0,0,0|2,0,0]=4 5691 B19R2.45043 C[C@H](O)c1cc(ccc1SCC2CNC(=O)O2)F 62a_100000181169_100134768474 [0,2,0,0,0,0|1,1,0]=4 5692 B19R2.45043 C[C@H](O)c1cc(ccc1SCC2CNC(=O)O2)F 62a_100134768474_100000181169 [0,2,0,0,0,0|1,1,0]=4 5693 B19R2.45043 Cc1ccc(c(c1)C(=O)N)OCC2CNC(=O)O2 34a_200000192840_100000181169 [0,2,0,0,0,0|2,0,0]=4 5694 B19R2.45043 Cc1ccc(c(c1)C(=O)N)OCC2CNC(=O)O2 7a_200000192840_100000181169 [0,2,0,0,0,0|2,0,0]=4 5695 B19R2.45043 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CNC(=O)O2 34a_100000195567_100000181169 [0,2,0,0,0,0|2,0,0]=4 5696 B19R2.45043 Cc1ccc(c(c1)[N+](=O)[O-])OCC2CNC(=O)O2 7a_100000195567_100000181169 [0,2,0,0,0,0|2,0,0]=4 5697 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)Br 34a_100000192807_100000181169 [0,2,0,0,0,0|2,0,0]=4 5698 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)Br 7a_100000192807_100000181169 [0,2,0,0,0,0|2,0,0]=4 5699 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)Cl 34a_100000185026_100000181169 [0,2,0,0,0,0|2,0,0]=4 5700 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)Cl 7a_100000185026_100000181169 [0,2,0,0,0,0|2,0,0]=4 5701 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)F 34a_100012186459_100000181169 [0,2,0,0,0,0|2,0,0]=4 5702 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)F 7a_100012186459_100000181169 [0,2,0,0,0,0|2,0,0]=4 5703 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)I 34a_100000192813_100000181169 [0,2,0,0,0,0|2,0,0]=4 5704 B19R2.45043 NC(=O)c1cc(ccc1OCC2CNC(=O)O2)I 7a_100000192813_100000181169 [0,2,0,0,0,0|2,0,0]=4 5705 B19R2.45043 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CNC(=O)O2 34a_100000032192_100000181169 [0,2,0,0,0,0|2,0,0]=4 5706 B19R2.45043 Nc1ccc(c(c1)[N+](=O)[O-])OCC2CNC(=O)O2 7a_100000032192_100000181169 [0,2,0,0,0,0|2,0,0]=4 5707 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])Br 34a_100000757407_100000181169 [0,2,0,0,0,0|2,0,0]=4 5708 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])Br 7a_100000757407_100000181169 [0,2,0,0,0,0|2,0,0]=4 5709 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])Cl 34a_100000212152_100000181169 [0,2,0,0,0,0|2,0,0]=4 5710 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])Cl 7a_100000212152_100000181169 [0,2,0,0,0,0|2,0,0]=4 5711 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])F 34a_100000748789_100000181169 [0,2,0,0,0,0|2,0,0]=4 5712 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])F 7a_100000748789_100000181169 [0,2,0,0,0,0|2,0,0]=4 5713 B19R2.45043 O=C1NCC(O1)COc2ccc(cc2[N+](=O)[O-])I 7a_100000698543_100000181169 [0,2,0,0,0,0|2,0,0]=4 5714 B19R2.195780 C=Cc1ccc(c(c1)OC)OCC2CNC(=O)O2 34a_100011217988_100000181169 [0,2,0,0,0,0|0,0,0]=2 5715 B19R2.195780 C=Cc1ccc(c(c1)OC)OCC2COC(=O)O2 34a_100011217988_100000073702 [0,2,0,0,0,0|1,0,0]=3 5716 B19R2.195780 C=Cc1ccc(c(c1)OC)OC[C@H]2COC(=O)N2 34a_100011217988_100015307671 [0,2,0,0,0,0|2,0,0]=4 5717 B19R2.195780 CCc1cc(ccc1NCC2CNC(=O)O2)C#N 34a_100011219738_100000181169 [0,2,0,0,0,0|2,0,0]=4 5718 B19R2.195780 CCc1cc(ccc1NCC2CNC(=O)O2)C#N 7a_100011219738_100000181169 [0,2,0,0,0,0|2,0,0]=4 5719 B19R2.195780 CCc1cc(ccc1SCC2CNC(=O)O2)C#N 62a_100000181169_100010115944 [0,2,0,0,0,0|1,1,0]=4 5720 B19R2.195780 CCc1cc(ccc1SCC2CNC(=O)O2)OC 62a_100000181169_100000720562 [0,2,0,0,0,0|1,1,0]=4 5721 B19R2.195780 CCc1cc(ccc1SCC2CNC(=O)O2)OC 62a_100000720562_100000181169 [0,2,0,0,0,0|1,1,0]=4 5722 B19R2.195780 CCc1ccc(c(c1)OC)OCC2CNC(=O)O2 34a_100000186467_100000181169 [0,2,0,0,0,0|0,0,0]=2 5723 B19R2.195780 CCc1ccc(c(c1)OC)OCC2CNC(=O)O2 7a_100000186467_100000181169 [0,2,0,0,0,0|0,0,0]=2 5724 B19R2.195780 CCc1ccc(c(c1)OC)OCC2COC(=O)O2 34a_100000186467_100000073702 [0,2,0,0,0,0|1,0,0]=3 5725 B19R2.195780 CCc1ccc(c(c1)OC)OC[C@@H]2CCC(=O)N2 7a_100000186467_100015189358 [0,2,0,0,0,0|2,0,0]=4 5726 B19R2.195780 CCc1ccc(c(c1)OC)OC[C@H]2COC(=O)N2 34a_100000186467_100015307671 [0,2,0,0,0,0|2,0,0]=4 5727 B19R2.195780 CCc1ccc(c(c1)OC)OC[C@H]2COC(=O)N2 7a_100000186467_100015307671 [0,2,0,0,0,0|2,0,0]=4 5728 B19R2.195780 CCc1ccc(c(c1)OC)SCC2CNC(=O)O2 62a_100000181169_200010710389 [0,2,0,0,0,0|0,1,0]=3 5729 B19R2.195780 CCc1ccc(c(c1)OC)SCC2CNC(=O)O2 62a_200010710389_100000181169 [0,2,0,0,0,0|0,1,0]=3 5730 B19R2.195780 CCc1ccc(c(c1)OC)SCC2COC(=O)O2 62a_100000073702_200010710389 [0,2,0,0,0,0|1,1,0]=4 5731 B19R2.195780 CCc1ccc(c(c1)OC)SCC2COC(=O)O2 62a_200010710389_100000073702 [0,2,0,0,0,0|1,1,0]=4 5732 B19R2.195780 COc1cc(c(cn1)SCC2CNC(=O)O2)OC 62a_100000181169_100010191559 [0,2,0,0,0,0|1,1,0]=4 5733 B19R2.195780 COc1cc(c(cn1)SCC2CNC(=O)O2)OC 62a_100010191559_100000181169 [0,2,0,0,0,0|1,1,0]=4 5734 B19R2.195780 COc1cc(ccc1NCC2CNC(=O)O2)C#N 34a_100000701993_100000181169 [0,2,0,0,0,0|1,0,0]=3 5735 B19R2.195780 COc1cc(ccc1NCC2CNC(=O)O2)CO 2230a_100000087641_100000181169 [0,2,0,0,0,0|1,0,0]=3 5736 B19R2.195780 COc1cc(ccc1NCC2CNC(=O)O2)CO 34a_100000087641_100000181169 [0,2,0,0,0,0|1,0,0]=3 5737 B19R2.195780 COc1cc(ccc1NCC2CNC(=O)O2)SC 2230a_100000766855_100000181169 [0,2,0,0,0,0|1,0,0]=3 5738 B19R2.195780 COc1cc(ccc1NCC2CNC(=O)O2)SC 34a_100000766855_100000181169 [0,2,0,0,0,0|1,0,0]=3 5739 B19R2.195780 COc1cc(ccc1NCC2COC(=O)O2)C#N 34a_100000701993_100000073702 [0,2,0,0,0,0|2,0,0]=4 5740 B19R2.195780 COc1cc(ccc1NCC2COC(=O)O2)CO 34a_100000087641_100000073702 [0,2,0,0,0,0|2,0,0]=4 5741 B19R2.195780 COc1cc(ccc1NCC2COC(=O)O2)SC 34a_100000766855_100000073702 [0,2,0,0,0,0|2,0,0]=4 5742 B19R2.195780 COc1cc(ccc1OCC2CNC(=O)O2)C#N 34a_100000184589_100000181169 [0,2,0,0,0,0|0,0,0]=2 5743 B19R2.195780 COc1cc(ccc1OCC2CNC(=O)O2)C#N 7a_100000184589_100000181169 [0,2,0,0,0,0|0,0,0]=2 5744 B19R2.195780 COc1cc(ccc1OCC2CNC(=O)O2)CN 34a_100000185554_100000181169 [0,2,0,0,0,0|0,0,0]=2 5745 B19R2.195780 COc1cc(ccc1OCC2COC(=O)O2)C#N 34a_100000184589_100000073702 [0,2,0,0,0,0|1,0,0]=3 5746 B19R2.195780 COc1cc(ccc1OCC2COC(=O)O2)CN 34a_100000185554_100000073702 [0,2,0,0,0,0|1,0,0]=3 5747 B19R2.195780 COc1cc(ccc1OC[C@@H]2CCC(=O)N2)C#N 7a_100000184589_100015189358 [0,2,0,0,0,0|2,0,0]=4 5748 B19R2.195780 COc1cc(ccc1OC[C@H]2COC(=O)N2)C#N 34a_100000184589_100015307671 [0,2,0,0,0,0|2,0,0]=4 5749 B19R2.195780 COc1cc(ccc1OC[C@H]2COC(=O)N2)C#N 7a_100000184589_100015307671 [0,2,0,0,0,0|2,0,0]=4 5750 B19R2.195780 COc1cc(ccc1OC[C@H]2COC(=O)N2)CN 34a_100000185554_100015307671 [0,2,0,0,0,0|2,0,0]=4 5751 B19R2.195780 COc1cc(ccc1SCC2CNC(=O)O2)C#N 62a_100000181169_100012356288 [0,2,0,0,0,0|0,1,0]=3 5752 B19R2.195780 COc1cc(ccc1SCC2CNC(=O)O2)C=O 62a_100000181169_100010244714 [0,2,0,0,0,0|0,1,0]=3 5753 B19R2.195780 COc1cc(ccc1SCC2CNC(=O)O2)C=O 62a_100010244714_100000181169 [0,2,0,0,0,0|0,1,0]=3 5754 B19R2.195780 COc1cc(ccc1SCC2CNC(=O)O2)CO 62a_100000181169_100010234685 [0,2,0,0,0,0|0,1,0]=3 5755 B19R2.195780 COc1cc(ccc1SCC2CNC(=O)O2)CO 62a_100010234685_100000181169 [0,2,0,0,0,0|0,1,0]=3 5756 B19R2.195780 COc1cc(ccc1SCC2COC(=O)O2)C#N 62a_100000073702_100012356288 [0,2,0,0,0,0|1,1,0]=4 5757 B19R2.195780 COc1cc(ccc1SCC2COC(=O)O2)C=O 62a_100000073702_100010244714 [0,2,0,0,0,0|1,1,0]=4 5758 B19R2.195780 COc1cc(ccc1SCC2COC(=O)O2)C=O 62a_100010244714_100000073702 [0,2,0,0,0,0|1,1,0]=4 5759 B19R2.195780 COc1cc(ccc1SCC2COC(=O)O2)CO 62a_100000073702_100010234685 [0,2,0,0,0,0|1,1,0]=4 5760 B19R2.195780 COc1cc(ccc1SCC2COC(=O)O2)CO 62a_100010234685_100000073702 [0,2,0,0,0,0|1,1,0]=4 5761 B19R2.195780 COc1cc(cnc1SCC2CNC(=O)O2)C#N 62a_100000181169_200009864118 [0,2,0,0,0,0|1,1,0]=4 5762 B19R2.195780 COc1cc(ncc1SCC2CNC(=O)O2)C#N 62a_100000181169_100010136804 [0,2,0,0,0,0|1,1,0]=4 5763 B19R2.195780 COc1cc(ncc1SCC2CNC(=O)O2)CO 62a_100000181169_100010999569 [0,2,0,0,0,0|1,1,0]=4 5764 B19R2.195780 COc1cc(ncc1SCC2CNC(=O)O2)CO 62a_100010999569_100000181169 [0,2,0,0,0,0|1,1,0]=4 5765 B19R2.195780 COc1ccc(c(c1)C#N)OCC2CNC(=O)O2 34a_200011934229_100000181169 [0,2,0,0,0,0|2,0,0]=4 5766 B19R2.195780 COc1ccc(c(c1)C#N)OCC2CNC(=O)O2 7a_200011934229_100000181169 [0,2,0,0,0,0|2,0,0]=4 5767 B19R2.195780 COc1ccc(c(c1)OC)NCC2CNC(=O)O2 2230a_100000211191_100000181169 [0,2,0,0,0,0|1,0,0]=3 5768 B19R2.195780 COc1ccc(c(c1)OC)NCC2CNC(=O)O2 34a_100000211191_100000181169 [0,2,0,0,0,0|1,0,0]=3 5769 B19R2.195780 COc1ccc(c(c1)OC)NCC2COC(=O)O2 34a_100000211191_100000073702 [0,2,0,0,0,0|2,0,0]=4 5770 B19R2.195780 COc1ccc(c(c1)OC)OCC2CNC(=O)O2 34a_100009840267_100000181169 [0,2,0,0,0,0|0,0,0]=2 5771 B19R2.195780 COc1ccc(c(c1)OC)OCC2COC(=O)O2 34a_100009840267_100000073702 [0,2,0,0,0,0|1,0,0]=3 5772 B19R2.195780 COc1ccc(c(c1)OC)OC[C@H]2COC(=O)N2 34a_100009840267_100015307671 [0,2,0,0,0,0|2,0,0]=4 5773 B19R2.195780 COc1ccc(c(c1)OC)SCC2CNC(=O)O2 62a_100000181169_100000750026 [0,2,0,0,0,0|0,1,0]=3 5774 B19R2.195780 COc1ccc(c(c1)OC)SCC2CNC(=O)O2 62a_100000750026_100000181169 [0,2,0,0,0,0|0,1,0]=3 5775 B19R2.195780 COc1ccc(c(c1)OC)SCC2COC(=O)O2 62a_100000073702_100000750026 [0,2,0,0,0,0|1,1,0]=4 5776 B19R2.195780 COc1ccc(c(c1)OC)SCC2COC(=O)O2 62a_100000750026_100000073702 [0,2,0,0,0,0|1,1,0]=4 5777 B19R2.195780 COc1ccc(c(n1)OC)OCC2CNC(=O)O2 34a_100000085135_100000181169 [0,2,0,0,0,0|1,0,0]=3 5778 B19R2.195780 COc1ccc(c(n1)OC)OCC2COC(=O)O2 34a_100000085135_100000073702 [0,2,0,0,0,0|2,0,0]=4 5779 B19R2.195780 COc1ccc(c(n1)OC)SCC2CNC(=O)O2 62a_100000181169_100009816055 [0,2,0,0,0,0|1,1,0]=4 5780 B19R2.195780 COc1ccc(c(n1)OC)SCC2CNC(=O)O2 62a_100009816055_100000181169 [0,2,0,0,0,0|1,1,0]=4 5781 B19R2.195780 N#Cc1ccc(c(c1)C#N)OCC2CNC(=O)O2 34a_200012183189_100000181169 [0,2,0,0,0,0|2,0,0]=4 5782 B19R2.195780 N#Cc1ccc(c(c1)C#N)OCC2CNC(=O)O2 7a_200012183189_100000181169 [0,2,0,0,0,0|2,0,0]=4 5783 B19R2.41279 COc1c(ccc(c1NCC2CNC(=O)O2)F)F 34a_100009873038_100000181169 [0,2,0,0,0,0|1,0,0]=3 5784 B19R2.41279 COc1c(ccc(c1NCC2COC(=O)O2)F)F 34a_100009873038_100000073702 [0,2,0,0,0,0|2,0,0]=4 5785 B19R2.41279 COc1c(ccc(c1OCC2CNC(=O)O2)F)Br 34a_200010167157_100000181169 [0,2,0,0,0,0|0,0,0]=2 5786 B19R2.41279 COc1c(ccc(c1OCC2CNC(=O)O2)F)F 34a_100000118042_100000181169 [0,2,0,0,0,0|0,0,0]=2 5787 B19R2.41279 COc1c(ccc(c1OCC2CNC(=O)O2)F)F 7a_100000118042_100000181169 [0,2,0,0,0,0|0,0,0]=2 5788 B19R2.41279 COc1c(ccc(c1OCC2COC(=O)O2)F)Br 34a_200010167157_100000073702 [0,2,0,0,0,0|1,0,0]=3 5789 B19R2.41279 COc1c(ccc(c1OCC2COC(=O)O2)F)F 34a_100000118042_100000073702 [0,2,0,0,0,0|1,0,0]=3 5790 B19R2.41279 COc1c(ccc(c1OC[C@@H]2CCC(=O)N2)F)F 7a_100000118042_100015189358 [0,2,0,0,0,0|2,0,0]=4 5791 B19R2.41279 COc1c(ccc(c1OC[C@H]2COC(=O)N2)F)Br 34a_200010167157_100015307671 [0,2,0,0,0,0|2,0,0]=4 5792 B19R2.41279 COc1c(ccc(c1OC[C@H]2COC(=O)N2)F)F 34a_100000118042_100015307671 [0,2,0,0,0,0|2,0,0]=4 5793 B19R2.41279 COc1c(ccc(c1OC[C@H]2COC(=O)N2)F)F 7a_100000118042_100015307671 [0,2,0,0,0,0|2,0,0]=4 5794 B19R2.41279 COc1c(ccc(c1SCC2CNC(=O)O2)F)Br 62a_100000181169_200034458476 [0,2,0,0,0,0|0,1,0]=3 5795 B19R2.41279 COc1c(ccc(c1SCC2CNC(=O)O2)F)Br 62a_200034458476_100000181169 [0,2,0,0,0,0|0,1,0]=3 5796 B19R2.41279 COc1c(ccc(c1SCC2CNC(=O)O2)F)F 62a_100000181169_100010254772 [0,2,0,0,0,0|0,1,0]=3 5797 B19R2.41279 COc1c(ccc(c1SCC2CNC(=O)O2)F)F 62a_100010254772_100000181169 [0,2,0,0,0,0|0,1,0]=3 5798 B19R2.41279 COc1c(ccc(c1SCC2CNC(=O)O2)F)N 62a_100000181169_102516457224 [0,2,0,0,0,0|0,1,0]=3 5799 B19R2.41279 COc1c(ccc(c1SCC2CNC(=O)O2)F)N 62a_102516457224_100000181169 [0,2,0,0,0,0|0,1,0]=3 5800 B19R2.41279 COc1c(ccc(c1SCC2COC(=O)O2)F)Br 62a_100000073702_200034458476 [0,2,0,0,0,0|1,1,0]=4 5801 B19R2.41279 COc1c(ccc(c1SCC2COC(=O)O2)F)Br 62a_200034458476_100000073702 [0,2,0,0,0,0|1,1,0]=4 5802 B19R2.41279 COc1c(ccc(c1SCC2COC(=O)O2)F)F 62a_100000073702_100010254772 [0,2,0,0,0,0|1,1,0]=4 5803 B19R2.41279 COc1c(ccc(c1SCC2COC(=O)O2)F)F 62a_100010254772_100000073702 [0,2,0,0,0,0|1,1,0]=4 5804 B19R2.41279 COc1c(ccc(c1SCC2COC(=O)O2)F)N 62a_100000073702_102516457224 [0,2,0,0,0,0|1,1,0]=4 5805 B19R2.41279 COc1c(ccc(c1SCC2COC(=O)O2)F)N 62a_102516457224_100000073702 [0,2,0,0,0,0|1,1,0]=4 5806 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)Br 34a_100010174959_100000181169 [0,2,0,0,0,0|1,0,0]=3 5807 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)Br 7a_100010174959_100000181169 [0,2,0,0,0,0|1,0,0]=3 5808 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)C 34a_100009860897_100000181169 [0,2,0,0,0,0|1,0,0]=3 5809 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)C 7a_100009860897_100000181169 [0,2,0,0,0,0|1,0,0]=3 5810 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)Cl 34a_100000730630_100000181169 [0,2,0,0,0,0|1,0,0]=3 5811 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)Cl 7a_100000730630_100000181169 [0,2,0,0,0,0|1,0,0]=3 5812 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)F 34a_100011216272_100000181169 [0,2,0,0,0,0|1,0,0]=3 5813 B19R2.45061 CC(=O)c1c(cccc1OCC2CNC(=O)O2)F 7a_100011216272_100000181169 [0,2,0,0,0,0|1,0,0]=3 5814 B19R2.45061 CC(=O)c1c(cccc1OCC2COC(=O)O2)Br 34a_100010174959_100000073702 [0,2,0,0,0,0|2,0,0]=4 5815 B19R2.45061 CC(=O)c1c(cccc1OCC2COC(=O)O2)C 34a_100009860897_100000073702 [0,2,0,0,0,0|2,0,0]=4 5816 B19R2.45061 CC(=O)c1c(cccc1OCC2COC(=O)O2)Cl 34a_100000730630_100000073702 [0,2,0,0,0,0|2,0,0]=4 5817 B19R2.45061 CC(=O)c1c(cccc1OCC2COC(=O)O2)F 34a_100011216272_100000073702 [0,2,0,0,0,0|2,0,0]=4 5818 B19R2.45061 CC(=O)c1c(cccc1SCC2CNC(=O)O2)F 62a_100012351873_100000181169 [0,2,0,0,0,0|1,1,0]=4 5819 B19R2.45061 CC(O)c1c(cccc1SCC2CNC(=O)O2)F 62a_100000181169_100013085324 [0,2,0,0,0,0|1,1,0]=4 5820 B19R2.45061 CC(O)c1c(cccc1SCC2CNC(=O)O2)F 62a_100013085324_100000181169 [0,2,0,0,0,0|1,1,0]=4 5821 B19R2.45061 Cc1cccc(c1[N+](=O)[O-])OCC2CNC(=O)O2 34a_100000740142_100000181169 [0,2,0,0,0,0|2,0,0]=4 5822 B19R2.45061 Cc1cccc(c1[N+](=O)[O-])OCC2CNC(=O)O2 7a_100000740142_100000181169 [0,2,0,0,0,0|2,0,0]=4 5823 B19R2.45061 NC(=O)c1c(cccc1OCC2CNC(=O)O2)F 34a_100000701607_100000181169 [0,2,0,0,0,0|2,0,0]=4 5824 B19R2.45061 NC(=O)c1c(cccc1OCC2CNC(=O)O2)F 7a_100000701607_100000181169 [0,2,0,0,0,0|2,0,0]=4 5825 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])Br 34a_100011934925_100000181169 [0,2,0,0,0,0|2,0,0]=4 5826 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])Br 7a_100011934925_100000181169 [0,2,0,0,0,0|2,0,0]=4 5827 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])Cl 34a_100011999376_100000181169 [0,2,0,0,0,0|2,0,0]=4 5828 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])Cl 7a_100011999376_100000181169 [0,2,0,0,0,0|2,0,0]=4 5829 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])F 34a_100011217962_100000181169 [0,2,0,0,0,0|2,0,0]=4 5830 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])F 7a_100011217962_100000181169 [0,2,0,0,0,0|2,0,0]=4 5831 B19R2.45061 O=C1NCC(O1)COc2cccc(c2[N+](=O)[O-])I 7a_100010150324_100000181169 [0,2,0,0,0,0|2,0,0]=4 5832 B19R2.190889 COc1c(cccc1NCC2CNC(=O)O2)C#N 34a_100000128487_100000181169 [0,2,0,0,0,0|1,0,0]=3 5833 B19R2.190889 COc1c(cccc1NCC2COC(=O)O2)C#N 34a_100000128487_100000073702 [0,2,0,0,0,0|2,0,0]=4 5834 B19R2.190889 COc1c(cccc1OCC2CNC(=O)O2)C#N 34a_200009874251_100000181169 [0,2,0,0,0,0|0,0,0]=2 5835 B19R2.190889 COc1c(cccc1OCC2COC(=O)O2)C#N 34a_200009874251_100000073702 [0,2,0,0,0,0|1,0,0]=3 5836 B19R2.190889 COc1c(cccc1OC[C@H]2COC(=O)N2)C#N 34a_200009874251_100015307671 [0,2,0,0,0,0|2,0,0]=4 5837 B19R2.190889 COc1c(cccc1SCC2CNC(=O)O2)C#N 62a_100000181169_100009817008 [0,2,0,0,0,0|0,1,0]=3 5838 B19R2.190889 COc1c(cccc1SCC2CNC(=O)O2)C=O 62a_100000181169_100000692592 [0,2,0,0,0,0|0,1,0]=3 5839 B19R2.190889 COc1c(cccc1SCC2CNC(=O)O2)C=O 62a_100000692592_100000181169 [0,2,0,0,0,0|0,1,0]=3 5840 B19R2.190889 COc1c(cccc1SCC2CNC(=O)O2)CO 62a_100000181169_100000704359 [0,2,0,0,0,0|0,1,0]=3 5841 B19R2.190889 COc1c(cccc1SCC2CNC(=O)O2)CO 62a_100000704359_100000181169 [0,2,0,0,0,0|0,1,0]=3 5842 B19R2.190889 COc1c(cccc1SCC2COC(=O)O2)C#N 62a_100000073702_100009817008 [0,2,0,0,0,0|1,1,0]=4 5843 B19R2.190889 COc1c(cccc1SCC2COC(=O)O2)C=O 62a_100000073702_100000692592 [0,2,0,0,0,0|1,1,0]=4 5844 B19R2.190889 COc1c(cccc1SCC2COC(=O)O2)C=O 62a_100000692592_100000073702 [0,2,0,0,0,0|1,1,0]=4 5845 B19R2.190889 COc1c(cccc1SCC2COC(=O)O2)CO 62a_100000073702_100000704359 [0,2,0,0,0,0|1,1,0]=4 5846 B19R2.190889 COc1c(cccc1SCC2COC(=O)O2)CO 62a_100000704359_100000073702 [0,2,0,0,0,0|1,1,0]=4 5847 B19R2.190889 COc1c(ccnc1CO)SCC2CNC(=O)O2 62a_100000181169_100009869429 [0,2,0,0,0,0|1,1,0]=4 5848 B19R2.190889 COc1c(ccnc1CO)SCC2CNC(=O)O2 62a_100009869429_100000181169 [0,2,0,0,0,0|1,1,0]=4 5849 B19R2.190889 COc1c(ccnc1SCC2CNC(=O)O2)C=O 62a_100000181169_100009863717 [0,2,0,0,0,0|1,1,0]=4 5850 B19R2.190889 COc1c(ccnc1SCC2CNC(=O)O2)C=O 62a_200009814792_100000181169 [0,2,0,0,0,0|1,1,0]=4 5851 B19R2.190889 COc1c(cncc1SCC2CNC(=O)O2)C#N 62a_100000181169_100016142170 [0,2,0,0,0,0|1,1,0]=4 5852 B19R2.190889 COc1c(cncc1SCC2CNC(=O)O2)C=O 62a_100000181169_100015834815 [0,2,0,0,0,0|1,1,0]=4 5853 B19R2.190889 COc1c(cncc1SCC2CNC(=O)O2)C=O 62a_100015834815_100000181169 [0,2,0,0,0,0|1,1,0]=4 5854 B19R2.190889 COc1cccc(c1OC)NCC2CNC(=O)O2 34a_100011217386_100000181169 [0,2,0,0,0,0|1,0,0]=3 5855 B19R2.190889 COc1cccc(c1OC)NCC2COC(=O)O2 34a_100011217386_100000073702 [0,2,0,0,0,0|2,0,0]=4 5856 B19R2.190889 COc1cccc(c1OC)OCC2CNC(=O)O2 34a_100000032319_100000181169 [0,2,0,0,0,0|0,0,0]=2 5857 B19R2.190889 COc1cccc(c1OC)OCC2COC(=O)O2 34a_100000032319_100000073702 [0,2,0,0,0,0|1,0,0]=3 5858 B19R2.190889 COc1cccc(c1OC)OC[C@H]2COC(=O)N2 34a_100000032319_100015307671 [0,2,0,0,0,0|2,0,0]=4 5859 B19R2.190889 COc1cccc(c1OC)SCC2CNC(=O)O2 62a_100000181169_100010163134 [0,2,0,0,0,0|0,1,0]=3 5860 B19R2.190889 COc1cccc(c1OC)SCC2COC(=O)O2 62a_100000073702_100010163134 [0,2,0,0,0,0|1,1,0]=4 5861 B19R2.44946 CC(C)(C)c1ccccc1NCC2CNC(=O)O2 2230a_100000211005_100000181169 [0,2,0,0,0,0|2,0,0]=4 5862 B19R2.44946 CC(C)(C)c1ccccc1NCC2CNC(=O)O2 34a_100000211005_100000181169 [0,2,0,0,0,0|2,0,0]=4 5863 B19R2.44946 CC(C)(C)c1ccccc1NCC2CNC(=O)O2 7a_100000211005_100000181169 [0,2,0,0,0,0|2,0,0]=4 5864 B19R2.44946 CC(C)(C)c1ccccc1OCC2CNC(=O)O2 34a_100000211619_100000181169 [0,2,0,0,0,0|1,0,0]=3 5865 B19R2.44946 CC(C)(C)c1ccccc1OCC2CNC(=O)O2 7a_100000211619_100000181169 [0,2,0,0,0,0|1,0,0]=3 5866 B19R2.44946 CC(C)(C)c1ccccc1OCC2COC(=O)O2 34a_100000211619_100000073702 [0,2,0,0,0,0|2,0,0]=4 5867 B19R2.44946 CC(C)(C)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100012339570 [0,2,0,0,0,0|1,1,0]=4 5868 B19R2.44946 CC(C)(C)c1ccccc1SCC2CNC(=O)O2 62a_100012339570_100000181169 [0,2,0,0,0,0|1,1,0]=4 5869 B19R2.44946 CC(C)(N)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100020606264 [0,2,0,0,0,0|1,1,0]=4 5870 B19R2.44946 CC(C)(N)c1ccccc1SCC2CNC(=O)O2 62a_100020606264_100000181169 [0,2,0,0,0,0|1,1,0]=4 5871 B19R2.44946 CC(C)(O)c1ccccc1NCC2CNC(=O)O2 34a_100000081495_100000181169 [0,2,0,0,0,0|2,0,0]=4 5872 B19R2.44946 CC(C)(O)c1ccccc1NCC2CNC(=O)O2 7a_100000081495_100000181169 [0,2,0,0,0,0|2,0,0]=4 5873 B19R2.44946 CC(C)(O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100011346021 [0,2,0,0,0,0|1,1,0]=4 5874 B19R2.44946 CC(C)(O)c1ccccc1SCC2CNC(=O)O2 62a_100011346021_100000181169 [0,2,0,0,0,0|1,1,0]=4 5875 B19R2.44946 CC(F)(F)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100010220483 [0,2,0,0,0,0|1,1,0]=4 5876 B19R2.44946 CC(F)(F)c1ccccc1SCC2CNC(=O)O2 62a_100010220483_100000181169 [0,2,0,0,0,0|1,1,0]=4 5877 B19R2.44946 CP(=O)(C)c1ccccc1NCC2CNC(=O)O2 2230a_100010749338_100000181169 [0,2,0,0,0,0|2,0,0]=4 5878 B19R2.44946 CP(=O)(C)c1ccccc1NCC2CNC(=O)O2 34a_100010749338_100000181169 [0,2,0,0,0,0|2,0,0]=4 5879 B19R2.44946 CS(=O)(=O)c1ccccc1NCC2CNC(=O)O2 34a_100000241000_100000181169 [0,2,0,0,0,0|1,1,0]=4 5880 B19R2.44946 CS(=O)(=O)c1ccccc1NCC2CNC(=O)O2 7a_100000241000_100000181169 [0,2,0,0,0,0|1,1,0]=4 5881 B19R2.44946 CS(=O)(=O)c1ccccc1OCC2CNC(=O)O2 34a_100000054562_100000181169 [0,2,0,0,0,0|0,1,0]=3 5882 B19R2.44946 CS(=O)(=O)c1ccccc1OCC2CNC(=O)O2 7a_100000054562_100000181169 [0,2,0,0,0,0|0,1,0]=3 5883 B19R2.44946 CS(=O)(=O)c1ccccc1OCC2COC(=O)O2 34a_100000054562_100000073702 [0,2,0,0,0,0|1,1,0]=4 5884 B19R2.44946 CS(=O)(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000181169_100000751929 [0,2,0,0,0,0|0,2,0]=4 5885 B19R2.44946 CS(=O)(=O)c1ccccc1SCC2CNC(=O)O2 62a_100000751929_100000181169 [0,2,0,0,0,0|0,2,0]=4 5886 B19R2.44946 C[Si](C)(C)c1ccccc1OCC2CNC(=O)O2 7a_100000095915_100000181169 [0,2,0,0,0,0|1,0,0]=3 5887 B19R2.44946 O=C1NCC(O1)COc2ccccc2C(F)(F)F 34a_100000236976_100000181169 [0,2,0,0,0,0|2,0,0]=4 5888 B19R2.44946 O=C1NCC(O1)COc2ccccc2C(F)(F)F 7a_100000236976_100000181169 [0,2,0,0,0,0|2,0,0]=4 5889 B19R2.465956 CC(=O)c1cccc(c1OCC2CNC(=O)O2)C 34a_100009847209_100000181169 [0,2,0,0,0,0|1,0,0]=3 5890 B19R2.465956 CC(=O)c1cccc(c1OCC2CNC(=O)O2)C 7a_100009847209_100000181169 [0,2,0,0,0,0|1,0,0]=3 5891 B19R2.465956 CC(=O)c1cccc(c1OCC2CNC(=O)O2)Cl 34a_100000043392_100000181169 [0,2,0,0,0,0|1,0,0]=3 5892 B19R2.465956 CC(=O)c1cccc(c1OCC2CNC(=O)O2)Cl 7a_100000043392_100000181169 [0,2,0,0,0,0|1,0,0]=3 5893 B19R2.465956 CC(=O)c1cccc(c1OCC2CNC(=O)O2)F 34a_100011246037_100000181169 [0,2,0,0,0,0|1,0,0]=3 5894 B19R2.465956 CC(=O)c1cccc(c1OCC2CNC(=O)O2)F 7a_100011246037_100000181169 [0,2,0,0,0,0|1,0,0]=3 5895 B19R2.465956 CC(=O)c1cccc(c1OCC2COC(=O)O2)C 34a_100009847209_100000073702 [0,2,0,0,0,0|2,0,0]=4 5896 B19R2.465956 CC(=O)c1cccc(c1OCC2COC(=O)O2)Cl 34a_100000043392_100000073702 [0,2,0,0,0,0|2,0,0]=4 5897 B19R2.465956 CC(=O)c1cccc(c1OCC2COC(=O)O2)F 34a_100011246037_100000073702 [0,2,0,0,0,0|2,0,0]=4 5898 B19R2.465956 CC(=O)c1cccc(c1SCC2CNC(=O)O2)F 62a_100000181169_100012362612 [0,2,0,0,0,0|1,1,0]=4 5899 B19R2.465956 CC(=O)c1cccc(c1SCC2CNC(=O)O2)F 62a_100012362612_100000181169 [0,2,0,0,0,0|1,1,0]=4 5900 B19R2.465956 CC(C)c1cccc(c1NCC2CNC(=O)O2)Br 2230a_100010571509_100000181169 [0,2,0,0,0,0|2,0,0]=4 5901 B19R2.465956 CC(C)c1cccc(c1NCC2CNC(=O)O2)Br 34a_100010571509_100000181169 [0,2,0,0,0,0|2,0,0]=4 5902 B19R2.465956 CC(C)c1cccc(c1NCC2CNC(=O)O2)Br 7a_100010571509_100000181169 [0,2,0,0,0,0|2,0,0]=4 5903 B19R2.465956 CC(C)c1cccc(c1NCC2CNC(=O)O2)Cl 2230a_200009958663_100000181169 [0,2,0,0,0,0|2,0,0]=4 5904 B19R2.465956 CC(C)c1cccc(c1NCC2CNC(=O)O2)Cl 34a_200009958663_100000181169 [0,2,0,0,0,0|2,0,0]=4 5905 B19R2.465956 CC(C)c1cccc(c1NCC2CNC(=O)O2)Cl 7a_200009958663_100000181169 [0,2,0,0,0,0|2,0,0]=4 5906 B19R2.465956 Cc1cccc(c1NCC2CNC(=O)O2)C(C)C 2230a_100138557336_100000181169 [0,2,0,0,0,0|2,0,0]=4 5907 B19R2.465956 Cc1cccc(c1NCC2CNC(=O)O2)C(C)C 34a_100138557336_100000181169 [0,2,0,0,0,0|2,0,0]=4 5908 B19R2.465956 Cc1cccc(c1NCC2CNC(=O)O2)C(C)C 7a_100138557336_100000181169 [0,2,0,0,0,0|2,0,0]=4 5909 B19R2.465956 Cc1cccc(c1OCC2CNC(=O)O2)[N+](=O)[O-] 34a_100000763257_100000181169 [0,2,0,0,0,0|2,0,0]=4 5910 B19R2.465956 Cc1cccc(c1OCC2CNC(=O)O2)[N+](=O)[O-] 7a_100000763257_100000181169 [0,2,0,0,0,0|2,0,0]=4 5911 B19R2.465956 NC(=O)c1cccc(c1OCC2CNC(=O)O2)Cl 34a_100009868166_100000181169 [0,2,0,0,0,0|2,0,0]=4 5912 B19R2.465956 NC(=O)c1cccc(c1OCC2CNC(=O)O2)Cl 7a_100009868166_100000181169 [0,2,0,0,0,0|2,0,0]=4 5913 B19R2.465956 NC(=O)c1cccc(c1OCC2CNC(=O)O2)F 34a_100009886295_100000181169 [0,2,0,0,0,0|2,0,0]=4 5914 B19R2.465956 NC(=O)c1cccc(c1OCC2CNC(=O)O2)F 7a_100009886295_100000181169 [0,2,0,0,0,0|2,0,0]=4 5915 B19R2.465956 O=C1NCC(O1)COc2c(cccc2[N+](=O)[O-])Br 34a_100000689966_100000181169 [0,2,0,0,0,0|2,0,0]=4 5916 B19R2.465956 O=C1NCC(O1)COc2c(cccc2[N+](=O)[O-])Cl 34a_100000686934_100000181169 [0,2,0,0,0,0|2,0,0]=4 5917 B19R2.465956 O=C1NCC(O1)COc2c(cccc2[N+](=O)[O-])Cl 7a_100000686934_100000181169 [0,2,0,0,0,0|2,0,0]=4 5918 B19R2.465956 O=C1NCC(O1)COc2c(cccc2[N+](=O)[O-])F 34a_100000690172_100000181169 [0,2,0,0,0,0|2,0,0]=4 5919 B19R2.191538 CCc1cccc(c1NCC2CNC(=O)O2)CC 2230a_100000211307_100000181169 [0,2,0,0,0,0|2,0,0]=4 5920 B19R2.191538 CCc1cccc(c1NCC2CNC(=O)O2)CC 34a_100000211307_100000181169 [0,2,0,0,0,0|2,0,0]=4 5921 B19R2.191538 CCc1cccc(c1NCC2CNC(=O)O2)CC 7a_100000211307_100000181169 [0,2,0,0,0,0|2,0,0]=4 5922 B19R2.191538 CCc1cccc(c1OCC2CNC(=O)O2)CC 34a_100000078057_100000181169 [0,2,0,0,0,0|1,0,0]=3 5923 B19R2.191538 CCc1cccc(c1OCC2CNC(=O)O2)CC 7a_100000078057_100000181169 [0,2,0,0,0,0|1,0,0]=3 5924 B19R2.191538 CCc1cccc(c1OCC2COC(=O)O2)CC 34a_100000078057_100000073702 [0,2,0,0,0,0|2,0,0]=4 5925 B19R2.191538 CCc1cccc(c1SCC2CNC(=O)O2)CC 62a_100000181169_100010212195 [0,2,0,0,0,0|1,1,0]=4 5926 B19R2.191538 CCc1cccc(c1SCC2CNC(=O)O2)CC 62a_100010212195_100000181169 [0,2,0,0,0,0|1,1,0]=4 5927 B19R2.191538 COc1cccc(c1NCC2CNC(=O)O2)C#N 2230a_100000722693_100000181169 [0,2,0,0,0,0|1,0,0]=3 5928 B19R2.191538 COc1cccc(c1NCC2CNC(=O)O2)CO 34a_100011999522_100000181169 [0,2,0,0,0,0|1,0,0]=3 5929 B19R2.191538 COc1cccc(c1NCC2CNC(=O)O2)OC 2230a_100011218430_100000181169 [0,2,0,0,0,0|1,0,0]=3 5930 B19R2.191538 COc1cccc(c1NCC2CNC(=O)O2)OC 34a_100011218430_100000181169 [0,2,0,0,0,0|1,0,0]=3 5931 B19R2.191538 COc1cccc(c1NCC2CNC(=O)O2)SC 2230a_200012283368_100000181169 [0,2,0,0,0,0|1,0,0]=3 5932 B19R2.191538 COc1cccc(c1NCC2CNC(=O)O2)SC 34a_200012283368_100000181169 [0,2,0,0,0,0|1,0,0]=3 5933 B19R2.191538 COc1cccc(c1NCC2COC(=O)O2)CO 34a_100011999522_100000073702 [0,2,0,0,0,0|2,0,0]=4 5934 B19R2.191538 COc1cccc(c1NCC2COC(=O)O2)OC 34a_100011218430_100000073702 [0,2,0,0,0,0|2,0,0]=4 5935 B19R2.191538 COc1cccc(c1NCC2COC(=O)O2)SC 34a_200012283368_100000073702 [0,2,0,0,0,0|2,0,0]=4 5936 B19R2.191538 COc1cccc(c1OCC2CNC(=O)O2)C#N 34a_100011934230_100000181169 [0,2,0,0,0,0|0,0,0]=2 5937 B19R2.191538 COc1cccc(c1OCC2CNC(=O)O2)CO 34a_100011218668_100000181169 [0,2,0,0,0,0|0,0,0]=2 5938 B19R2.191538 COc1cccc(c1OCC2CNC(=O)O2)OC 34a_100000211025_100000181169 [0,2,0,0,0,0|0,0,0]=2 5939 B19R2.191538 COc1cccc(c1OCC2COC(=O)O2)C#N 34a_100011934230_100000073702 [0,2,0,0,0,0|1,0,0]=3 5940 B19R2.191538 COc1cccc(c1OCC2COC(=O)O2)CO 34a_100011218668_100000073702 [0,2,0,0,0,0|1,0,0]=3 5941 B19R2.191538 COc1cccc(c1OCC2COC(=O)O2)OC 34a_100000211025_100000073702 [0,2,0,0,0,0|1,0,0]=3 5942 B19R2.191538 COc1cccc(c1OC[C@H]2COC(=O)N2)C#N 34a_100011934230_100015307671 [0,2,0,0,0,0|2,0,0]=4 5943 B19R2.191538 COc1cccc(c1OC[C@H]2COC(=O)N2)CO 34a_100011218668_100015307671 [0,2,0,0,0,0|2,0,0]=4 5944 B19R2.191538 COc1cccc(c1OC[C@H]2COC(=O)N2)OC 34a_100000211025_100015307671 [0,2,0,0,0,0|2,0,0]=4 5945 B19R2.191538 COc1cccc(c1SCC2CNC(=O)O2)C=O 62a_100000181169_100010209554 [0,2,0,0,0,0|0,1,0]=3 5946 B19R2.191538 COc1cccc(c1SCC2CNC(=O)O2)C=O 62a_100010209554_100000181169 [0,2,0,0,0,0|0,1,0]=3 5947 B19R2.191538 COc1cccc(c1SCC2CNC(=O)O2)CO 62a_100000181169_100010236476 [0,2,0,0,0,0|0,1,0]=3 5948 B19R2.191538 COc1cccc(c1SCC2CNC(=O)O2)CO 62a_100010236476_100000181169 [0,2,0,0,0,0|0,1,0]=3 5949 B19R2.191538 COc1cccc(c1SCC2CNC(=O)O2)OC 62a_100000181169_100000690108 [0,2,0,0,0,0|0,1,0]=3 5950 B19R2.191538 COc1cccc(c1SCC2CNC(=O)O2)OC 62a_100000690108_100000181169 [0,2,0,0,0,0|0,1,0]=3 5951 B19R2.191538 COc1cccc(c1SCC2COC(=O)O2)C=O 62a_100000073702_100010209554 [0,2,0,0,0,0|1,1,0]=4 5952 B19R2.191538 COc1cccc(c1SCC2COC(=O)O2)C=O 62a_100010209554_100000073702 [0,2,0,0,0,0|1,1,0]=4 5953 B19R2.191538 COc1cccc(c1SCC2COC(=O)O2)CO 62a_100000073702_100010236476 [0,2,0,0,0,0|1,1,0]=4 5954 B19R2.191538 COc1cccc(c1SCC2COC(=O)O2)CO 62a_100010236476_100000073702 [0,2,0,0,0,0|1,1,0]=4 5955 B19R2.191538 COc1cccc(c1SCC2COC(=O)O2)OC 62a_100000073702_100000690108 [0,2,0,0,0,0|1,1,0]=4 5956 B19R2.191538 COc1cccc(c1SCC2COC(=O)O2)OC 62a_100000690108_100000073702 [0,2,0,0,0,0|1,1,0]=4 5957 B19R2.191538 COc1ccnc(c1SCC2CNC(=O)O2)OC 62a_100000181169_100010114374 [0,2,0,0,0,0|1,1,0]=4 5958 B19R2.191538 COc1ccnc(c1SCC2CNC(=O)O2)OC 62a_100010114374_100000181169 [0,2,0,0,0,0|1,1,0]=4 5959 B19R2.191538 COc1cncc(c1SCC2CNC(=O)O2)OC 62a_100000181169_200010191558 [0,2,0,0,0,0|1,1,0]=4 5960 B19R2.191538 COc1cncc(c1SCC2CNC(=O)O2)OC 62a_200010191558_100000181169 [0,2,0,0,0,0|1,1,0]=4 5961 B19R2.191538 COc1nccc(c1SCC2CNC(=O)O2)C#N 62a_100000181169_200000050020 [0,2,0,0,0,0|1,1,0]=4 5962 B17R2.18967 CC(=O)NC(C)C1COc2ccccc2O1 11a_100015185755_100015343762 [0,0,1,1,0,0|2,0,0]=4 5963 B17R2.18967 CC(=O)NC(C)C1COc2ccccc2O1 1626a_100015185755_100015343762 [0,0,1,1,0,0|2,0,0]=4 5964 B17R2.18967 CC(=O)NC(C)C1COc2ccccc2O1 240690a_100015185755_100015343762 [0,0,1,1,0,0|2,0,0]=4 5965 B17R2.63310 COc1cccc2c1OCC(C2)NC(=O)C 11a_100000059700_100015343762 [0,0,1,1,0,0|2,0,0]=4 5966 B17R2.63310 COc1cccc2c1OCC(C2)NC(=O)C 1626a_100000059700_100015343762 [0,0,1,1,0,0|2,0,0]=4 5967 B17R2.63310 COc1cccc2c1OCC(C2)NC(=O)C 240690a_100000059700_100015343762 [0,0,1,1,0,0|2,0,0]=4 5968 B17R2.63310 COc1cccc2c1OCC(C2)NC(=O)C 527a_100000059700_100103153847 [0,0,1,1,0,0|2,0,0]=4 5969 B17R2.5669 O=C(O)CNCC1COc2ccccc2O1 269956a_100016091260_100011215957 [0,0,1,1,0,0|2,0,0]=4 5970 B17R2.8834 COc1ccccc1C2CCCN2C(=O)C 11a_200000751146_100015343762 [0,0,1,1,0,0|2,0,0]=4 5971 B17R2.8834 COc1ccccc1C2CCCN2C(=O)C 1626a_200000751146_100015343762 [0,0,1,1,0,0|2,0,0]=4 5972 B17R2.8834 COc1ccccc1C2CCCN2C(=O)C 240690a_200000751146_100015343762 [0,0,1,1,0,0|2,0,0]=4 5973 B17R2.8834 COc1ccccc1C2CCCN2C(=O)C 527a_200000751146_100103153847 [0,0,1,1,0,0|2,0,0]=4 5974 B17R2.18638 Cc1ccccc1COCC2CNC(=O)O2 34a_100000698903_100000181169 [0,0,1,1,0,0|1,0,1]=4 5975 B17R2.18638 Cc1ccccc1COCC2CNC(=O)O2 34a_100011315639_100000211839 [0,0,1,1,0,0|1,0,1]=4 5976 B17R2.18638 Cc1ccccc1COCC2CNC(=O)O2 7a_100000698903_100000181169 [0,0,1,1,0,0|1,0,1]=4 5977 B17R2.18642 O=C1NCC(O1)COc2cccccc2=O 34a_100000036025_100000181169 [0,0,1,1,0,0|2,0,0]=4 5978 B17R2.18642 O=C1NCC(O1)COc2cccccc2=O 7a_100000036025_100000181169 [0,0,1,1,0,0|2,0,0]=4 5979 B17R2.556 CCC(=O)NCC1COc2ccccc2O1 11a_100000682559_100000210414 [0,0,1,1,0,0|2,0,0]=4 5980 B17R2.556 CCC(=O)NCC1COc2ccccc2O1 1626a_100000682559_100000210414 [0,0,1,1,0,0|2,0,0]=4 5981 B17R2.556 CCC(=O)NCC1COc2ccccc2O1 240690a_100000682559_100000210414 [0,0,1,1,0,0|2,0,0]=4 5982 B17R2.556 CCC(=O)NCC1COc2ccccc2O1 527a_100000682559_100000210414 [0,0,1,1,0,0|2,0,0]=4 5983 B17R2.556 CNC(=O)NCC1CCc2ccccc2O1 2708a_100102422350_106832991635 [0,0,1,1,0,0|2,0,0]=4 5984 B17R2.556 CNC(=O)NCC1CCc2ccccc2O1 2708a_100102657272_100102422350 [0,0,1,1,0,0|2,0,0]=4 5985 B17R2.556 CNC(=O)NCC1CCc2ccccc2O1 273464a_100102422350_100102657272 [0,0,1,1,0,0|2,0,0]=4 5986 B17R2.556 CNC(=O)NCC1CCc2ccccc2O1 273464a_100102657272_100102422350 [0,0,1,1,0,0|2,0,0]=4 5987 B17R2.556 CNC(=O)NCC1CCc2ccccc2O1 512a_100102422350_100102657272 [0,0,1,1,0,0|2,0,0]=4 5988 B17R2.556 CNC(=O)NCC1CCc2ccccc2O1 512a_106832991638_100102422350 [0,0,1,1,0,0|2,0,0]=4 5989 B17R2.556 CNC(=O)NCC1COc2ccccc2C1 2708a_100000703909_106832991635 [0,0,1,1,0,0|2,0,0]=4 5990 B17R2.556 CNC(=O)NCC1COc2ccccc2C1 2708a_100102657272_100000703909 [0,0,1,1,0,0|2,0,0]=4 5991 B17R2.556 CNC(=O)NCC1COc2ccccc2C1 273464a_100000703909_100102657272 [0,0,1,1,0,0|2,0,0]=4 5992 B17R2.556 CNC(=O)NCC1COc2ccccc2C1 273464a_100102657272_100000703909 [0,0,1,1,0,0|2,0,0]=4 5993 B17R2.556 CNC(=O)NCC1COc2ccccc2C1 512a_100000703909_100102657272 [0,0,1,1,0,0|2,0,0]=4 5994 B17R2.556 CNC(=O)NCC1COc2ccccc2C1 512a_106832991638_100000703909 [0,0,1,1,0,0|2,0,0]=4 5995 B17R2.556 CNC(=O)NCC1COc2ccccc2O1 2708a_100000682559_106832991635 [0,0,1,1,0,0|1,0,0]=3 5996 B17R2.556 CNC(=O)NCC1COc2ccccc2O1 2708a_100102657272_100000682559 [0,0,1,1,0,0|1,0,0]=3 5997 B17R2.556 CNC(=O)NCC1COc2ccccc2O1 273464a_100000682559_100102657272 [0,0,1,1,0,0|1,0,0]=3 5998 B17R2.556 CNC(=O)NCC1COc2ccccc2O1 273464a_100102657272_100000682559 [0,0,1,1,0,0|1,0,0]=3 5999 B17R2.556 CNC(=O)NCC1COc2ccccc2O1 512a_100000682559_100102657272 [0,0,1,1,0,0|1,0,0]=3 6000 B17R2.556 CNC(=O)NCC1COc2ccccc2O1 512a_106832991638_100000682559 [0,0,1,1,0,0|1,0,0]=3 6001 B17R2.63265 CNC(=O)NC1CCc2c1cccc2OC 2708a_100000687940_106832991635 [0,0,1,1,0,0|2,0,0]=4 6002 B17R2.63265 CNC(=O)NC1CCc2c1cccc2OC 2708a_100102657272_100000687940 [0,0,1,1,0,0|2,0,0]=4 6003 B17R2.63265 CNC(=O)NC1CCc2c1cccc2OC 273464a_100000687940_100102657272 [0,0,1,1,0,0|2,0,0]=4 6004 B17R2.63265 CNC(=O)NC1CCc2c1cccc2OC 273464a_100102657272_100000687940 [0,0,1,1,0,0|2,0,0]=4 6005 B17R2.63265 CNC(=O)NC1CCc2c1cccc2OC 512a_100000687940_100102657272 [0,0,1,1,0,0|2,0,0]=4 6006 B17R2.63265 CNC(=O)NC1CCc2c1cccc2OC 512a_106832991638_100000687940 [0,0,1,1,0,0|2,0,0]=4 6007 B17R2.1828 C=Cc1cccc(c1)OCC2CNC(=O)O2 34a_100011309434_100000181169 [0,0,1,1,0,0|1,0,1]=4 6008 B17R2.1828 C=Cc1cccc(c1)OCC2CNC(=O)O2 7a_100011309434_100000181169 [0,0,1,1,0,0|1,0,1]=4 6009 B17R2.18661 Cc1cc(ccc1Br)OCC2CNC(=O)O2 34a_100000690111_100000181169 [0,0,1,1,0,0|2,0,0]=4 6010 B17R2.18661 Cc1cc(ccc1Br)OCC2CNC(=O)O2 7a_100000690111_100000181169 [0,0,1,1,0,0|2,0,0]=4 6011 B17R2.18661 Cc1cc(ccc1Cl)OCC2CNC(=O)O2 34a_100000211092_100000181169 [0,0,1,1,0,0|2,0,0]=4 6012 B17R2.18661 Cc1cc(ccc1Cl)OCC2CNC(=O)O2 7a_100000211092_100000181169 [0,0,1,1,0,0|2,0,0]=4 6013 B17R2.18661 Cc1cc(ccc1F)OCC2CNC(=O)O2 34a_100000751312_100000181169 [0,0,1,1,0,0|2,0,0]=4 6014 B17R2.18661 Cc1cc(ccc1F)OCC2CNC(=O)O2 7a_100000751312_100000181169 [0,0,1,1,0,0|2,0,0]=4 6015 B17R2.18661 Cc1cc(ccc1I)OCC2CNC(=O)O2 34a_100000729255_100000181169 [0,0,1,1,0,0|2,0,0]=4 6016 B17R2.18661 Cc1cc(ccc1I)OCC2CNC(=O)O2 7a_100000729255_100000181169 [0,0,1,1,0,0|2,0,0]=4 6017 B17R2.18661 Cc1cc(ccc1N)OCC2CNC(=O)O2 34a_100000756630_100000181169 [0,0,1,1,0,0|2,0,0]=4 6018 B17R2.18661 Cc1cc(ccc1N)OCC2CNC(=O)O2 7a_100000756630_100000181169 [0,0,1,1,0,0|2,0,0]=4 6019 B17R2.18661 Cc1ccc(cc1C)OCC2CNC(=O)O2 34a_100000210932_100000181169 [0,0,1,1,0,0|1,0,1]=4 6020 B17R2.18661 Cc1ccc(cc1C)OCC2CNC(=O)O2 7a_100000210932_100000181169 [0,0,1,1,0,0|1,0,1]=4 6021 B19R3.3759 O=C1NCC(O1)CNC2COc3c2cccc3 2230a_100000747519_100000181169 [0,0,0,1,0,1|1,0,0]=3 6022 B19R3.3759 O=C1NCC(O1)CN[C@H]2CCc3c2cccc3 2230a_100016989578_100000181169 [0,0,0,1,0,1|2,0,0]=4 6023 B19R3.3759 O=C1NCC(O1)CN[C@H]2CCc3c2cccc3 34a_100016989578_100000181169 [0,0,0,1,0,1|2,0,0]=4 6024 B19R3.3759 O=C1NCC(O1)COC2CCc3c2cccc3 34a_100000212247_100000181169 [0,0,0,1,0,1|1,0,0]=3 6025 B19R3.3759 O=C1NCC(O1)COC2CCc3c2cccc3 7a_100000212247_100000181169 [0,0,0,1,0,1|1,0,0]=3 6026 B19R3.3759 O=C1NCC(O1)COc2csc3c2cccc3 34a_100000077758_100000181169 [0,0,0,1,0,1|0,1,1]=4 6027 B19R3.3759 O=C1NCC(O1)COc2csc3c2cccc3 7a_100000077758_100000181169 [0,0,0,1,0,1|0,1,1]=4 6028 B19R3.3759 O=C1NCC(O1)CSC2CCc3c2cccc3 62a_100000181169_200000721974 [0,0,0,1,0,1|1,1,0]=4 6029 B19R3.3759 O=C1NCC(O1)CSc2coc3c2cccc3 62a_100000181169_100009812202 [0,0,0,1,0,1|0,1,1]=4 6030 B19R3.3759 O=C1NCC(O1)CSc2noc3c2cccc3 62a_100000181169_200000703156 [0,0,0,1,0,1|1,1,0]=4 6031 B19R3.3759 O=C1NCC(O1)CSc2noc3c2cccc3 62a_200000703156_100000181169 [0,0,0,1,0,1|1,1,0]=4 6032 B19R3.3759 O=C1OCC(O1)COC2CCc3c2cccc3 34a_100000212247_100000073702 [0,0,0,1,0,1|2,0,0]=4 6033 B19R3.50998 O=C1CN(CN1)CC2COc3ccccc3O2 2230a_200000708111_100011215957 [0,0,0,1,0,1|2,0,0]=4 6034 B19R3.50998 O=C1NCC(O1)CN2CCc3ccccc3C2 2230a_100000188457_100000181169 [0,0,0,1,0,1|2,0,0]=4 6035 B19R3.50998 O=C1NCC(O1)CN2CCc3ccccc3C2 269982a_100000188457_100000181169 [0,0,0,1,0,1|2,0,0]=4 6036 B19R3.50998 O=C1NCC(O1)CN2CCc3ccccc3C2 34a_100000188457_100000181169 [0,0,0,1,0,1|2,0,0]=4 6037 B19R3.51001 O=C1NCC(O1)CNc2ccccc2C3CC3 34a_100011236190_100000181169 [0,1,0,1,0,0|2,0,0]=4 6038 B19R3.51001 O=C1NCC(O1)CSc2ccccc2C3CC3 62a_100000181169_100009819954 [0,1,0,1,0,0|1,1,0]=4 6039 B19R3.51001 O=C1NCC(O1)CSc2ccccc2C3CC3 62a_100009819954_100000181169 [0,1,0,1,0,0|1,1,0]=4 6040 B19R3.51160 O=C1CC[C@H](N1)COc2cccc3c2OCO3 7a_100000046630_100015189358 [0,1,0,1,0,0|2,0,0]=4 6041 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2CCC3 2230a_100000043548_100000181169 [0,1,0,1,0,0|2,0,0]=4 6042 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2CCC3 34a_100000043548_100000181169 [0,1,0,1,0,0|2,0,0]=4 6043 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2CCO3 2230a_100000084147_100000181169 [0,1,0,1,0,0|2,0,0]=4 6044 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2CCO3 34a_100000084147_100000181169 [0,1,0,1,0,0|2,0,0]=4 6045 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2COC3 2230a_100000125316_100000181169 [0,1,0,1,0,0|1,0,0]=3 6046 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2COC3 34a_100000125316_100000181169 [0,1,0,1,0,0|1,0,0]=3 6047 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2OCC3 2230a_100000102157_100000181169 [0,1,0,1,0,0|1,0,0]=3 6048 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2OCC3 34a_100000102157_100000181169 [0,1,0,1,0,0|1,0,0]=3 6049 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2OCO3 2230a_100000699912_100000181169 [0,1,0,1,0,0|1,0,0]=3 6050 B19R3.51160 O=C1NCC(O1)CNc2cccc3c2OCO3 34a_100000699912_100000181169 [0,1,0,1,0,0|1,0,0]=3 6051 B19R3.51160 O=C1NCC(O1)COc2cccc3c2CCC3 34a_100000074356_100000181169 [0,1,0,1,0,0|1,0,0]=3 6052 B19R3.51160 O=C1NCC(O1)COc2cccc3c2CCC3 7a_100000074356_100000181169 [0,1,0,1,0,0|1,0,0]=3 6053 B19R3.51160 O=C1NCC(O1)COc2cccc3c2CCN3 34a_100000703684_100000181169 [0,1,0,1,0,0|1,0,0]=3 6054 B19R3.51160 O=C1NCC(O1)COc2cccc3c2CCO3 34a_100000090053_100000181169 [0,1,0,1,0,0|1,0,0]=3 6055 B19R3.51160 O=C1NCC(O1)COc2cccc3c2CCO3 7a_100000090053_100000181169 [0,1,0,1,0,0|1,0,0]=3 6056 B19R3.51160 O=C1NCC(O1)COc2cccc3c2CNC3 34a_100015191671_100000181169 [0,1,0,1,0,0|1,0,0]=3 6057 B19R3.51160 O=C1NCC(O1)COc2cccc3c2OCO3 34a_100000046630_100000181169 [0,1,0,1,0,0|0,0,0]=2 6058 B19R3.51160 O=C1NCC(O1)COc2cccc3c2OCO3 7a_100000046630_100000181169 [0,1,0,1,0,0|0,0,0]=2 6059 B19R3.51160 O=C1NCC(O1)COc2cccc3c2cc[nH]3 34a_100000763377_100000181169 [0,1,0,1,0,0|1,0,1]=4 6060 B19R3.51160 O=C1NCC(O1)COc2cccc3c2ccs3 34a_100000077759_100000181169 [0,1,0,1,0,0|1,0,1]=4 6061 B19R3.51160 O=C1NCC(O1)COc2cccc3c2ccs3 7a_100000077759_100000181169 [0,1,0,1,0,0|1,0,1]=4 6062 B19R3.51160 O=C1NCC(O1)COc2cccc3c2ncs3 34a_100000101385_100000181169 [0,1,0,1,0,0|1,0,1]=4 6063 B19R3.51160 O=C1NCC(O1)COc2cccc3c2ncs3 7a_100000101385_100000181169 [0,1,0,1,0,0|1,0,1]=4 6064 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CCC3 62a_100000181169_100010343934 [0,1,0,1,0,0|1,1,0]=4 6065 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CCC3 62a_100010343934_100000181169 [0,1,0,1,0,0|1,1,0]=4 6066 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CCN3 62a_100000181169_100009817896 [0,1,0,1,0,0|1,1,0]=4 6067 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CCN3 62a_100009817896_100000181169 [0,1,0,1,0,0|1,1,0]=4 6068 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CCO3 62a_100000181169_100009819624 [0,1,0,1,0,0|1,1,0]=4 6069 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CCO3 62a_100009819624_100000181169 [0,1,0,1,0,0|1,1,0]=4 6070 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CNC3 62a_100000181169_100000703859 [0,1,0,1,0,0|1,1,0]=4 6071 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2CNC3 62a_100000703859_100000181169 [0,1,0,1,0,0|1,1,0]=4 6072 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2COC3 62a_100000181169_100010384907 [0,1,0,1,0,0|0,1,0]=3 6073 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2COC3 62a_100010384907_100000181169 [0,1,0,1,0,0|0,1,0]=3 6074 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2NCC3 62a_100000181169_100016995435 [0,1,0,1,0,0|1,1,0]=4 6075 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2NCC3 62a_100016995435_100000181169 [0,1,0,1,0,0|1,1,0]=4 6076 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2OCC3 62a_100000181169_100009818991 [0,1,0,1,0,0|0,1,0]=3 6077 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2OCC3 62a_100009818991_100000181169 [0,1,0,1,0,0|0,1,0]=3 6078 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2non3 62a_100000181169_100009820244 [0,1,0,1,0,0|1,1,0]=4 6079 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2non3 62a_100009820244_100000181169 [0,1,0,1,0,0|1,1,0]=4 6080 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2occ3 62a_100000181169_100011935138 [0,1,0,1,0,0|0,1,1]=4 6081 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2ocn3 62a_100000181169_100000728214 [0,1,0,1,0,0|0,1,1]=4 6082 B19R3.51160 O=C1NCC(O1)CSc2cccc3c2onc3 62a_100000181169_100000765530 [0,1,0,1,0,0|0,1,1]=4 6083 B19R3.51160 O=C1N[C@H](CO1)COc2cccc3c2OCO3 34a_100000046630_100015307671 [0,1,0,1,0,0|2,0,0]=4 6084 B19R3.51160 O=C1N[C@H](CO1)COc2cccc3c2OCO3 7a_100000046630_100015307671 [0,1,0,1,0,0|2,0,0]=4 6085 B19R3.51160 O=C1OCC(O1)CNc2cccc3c2COC3 34a_100000125316_100000073702 [0,1,0,1,0,0|2,0,0]=4 6086 B19R3.51160 O=C1OCC(O1)CNc2cccc3c2OCC3 34a_100000102157_100000073702 [0,1,0,1,0,0|2,0,0]=4 6087 B19R3.51160 O=C1OCC(O1)CNc2cccc3c2OCO3 34a_100000699912_100000073702 [0,1,0,1,0,0|2,0,0]=4 6088 B19R3.51160 O=C1OCC(O1)COc2cccc3c2CCC3 34a_100000074356_100000073702 [0,1,0,1,0,0|2,0,0]=4 6089 B19R3.51160 O=C1OCC(O1)COc2cccc3c2CCN3 34a_100000703684_100000073702 [0,1,0,1,0,0|2,0,0]=4 6090 B19R3.51160 O=C1OCC(O1)COc2cccc3c2CCO3 34a_100000090053_100000073702 [0,1,0,1,0,0|2,0,0]=4 6091 B19R3.51160 O=C1OCC(O1)COc2cccc3c2CNC3 34a_100015191671_100000073702 [0,1,0,1,0,0|2,0,0]=4 6092 B19R3.51160 O=C1OCC(O1)COc2cccc3c2OCO3 34a_100000046630_100000073702 [0,1,0,1,0,0|1,0,0]=3 6093 B19R3.51160 O=C1OCC(O1)CSc2cccc3c2COC3 62a_100000073702_100010384907 [0,1,0,1,0,0|1,1,0]=4 6094 B19R3.51160 O=C1OCC(O1)CSc2cccc3c2COC3 62a_100010384907_100000073702 [0,1,0,1,0,0|1,1,0]=4 6095 B19R3.51160 O=C1OCC(O1)CSc2cccc3c2OCC3 62a_100000073702_100009818991 [0,1,0,1,0,0|1,1,0]=4 6096 B19R3.51160 O=C1OCC(O1)CSc2cccc3c2OCC3 62a_100009818991_100000073702 [0,1,0,1,0,0|1,1,0]=4 6097 B15R1.87 COc1ccccc1CNC(C)C(=O)N 34a_100000188900_100000702099 [0,0,1,0,1,0|2,0,0]=4 6098 B15R1.87 COc1ccccc1CN[C@H](C)C(=O)N 2230a_100000119354_100000210004 [0,0,1,0,1,0|2,0,0]=4 6099 B15R1.87 COc1ccccc1CN[C@H](C)C(=O)N 270004a_100000119354_100000169842 [0,0,1,0,1,0|2,0,0]=4 6100 B15R1.87 COc1ccccc1CN[C@H](C)C(=O)N 34a_100000119354_100000210004 [0,0,1,0,1,0|2,0,0]=4 6101 B15R1.87 COc1ccccc1COC(C)C(=O)N 34a_100000211301_100000702099 [0,0,1,0,1,0|2,0,0]=4 6102 B15R1.87 COc1ccccc1CO[C@H](C)C(=O)N 34a_100000731257_100000210004 [0,0,1,0,1,0|2,0,0]=4 6103 B15R1.87 COc1ccccc1CO[C@H](C)C(=O)N 7a_100000731257_100000210004 [0,0,1,0,1,0|2,0,0]=4 6104 B15R1.87 COc1ccccc1CSC(C)C(=O)N 62a_100000210004_100000702099 [0,0,1,0,1,0|2,0,0]=4 6105 B15R1.87 COc1ccccc1CSC(C)C(=O)N 62a_100000702099_100000210004 [0,0,1,0,1,0|2,0,0]=4 6106 B15R1.1145 COc1ccccc1CN(C)CC(=O)N 2230a_100000184376_100000747473 [0,0,1,0,1,0|2,0,0]=4 6107 B15R1.1145 COc1ccccc1CN(C)CC(=O)N 2230a_100000739694_100000210004 [0,0,1,0,1,0|2,0,0]=4 6108 B15R1.1145 COc1ccccc1CN(C)CC(=O)N 269982a_100000184376_100000187820 [0,0,1,0,1,0|2,0,0]=4 6109 B15R1.1145 COc1ccccc1CN(C)CC(=O)N 270004a_100000739694_100000169842 [0,0,1,0,1,0|2,0,0]=4 6110 B15R1.1145 COc1ccccc1SC(C)OC(=O)C 62a_100000210334_100009818208 [0,0,1,0,1,0|1,1,0]=4 6111 B15R1.1145 COc1ccccc1SC(C)OC(=O)C 62a_100009818208_100000210334 [0,0,1,0,1,0|1,1,0]=4 6112 B15R1.85 C#CC(=O)CCOc1ccccc1OC 1458a_100000211873_100000188471 [0,0,1,0,1,0|1,0,1]=4 6113 B15R1.85 C#Cc1ccccc1OCCC(=O)NC 34a_200011470546_100012179268 [0,0,1,0,1,0|1,0,1]=4 6114 B15R1.85 C#Cc1ccccc1OCCC(=O)NC 7a_200011470546_100000737683 [0,0,1,0,1,0|1,0,1]=4 6115 B15R1.85 C=CC(=O)CCOc1ccccc1OC 1458a_100000185746_100000188471 [0,0,1,0,1,0|1,0,1]=4 6116 B15R1.85 CCC(=O)CCOc1ccccc1OC 1458a_100000182669_100000210202 [0,0,1,0,1,0|1,0,0]=3 6117 B15R1.85 CCC(=O)CCOc1ccccc1OC 1458a_100000210414_100000188471 [0,0,1,0,1,0|1,0,0]=3 6118 B15R1.85 CCC(=O)NCCc1ccccc1OC 11a_100000211851_100000210414 [0,0,1,0,1,0|2,0,0]=4 6119 B15R1.85 CCC(=O)NCCc1ccccc1OC 1626a_100000211851_100000210414 [0,0,1,0,1,0|2,0,0]=4 6120 B15R1.85 CCC(=O)NCCc1ccccc1OC 240690a_100000211851_100000210414 [0,0,1,0,1,0|2,0,0]=4 6121 B15R1.85 CCC(=O)NCCc1ccccc1OC 527a_100000211851_100000210414 [0,0,1,0,1,0|2,0,0]=4 6122 B15R1.85 CCc1ccccc1CCNC(=O)NC 2708a_100011663701_106832991635 [0,0,1,0,1,0|2,0,0]=4 6123 B15R1.85 CCc1ccccc1CCNC(=O)NC 2708a_100102657272_100011663701 [0,0,1,0,1,0|2,0,0]=4 6124 B15R1.85 CCc1ccccc1CCNC(=O)NC 273464a_100011663701_100102657272 [0,0,1,0,1,0|2,0,0]=4 6125 B15R1.85 CCc1ccccc1CCNC(=O)NC 273464a_100102657272_100011663701 [0,0,1,0,1,0|2,0,0]=4 6126 B15R1.85 CCc1ccccc1CCNC(=O)NC 512a_100011663701_100102657272 [0,0,1,0,1,0|2,0,0]=4 6127 B15R1.85 CCc1ccccc1CCNC(=O)NC 512a_106832991638_100011663701 [0,0,1,0,1,0|2,0,0]=4 6128 B15R1.85 CCc1ccccc1NCCC(=O)NC 2230a_100000212081_100000737683 [0,0,1,0,1,0|2,0,0]=4 6129 B15R1.85 CCc1ccccc1NCCC(=O)NC 34a_100000212081_100012179268 [0,0,1,0,1,0|2,0,0]=4 6130 B15R1.85 CCc1ccccc1NCCC(=O)NC 7a_100000212081_100000737683 [0,0,1,0,1,0|2,0,0]=4 6131 B15R1.85 CCc1ccccc1OCCC(=O)NC 34a_100000210936_100012179268 [0,0,1,0,1,0|1,0,0]=3 6132 B15R1.85 CCc1ccccc1OCCC(=O)NC 7a_100000210936_100000737683 [0,0,1,0,1,0|1,0,0]=3 6133 B15R1.85 CCc1ccccc1OCCC(=O)OC 34a_100000210936_100000742370 [0,0,1,0,1,0|2,0,0]=4 6134 B15R1.85 CCc1ccccc1OCCC(=O)OC 7a_100000210936_100000204255 [0,0,1,0,1,0|2,0,0]=4 6135 B15R1.85 CCc1ccccc1SCCC(=O)NC 62a_100000737683_100011215823 [0,0,1,0,1,0|1,1,0]=4 6136 B15R1.85 CCc1ccccc1SCCC(=O)NC 62a_100011215823_100000737683 [0,0,1,0,1,0|1,1,0]=4 6137 B15R1.85 CNC(=O)CCNc1ccccc1OC 34a_100000210025_100012179268 [0,0,1,0,1,0|1,0,0]=3 6138 B15R1.85 CNC(=O)CCNc1ccccc1SC 34a_100000211160_100012179268 [0,0,1,0,1,0|1,1,0]=4 6139 B15R1.85 CNC(=O)CCOc1ccccc1C#N 34a_100000211048_100012179268 [0,0,1,0,1,0|2,0,0]=4 6140 B15R1.85 CNC(=O)CCOc1ccccc1C#N 7a_100000211048_100000737683 [0,0,1,0,1,0|2,0,0]=4 6141 B15R1.85 CNC(=O)CCOc1ccccc1CN 34a_100000185550_100012179268 [0,0,1,0,1,0|2,0,0]=4 6142 B15R1.85 CNC(=O)CCOc1ccccc1CO 34a_100011216872_100012179268 [0,0,1,0,1,0|2,0,0]=4 6143 B15R1.85 CNC(=O)CCOc1ccccc1NC 34a_100000033821_100012179268 [0,0,1,0,1,0|1,0,0]=3 6144 B15R1.85 CNC(=O)CCOc1ccccc1OC 11a_106832991635_100000182669 [0,0,1,0,1,0|0,0,0]=2 6145 B15R1.85 CNC(=O)CCOc1ccccc1OC 240690a_100102657272_100000182669 [0,0,1,0,1,0|0,0,0]=2 6146 B15R1.85 CNC(=O)CCOc1ccccc1OC 34a_100000210385_100012179268 [0,0,1,0,1,0|0,0,0]=2 6147 B15R1.85 CNC(=O)CCOc1ccccc1SC 34a_100011216402_100012179268 [0,0,1,0,1,0|0,1,0]=3 6148 B15R1.85 CNC(=O)CCOc1cccnc1OC 34a_100000698397_100012179268 [0,0,1,0,1,0|1,0,0]=3 6149 B15R1.85 CNC(=O)CCOc1cccnc1OC 7a_100000698397_100000737683 [0,0,1,0,1,0|1,0,0]=3 6150 B15R1.85 CNC(=O)CCOc1cnccc1OC 34a_100000101186_100012179268 [0,0,1,0,1,0|1,0,0]=3 6151 B15R1.85 CNC(=O)CCOc1ncccc1OC 34a_100025773188_100012179268 [0,0,1,0,1,0|1,0,0]=3 6152 B15R1.85 CNC(=O)CCSc1ccccc1NC 62a_100000737683_100020606079 [0,0,1,0,1,0|1,1,0]=4 6153 B15R1.85 CNC(=O)CCSc1ccccc1NC 62a_100020606079_100000737683 [0,0,1,0,1,0|1,1,0]=4 6154 B15R1.85 CNC(=O)CCSc1ccccc1OC 62a_100000210334_100000737683 [0,0,1,0,1,0|0,1,0]=3 6155 B15R1.85 CNC(=O)CCSc1ccccc1OC 62a_100000737683_100000210334 [0,0,1,0,1,0|0,1,0]=3 6156 B15R1.85 CNC(=O)CCSc1ccccc1SC 62a_100000737683_100011217816 [0,0,1,0,1,0|0,2,0]=4 6157 B15R1.85 CNC(=O)CCSc1ccccc1SC 62a_100011217816_100000737683 [0,0,1,0,1,0|0,2,0]=4 6158 B15R1.85 CNC(=O)CCSc1cccnc1OC 62a_100000047025_100000737683 [0,0,1,0,1,0|1,1,0]=4 6159 B15R1.85 CNC(=O)CCSc1cccnc1OC 62a_100000737683_100000047025 [0,0,1,0,1,0|1,1,0]=4 6160 B15R1.85 CNC(=O)CCSc1ccncc1OC 62a_100000737683_100016988167 [0,0,1,0,1,0|1,1,0]=4 6161 B15R1.85 CNC(=O)CCSc1ccncc1OC 62a_100016988167_100000737683 [0,0,1,0,1,0|1,1,0]=4 6162 B15R1.85 CNC(=O)CCSc1cnccc1OC 62a_100000737683_100011997281 [0,0,1,0,1,0|1,1,0]=4 6163 B15R1.85 CNC(=O)CCSc1cnccc1OC 62a_100011997281_100000737683 [0,0,1,0,1,0|1,1,0]=4 6164 B15R1.85 CNC(=O)CCSc1ncccc1OC 62a_100000737683_100000690851 [0,0,1,0,1,0|1,1,0]=4 6165 B15R1.85 CNC(=O)CCSc1ncccc1OC 62a_100000767102_100000737683 [0,0,1,0,1,0|1,1,0]=4 6166 B15R1.85 CNC(=O)CNCc1ccccc1OC 207a_100000693194_100000169842 [0,0,1,0,1,0|2,0,0]=4 6167 B15R1.85 CNC(=O)CNCc1ccccc1OC 2230a_100000693194_100000210004 [0,0,1,0,1,0|2,0,0]=4 6168 B15R1.85 CNC(=O)CNCc1ccccc1OC 270004a_100000693194_100000169842 [0,0,1,0,1,0|2,0,0]=4 6169 B15R1.85 CNC(=O)CNCc1ccccc1OC 34a_100000188900_100000183359 [0,0,1,0,1,0|2,0,0]=4 6170 B15R1.85 CNC(=O)COCc1ccccc1OC 11a_106832991635_100012176948 [0,0,1,0,1,0|2,0,0]=4 6171 B15R1.85 CNC(=O)COCc1ccccc1OC 1626a_100102657272_100012176948 [0,0,1,0,1,0|2,0,0]=4 6172 B15R1.85 CNC(=O)COCc1ccccc1OC 34a_100000211301_100000183359 [0,0,1,0,1,0|2,0,0]=4 6173 B15R1.85 CNC(=O)COCc1ccccc1OC 34a_100000750040_100000210004 [0,0,1,0,1,0|2,0,0]=4 6174 B15R1.85 CNC(=O)COCc1ccccc1OC 527a_100102657272_100012176948 [0,0,1,0,1,0|2,0,0]=4 6175 B15R1.85 CNC(=O)CSCc1ccccc1OC 62a_100000183359_100000210004 [0,0,1,0,1,0|2,0,0]=4 6176 B15R1.85 CNC(=O)CSCc1ccccc1OC 62a_100000210004_100000183359 [0,0,1,0,1,0|2,0,0]=4 6177 B15R1.85 CNC(=O)NCCc1ccccc1OC 2708a_100000211851_106832991635 [0,0,1,0,1,0|1,0,0]=3 6178 B15R1.85 CNC(=O)NCCc1ccccc1OC 2708a_100102657272_100000211851 [0,0,1,0,1,0|1,0,0]=3 6179 B15R1.85 CNC(=O)NCCc1ccccc1OC 273464a_100000211851_100102657272 [0,0,1,0,1,0|1,0,0]=3 6180 B15R1.85 CNC(=O)NCCc1ccccc1OC 273464a_100102657272_100000211851 [0,0,1,0,1,0|1,0,0]=3 6181 B15R1.85 CNC(=O)NCCc1ccccc1OC 512a_100000211851_100102657272 [0,0,1,0,1,0|1,0,0]=3 6182 B15R1.85 CNC(=O)NCCc1ccccc1OC 512a_106832991638_100000211851 [0,0,1,0,1,0|1,0,0]=3 6183 B15R1.85 CNC(=O)NNCc1ccccc1OC 273464a_100102657272_100020605366 [0,0,1,0,1,0|2,0,0]=4 6184 B15R1.85 CNC(=O)NNCc1ccccc1OC 512a_100020605366_100102657272 [0,0,1,0,1,0|2,0,0]=4 6185 B15R1.85 CNC(=O)NNCc1ccccc1OC 512a_106832991638_100020605366 [0,0,1,0,1,0|2,0,0]=4 6186 B15R1.85 CNc1ccccc1OCCC(=O)OC 34a_100000033821_100000742370 [0,0,1,0,1,0|2,0,0]=4 6187 B15R1.85 COC(=O)CCCc1ccccc1OC 34a_100010659817_200000210301 [0,0,1,0,1,0|2,0,0]=4 6188 B15R1.85 COC(=O)CCCc1ccccc1OC 7a_100010659817_200000210301 [0,0,1,0,1,0|2,0,0]=4 6189 B15R1.85 COC(=O)CCCc1ccccc1O[13CH3] 34a_100010659817_200025704644 [0,0,1,0,1,0|2,0,0]=4 6190 B15R1.85 COC(=O)CCCc1ccccc1O[13CH3] 7a_100010659817_200025704644 [0,0,1,0,1,0|2,0,0]=4 6191 B15R1.85 COC(=O)CCNc1ccccc1OC 34a_100000210025_100000742370 [0,0,1,0,1,0|2,0,0]=4 6192 B15R1.85 COC(=O)CCOc1ccccc1OC 34a_100000210385_100000742370 [0,0,1,0,1,0|1,0,0]=3 6193 B15R1.85 COC(=O)CCOc1ccccc1SC 34a_100011216402_100000742370 [0,0,1,0,1,0|1,1,0]=4 6194 B15R1.85 COC(=O)CCOc1cccnc1OC 34a_100000698397_100000742370 [0,0,1,0,1,0|2,0,0]=4 6195 B15R1.85 COC(=O)CCOc1cccnc1OC 7a_100000698397_100000204255 [0,0,1,0,1,0|2,0,0]=4 6196 B15R1.85 COC(=O)CCOc1cnccc1OC 34a_100000101186_100000742370 [0,0,1,0,1,0|2,0,0]=4 6197 B15R1.85 COC(=O)CCOc1ncccc1OC 34a_100025773188_100000742370 [0,0,1,0,1,0|2,0,0]=4 6198 B15R1.85 COC(=O)CCSc1ccccc1OC 62a_100000204255_100000210334 [0,0,1,0,1,0|1,1,0]=4 6199 B15R1.85 COC(=O)CCSc1ccccc1OC 62a_100000210334_100000204255 [0,0,1,0,1,0|1,1,0]=4 6200 B15R1.85 COC(=O)OCSc1ccccc1OC 62a_100000210334_100000139417 [0,0,1,0,1,0|1,1,0]=4 6201 B15R1.85 COc1ccccc1OCCC(=O)CF 1458a_100000182669_100015361967 [0,0,1,0,1,0|2,0,0]=4 6202 B15R1.85 COc1ccccc1OCCC(=O)CO 1458a_100000210174_100000188471 [0,0,1,0,1,0|2,0,0]=4 6203 B15R2.4953 CCc1ccccc1OCC2CCO2 34a_100000210936_100000103362 [1,0,0,0,1,0|1,0,1]=4 6204 B15R2.4953 CCc1ccccc1OCC2CCO2 7a_100000210936_100000103362 [1,0,0,0,1,0|1,0,1]=4 6205 B15R2.4953 CNc1ccccc1OCC2CCO2 34a_100000033821_100000103362 [1,0,0,0,1,0|1,0,1]=4 6206 B15R2.4953 COc1ccccc1NCC2CCO2 34a_100000210025_100000103362 [1,0,0,0,1,0|1,0,1]=4 6207 B15R2.4953 COc1ccccc1OCC2CCC2 34a_100000210385_100000763275 [1,0,0,0,1,0|1,0,1]=4 6208 B15R2.4953 COc1ccccc1OCC2CCO2 34a_100000210385_100000103362 [1,0,0,0,1,0|0,0,1]=3 6209 B15R2.4953 COc1ccccc1OCC2COC2 34a_100000210385_100010264016 [1,0,0,0,1,0|1,0,1]=4 6210 B15R2.4953 COc1ccccc1SCC2CCO2 62a_100000103362_100000210334 [1,0,0,0,1,0|0,1,1]=4 6211 B15R2.4953 COc1ccccc1SCC2CCO2 62a_100000210334_100000103362 [1,0,0,0,1,0|0,1,1]=4 6212 B15R2.4953 COc1cccnc1OCC2CCO2 34a_100025773188_100000103362 [1,0,0,0,1,0|1,0,1]=4 6213 B15R2.4953 COc1ccncc1OCC2CCO2 34a_100000101186_100000103362 [1,0,0,0,1,0|1,0,1]=4 6214 B15R2.4953 COc1ncccc1OCC2CCO2 34a_100000698397_100000103362 [1,0,0,0,1,0|1,0,1]=4 6215 B15R2.4953 COc1ncccc1OCC2CCO2 7a_100000698397_100000103362 [1,0,0,0,1,0|1,0,1]=4 6216 B15R2.4953 CSc1ccccc1OCC2CCO2 34a_100011216402_100000103362 [1,0,0,0,1,0|0,1,1]=4 6217 B15R2.287 Cc1ccsc1SCC2CNC(=O)O2 62a_100000181169_100010247149 [1,0,0,0,1,0|1,1,0]=4 6218 B15R2.287 Cc1ccsc1SCC2CNC(=O)O2 62a_100010247149_100000181169 [1,0,0,0,1,0|1,1,0]=4 6219 B15R2.287 Cc1cscc1SCC2CNC(=O)O2 62a_100000181169_100000759966 [1,0,0,0,1,0|1,1,0]=4 6220 B15R2.287 Cc1cscc1SCC2CNC(=O)O2 62a_100000759966_100000181169 [1,0,0,0,1,0|1,1,0]=4 6221 B15R2.287 Cc1sccc1SCC2CNC(=O)O2 62a_100000181169_100000684487 [1,0,0,0,1,0|1,1,0]=4 6222 B15R2.287 Cc1sccc1SCC2CNC(=O)O2 62a_100000684487_100000181169 [1,0,0,0,1,0|1,1,0]=4 6223 B15R2.287 Cn1nccc1OCC2CNC(=O)O2 34a_100020632926_100000181169 [1,0,0,0,1,0|2,0,0]=4 6224 B15R2.305 Cc1ccccc1CN2CNC(=O)C2 2230a_200000708111_100000211839 [1,0,0,0,1,0|2,0,0]=4 6225 B15R2.305 Cc1ccccc1NC2COC(=O)O2 34a_100015192222_100000032252 [1,0,0,0,1,0|2,0,0]=4 6226 B15R2.305 Cc1ccccc1OC2COC(=O)O2 34a_100000210338_100000032252 [1,0,0,0,1,0|1,0,0]=3 6227 B15R2.305 Cc1ccccc1SC2COC(=O)O2 62a_100000210755_100000032252 [1,0,0,0,1,0|1,1,0]=4 6228 B15R2.305 Cc1ccncc1OC2COC(=O)O2 34a_100011997053_100000032252 [1,0,0,0,1,0|2,0,0]=4 6229 B15R2.305 Cc1cnccc1OC2COC(=O)O2 34a_100000694293_100000032252 [1,0,0,0,1,0|2,0,0]=4 6230 B15R2.305 Cc1ncccc1OC2COC(=O)O2 34a_100000745507_100000032252 [1,0,0,0,1,0|2,0,0]=4 6231 B15R2.305 Nc1ccccc1OC2COC(=O)O2 34a_100000185747_100000032252 [1,0,0,0,1,0|2,0,0]=4 6232 B15R2.305 O=C1OCC(O1)Nc2ccccc2O 34a_100000185747_100000032252 [1,0,0,0,1,0|2,0,0]=4 6233 B15R2.305 O=C1OCC(O1)Oc2ccccc2Br 34a_100000181306_100000032252 [1,0,0,0,1,0|2,0,0]=4 6234 B15R2.305 O=C1OCC(O1)Oc2ccccc2Cl 34a_100000210172_100000032252 [1,0,0,0,1,0|2,0,0]=4 6235 B15R2.305 O=C1OCC(O1)Oc2ccccc2F 34a_100000210171_100000032252 [1,0,0,0,1,0|2,0,0]=4 6236 B15R2.305 O=C1OCC(O1)Oc2ccccc2I 34a_100000739446_100000032252 [1,0,0,0,1,0|2,0,0]=4 6237 B15R2.305 O=C1OCC(O1)Sc2ccccc2O 62a_100000739446_100000032252 [1,0,0,0,1,0|1,1,0]=4 6238 B15R2.8833 Cc1ccccc1OCC2CC(=O)C2 7a_100000210338_100009874392 [1,0,0,0,1,0|1,0,0]=3 6239 B15R2.8833 Cc1ccccc1SCC2CC(=O)C2 62a_100000210755_100009874392 [1,0,0,0,1,0|1,1,0]=4 6240 B15R2.8833 Cc1ccccc1SCC2CC(=O)C2 62a_100009874392_100000210755 [1,0,0,0,1,0|1,1,0]=4 6241 B15R2.8833 Cc1ccncc1OCC2CC(=O)C2 7a_100011997053_100009874392 [1,0,0,0,1,0|2,0,0]=4 6242 B15R2.8833 Cc1ncccc1OCC2CC(=O)C2 7a_100000745507_100009874392 [1,0,0,0,1,0|2,0,0]=4 6243 B15R2.8833 Nc1ccccc1OCC2CC(=O)C2 7a_100000185747_100009874392 [1,0,0,0,1,0|2,0,0]=4 6244 B15R2.8833 O=C1CC(C1)COc2ccccc2Br 7a_100000181306_100009874392 [1,0,0,0,1,0|2,0,0]=4 6245 B15R2.8833 O=C1CC(C1)COc2ccccc2Cl 7a_100000210172_100009874392 [1,0,0,0,1,0|2,0,0]=4 6246 B15R2.8833 O=C1CC(C1)COc2ccccc2F 7a_100000210171_100009874392 [1,0,0,0,1,0|2,0,0]=4 6247 B15R2.8833 O=C1CC(C1)COc2ccccc2I 7a_100000739446_100009874392 [1,0,0,0,1,0|2,0,0]=4 6248 B15R2.8833 O=C1CC(C1)CSc2ccccc2O 62a_100000739446_100009874392 [1,0,0,0,1,0|1,1,0]=4 6249 B15R2.8833 O=C1CC(C1)CSc2ccccc2O 62a_100009874392_100000739446 [1,0,0,0,1,0|1,1,0]=4 6250 B15R2.1919 CCc1ccccc1OC2CCC2=O 34a_100000210936_100009892977 [0,0,0,0,2,0|2,0,0]=4 6251 B15R2.1919 CCc1ccccc1OC2CCC2=O 7a_100000210936_100009892977 [0,0,0,0,2,0|2,0,0]=4 6252 B15R2.1919 CNc1ccccc1OC2CCC2=O 34a_100000033821_100009892977 [0,0,0,0,2,0|2,0,0]=4 6253 B15R2.1919 COc1ccccc1NC2CCC2=O 34a_100000210025_100009892977 [0,0,0,0,2,0|2,0,0]=4 6254 B15R2.1919 COc1ccccc1OC2CCC2=O 34a_100000210385_100009892977 [0,0,0,0,2,0|1,0,0]=3 6255 B15R2.1919 COc1ccccc1SC2CCC2=O 62a_100000210334_100009892977 [0,0,0,0,2,0|1,1,0]=4 6256 B15R2.1919 COc1ccccc1SC2CCC2=O 62a_100009892977_100000210334 [0,0,0,0,2,0|1,1,0]=4 6257 B15R2.1919 COc1cccnc1OC2CCC2=O 34a_100025773188_100009892977 [0,0,0,0,2,0|2,0,0]=4 6258 B15R2.1919 COc1ccncc1OC2CCC2=O 34a_100000101186_100009892977 [0,0,0,0,2,0|2,0,0]=4 6259 B15R2.1919 COc1ncccc1OC2CCC2=O 34a_100000698397_100009892977 [0,0,0,0,2,0|2,0,0]=4 6260 B15R2.1919 COc1ncccc1OC2CCC2=O 7a_100000698397_100009892977 [0,0,0,0,2,0|2,0,0]=4 6261 B15R2.1919 CSc1ccccc1OC2CCC2=O 34a_100011216402_100009892977 [0,0,0,0,2,0|1,1,0]=4 6262 B15R2.1921 COc1ccccc1SC2CC(=O)C2 62a_100009894365_100000210334 [0,0,0,0,2,0|1,1,0]=4 6263 B15R2.2189 CSc1ccccc1C2CNC(=O)C2 62a_100015473168_200000210301 [0,0,0,0,2,0|1,1,0]=4 6264 B15R2.2189 CSc1ccccc1C2CNC(=O)C2 62a_200000210301_100015473168 [0,0,0,0,2,0|1,1,0]=4 6265 B15R2.2189 [13CH3]Sc1ccccc1C2CNC(=O)C2 62a_100015473168_200025704644 [0,0,0,0,2,0|1,1,0]=4 6266 B15R2.2189 [13CH3]Sc1ccccc1C2CNC(=O)C2 62a_200025704644_100015473168 [0,0,0,0,2,0|1,1,0]=4 6267 B17R1.1419 C=C(C)CNCCCOc1ccccc1OC 34a_100000752037_100000748629 [0,0,1,0,0,1|2,0,0]=4 6268 B17R1.1419 C=C(F)CNCCCOc1ccccc1OC 34a_100000752037_100009893438 [0,0,1,0,0,1|2,0,0]=4 6269 B17R1.1419 COc1ccccc1CCNCCNC(=O)C 2230a_100000209853_100011713687 [0,0,1,0,0,1|2,0,0]=4 6270 B17R1.1419 COc1ccccc1CCNCCNC(=O)C 2230a_100000211851_100000189650 [0,0,1,0,0,1|2,0,0]=4 6271 B17R1.1419 COc1ccccc1CCNCCNC(=O)N 2230a_100000211851_200000034859 [0,0,1,0,0,1|2,0,0]=4 6272 B17R1.1419 COc1ccccc1CCNCCNC(=O)N 34a_100020590234_100011713687 [0,0,1,0,0,1|2,0,0]=4 6273 B17R1.1419 COc1ccccc1CCOCCNC(=O)C 34a_100000158858_100011713687 [0,0,1,0,0,1|2,0,0]=4 6274 B17R1.1419 COc1ccccc1CCOCCNC(=O)C 7a_100011218620_100000189650 [0,0,1,0,0,1|2,0,0]=4 6275 B17R1.1419 COc1ccccc1CCOCCNC(=O)N 34a_100000181757_100011713687 [0,0,1,0,0,1|2,0,0]=4 6276 B17R1.1419 COc1ccccc1CCOCCNC(=O)N 7a_100011218620_200000034859 [0,0,1,0,0,1|2,0,0]=4 6277 B17R1.1419 COc1ccccc1CCSCCNC(=O)C 62a_100000189650_100011713687 [0,0,1,0,0,1|2,0,0]=4 6278 B17R1.1419 COc1ccccc1CCSCCNC(=O)C 62a_100011713687_100000189650 [0,0,1,0,0,1|2,0,0]=4 6279 B17R1.1419 COc1ccccc1CCSCCNC(=O)N 62a_100011713687_200000034859 [0,0,1,0,0,1|2,0,0]=4 6280 B17R1.1419 COc1ccccc1CCSCCNC(=O)N 62a_200000034859_100011713687 [0,0,1,0,0,1|2,0,0]=4 6281 B17R1.1419 COc1ccccc1CNCCCNC(=O)C 207a_100000736810_100000169842 [0,0,1,0,0,1|2,0,0]=4 6282 B17R1.1419 COc1ccccc1CNCCCNC(=O)C 270004a_100000736810_100000169842 [0,0,1,0,0,1|2,0,0]=4 6283 B17R1.1419 COc1ccccc1CNCCCNC(=O)C 34a_100000736810_100000210004 [0,0,1,0,0,1|2,0,0]=4 6284 B17R1.1419 COc1ccccc1COCCCCC(=O)C 34a_100000211301_100009817362 [0,0,1,0,0,1|2,0,0]=4 6285 B17R1.1419 COc1ccccc1COCCCCC(=O)N 34a_100012022536_100000210004 [0,0,1,0,0,1|2,0,0]=4 6286 B17R1.1419 COc1ccccc1COCCCCC(=O)N 7a_100012022536_100000210004 [0,0,1,0,0,1|2,0,0]=4 6287 B17R1.1419 COc1ccccc1COCCCNC(=O)C 34a_100000752032_100000210004 [0,0,1,0,0,1|1,0,0]=3 6288 B17R1.1419 COc1ccccc1COCCCOC(=O)C 34a_100000211301_100000042594 [0,0,1,0,0,1|2,0,0]=4 6289 B17R1.1419 COc1ccccc1COCCCSC(=O)C 34a_100000211301_100000038929 [0,0,1,0,0,1|2,0,0]=4 6290 B17R1.1419 COc1ccccc1OCCCCCC(=O)N 34a_100000210385_100009817443 [0,0,1,0,0,1|2,0,0]=4 6291 B17R1.1419 COc1ccccc1OCCCCOC(=O)C 34a_100000210385_100000033659 [0,0,1,0,0,1|2,0,0]=4 6292 B17R1.1419 COc1ccccc1OCCCCSC(=O)C 34a_100000210385_200010402107 [0,0,1,0,0,1|2,0,0]=4 6293 B17R1.1419 COc1ccccc1OCCCNCC(=O)N 2230a_100000711301_100011259231 [0,0,1,0,0,1|1,0,0]=3 6294 B17R1.1419 COc1ccccc1OCCCNCC(=O)N 34a_100000752037_100000187820 [0,0,1,0,0,1|1,0,0]=3 6295 B17R1.1419 COc1ccccc1OCCCNCC(=O)O 269956a_100016091260_100011259231 [0,0,1,0,0,1|0,0,0]=2 6296 B17R1.1419 COc1ccccc1OCCCNCC(=O)[O-] 34a_100000752037_100020667443 [0,0,1,0,0,1|0,0,1]=3 6297 B17R1.1419 COc1ccccc1OCCCNCC(C)O 2230a_100000210904_100011259231 [0,0,1,0,0,1|1,0,1]=4 6298 B17R1.1419 COc1ccccc1OCCCNCC(C)O 34a_100000210904_100011259231 [0,0,1,0,0,1|1,0,1]=4 6299 B17R1.1419 COc1ccccc1OCCCNCC(C)O 34a_100000752037_100011218427 [0,0,1,0,0,1|1,0,1]=4 6300 B17R1.1419 COc1ccccc1OCCCNC[C@@H](C)O 34a_100000752037_100009817552 [0,0,1,0,0,1|1,0,1]=4 6301 B17R1.1419 COc1ccccc1OCCCNC[N+](=O)[O-] 34a_100000752037_100000761209 [0,0,1,0,0,1|1,0,1]=4 6302 B17R1.1419 COc1ccccc1OCCCOCC(=O)C 34a_100000211253_100011259231 [0,0,1,0,0,1|2,0,0]=4 6303 B17R1.1419 COc1ccccc1OCCCSCC(=O)N 62a_100000747473_100011259231 [0,0,1,0,0,1|2,0,0]=4 6304 B17R1.1419 COc1ccccc1OCCCSCC(=O)N 62a_100011259231_100000747473 [0,0,1,0,0,1|2,0,0]=4 6305 B17R1.1419 COc1ccccc1OCCCSCC(=O)[O-] 62a_100011259231_100020667443 [0,0,1,0,0,1|1,0,1]=4 6306 B17R1.1419 COc1ccccc1OCCCSCC(=O)[O-] 62a_100020667443_100011259231 [0,0,1,0,0,1|1,0,1]=4 6307 B17R1.1419 COc1ccccc1OCCNCCC(=O)N 2230a_100000683763_100000744528 [0,0,1,0,0,1|2,0,0]=4 6308 B17R1.1419 COc1ccccc1OCCNCCC(=O)N 34a_100000683763_100000731001 [0,0,1,0,0,1|2,0,0]=4 6309 B17R1.1419 COc1ccccc1OCCNCOC(=O)C 34a_100000683763_100009813279 [0,0,1,0,0,1|2,0,0]=4 6310 B17R1.1419 COc1ccccc1OCCNOCC(=O)O 269956a_100000106656_100000188471 [0,0,1,0,0,1|2,0,0]=4 6311 B17R1.1419 COc1ccccc1OCCOCCC(=O)C 34a_100000759926_100000188471 [0,0,1,0,0,1|2,0,0]=4 6312 B17R1.1419 COc1ccccc1OCCOCCC(=O)C 7a_100000759926_100000188471 [0,0,1,0,0,1|2,0,0]=4 6313 B17R1.1419 COc1ccccc1OCCOCCC(=O)N 34a_100000757172_100000188471 [0,0,1,0,0,1|2,0,0]=4 6314 B17R1.1419 COc1ccccc1OCCOCCC(=O)N 7a_100000757172_100000188471 [0,0,1,0,0,1|2,0,0]=4 6315 B17R1.1419 COc1ccccc1OCCSCCC(=O)C 62a_100000053229_100000188471 [0,0,1,0,0,1|2,0,0]=4 6316 B17R1.1419 COc1ccccc1OCCSCCC(=O)C 62a_100000188471_100000053229 [0,0,1,0,0,1|2,0,0]=4 6317 B17R1.1419 COc1ccccc1OCCSCCC(=O)N 62a_100000188471_100000744528 [0,0,1,0,0,1|2,0,0]=4 6318 B17R1.1419 COc1ccccc1OCCSCCC(=O)N 62a_100000744528_100000188471 [0,0,1,0,0,1|2,0,0]=4 6319 B17R1.1419 COc1ccccc1OCCSCOC(=O)C 62a_100000076356_100000188471 [0,0,1,0,0,1|2,0,0]=4 6320 B17R1.1419 COc1ccccc1OCCSCOC(=O)C 62a_100000188471_100000076356 [0,0,1,0,0,1|2,0,0]=4 6321 B17R1.1419 COc1ccccc1OCOCCOC(=O)C 34a_100000210385_100000076355 [0,0,1,0,0,1|2,0,0]=4 6322 B17R1.1419 COc1ncccc1COCCCNC(=O)C 34a_100000752032_100020631285 [0,0,1,0,0,1|2,0,0]=4 6323 B17R1.1419 CSc1ccccc1COCCCNC(=O)C 34a_100000752032_100000699184 [0,0,1,0,0,1|1,1,0]=4 6324 B17R2.2739 COc1ccccc1COCC2CC=CC2 34a_100000688395_100000210004 [1,0,0,0,0,1|2,0,0]=4 6325 B17R2.2739 COc1ccccc1COCC2CCCO2 34a_100000210270_100000210004 [1,0,0,0,0,1|1,0,1]=4 6326 B17R2.2739 COc1ccccc1COCC2CCCO2 7a_100000210270_100000210004 [1,0,0,0,0,1|1,0,1]=4 6327 B17R2.2739 COc1ccccc1COCC2CCNC2 34a_100000748654_100000210004 [1,0,0,0,0,1|1,0,1]=4 6328 B17R2.2739 COc1ccccc1COCC2COCO2 34a_100011216627_100000210004 [1,0,0,0,0,1|1,0,1]=4 6329 B19R2.13814 COc1ccccc1CCNC2CCC(=O)NC2 2230a_100000748762_100011713687 [0,0,0,0,0,2|2,0,0]=4 6330 B19R2.13814 COc1ccccc1CCNC2CCC(=O)NC2 270004a_100000748762_100011713418 [0,0,0,0,0,2|2,0,0]=4 6331 B19R2.13814 COc1ccccc1CCNC2CCC(=O)NC2 34a_100000748762_100011713687 [0,0,0,0,0,2|2,0,0]=4 6332 B19R2.13814 COc1ccccc1CCOC2CCC(=O)NC2 34a_100000079199_100011713687 [0,0,0,0,0,2|2,0,0]=4 6333 B19R2.13814 COc1ccccc1CCOC2CNC(=O)NC2 34a_100000080929_100011713687 [0,0,0,0,0,2|2,0,0]=4 6334 B19R2.13814 COc1ccccc1COCC2CCC(=O)CC2 34a_100000062911_100000210004 [0,0,0,0,0,2|2,0,0]=4 6335 B19R2.3386 COc1ccccc1CCNC2CCNC(=O)C2 2230a_100016994916_100011713687 [0,0,0,0,0,2|2,0,0]=4 6336 B19R2.3386 COc1ccccc1CCNC2CCNC(=O)C2 34a_100016994916_100011713687 [0,0,0,0,0,2|2,0,0]=4 6337 B19R2.3386 COc1ccccc1CCO[C@@H]2CCNC(=O)C2 34a_100015189427_100011713687 [0,0,0,0,0,2|2,0,0]=4 6338 B19R2.3386 COc1ccccc1COCC2CCCC(=O)N2 34a_200000102386_100000210004 [0,0,0,0,0,2|2,0,0]=4 6339 B19R2.3386 COc1ccccc1COCC2CCNC(=O)C2 34a_100009886756_100000210004 [0,0,0,0,0,2|1,0,0]=3 6340 B19R2.3386 COc1ccccc1COCC2COCC(=O)N2 34a_200000101122_100000210004 [0,0,0,0,0,2|2,0,0]=4 6341 B19R2.3386 COc1ccccc1OCCN2CCNC(=O)C2 2230a_100000184651_100000188471 [0,0,0,0,0,2|2,0,0]=4 6342 B19R2.3386 COc1ncccc1COCC2CCNC(=O)C2 34a_100009886756_100020631285 [0,0,0,0,0,2|2,0,0]=4 6343 B19R2.3386 CSc1ccccc1COCC2CCNC(=O)C2 34a_100009886756_100000699184 [0,0,0,0,0,2|1,1,0]=4 6344 B19R2.3400 CCc1ccccc1CCNCC2CNC(=O)O2 2230a_100011663701_100000181169 [0,0,0,0,0,2|2,0,0]=4 6345 B19R2.3400 CCc1ccccc1CCNCC2CNC(=O)O2 34a_100011663701_100000181169 [0,0,0,0,0,2|2,0,0]=4 6346 B19R2.3400 COc1ccccc1CCCOC2COC(=O)O2 34a_100011709264_100000032252 [0,0,0,0,0,2|2,0,0]=4 6347 B19R2.3400 COc1ccccc1CCNCC2CNC(=O)C2 2230a_100016993742_100011713687 [0,0,0,0,0,2|2,0,0]=4 6348 B19R2.3400 COc1ccccc1CCNCC2CNC(=O)C2 34a_100016993742_100011713687 [0,0,0,0,0,2|2,0,0]=4 6349 B19R2.3400 COc1ccccc1CCNCC2CNC(=O)O2 2230a_100000211851_100000181169 [0,0,0,0,0,2|1,0,0]=3 6350 B19R2.3400 COc1ccccc1CCNCC2CNC(=O)O2 34a_100000211851_100000181169 [0,0,0,0,0,2|1,0,0]=3 6351 B19R2.3400 COc1ccccc1CCNCC2COC(=O)O2 34a_100000211851_100000073702 [0,0,0,0,0,2|2,0,0]=4 6352 B19R2.3400 COc1ccccc1CCOCC2CCC(=O)N2 34a_100000737831_100011713687 [0,0,0,0,0,2|2,0,0]=4 6353 B19R2.3400 COc1ccccc1CCOCC2CNC(=O)C2 34a_100016041077_100011713687 [0,0,0,0,0,2|1,0,0]=3 6354 B19R2.3400 COc1ccccc1CCOCC2CNC(=O)O2 34a_100011218620_100000181169 [0,0,0,0,0,2|0,0,0]=2 6355 B19R2.3400 COc1ccccc1CCOCC2CNC(=O)O2 34a_100011315639_100011713687 [0,0,0,0,0,2|0,0,0]=2 6356 B19R2.3400 COc1ccccc1CCOCC2CNC(=O)O2 7a_100011218620_100000181169 [0,0,0,0,0,2|0,0,0]=2 6357 B19R2.3400 COc1ccccc1CCOCC2COC(=O)O2 34a_100011218620_100000073702 [0,0,0,0,0,2|1,0,0]=3 6358 B19R2.3400 COc1ccccc1CCOC[C@@H]2CCC(=O)N2 7a_100011218620_100015189358 [0,0,0,0,0,2|2,0,0]=4 6359 B19R2.3400 COc1ccccc1CCOC[C@H]2COC(=O)N2 34a_100011218620_100015307671 [0,0,0,0,0,2|2,0,0]=4 6360 B19R2.3400 COc1ccccc1CCOC[C@H]2COC(=O)N2 7a_100011218620_100015307671 [0,0,0,0,0,2|2,0,0]=4 6361 B19R2.3400 COc1ccccc1CCSCC2CNC(=O)O2 62a_100000181169_100011713687 [0,0,0,0,0,2|0,1,0]=3 6362 B19R2.3400 COc1ccccc1CCSCC2CNC(=O)O2 62a_100011713687_100000181169 [0,0,0,0,0,2|0,1,0]=3 6363 B19R2.3400 COc1ccccc1CCSCC2COC(=O)O2 62a_100000073702_100011713687 [0,0,0,0,0,2|1,1,0]=4 6364 B19R2.3400 COc1ccccc1CCSCC2COC(=O)O2 62a_100011713687_100000073702 [0,0,0,0,0,2|1,1,0]=4 6365 B19R2.3400 COc1ccccc1OCCCN2CNC(=O)C2 2230a_200000708111_100011259231 [0,0,0,0,0,2|2,0,0]=4 6366 B19R2.3400 COc1ccccc1OCCNC2CNC(=O)C2 2230a_100000697751_100000188471 [0,0,0,0,0,2|1,0,0]=3 6367 B19R2.3400 COc1ccccc1OCCNC2COC(=O)O2 34a_100000683763_100000032252 [0,0,0,0,0,2|1,0,0]=3 6368 B19R2.3400 COc1ccccc1OCCOC2CCC(=O)C2 34a_100012614533_100000188471 [0,0,0,0,0,2|2,0,0]=4 6369 B19R2.3400 COc1ccccc1OCCOC2CNC(=O)C2 34a_100000690082_100000188471 [0,0,0,0,0,2|1,0,0]=3 6370 B19R2.3400 COc1ccccc1OCCSC2COC(=O)O2 62a_100000188471_100000032252 [0,0,0,0,0,2|1,0,0]=3 6371 B19R2.3400 CSc1ccccc1OCCNC2COC(=O)O2 34a_100011893647_100000032252 [0,0,0,0,0,2|1,1,0]=4 6372 B19R2.3400 N#Cc1ccccc1CCOCC2CNC(=O)O2 34a_100011315639_200013032965 [0,0,0,0,0,2|2,0,0]=4 6373 B19R2.3400 O=Cc1ccccc1CCOCC2CNC(=O)O2 34a_100011315639_100010186698 [0,0,0,0,0,2|2,0,0]=4