0 B14R1.160 C=C(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000730704 [0,0,0,0,0,0|3,0,0]=3 1 B14R1.160 C=C(C)CCC(=O)c1ccccc1C 1458a_100000212026_100000730704 [0,0,0,0,0,0|3,0,0]=3 2 B14R1.160 C=C(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000730704 [0,0,0,0,0,0|3,0,0]=3 3 B14R1.160 C=C(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000730704 [0,0,0,0,0,0|3,0,0]=3 4 B14R1.160 C=C(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000730704 [0,0,0,0,0,0|3,0,0]=3 5 B14R1.160 C=C(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000730704 [0,0,0,0,0,0|2,0,0]=2 6 B14R1.160 C=C(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730704 [0,0,0,0,0,0|2,0,1]=3 7 B14R1.160 C=C(C)CCN(C)c1ccccc1O 269982a_100000033821_100000730704 [0,0,0,0,0,0|4,0,0]=4 8 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 11a_100000765925_100000188424 [0,0,0,0,0,0|4,0,0]=4 9 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 1626a_100000765925_100000188424 [0,0,0,0,0,0|4,0,0]=4 10 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 240690a_100000765925_100000188424 [0,0,0,0,0,0|4,0,0]=4 11 B14R1.160 C=C(C)CNC(=O)c1ccccc1Br 527a_100000765925_100000188424 [0,0,0,0,0,0|4,0,0]=4 12 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 11a_100000765925_100000212026 [0,0,0,0,0,0|4,0,0]=4 13 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 1626a_100000765925_100000212026 [0,0,0,0,0,0|4,0,0]=4 14 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 240690a_100000765925_100000212026 [0,0,0,0,0,0|4,0,0]=4 15 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 527a_100000765925_100000212026 [0,0,0,0,0,0|4,0,0]=4 16 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 11a_100000765925_100000185844 [0,0,0,0,0,0|4,0,0]=4 17 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 1626a_100000765925_100000185844 [0,0,0,0,0,0|4,0,0]=4 18 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 240690a_100000765925_100000185844 [0,0,0,0,0,0|4,0,0]=4 19 B14R1.160 C=C(C)CNC(=O)c1ccccc1Cl 527a_100000765925_100000185844 [0,0,0,0,0,0|4,0,0]=4 20 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 11a_100000765925_100000188656 [0,0,0,0,0,0|4,0,0]=4 21 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 1626a_100000765925_100000188656 [0,0,0,0,0,0|4,0,0]=4 22 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 240690a_100000765925_100000188656 [0,0,0,0,0,0|4,0,0]=4 23 B14R1.160 C=C(C)CNC(=O)c1ccccc1F 527a_100000765925_100000188656 [0,0,0,0,0,0|4,0,0]=4 24 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 11a_100000765925_100000187884 [0,0,0,0,0,0|4,0,0]=4 25 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 1626a_100000765925_100000187884 [0,0,0,0,0,0|4,0,0]=4 26 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 240690a_100000765925_100000187884 [0,0,0,0,0,0|4,0,0]=4 27 B14R1.160 C=C(C)CNC(=O)c1ccccc1I 527a_100000765925_100000187884 [0,0,0,0,0,0|4,0,0]=4 28 B14R1.160 C=C(C)CNC(=O)c1ccccc1O 240690a_100000765925_100015234032 [0,0,0,0,0,0|3,0,0]=3 29 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 1626a_100000765925_100009911694 [0,0,0,0,0,0|3,0,1]=4 30 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 240690a_100000765925_100009911694 [0,0,0,0,0,0|3,0,1]=4 31 B14R1.160 C=C(C)CNC(=O)c1ccccc1[O-] 527a_100000765925_100009911694 [0,0,0,0,0,0|3,0,1]=4 32 B14R1.160 CC(=CCC(=O)c1ccccc1Br)C 1458a_100000188424_100000761012 [0,0,0,0,0,0|3,0,1]=4 33 B14R1.160 CC(=CCC(=O)c1ccccc1C)C 1458a_100000212026_100000761012 [0,0,0,0,0,0|3,0,1]=4 34 B14R1.160 CC(=CCC(=O)c1ccccc1Cl)C 1458a_100000185844_100000761012 [0,0,0,0,0,0|3,0,1]=4 35 B14R1.160 CC(=CCC(=O)c1ccccc1F)C 1458a_100000188656_100000761012 [0,0,0,0,0,0|3,0,1]=4 36 B14R1.160 CC(=CCC(=O)c1ccccc1I)C 1458a_100000187884_100000761012 [0,0,0,0,0,0|3,0,1]=4 37 B14R1.160 CC(=CCC(=O)c1ccccc1O)C 1458a_100015234032_100000761012 [0,0,0,0,0,0|2,0,1]=3 38 B14R1.160 CC(=CCC(=O)c1ccccc1[O-])C 1458a_100009911694_100000761012 [0,0,0,0,0,0|2,0,2]=4 39 B14R1.160 CC(=O)CCC(=O)c1ccccc1F 1458a_100000070787_100000086012 [0,0,0,0,0,0|2,0,0]=2 40 B14R1.160 CC(=O)CCN(C)c1ccccc1Br 269982a_100020606079_100000053229 [0,0,0,0,0,0|4,0,0]=4 41 B14R1.160 CC(=O)CCN(C)c1ccccc1C 269982a_100000219699_100000053229 [0,0,0,0,0,0|4,0,0]=4 42 B14R1.160 CC(=O)CCN(C)c1ccccc1Cl 269982a_100000219374_100000053229 [0,0,0,0,0,0|4,0,0]=4 43 B14R1.160 CC(=O)CCN(C)c1ccccc1F 269982a_100000220357_100000053229 [0,0,0,0,0,0|4,0,0]=4 44 B14R1.160 CC(=O)CCN(C)c1ccccc1O 269982a_100000033821_100000053229 [0,0,0,0,0,0|3,0,0]=3 45 B14R1.160 CC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_200000210301 [0,0,0,0,0,0|3,0,0]=3 46 B14R1.160 CC(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_200000210301 [0,0,0,0,0,0|3,0,0]=3 47 B14R1.160 CC(=O)CNC(=O)c1ccccc1F 1458a_100000182453_200000210301 [0,0,0,0,0,0|3,0,0]=3 48 B14R1.160 CC(=O)CNC(=O)c1ccccc1I 1458a_100000194700_200000210301 [0,0,0,0,0,0|3,0,0]=3 49 B14R1.160 CC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200000210301 [0,0,0,0,0,0|2,0,0]=2 50 B14R1.160 CC(=O)COC(=O)c1ccccc1O 271570a_203496583355_201991511838 [0,0,0,0,0,0|2,0,0]=2 51 B14R1.160 CC(=O)NN=C(C)c1ccccc1O 4a_100000189765_100000188907 [0,0,0,0,0,0|4,0,0]=4 52 B14R1.160 CC(=O)NNC(=O)c1ccccc1Br 22a_100000183644_100000070787 [0,0,0,0,0,0|4,0,0]=4 53 B14R1.160 CC(=O)NNC(=O)c1ccccc1Br 22a_100000189765_100000188424 [0,0,0,0,0,0|4,0,0]=4 54 B14R1.160 CC(=O)NNC(=O)c1ccccc1C 22a_100000181371_100000070787 [0,0,0,0,0,0|4,0,0]=4 55 B14R1.160 CC(=O)NNC(=O)c1ccccc1C 22a_100000189765_100000212026 [0,0,0,0,0,0|4,0,0]=4 56 B14R1.160 CC(=O)NNC(=O)c1ccccc1Cl 22a_100000186534_100000070787 [0,0,0,0,0,0|4,0,0]=4 57 B14R1.160 CC(=O)NNC(=O)c1ccccc1Cl 22a_100000189765_100000185844 [0,0,0,0,0,0|4,0,0]=4 58 B14R1.160 CC(=O)NNC(=O)c1ccccc1F 22a_100000183521_100000070787 [0,0,0,0,0,0|4,0,0]=4 59 B14R1.160 CC(=O)NNC(=O)c1ccccc1F 22a_100000189765_100000188656 [0,0,0,0,0,0|4,0,0]=4 60 B14R1.160 CC(=O)NNC(=O)c1ccccc1I 22a_100000189765_100000187884 [0,0,0,0,0,0|4,0,0]=4 61 B14R1.160 CC(=O)NNC(=O)c1ccccc1I 22a_100000190081_100000070787 [0,0,0,0,0,0|4,0,0]=4 62 B14R1.160 CC(=O)NNC(=O)c1ccccc1O 22a_100000189765_100015234032 [0,0,0,0,0,0|3,0,0]=3 63 B14R1.160 CC(=O)NNC(=O)c1ccccc1[O-] 22a_100000189765_100009911694 [0,0,0,0,0,0|3,0,1]=4 64 B14R1.160 CC(=O)OCN(C)c1ccccc1O 269982a_100000033821_100000076356 [0,0,0,0,0,0|4,0,0]=4 65 B14R1.160 CC(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000210312 [0,0,0,0,0,0|3,0,1]=4 66 B14R1.160 CC(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210312 [0,0,0,0,0,0|3,0,1]=4 67 B14R1.160 CC(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000210312 [0,0,0,0,0,0|3,0,1]=4 68 B14R1.160 CC(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000210312 [0,0,0,0,0,0|3,0,1]=4 69 B14R1.160 CC(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000210312 [0,0,0,0,0,0|2,0,1]=3 70 B14R1.160 CC(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210312 [0,0,0,0,0,0|2,0,2]=4 71 B14R1.160 CC(C)CNC(=O)c1ccccc1O 240690a_100000210953_100015234032 [0,0,0,0,0,0|3,0,1]=4 72 B14R1.160 CC(C)CNC(=O)c1ccccc1O 271570a_203496583355_200000155729 [0,0,0,0,0,0|3,0,1]=4 73 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000210206 [0,0,0,0,0,0|3,0,1]=4 74 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000210206_100000188908 [0,0,0,0,0,0|3,0,1]=4 75 B14R1.160 CC(NCC(=O)O)c1ccccc1Cl 269956a_100016091260_100000181259 [0,0,0,0,0,0|3,0,1]=4 76 B14R1.160 CC(NCC(=O)O)c1ccccc1F 269956a_100016091260_200000741388 [0,0,0,0,0,0|3,0,1]=4 77 B14R1.160 CC(O)CCC(=O)c1ccccc1Br 1458a_100000188424_100012276601 [0,0,0,0,0,0|2,0,1]=3 78 B14R1.160 CC(O)CCC(=O)c1ccccc1Cl 1458a_100000185844_100012276601 [0,0,0,0,0,0|2,0,1]=3 79 B14R1.160 CC(O)CCC(=O)c1ccccc1F 1458a_100000188656_100012276601 [0,0,0,0,0,0|2,0,1]=3 80 B14R1.160 CC(O)CCC(=O)c1ccccc1I 1458a_100000187884_100012276601 [0,0,0,0,0,0|2,0,1]=3 81 B14R1.160 CC(O)CCC(=O)c1ccccc1O 1458a_100015234032_100012276601 [0,0,0,0,0,0|1,0,1]=2 82 B14R1.160 CC(O)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100012276601 [0,0,0,0,0,0|1,0,2]=3 83 B14R1.160 CC(O)CCN(C)c1ccccc1O 269982a_100000033821_100012276601 [0,0,0,0,0,0|3,0,1]=4 84 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 11a_100000210904_100000188424 [0,0,0,0,0,0|3,0,1]=4 85 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 240690a_100000210904_100000188424 [0,0,0,0,0,0|3,0,1]=4 86 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 527a_100000210904_100000188424 [0,0,0,0,0,0|3,0,1]=4 87 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 11a_100000210904_100000185844 [0,0,0,0,0,0|3,0,1]=4 88 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 240690a_100000210904_100000185844 [0,0,0,0,0,0|3,0,1]=4 89 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 527a_100000210904_100000185844 [0,0,0,0,0,0|3,0,1]=4 90 B14R1.160 CC(O)CNC(=O)c1ccccc1F 11a_100000210904_100000188656 [0,0,0,0,0,0|3,0,1]=4 91 B14R1.160 CC(O)CNC(=O)c1ccccc1F 240690a_100000210904_100000188656 [0,0,0,0,0,0|3,0,1]=4 92 B14R1.160 CC(O)CNC(=O)c1ccccc1F 527a_100000210904_100000188656 [0,0,0,0,0,0|3,0,1]=4 93 B14R1.160 CC(O)CNC(=O)c1ccccc1I 11a_100000210904_100000187884 [0,0,0,0,0,0|3,0,1]=4 94 B14R1.160 CC(O)CNC(=O)c1ccccc1I 240690a_100000210904_100000187884 [0,0,0,0,0,0|3,0,1]=4 95 B14R1.160 CC(O)CNC(=O)c1ccccc1I 527a_100000210904_100000187884 [0,0,0,0,0,0|3,0,1]=4 96 B14R1.160 CC(O)CNC(=O)c1ccccc1O 240690a_100000210904_100015234032 [0,0,0,0,0,0|2,0,1]=3 97 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 240690a_100000210904_100009911694 [0,0,0,0,0,0|2,0,2]=4 98 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 527a_100000210904_100009911694 [0,0,0,0,0,0|2,0,2]=4 99 B14R1.160 CN(C)CCC(=O)c1ccccc1F 2230a_100102631434_100000086012 [0,0,0,0,0,0|4,0,0]=4 100 B14R1.160 CN(C)CCC(=O)c1ccccc1F 269982a_100102631434_100000086012 [0,0,0,0,0,0|4,0,0]=4 101 B14R1.160 CN(C)CCC(=O)c1ccccc1O 269982a_100102631434_100009873196 [0,0,0,0,0,0|3,0,0]=3 102 B14R1.160 CN(CCC(=O)N)c1ccccc1Br 2230a_100020606079_100000744528 [0,0,0,0,0,0|4,0,0]=4 103 B14R1.160 CN(CCC(=O)N)c1ccccc1Br 269982a_100020606079_100000744528 [0,0,0,0,0,0|4,0,0]=4 104 B14R1.160 CN(CCC(=O)N)c1ccccc1Br 34a_100020606079_100000731001 [0,0,0,0,0,0|4,0,0]=4 105 B14R1.160 CN(CCC(=O)N)c1ccccc1Cl 2230a_100000219374_100000744528 [0,0,0,0,0,0|4,0,0]=4 106 B14R1.160 CN(CCC(=O)N)c1ccccc1Cl 269982a_100000219374_100000744528 [0,0,0,0,0,0|4,0,0]=4 107 B14R1.160 CN(CCC(=O)N)c1ccccc1Cl 269982a_100000231022_200000210301 [0,0,0,0,0,0|4,0,0]=4 108 B14R1.160 CN(CCC(=O)N)c1ccccc1Cl 34a_100000219374_100000731001 [0,0,0,0,0,0|4,0,0]=4 109 B14R1.160 CN(CCC(=O)N)c1ccccc1Cl 34a_100000231022_200000210301 [0,0,0,0,0,0|4,0,0]=4 110 B14R1.160 CN(CCC(=O)N)c1ccccc1F 2230a_100000220357_100000744528 [0,0,0,0,0,0|4,0,0]=4 111 B14R1.160 CN(CCC(=O)N)c1ccccc1F 269982a_100000220357_100000744528 [0,0,0,0,0,0|4,0,0]=4 112 B14R1.160 CN(CCC(=O)N)c1ccccc1F 34a_100000220357_100000731001 [0,0,0,0,0,0|4,0,0]=4 113 B14R1.160 CN(CCC(=O)N)c1ccccc1O 269982a_100000033821_100000744528 [0,0,0,0,0,0|3,0,0]=3 114 B14R1.160 C[C@@H](NCC(=O)N)c1ccccc1O 2230a_100025703389_100000747473 [0,0,0,0,0,0|3,0,1]=4 115 B14R1.160 Cc1ccccc1C(=O)CCC(C)C 1458a_100000212026_100000210312 [0,0,0,0,0,0|3,0,1]=4 116 B14R1.160 Cc1ccccc1C(=O)CCC(C)O 1458a_100000212026_100012276601 [0,0,0,0,0,0|2,0,1]=3 117 B14R1.160 Cc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000212026 [0,0,0,0,0,0|3,0,0]=3 118 B14R1.160 Cc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000212026 [0,0,0,0,0,0|3,0,0]=3 119 B14R1.160 Cc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000212026 [0,0,0,0,0,0|3,0,0]=3 120 B14R1.160 Cc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000184812_200025704644 [0,0,0,0,0,0|3,0,0]=3 121 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000212026 [0,0,0,0,0,0|3,0,1]=4 122 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000212026 [0,0,0,0,0,0|3,0,1]=4 123 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000212026 [0,0,0,0,0,0|3,0,1]=4 124 B14R1.160 Cc1ccccc1N(C)CCC(=O)N 2230a_100000219699_100000744528 [0,0,0,0,0,0|4,0,0]=4 125 B14R1.160 Cc1ccccc1N(C)CCC(=O)N 269982a_100000219699_100000744528 [0,0,0,0,0,0|4,0,0]=4 126 B14R1.160 Cc1ccccc1N(C)CCC(=O)N 34a_100000219699_100000731001 [0,0,0,0,0,0|4,0,0]=4 127 B14R1.160 NC(=O)CNC(=O)c1ccccc1Br 11a_100000711301_100000188424 [0,0,0,0,0,0|3,0,0]=3 128 B14R1.160 NC(=O)CNC(=O)c1ccccc1Br 240690a_100000711301_100000188424 [0,0,0,0,0,0|3,0,0]=3 129 B14R1.160 NC(=O)CNC(=O)c1ccccc1Br 527a_100000711301_100000188424 [0,0,0,0,0,0|3,0,0]=3 130 B14R1.160 NC(=O)CNC(=O)c1ccccc1Cl 11a_100000711301_100000185844 [0,0,0,0,0,0|3,0,0]=3 131 B14R1.160 NC(=O)CNC(=O)c1ccccc1Cl 240690a_100000711301_100000185844 [0,0,0,0,0,0|3,0,0]=3 132 B14R1.160 NC(=O)CNC(=O)c1ccccc1Cl 527a_100000711301_100000185844 [0,0,0,0,0,0|3,0,0]=3 133 B14R1.160 NC(=O)CNC(=O)c1ccccc1F 11a_100000711301_100000188656 [0,0,0,0,0,0|3,0,0]=3 134 B14R1.160 NC(=O)CNC(=O)c1ccccc1F 240690a_100000711301_100000188656 [0,0,0,0,0,0|3,0,0]=3 135 B14R1.160 NC(=O)CNC(=O)c1ccccc1F 527a_100000711301_100000188656 [0,0,0,0,0,0|3,0,0]=3 136 B14R1.160 NC(=O)CNC(=O)c1ccccc1I 11a_100000711301_100000187884 [0,0,0,0,0,0|3,0,0]=3 137 B14R1.160 NC(=O)CNC(=O)c1ccccc1I 240690a_100000711301_100000187884 [0,0,0,0,0,0|3,0,0]=3 138 B14R1.160 NC(=O)CNC(=O)c1ccccc1I 527a_100000711301_100000187884 [0,0,0,0,0,0|3,0,0]=3 139 B14R1.160 NC(=O)CNC(=O)c1ccccc1O 240690a_100000711301_100015234032 [0,0,0,0,0,0|2,0,0]=2 140 B14R1.160 NC(=O)CNC(=O)c1ccccc1[O-] 240690a_100000711301_100009911694 [0,0,0,0,0,0|2,0,1]=3 141 B14R1.160 NC(=O)CNC(=O)c1ccccc1[O-] 527a_100000711301_100009911694 [0,0,0,0,0,0|2,0,1]=3 142 B14R1.160 O=C(NCC(F)F)c1ccccc1O 240690a_100000765723_100015234032 [0,0,0,0,0,0|3,0,1]=4 143 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_200025704644 [0,0,0,0,0,0|3,0,0]=3 144 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1F 1458a_100000182453_200025704644 [0,0,0,0,0,0|3,0,0]=3 145 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1I 1458a_100000194700_200025704644 [0,0,0,0,0,0|3,0,0]=3 146 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200025704644 [0,0,0,0,0,0|2,0,0]=2 147 B14R1.160 [13CH3]N(CCC(=O)N)c1ccccc1Cl 269982a_100000231022_200025704644 [0,0,0,0,0,0|4,0,0]=4 148 B14R1.160 [13CH3]N(CCC(=O)N)c1ccccc1Cl 34a_100000231022_200025704644 [0,0,0,0,0,0|4,0,0]=4 149 B13R1.45 C=C(C)CCC(=O)c1ccccc1 1458a_100000185807_100000730704 [1,0,0,0,0,0|2,0,0]=3 150 B13R1.45 C=C(C)CNC(=O)c1ccccc1 11a_100000765925_100000185807 [1,0,0,0,0,0|3,0,0]=4 151 B13R1.45 C=C(C)CNC(=O)c1ccccc1 1626a_100000765925_100000185807 [1,0,0,0,0,0|3,0,0]=4 152 B13R1.45 C=C(C)CNC(=O)c1ccccc1 240690a_100000765925_100000185807 [1,0,0,0,0,0|3,0,0]=4 153 B13R1.45 C=C(C)CNC(=O)c1ccccc1 527a_100000765925_100000185807 [1,0,0,0,0,0|3,0,0]=4 154 B13R1.45 CC(=CCC(=O)c1ccccc1)C 1458a_100000185807_100000761012 [1,0,0,0,0,0|2,0,1]=4 155 B13R1.45 CC(=O)CCC(=O)c1ccccc1 1458a_100000070787_100000750707 [1,0,0,0,0,0|1,0,0]=2 156 B13R1.45 CC(=O)CCN(C)c1ccccc1 269982a_100000210012_100000053229 [1,0,0,0,0,0|3,0,0]=4 157 B13R1.45 CC(=O)CC[C@@H](O)c1ccccc1 1458a_100000070787_100000729684 [1,0,0,0,0,0|1,0,2]=4 158 B13R1.45 CC(=O)CNC(=O)c1ccccc1 1458a_100000182045_200000210301 [1,0,0,0,0,0|2,0,0]=3 159 B13R1.45 CC(=O)CNC(=O)c1cccnc1 1458a_100000688122_200000210301 [1,0,0,0,0,0|3,0,0]=4 160 B13R1.45 CC(=O)COC(=O)c1ccccc1 1458a_100000070787_100000073877 [1,0,0,0,0,0|2,0,0]=3 161 B13R1.45 CC(=O)CSC(=S)c1ccccc1 1458a_100000043459_200000210301 [1,0,0,0,0,0|2,1,0]=4 162 B13R1.45 CC(=O)NNC(=O)c1ccccc1 22a_100000184135_100000070787 [1,0,0,0,0,0|3,0,0]=4 163 B13R1.45 CC(=O)NNC(=O)c1ccccc1 22a_100000189765_100000185807 [1,0,0,0,0,0|3,0,0]=4 164 B13R1.45 CC(C)CCC(=O)c1ccccc1 1458a_100000185807_100000210312 [1,0,0,0,0,0|2,0,1]=4 165 B13R1.45 CC(NCC(=O)O)c1ccccc1 269956a_100016091260_100000211855 [1,0,0,0,0,0|2,0,1]=4 166 B13R1.45 CC(O)CCC(=O)c1ccccc1 1458a_100000185807_100012276601 [1,0,0,0,0,0|1,0,1]=3 167 B13R1.45 CC(O)CNC(=O)c1ccccc1 11a_100000210904_100000185807 [1,0,0,0,0,0|2,0,1]=4 168 B13R1.45 CC(O)CNC(=O)c1ccccc1 240690a_100000210904_100000185807 [1,0,0,0,0,0|2,0,1]=4 169 B13R1.45 CC(O)CNC(=O)c1ccccc1 527a_100000210904_100000185807 [1,0,0,0,0,0|2,0,1]=4 170 B13R1.45 CN(C)CCC(=O)c1ccccc1 2230a_100102631434_100000750707 [1,0,0,0,0,0|3,0,0]=4 171 B13R1.45 CN(C)CCC(=O)c1ccccc1 269982a_100102631434_100000750707 [1,0,0,0,0,0|3,0,0]=4 172 B13R1.45 CN(CCC(=O)N)c1ccccc1 2230a_100000210012_100000744528 [1,0,0,0,0,0|3,0,0]=4 173 B13R1.45 CN(CCC(=O)N)c1ccccc1 269982a_100000210012_100000744528 [1,0,0,0,0,0|3,0,0]=4 174 B13R1.45 CN(CCC(=O)N)c1ccccc1 34a_100000210012_100000731001 [1,0,0,0,0,0|3,0,0]=4 175 B13R1.45 NC(=O)CNC(=O)c1ccccc1 11a_100000711301_100000185807 [1,0,0,0,0,0|2,0,0]=3 176 B13R1.45 NC(=O)CNC(=O)c1ccccc1 240690a_100000711301_100000185807 [1,0,0,0,0,0|2,0,0]=3 177 B13R1.45 NC(=O)CNC(=O)c1ccccc1 527a_100000711301_100000185807 [1,0,0,0,0,0|2,0,0]=3 178 B13R1.45 [13CH3]C(=O)CNC(=O)c1ccccc1 1458a_100000182045_200025704644 [1,0,0,0,0,0|2,0,0]=3 179 B13R1.45 [13CH3]C(=O)CNC(=O)c1cccnc1 1458a_100000688122_200025704644 [1,0,0,0,0,0|3,0,0]=4 180 B13R1.45 [13CH3]C(=O)CSC(=S)c1ccccc1 1458a_100000043459_200025704644 [1,0,0,0,0,0|2,1,0]=4 181 B13R1.158 C=C(C)CCNc1ccccc1O 34a_100000185747_100000730704 [1,0,0,0,0,0|3,0,0]=4 182 B13R1.158 C=C(C)CCSc1ccccc1O 62a_100000730704_100000739446 [1,0,0,0,0,0|3,0,0]=4 183 B13R1.158 C=C(C)CCSc1ccccc1O 62a_100000739446_100000730704 [1,0,0,0,0,0|3,0,0]=4 184 B13R1.158 CC(=O)CCCc1ccccc1Br 1458a_100000070787_200011713681 [1,0,0,0,0,0|2,0,1]=4 185 B13R1.158 CC(=O)CCCc1ccccc1Cl 1458a_100000700343_200000210301 [1,0,0,0,0,0|2,0,1]=4 186 B13R1.158 CC(=O)CCCc1ccccc1O 1458a_100009859317_200000210301 [1,0,0,0,0,0|1,0,1]=3 187 B13R1.158 CC(=O)CCOc1ccccc1Br 1458a_100000070787_100000695877 [1,0,0,0,0,0|3,0,0]=4 188 B13R1.158 CC(=O)CCOc1ccccc1Br 1458a_100000740817_200000210301 [1,0,0,0,0,0|3,0,0]=4 189 B13R1.158 CC(=O)CCOc1ccccc1Br 7a_100000181306_100000053229 [1,0,0,0,0,0|3,0,0]=4 190 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000070787_100000184434 [1,0,0,0,0,0|3,0,0]=4 191 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000182324_200000210301 [1,0,0,0,0,0|3,0,0]=4 192 B13R1.158 CC(=O)CCOc1ccccc1C 7a_100000210338_100000053229 [1,0,0,0,0,0|3,0,0]=4 193 B13R1.158 CC(=O)CCOc1ccccc1Cl 1458a_100000240438_200000210301 [1,0,0,0,0,0|3,0,0]=4 194 B13R1.158 CC(=O)CCOc1ccccc1Cl 7a_100000210172_100000053229 [1,0,0,0,0,0|3,0,0]=4 195 B13R1.158 CC(=O)CCOc1ccccc1F 1458a_100000070787_100000183290 [1,0,0,0,0,0|3,0,0]=4 196 B13R1.158 CC(=O)CCOc1ccccc1F 1458a_100000184057_200000210301 [1,0,0,0,0,0|3,0,0]=4 197 B13R1.158 CC(=O)CCOc1ccccc1F 7a_100000210171_100000053229 [1,0,0,0,0,0|3,0,0]=4 198 B13R1.158 CC(=O)CCOc1ccccc1I 7a_100000739446_100000053229 [1,0,0,0,0,0|3,0,0]=4 199 B13R1.158 CC(=O)CCOc1ccccc1N 7a_100000185747_100000053229 [1,0,0,0,0,0|3,0,0]=4 200 B13R1.158 CC(=O)CCSc1ccccc1Br 62a_100000053229_100000695589 [1,0,0,0,0,0|3,0,0]=4 201 B13R1.158 CC(=O)CCSc1ccccc1Br 62a_100000695589_100000053229 [1,0,0,0,0,0|3,0,0]=4 202 B13R1.158 CC(=O)CCSc1ccccc1C 62a_100000053229_100000210755 [1,0,0,0,0,0|3,0,0]=4 203 B13R1.158 CC(=O)CCSc1ccccc1C 62a_100000210755_100000053229 [1,0,0,0,0,0|3,0,0]=4 204 B13R1.158 CC(=O)CCSc1ccccc1Cl 62a_100000053229_100000764095 [1,0,0,0,0,0|3,0,0]=4 205 B13R1.158 CC(=O)CCSc1ccccc1Cl 62a_100000764095_100000053229 [1,0,0,0,0,0|3,0,0]=4 206 B13R1.158 CC(=O)CCSc1ccccc1F 1458a_100000208832_200000210301 [1,0,0,0,0,0|3,0,0]=4 207 B13R1.158 CC(=O)CCSc1ccccc1F 62a_100000053229_100011215700 [1,0,0,0,0,0|3,0,0]=4 208 B13R1.158 CC(=O)CCSc1ccccc1F 62a_100011215700_100000053229 [1,0,0,0,0,0|3,0,0]=4 209 B13R1.158 CC(=O)CCSc1ccccc1N 62a_100000053229_100000210017 [1,0,0,0,0,0|3,0,0]=4 210 B13R1.158 CC(=O)CCSc1ccccc1N 62a_100000210017_100000053229 [1,0,0,0,0,0|3,0,0]=4 211 B13R1.158 CC(=O)CCSc1ccccc1O 62a_100000053229_100000739446 [1,0,0,0,0,0|2,0,0]=3 212 B13R1.158 CC(=O)CCSc1ccccc1O 62a_100000739446_100000053229 [1,0,0,0,0,0|2,0,0]=3 213 B13R1.158 CC(=O)CCSc1cccnc1O 62a_100000053229_100000760158 [1,0,0,0,0,0|3,0,0]=4 214 B13R1.158 CC(=O)CCSc1cccnc1O 62a_100000760158_100000053229 [1,0,0,0,0,0|3,0,0]=4 215 B13R1.158 CC(=O)CCSc1ccncc1O 62a_100000053229_100009817591 [1,0,0,0,0,0|3,0,0]=4 216 B13R1.158 CC(=O)CCSc1ccncc1O 62a_100009817591_100000053229 [1,0,0,0,0,0|3,0,0]=4 217 B13R1.158 CC(=O)CCSc1ncccc1O 62a_100000034122_100000053229 [1,0,0,0,0,0|3,0,0]=4 218 B13R1.158 CC(=O)CCSc1ncccc1O 62a_100000053229_100000034122 [1,0,0,0,0,0|3,0,0]=4 219 B13R1.158 CC(=O)NCCc1ccccc1O 240690a_100011207237_100015343762 [1,0,0,0,0,0|2,0,1]=4 220 B13R1.158 CC(=O)NCCc1ccccc1O 527a_100011207237_100103153847 [1,0,0,0,0,0|2,0,1]=4 221 B13R1.158 CC(=O)NN=Cc1ccccc1O 4a_100000189765_100000185834 [1,0,0,0,0,0|3,0,0]=4 222 B13R1.158 CC(=O)OCNc1ccccc1O 34a_100000185747_100009813279 [1,0,0,0,0,0|3,0,0]=4 223 B13R1.158 CC(=O)OCSc1ccccc1O 62a_100000076356_100000739446 [1,0,0,0,0,0|3,0,0]=4 224 B13R1.158 CC(=O)OCSc1ccccc1O 62a_100000739446_100000076356 [1,0,0,0,0,0|3,0,0]=4 225 B13R1.158 CC(O)CCNc1ccccc1O 34a_100000185747_100012276601 [1,0,0,0,0,0|2,0,1]=4 226 B13R1.158 CC(O)CCSc1ccccc1O 62a_100000739446_100012276601 [1,0,0,0,0,0|2,0,1]=4 227 B13R1.158 CC(O)CCSc1ccccc1O 62a_100012276601_100000739446 [1,0,0,0,0,0|2,0,1]=4 228 B13R1.158 Cc1ccccc1CNCC(=O)O 269956a_100016091260_100000211750 [1,0,0,0,0,0|2,0,1]=4 229 B13R1.158 Cc1ccccc1NCCC(=O)N 34a_100015192222_100000731001 [1,0,0,0,0,0|3,0,0]=4 230 B13R1.158 Cc1ccccc1OCCC(=O)N 34a_100000210338_100000731001 [1,0,0,0,0,0|3,0,0]=4 231 B13R1.158 Cc1ccccc1OCCC(=O)N 7a_100000210338_100000744528 [1,0,0,0,0,0|3,0,0]=4 232 B13R1.158 Cc1ccccc1OCCC(=O)[13CH3] 1458a_100000182324_200025704644 [1,0,0,0,0,0|3,0,0]=4 233 B13R1.158 Cc1ccccc1SCCC(=O)N 62a_100000210755_100000744528 [1,0,0,0,0,0|3,0,0]=4 234 B13R1.158 Cc1ccccc1SCCC(=O)N 62a_100000744528_100000210755 [1,0,0,0,0,0|3,0,0]=4 235 B13R1.158 NC(=O)CCNc1ccccc1Br 34a_100000210017_100000731001 [1,0,0,0,0,0|3,0,0]=4 236 B13R1.158 NC(=O)CCNc1ccccc1Cl 34a_100000185783_100000731001 [1,0,0,0,0,0|3,0,0]=4 237 B13R1.158 NC(=O)CCNc1ccccc1F 34a_100000210422_100000731001 [1,0,0,0,0,0|3,0,0]=4 238 B13R1.158 NC(=O)CCNc1ccccc1I 34a_100000210053_100000731001 [1,0,0,0,0,0|3,0,0]=4 239 B13R1.158 NC(=O)CCNc1ccccc1O 34a_100000185747_100000731001 [1,0,0,0,0,0|2,0,0]=3 240 B13R1.158 NC(=O)CCOc1ccccc1Br 34a_100000181306_100000731001 [1,0,0,0,0,0|3,0,0]=4 241 B13R1.158 NC(=O)CCOc1ccccc1Br 7a_100000181306_100000744528 [1,0,0,0,0,0|3,0,0]=4 242 B13R1.158 NC(=O)CCOc1ccccc1Cl 34a_100000210172_100000731001 [1,0,0,0,0,0|3,0,0]=4 243 B13R1.158 NC(=O)CCOc1ccccc1Cl 7a_100000210172_100000744528 [1,0,0,0,0,0|3,0,0]=4 244 B13R1.158 NC(=O)CCOc1ccccc1F 34a_100000210171_100000731001 [1,0,0,0,0,0|3,0,0]=4 245 B13R1.158 NC(=O)CCOc1ccccc1F 7a_100000210171_100000744528 [1,0,0,0,0,0|3,0,0]=4 246 B13R1.158 NC(=O)CCOc1ccccc1I 34a_100000739446_100000731001 [1,0,0,0,0,0|3,0,0]=4 247 B13R1.158 NC(=O)CCOc1ccccc1I 7a_100000739446_100000744528 [1,0,0,0,0,0|3,0,0]=4 248 B13R1.158 NC(=O)CCOc1ccccc1N 34a_100000185747_100000731001 [1,0,0,0,0,0|3,0,0]=4 249 B13R1.158 NC(=O)CCOc1ccccc1N 7a_100000185747_100000744528 [1,0,0,0,0,0|3,0,0]=4 250 B13R1.158 NC(=O)CCSc1ccccc1Br 62a_100000695589_100000744528 [1,0,0,0,0,0|3,0,0]=4 251 B13R1.158 NC(=O)CCSc1ccccc1Br 62a_100000744528_100000695589 [1,0,0,0,0,0|3,0,0]=4 252 B13R1.158 NC(=O)CCSc1ccccc1Cl 62a_100000744528_100000764095 [1,0,0,0,0,0|3,0,0]=4 253 B13R1.158 NC(=O)CCSc1ccccc1Cl 62a_100000764095_100000744528 [1,0,0,0,0,0|3,0,0]=4 254 B13R1.158 NC(=O)CCSc1ccccc1F 62a_100000744528_100011215700 [1,0,0,0,0,0|3,0,0]=4 255 B13R1.158 NC(=O)CCSc1ccccc1F 62a_100011215700_100000744528 [1,0,0,0,0,0|3,0,0]=4 256 B13R1.158 NC(=O)CCSc1ccccc1N 62a_100000210017_100000744528 [1,0,0,0,0,0|3,0,0]=4 257 B13R1.158 NC(=O)CCSc1ccccc1N 62a_100000744528_100000210017 [1,0,0,0,0,0|3,0,0]=4 258 B13R1.158 NC(=O)CCSc1ccccc1O 62a_100000739446_100000744528 [1,0,0,0,0,0|2,0,0]=3 259 B13R1.158 NC(=O)CCSc1ccccc1O 62a_100000744528_100000739446 [1,0,0,0,0,0|2,0,0]=3 260 B13R1.158 NC(=O)CCSc1cccnc1O 62a_100000744528_100000760158 [1,0,0,0,0,0|3,0,0]=4 261 B13R1.158 NC(=O)CCSc1cccnc1O 62a_100000760158_100000744528 [1,0,0,0,0,0|3,0,0]=4 262 B13R1.158 NC(=O)CCSc1ccncc1O 62a_100000744528_100009817591 [1,0,0,0,0,0|3,0,0]=4 263 B13R1.158 NC(=O)CCSc1ccncc1O 62a_100009817591_100000744528 [1,0,0,0,0,0|3,0,0]=4 264 B13R1.158 NC(=O)CCSc1ncccc1O 62a_100000034122_100000744528 [1,0,0,0,0,0|3,0,0]=4 265 B13R1.158 NC(=O)CCSc1ncccc1O 62a_100000744528_100000034122 [1,0,0,0,0,0|3,0,0]=4 266 B13R1.158 NC(=O)CNCc1ccccc1O 34a_100000185550_100000187820 [1,0,0,0,0,0|2,0,1]=4 267 B13R1.158 O=C(O)CNCc1ccccc1Br 269956a_100016091260_100000184730 [1,0,0,0,0,0|2,0,1]=4 268 B13R1.158 O=C(O)CNCc1ccccc1Cl 269956a_100016091260_100000187162 [1,0,0,0,0,0|2,0,1]=4 269 B13R1.158 O=C(O)CNCc1ccccc1F 269956a_100016091260_100000187165 [1,0,0,0,0,0|2,0,1]=4 270 B13R1.158 O=C(O)CNCc1ccccc1I 269956a_100016091260_100011216222 [1,0,0,0,0,0|2,0,1]=4 271 B13R1.158 O=C(O)CNCc1ncccc1O 269956a_100016091260_200020655725 [1,0,0,0,0,0|2,0,1]=4 272 B13R1.158 O=C([O-])CNCc1ccccc1O 34a_100000185550_100020667443 [1,0,0,0,0,0|1,0,2]=4 273 B13R1.158 [13CH3]C(=O)CCCc1ccccc1Cl 1458a_100000700343_200025704644 [1,0,0,0,0,0|2,0,1]=4 274 B13R1.158 [13CH3]C(=O)CCCc1ccccc1O 1458a_100009859317_200025704644 [1,0,0,0,0,0|1,0,1]=3 275 B13R1.158 [13CH3]C(=O)CCOc1ccccc1Br 1458a_100000740817_200025704644 [1,0,0,0,0,0|3,0,0]=4 276 B13R1.158 [13CH3]C(=O)CCOc1ccccc1Cl 1458a_100000240438_200025704644 [1,0,0,0,0,0|3,0,0]=4 277 B13R1.158 [13CH3]C(=O)CCOc1ccccc1F 1458a_100000184057_200025704644 [1,0,0,0,0,0|3,0,0]=4 278 B13R1.158 [13CH3]C(=O)CCSc1ccccc1F 1458a_100000208832_200025704644 [1,0,0,0,0,0|3,0,0]=4 279 B13R1.674 C#CCCC(=O)c1ccccc1Br 1458a_100000188424_100000753159 [1,0,0,0,0,0|2,0,1]=4 280 B13R1.674 C#CCCC(=O)c1ccccc1C 1458a_100000212026_100000753159 [1,0,0,0,0,0|2,0,1]=4 281 B13R1.674 C#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000753159 [1,0,0,0,0,0|2,0,1]=4 282 B13R1.674 C#CCCC(=O)c1ccccc1F 1458a_100000188656_100000753159 [1,0,0,0,0,0|2,0,1]=4 283 B13R1.674 C#CCCC(=O)c1ccccc1I 1458a_100000187884_100000753159 [1,0,0,0,0,0|2,0,1]=4 284 B13R1.674 C#CCCC(=O)c1ccccc1O 1458a_100015234032_100000753159 [1,0,0,0,0,0|1,0,1]=3 285 B13R1.674 C#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000753159 [1,0,0,0,0,0|1,0,2]=4 286 B13R1.674 C#CCNC(=O)c1ccccc1O 240690a_100000212058_100015234032 [1,0,0,0,0,0|2,0,1]=4 287 B13R1.674 C/C=C/CC(=O)c1ccccc1Br 1458a_100000188424_100102629194 [1,0,0,0,0,0|2,0,1]=4 288 B13R1.674 C/C=C/CC(=O)c1ccccc1C 1458a_100000212026_100102629194 [1,0,0,0,0,0|2,0,1]=4 289 B13R1.674 C/C=C/CC(=O)c1ccccc1Cl 1458a_100000185844_100102629194 [1,0,0,0,0,0|2,0,1]=4 290 B13R1.674 C/C=C/CC(=O)c1ccccc1F 1458a_100000188656_100102629194 [1,0,0,0,0,0|2,0,1]=4 291 B13R1.674 C/C=C/CC(=O)c1ccccc1I 1458a_100000187884_100102629194 [1,0,0,0,0,0|2,0,1]=4 292 B13R1.674 C/C=C/CC(=O)c1ccccc1O 1458a_100015234032_100102629194 [1,0,0,0,0,0|1,0,1]=3 293 B13R1.674 C/C=C/CC(=O)c1ccccc1[O-] 1458a_100009911694_100102629194 [1,0,0,0,0,0|1,0,2]=4 294 B13R1.674 C=CCCC(=O)c1ccccc1Br 1458a_100000188424_100000754431 [1,0,0,0,0,0|2,0,0]=3 295 B13R1.674 C=CCCC(=O)c1ccccc1C 1458a_100000212026_100000754431 [1,0,0,0,0,0|2,0,0]=3 296 B13R1.674 C=CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000754431 [1,0,0,0,0,0|2,0,0]=3 297 B13R1.674 C=CCCC(=O)c1ccccc1F 1458a_100000188656_100000754431 [1,0,0,0,0,0|2,0,0]=3 298 B13R1.674 C=CCCC(=O)c1ccccc1I 1458a_100000187884_100000754431 [1,0,0,0,0,0|2,0,0]=3 299 B13R1.674 C=CCCC(=O)c1ccccc1O 1458a_100015234032_100000754431 [1,0,0,0,0,0|1,0,0]=2 300 B13R1.674 C=CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000754431 [1,0,0,0,0,0|1,0,1]=3 301 B13R1.674 C=CCCN(C)c1ccccc1O 269982a_100000033821_100000754431 [1,0,0,0,0,0|3,0,0]=4 302 B13R1.674 C=CCNC(=O)c1ccccc1Br 1626a_100020586998_100000188424 [1,0,0,0,0,0|3,0,0]=4 303 B13R1.674 C=CCNC(=O)c1ccccc1Br 240690a_100020586998_100000188424 [1,0,0,0,0,0|3,0,0]=4 304 B13R1.674 C=CCNC(=O)c1ccccc1Br 527a_100020586998_100000188424 [1,0,0,0,0,0|3,0,0]=4 305 B13R1.674 C=CCNC(=O)c1ccccc1C 1626a_100020586998_100000212026 [1,0,0,0,0,0|3,0,0]=4 306 B13R1.674 C=CCNC(=O)c1ccccc1C 240690a_100020586998_100000212026 [1,0,0,0,0,0|3,0,0]=4 307 B13R1.674 C=CCNC(=O)c1ccccc1C 527a_100020586998_100000212026 [1,0,0,0,0,0|3,0,0]=4 308 B13R1.674 C=CCNC(=O)c1ccccc1Cl 1626a_100020586998_100000185844 [1,0,0,0,0,0|3,0,0]=4 309 B13R1.674 C=CCNC(=O)c1ccccc1Cl 240690a_100020586998_100000185844 [1,0,0,0,0,0|3,0,0]=4 310 B13R1.674 C=CCNC(=O)c1ccccc1Cl 527a_100020586998_100000185844 [1,0,0,0,0,0|3,0,0]=4 311 B13R1.674 C=CCNC(=O)c1ccccc1F 1626a_100020586998_100000188656 [1,0,0,0,0,0|3,0,0]=4 312 B13R1.674 C=CCNC(=O)c1ccccc1F 240690a_100020586998_100000188656 [1,0,0,0,0,0|3,0,0]=4 313 B13R1.674 C=CCNC(=O)c1ccccc1F 527a_100020586998_100000188656 [1,0,0,0,0,0|3,0,0]=4 314 B13R1.674 C=CCNC(=O)c1ccccc1I 1626a_100020586998_100000187884 [1,0,0,0,0,0|3,0,0]=4 315 B13R1.674 C=CCNC(=O)c1ccccc1I 240690a_100020586998_100000187884 [1,0,0,0,0,0|3,0,0]=4 316 B13R1.674 C=CCNC(=O)c1ccccc1I 527a_100020586998_100000187884 [1,0,0,0,0,0|3,0,0]=4 317 B13R1.674 C=CCNC(=O)c1ccccc1O 240690a_100020586998_100015234032 [1,0,0,0,0,0|2,0,0]=3 318 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 1626a_100020586998_100009911694 [1,0,0,0,0,0|2,0,1]=4 319 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 240690a_100020586998_100009911694 [1,0,0,0,0,0|2,0,1]=4 320 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 527a_100020586998_100009911694 [1,0,0,0,0,0|2,0,1]=4 321 B13R1.674 CC#CCC(=O)c1ccccc1O 1458a_100015234032_100000748600 [1,0,0,0,0,0|1,0,2]=4 322 B13R1.674 CC=CCC(=O)c1ccccc1Br 1458a_100000188424_100000070051 [1,0,0,0,0,0|2,0,1]=4 323 B13R1.674 CC=CCC(=O)c1ccccc1C 1458a_100000212026_100000070051 [1,0,0,0,0,0|2,0,1]=4 324 B13R1.674 CC=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000070051 [1,0,0,0,0,0|2,0,1]=4 325 B13R1.674 CC=CCC(=O)c1ccccc1F 1458a_100000188656_100000070051 [1,0,0,0,0,0|2,0,1]=4 326 B13R1.674 CC=CCC(=O)c1ccccc1I 1458a_100000187884_100000070051 [1,0,0,0,0,0|2,0,1]=4 327 B13R1.674 CC=CCC(=O)c1ccccc1O 1458a_100015234032_100000070051 [1,0,0,0,0,0|1,0,1]=3 328 B13R1.674 CC=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000070051 [1,0,0,0,0,0|1,0,2]=4 329 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [1,0,0,0,0,0|2,0,1]=4 330 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [1,0,0,0,0,0|2,0,1]=4 331 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [1,0,0,0,0,0|2,0,1]=4 332 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [1,0,0,0,0,0|2,0,1]=4 333 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [1,0,0,0,0,0|2,0,1]=4 334 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [1,0,0,0,0,0|1,0,1]=3 335 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [1,0,0,0,0,0|1,0,2]=4 336 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [1,0,0,0,0,0|2,0,1]=4 337 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [1,0,0,0,0,0|2,0,1]=4 338 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000188908_100000210202 [1,0,0,0,0,0|2,0,1]=4 339 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000210202_100000188908 [1,0,0,0,0,0|2,0,1]=4 340 B13R1.674 CN(CCCO)c1ccccc1O 269982a_100000033821_100011215043 [1,0,0,0,0,0|2,0,1]=4 341 B13R1.674 CNCCC(=O)c1ccccc1F 2230a_106832991635_100000086012 [1,0,0,0,0,0|3,0,0]=4 342 B13R1.674 CNCCC(=O)c1ccccc1F 7a_106832991635_100000086012 [1,0,0,0,0,0|3,0,0]=4 343 B13R1.674 CNCCC(=O)c1ccccc1O 7a_106832991635_100009873196 [1,0,0,0,0,0|2,0,0]=3 344 B13R1.674 COCCC(=O)c1ccccc1Br 1458a_100000188424_100000233755 [1,0,0,0,0,0|3,0,0]=4 345 B13R1.674 COCCC(=O)c1ccccc1C 1458a_100000212026_100000233755 [1,0,0,0,0,0|3,0,0]=4 346 B13R1.674 COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000233755 [1,0,0,0,0,0|3,0,0]=4 347 B13R1.674 COCCC(=O)c1ccccc1F 1458a_100000188656_100000233755 [1,0,0,0,0,0|3,0,0]=4 348 B13R1.674 COCCC(=O)c1ccccc1I 1458a_100000187884_100000233755 [1,0,0,0,0,0|3,0,0]=4 349 B13R1.674 COCCC(=O)c1ccccc1O 1458a_100015234032_100000233755 [1,0,0,0,0,0|2,0,0]=3 350 B13R1.674 COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000233755 [1,0,0,0,0,0|2,0,1]=4 351 B13R1.674 CSCCC(=O)c1ccccc1Br 1458a_100000188424_100000751147 [1,0,0,0,0,0|3,0,0]=4 352 B13R1.674 CSCCC(=O)c1ccccc1C 1458a_100000212026_100000751147 [1,0,0,0,0,0|3,0,0]=4 353 B13R1.674 CSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000751147 [1,0,0,0,0,0|3,0,0]=4 354 B13R1.674 CSCCC(=O)c1ccccc1F 1458a_100000188656_100000751147 [1,0,0,0,0,0|3,0,0]=4 355 B13R1.674 CSCCC(=O)c1ccccc1F 62a_100000086012_200000210301 [1,0,0,0,0,0|3,0,0]=4 356 B13R1.674 CSCCC(=O)c1ccccc1F 62a_200000210301_100000086012 [1,0,0,0,0,0|3,0,0]=4 357 B13R1.674 CSCCC(=O)c1ccccc1I 1458a_100000187884_100000751147 [1,0,0,0,0,0|3,0,0]=4 358 B13R1.674 CSCCC(=O)c1ccccc1O 1458a_100015234032_100000751147 [1,0,0,0,0,0|2,0,0]=3 359 B13R1.674 CSCCC(=O)c1ccccc1O 62a_200000210301_100009873196 [1,0,0,0,0,0|2,0,0]=3 360 B13R1.674 CSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000751147 [1,0,0,0,0,0|2,0,1]=4 361 B13R1.674 C[C@@H](NCC=O)c1ccccc1O 2230a_100025703389_200015260668 [1,0,0,0,0,0|2,0,1]=4 362 B13R1.674 Cc1ccccc1C(=O)CCC#N 1458a_100000212026_100011215226 [1,0,0,0,0,0|2,0,1]=4 363 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [1,0,0,0,0,0|2,0,1]=4 364 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [1,0,0,0,0,0|1,0,1]=3 365 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [1,0,0,0,0,0|2,0,1]=4 366 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [1,0,0,0,0,0|2,0,1]=4 367 B13R1.674 N#CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215226 [1,0,0,0,0,0|2,0,1]=4 368 B13R1.674 N#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215226 [1,0,0,0,0,0|2,0,1]=4 369 B13R1.674 N#CCCC(=O)c1ccccc1F 1458a_100000188656_100011215226 [1,0,0,0,0,0|2,0,1]=4 370 B13R1.674 N#CCCC(=O)c1ccccc1I 1458a_100000187884_100011215226 [1,0,0,0,0,0|2,0,1]=4 371 B13R1.674 N#CCCC(=O)c1ccccc1O 1458a_100015234032_100011215226 [1,0,0,0,0,0|1,0,1]=3 372 B13R1.674 N#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215226 [1,0,0,0,0,0|1,0,2]=4 373 B13R1.674 O=C(CCCF)c1ccccc1Br 1458a_100000188424_100011934791 [1,0,0,0,0,0|2,0,1]=4 374 B13R1.674 O=C(CCCF)c1ccccc1Cl 1458a_100000185844_100011934791 [1,0,0,0,0,0|2,0,1]=4 375 B13R1.674 O=C(CCCF)c1ccccc1F 1458a_100000188656_100011934791 [1,0,0,0,0,0|2,0,1]=4 376 B13R1.674 O=C(CCCF)c1ccccc1I 1458a_100000187884_100011934791 [1,0,0,0,0,0|2,0,1]=4 377 B13R1.674 O=C(CCCF)c1ccccc1O 1458a_100015234032_100011934791 [1,0,0,0,0,0|1,0,1]=3 378 B13R1.674 O=C(CCCF)c1ccccc1[O-] 1458a_100009911694_100011934791 [1,0,0,0,0,0|1,0,2]=4 379 B13R1.674 O=C(CCCO)c1ccccc1Br 1458a_100000188424_100011215043 [1,0,0,0,0,0|1,0,1]=3 380 B13R1.674 O=C(CCCO)c1ccccc1Cl 1458a_100000185844_100011215043 [1,0,0,0,0,0|1,0,1]=3 381 B13R1.674 O=C(CCCO)c1ccccc1F 1458a_100000188656_100011215043 [1,0,0,0,0,0|1,0,1]=3 382 B13R1.674 O=C(CCCO)c1ccccc1I 1458a_100000187884_100011215043 [1,0,0,0,0,0|1,0,1]=3 383 B13R1.674 O=C(CCCO)c1ccccc1O 1458a_100015234032_100011215043 [1,0,0,0,0,0|0,0,1]=2 384 B13R1.674 O=C(CCCO)c1ccccc1[O-] 1458a_100009911694_100011215043 [1,0,0,0,0,0|0,0,2]=3 385 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100000188908_100015361967 [1,0,0,0,0,0|2,0,1]=4 386 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100015361967_100000188908 [1,0,0,0,0,0|2,0,1]=4 387 B13R1.674 O=C(NCCF)c1ccccc1O 240690a_100000724931_100015234032 [1,0,0,0,0,0|2,0,1]=4 388 B13R1.674 O=C(NCCO)c1ccccc1Br 240690a_100000210304_100000188424 [1,0,0,0,0,0|2,0,1]=4 389 B13R1.674 O=C(NCCO)c1ccccc1Br 527a_100000210304_100000188424 [1,0,0,0,0,0|2,0,1]=4 390 B13R1.674 O=C(NCCO)c1ccccc1Cl 240690a_100000210304_100000185844 [1,0,0,0,0,0|2,0,1]=4 391 B13R1.674 O=C(NCCO)c1ccccc1Cl 527a_100000210304_100000185844 [1,0,0,0,0,0|2,0,1]=4 392 B13R1.674 O=C(NCCO)c1ccccc1F 240690a_100000210304_100000188656 [1,0,0,0,0,0|2,0,1]=4 393 B13R1.674 O=C(NCCO)c1ccccc1F 527a_100000210304_100000188656 [1,0,0,0,0,0|2,0,1]=4 394 B13R1.674 O=C(NCCO)c1ccccc1I 240690a_100000210304_100000187884 [1,0,0,0,0,0|2,0,1]=4 395 B13R1.674 O=C(NCCO)c1ccccc1I 527a_100000210304_100000187884 [1,0,0,0,0,0|2,0,1]=4 396 B13R1.674 O=C(NCCO)c1ccccc1O 240690a_100000210304_100015234032 [1,0,0,0,0,0|1,0,1]=3 397 B13R1.674 O=C(NCCO)c1ccccc1O 271570a_203496583355_200000158863 [1,0,0,0,0,0|1,0,1]=3 398 B13R1.674 O=C(NCCO)c1ccccc1[O-] 240690a_100000210304_100009911694 [1,0,0,0,0,0|1,0,2]=4 399 B13R1.674 O=C(NCCO)c1ccccc1[O-] 527a_100000210304_100009911694 [1,0,0,0,0,0|1,0,2]=4 400 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_100000086012_200025704644 [1,0,0,0,0,0|3,0,0]=4 401 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_200025704644_100000086012 [1,0,0,0,0,0|3,0,0]=4 402 B13R1.674 [13CH3]SCCC(=O)c1ccccc1O 62a_200025704644_100009873196 [1,0,0,0,0,0|2,0,0]=3 403 B15R1.86 C#Cc1ccccc1C(=O)CCC(=C)C 1458a_100011243808_100000730704 [0,1,0,0,0,0|3,0,0]=4 404 B15R1.86 C#Cc1ccccc1C(=O)CCC(C)O 1458a_100011243808_100012276601 [0,1,0,0,0,0|2,0,1]=4 405 B15R1.86 C#Cc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100011243808 [0,1,0,0,0,0|3,0,0]=4 406 B15R1.86 C=C(C)CCC(=O)c1ccccc1C#N 1458a_100000742908_100000730704 [0,1,0,0,0,0|3,0,0]=4 407 B15R1.86 C=C(C)CCC(=O)c1ccccc1CC 1458a_100000689120_100000730704 [0,1,0,0,0,0|3,0,0]=4 408 B15R1.86 C=C(C)CCC(=O)c1ccccc1CO 1458a_100011301526_100000730704 [0,1,0,0,0,0|2,0,0]=3 409 B15R1.86 C=C(C)CCC(=O)c1ccccc1I=O 1458a_100000032414_100000730704 [0,1,0,0,0,0|2,0,1]=4 410 B15R1.86 C=C(C)CCC(=O)c1ccccc1OC 1458a_100000185835_100000730704 [0,1,0,0,0,0|2,0,0]=3 411 B15R1.86 C=C(C)CCC(=O)c1ccccc1SC 1458a_100000183967_100000730704 [0,1,0,0,0,0|2,1,0]=4 412 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 11a_100000765925_100000185835 [0,1,0,0,0,0|3,0,0]=4 413 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 1626a_100000765925_100000185835 [0,1,0,0,0,0|3,0,0]=4 414 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 240690a_100000765925_100000185835 [0,1,0,0,0,0|3,0,0]=4 415 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 527a_100000765925_100000185835 [0,1,0,0,0,0|3,0,0]=4 416 B15R1.86 C=Cc1ccccc1C(=O)CCC(=C)C 1458a_100011830265_100000730704 [0,1,0,0,0,0|3,0,0]=4 417 B15R1.86 C=Cc1ccccc1C(=O)CCC(C)O 1458a_100011830265_100012276601 [0,1,0,0,0,0|2,0,1]=4 418 B15R1.86 C=Cc1ccccc1C(=O)OCC(=O)C 271570a_100011290941_201991511838 [0,1,0,0,0,0|3,0,0]=4 419 B15R1.86 CC(=CCC(=O)c1ccccc1CO)C 1458a_100011301526_100000761012 [0,1,0,0,0,0|2,0,1]=4 420 B15R1.86 CC(=O)COC(=O)c1ccccc1S[13CH3] 62a_200025704644_201991511838 [0,1,0,0,0,0|2,1,0]=4 421 B15R1.86 CC(=O)COC(=O)c1ccccc1S[13CH3] 62a_201991511838_200025704644 [0,1,0,0,0,0|2,1,0]=4 422 B15R1.86 CC(C)CCC(=O)c1ccccc1CO 1458a_100011301526_100000210312 [0,1,0,0,0,0|2,0,1]=4 423 B15R1.86 CC(O)CCC(=O)c1ccccc1C#N 1458a_100000742908_100012276601 [0,1,0,0,0,0|2,0,1]=4 424 B15R1.86 CC(O)CCC(=O)c1ccccc1CO 1458a_100011301526_100012276601 [0,1,0,0,0,0|1,0,1]=3 425 B15R1.86 CC(O)CCC(=O)c1ccccc1I=O 1458a_100000032414_100012276601 [0,1,0,0,0,0|1,0,2]=4 426 B15R1.86 CCc1ccccc1C(=O)CCC(C)O 1458a_100000689120_100012276601 [0,1,0,0,0,0|2,0,1]=4 427 B15R1.86 CCc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000689120 [0,1,0,0,0,0|3,0,0]=4 428 B15R1.86 CCc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000689120 [0,1,0,0,0,0|3,0,0]=4 429 B15R1.86 CCc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000689120 [0,1,0,0,0,0|3,0,0]=4 430 B15R1.86 COc1ccccc1C(=O)CC=C(C)C 1458a_100000185835_100000761012 [0,1,0,0,0,0|2,0,1]=4 431 B15R1.86 COc1ccccc1C(=O)CCC(C)C 1458a_100000185835_100000210312 [0,1,0,0,0,0|2,0,1]=4 432 B15R1.86 COc1ccccc1C(=O)CCC(C)O 1458a_100000185835_100012276601 [0,1,0,0,0,0|1,0,1]=3 433 B15R1.86 COc1ccccc1C(=O)NCC(=O)C 1458a_100000183908_200000210301 [0,1,0,0,0,0|2,0,0]=3 434 B15R1.86 COc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000185835 [0,1,0,0,0,0|2,0,0]=3 435 B15R1.86 COc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000185835 [0,1,0,0,0,0|2,0,0]=3 436 B15R1.86 COc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000185835 [0,1,0,0,0,0|2,0,0]=3 437 B15R1.86 COc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000183908_200025704644 [0,1,0,0,0,0|2,0,0]=3 438 B15R1.86 COc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000185835 [0,1,0,0,0,0|2,0,1]=4 439 B15R1.86 COc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000185835 [0,1,0,0,0,0|2,0,1]=4 440 B15R1.86 COc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000185835 [0,1,0,0,0,0|2,0,1]=4 441 B15R1.86 COc1ccccc1C(=O)NNC(=O)C 22a_100000189102_100000070787 [0,1,0,0,0,0|3,0,0]=4 442 B15R1.86 COc1ccccc1C(=O)NNC(=O)C 22a_100000189765_100000185835 [0,1,0,0,0,0|3,0,0]=4 443 B15R1.86 COc1ccccc1N(C)CCC(=O)C 269982a_100000219746_100000053229 [0,1,0,0,0,0|3,0,0]=4 444 B15R1.86 COc1ccccc1N(C)CCC(=O)N 2230a_100000219746_100000744528 [0,1,0,0,0,0|3,0,0]=4 445 B15R1.86 COc1ccccc1N(C)CCC(=O)N 269982a_100000219746_100000744528 [0,1,0,0,0,0|3,0,0]=4 446 B15R1.86 COc1ccccc1N(C)CCC(=O)N 34a_100000219746_100000731001 [0,1,0,0,0,0|3,0,0]=4 447 B15R1.86 CSc1ccccc1C(=O)CCC(C)O 1458a_100000183967_100012276601 [0,1,0,0,0,0|1,1,1]=4 448 B15R1.86 CSc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000183967 [0,1,0,0,0,0|2,1,0]=4 449 B15R1.86 CSc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000183967 [0,1,0,0,0,0|2,1,0]=4 450 B15R1.86 CSc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000183967 [0,1,0,0,0,0|2,1,0]=4 451 B15R1.86 CSc1ccccc1C(=O)OCC(=O)C 62a_200000210301_201991511838 [0,1,0,0,0,0|2,1,0]=4 452 B15R1.86 CSc1ccccc1C(=O)OCC(=O)C 62a_201991511838_200000210301 [0,1,0,0,0,0|2,1,0]=4 453 B15R1.86 N#Cc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000742908 [0,1,0,0,0,0|3,0,0]=4 454 B15R1.86 N#Cc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000742908 [0,1,0,0,0,0|3,0,0]=4 455 B15R1.86 NC(=O)CNC(=O)c1ccccc1I=O 240690a_100000711301_100000032414 [0,1,0,0,0,0|2,0,1]=4 456 B15R1.86 NC(=O)CNC(=O)c1ccccc1I=O 527a_100000711301_100000032414 [0,1,0,0,0,0|2,0,1]=4 457 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000730704 [0,1,0,0,0,0|3,0,0]=4 458 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000730704 [0,1,0,0,0,0|3,0,0]=4 459 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000730704 [0,1,0,0,0,0|3,0,0]=4 460 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000730704 [0,1,0,0,0,0|3,0,0]=4 461 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000730704 [0,1,0,0,0,0|3,0,0]=4 462 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000730704 [0,1,0,0,0,0|3,0,0]=4 463 B15R1.124 C=C(C)CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000730704 [0,1,0,0,0,0|3,0,0]=4 464 B15R1.124 C=C(C)CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000730704 [0,1,0,0,0,0|3,0,0]=4 465 B15R1.124 C=C(C)CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000730704 [0,1,0,0,0,0|3,0,0]=4 466 B15R1.124 C=C(C)CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000730704 [0,1,0,0,0,0|3,0,0]=4 467 B15R1.124 C=C(C)CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000730704 [0,1,0,0,0,0|3,0,0]=4 468 B15R1.124 C=C(C)CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000730704 [0,1,0,0,0,0|3,0,0]=4 469 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000730704 [0,1,0,0,0,0|3,0,0]=4 470 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000730704 [0,1,0,0,0,0|3,0,0]=4 471 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000730704 [0,1,0,0,0,0|3,0,0]=4 472 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000730704 [0,1,0,0,0,0|3,0,0]=4 473 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000730704 [0,1,0,0,0,0|3,0,0]=4 474 B15R1.124 C=C(C)CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000730704 [0,1,0,0,0,0|3,0,0]=4 475 B15R1.124 C=C(C)CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000730704 [0,1,0,0,0,0|3,0,0]=4 476 B15R1.124 C=C(C)CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000730704 [0,1,0,0,0,0|3,0,0]=4 477 B15R1.124 C=C(C)CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000730704 [0,1,0,0,0,0|3,0,0]=4 478 B15R1.124 C=C(C)CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000730704 [0,1,0,0,0,0|3,0,0]=4 479 B15R1.124 C=C(C)CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000730704 [0,1,0,0,0,0|3,0,0]=4 480 B15R1.124 C=C(C)CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000730704 [0,1,0,0,0,0|3,0,0]=4 481 B15R1.124 C=C(C)CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000730704 [0,1,0,0,0,0|3,0,0]=4 482 B15R1.124 C=C(C)CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000730704 [0,1,0,0,0,0|3,0,0]=4 483 B15R1.124 C=C(C)CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000730704 [0,1,0,0,0,0|3,0,0]=4 484 B15R1.124 C=C(C)CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000730704 [0,1,0,0,0,0|3,0,0]=4 485 B15R1.124 C=C(C)CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000730704 [0,1,0,0,0,0|3,0,0]=4 486 B15R1.124 C=C(C)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000730704 [0,1,0,0,0,0|2,0,0]=3 487 B15R1.124 C=C(C)CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000730704 [0,1,0,0,0,0|2,0,0]=3 488 B15R1.124 C=C(C)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000730704 [0,1,0,0,0,0|2,0,0]=3 489 B15R1.124 C=C(C)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000730704 [0,1,0,0,0,0|2,0,0]=3 490 B15R1.124 C=C(C)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000730704 [0,1,0,0,0,0|2,0,0]=3 491 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)Br 240690a_100000765925_100000752940 [0,1,0,0,0,0|3,0,0]=4 492 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)Br 527a_100000765925_100000752940 [0,1,0,0,0,0|3,0,0]=4 493 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)C 240690a_100000765925_100000183896 [0,1,0,0,0,0|3,0,0]=4 494 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)C 527a_100000765925_100000183896 [0,1,0,0,0,0|3,0,0]=4 495 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)Cl 240690a_100000765925_100000742801 [0,1,0,0,0,0|3,0,0]=4 496 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)Cl 527a_100000765925_100000742801 [0,1,0,0,0,0|3,0,0]=4 497 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)F 240690a_100000765925_100011217230 [0,1,0,0,0,0|3,0,0]=4 498 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)F 527a_100000765925_100011217230 [0,1,0,0,0,0|3,0,0]=4 499 B15R1.124 C=C(C)CNC(=O)c1cccc(c1O)O 527a_100000765925_100000690420 [0,1,0,0,0,0|3,0,0]=4 500 B15R1.124 CC(=CCC(=O)c1cccc(c1O)Br)C 1458a_100000752940_100000761012 [0,1,0,0,0,0|2,0,1]=4 501 B15R1.124 CC(=CCC(=O)c1cccc(c1O)C)C 1458a_100000183896_100000761012 [0,1,0,0,0,0|2,0,1]=4 502 B15R1.124 CC(=CCC(=O)c1cccc(c1O)Cl)C 1458a_100000742801_100000761012 [0,1,0,0,0,0|2,0,1]=4 503 B15R1.124 CC(=CCC(=O)c1cccc(c1O)F)C 1458a_100011217230_100000761012 [0,1,0,0,0,0|2,0,1]=4 504 B15R1.124 CC(=CCC(=O)c1cccc(c1O)O)C 1458a_100000690420_100000761012 [0,1,0,0,0,0|2,0,1]=4 505 B15R1.124 CC(=O)NNC(=O)c1cccc(c1O)Br 22a_100000189765_100000752940 [0,1,0,0,0,0|3,0,0]=4 506 B15R1.124 CC(=O)NNC(=O)c1cccc(c1O)C 22a_100000189765_100000183896 [0,1,0,0,0,0|3,0,0]=4 507 B15R1.124 CC(=O)NNC(=O)c1cccc(c1O)Cl 22a_100000189765_100000742801 [0,1,0,0,0,0|3,0,0]=4 508 B15R1.124 CC(=O)NNC(=O)c1cccc(c1O)F 22a_100000189765_100011217230 [0,1,0,0,0,0|3,0,0]=4 509 B15R1.124 CC(=O)NNC(=O)c1cccc(c1O)O 22a_100000189765_100000690420 [0,1,0,0,0,0|3,0,0]=4 510 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210312 [0,1,0,0,0,0|2,0,1]=4 511 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210312 [0,1,0,0,0,0|2,0,1]=4 512 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210312 [0,1,0,0,0,0|2,0,1]=4 513 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210312 [0,1,0,0,0,0|2,0,1]=4 514 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100012276601 [0,1,0,0,0,0|2,0,1]=4 515 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100012276601 [0,1,0,0,0,0|2,0,1]=4 516 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100012276601 [0,1,0,0,0,0|2,0,1]=4 517 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100012276601 [0,1,0,0,0,0|2,0,1]=4 518 B15R1.124 CC(O)CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100012276601 [0,1,0,0,0,0|2,0,1]=4 519 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100012276601 [0,1,0,0,0,0|2,0,1]=4 520 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100012276601 [0,1,0,0,0,0|2,0,1]=4 521 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100012276601 [0,1,0,0,0,0|2,0,1]=4 522 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100012276601 [0,1,0,0,0,0|2,0,1]=4 523 B15R1.124 CC(O)CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100012276601 [0,1,0,0,0,0|2,0,1]=4 524 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100012276601 [0,1,0,0,0,0|2,0,1]=4 525 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100012276601 [0,1,0,0,0,0|2,0,1]=4 526 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)F 1458a_100000748134_100012276601 [0,1,0,0,0,0|2,0,1]=4 527 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)I 1458a_100010185205_100012276601 [0,1,0,0,0,0|2,0,1]=4 528 B15R1.124 CC(O)CCC(=O)c1cccc(c1F)O 1458a_100000037433_100012276601 [0,1,0,0,0,0|2,0,1]=4 529 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100012276601 [0,1,0,0,0,0|2,0,1]=4 530 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100012276601 [0,1,0,0,0,0|2,0,1]=4 531 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)F 1458a_100000690930_100012276601 [0,1,0,0,0,0|2,0,1]=4 532 B15R1.124 CC(O)CCC(=O)c1cccc(c1I)O 1458a_100010084636_100012276601 [0,1,0,0,0,0|2,0,1]=4 533 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100012276601 [0,1,0,0,0,0|1,0,1]=3 534 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100012276601 [0,1,0,0,0,0|1,0,1]=3 535 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100012276601 [0,1,0,0,0,0|1,0,1]=3 536 B15R1.124 CC(O)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100012276601 [0,1,0,0,0,0|1,0,1]=3 537 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Br 240690a_100000210904_100000752940 [0,1,0,0,0,0|2,0,1]=4 538 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Br 527a_100000210904_100000752940 [0,1,0,0,0,0|2,0,1]=4 539 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Cl 240690a_100000210904_100000742801 [0,1,0,0,0,0|2,0,1]=4 540 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)Cl 527a_100000210904_100000742801 [0,1,0,0,0,0|2,0,1]=4 541 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)F 240690a_100000210904_100011217230 [0,1,0,0,0,0|2,0,1]=4 542 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)F 527a_100000210904_100011217230 [0,1,0,0,0,0|2,0,1]=4 543 B15R1.124 CC(O)CNC(=O)c1cccc(c1O)O 527a_100000210904_100000690420 [0,1,0,0,0,0|2,0,1]=4 544 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)Br 1458a_100000760464_100012276601 [0,1,0,0,0,0|2,0,1]=4 545 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)Cl 1458a_100000690184_100012276601 [0,1,0,0,0,0|2,0,1]=4 546 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)F 1458a_100011218272_100012276601 [0,1,0,0,0,0|2,0,1]=4 547 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)I 1458a_100000751865_100012276601 [0,1,0,0,0,0|2,0,1]=4 548 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)O 1458a_100000766327_100012276601 [0,1,0,0,0,0|2,0,1]=4 549 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)Br 11a_100000711301_100000760464 [0,1,0,0,0,0|3,0,0]=4 550 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)Br 240690a_100000711301_100000760464 [0,1,0,0,0,0|3,0,0]=4 551 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)Br 527a_100000711301_100000760464 [0,1,0,0,0,0|3,0,0]=4 552 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)Cl 11a_100000711301_100000690184 [0,1,0,0,0,0|3,0,0]=4 553 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000690184 [0,1,0,0,0,0|3,0,0]=4 554 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)Cl 527a_100000711301_100000690184 [0,1,0,0,0,0|3,0,0]=4 555 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)F 11a_100000711301_100011218272 [0,1,0,0,0,0|3,0,0]=4 556 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)F 240690a_100000711301_100011218272 [0,1,0,0,0,0|3,0,0]=4 557 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)F 527a_100000711301_100011218272 [0,1,0,0,0,0|3,0,0]=4 558 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)I 11a_100000711301_100000751865 [0,1,0,0,0,0|3,0,0]=4 559 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)I 240690a_100000711301_100000751865 [0,1,0,0,0,0|3,0,0]=4 560 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)I 527a_100000711301_100000751865 [0,1,0,0,0,0|3,0,0]=4 561 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)O 240690a_100000711301_100000766327 [0,1,0,0,0,0|3,0,0]=4 562 B15R1.124 Cc1c(cccc1C(=O)NCC(=O)N)O 527a_100000711301_100000766327 [0,1,0,0,0,0|3,0,0]=4 563 B15R1.124 Cc1cccc(c1Br)C(=O)CCC(C)O 1458a_100000692419_100012276601 [0,1,0,0,0,0|2,0,1]=4 564 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(=O)N 11a_100000711301_100000692419 [0,1,0,0,0,0|3,0,0]=4 565 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(=O)N 240690a_100000711301_100000692419 [0,1,0,0,0,0|3,0,0]=4 566 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(=O)N 527a_100000711301_100000692419 [0,1,0,0,0,0|3,0,0]=4 567 B15R1.124 Cc1cccc(c1C)C(=O)CCC(C)O 1458a_100000183679_100012276601 [0,1,0,0,0,0|2,0,1]=4 568 B15R1.124 Cc1cccc(c1C)C(=O)NCC(=O)N 11a_100000711301_100000183679 [0,1,0,0,0,0|3,0,0]=4 569 B15R1.124 Cc1cccc(c1C)C(=O)NCC(=O)N 240690a_100000711301_100000183679 [0,1,0,0,0,0|3,0,0]=4 570 B15R1.124 Cc1cccc(c1C)C(=O)NCC(=O)N 527a_100000711301_100000183679 [0,1,0,0,0,0|3,0,0]=4 571 B15R1.124 Cc1cccc(c1Cl)C(=O)CCC(C)O 1458a_100000693142_100012276601 [0,1,0,0,0,0|2,0,1]=4 572 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(=O)N 11a_100000711301_100000693142 [0,1,0,0,0,0|3,0,0]=4 573 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(=O)N 240690a_100000711301_100000693142 [0,1,0,0,0,0|3,0,0]=4 574 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(=O)N 527a_100000711301_100000693142 [0,1,0,0,0,0|3,0,0]=4 575 B15R1.124 Cc1cccc(c1F)C(=O)CCC(C)O 1458a_100000766181_100012276601 [0,1,0,0,0,0|2,0,1]=4 576 B15R1.124 Cc1cccc(c1F)C(=O)NCC(=O)N 11a_100000711301_100000766181 [0,1,0,0,0,0|3,0,0]=4 577 B15R1.124 Cc1cccc(c1F)C(=O)NCC(=O)N 240690a_100000711301_100000766181 [0,1,0,0,0,0|3,0,0]=4 578 B15R1.124 Cc1cccc(c1F)C(=O)NCC(=O)N 527a_100000711301_100000766181 [0,1,0,0,0,0|3,0,0]=4 579 B15R1.124 Cc1cccc(c1I)C(=O)CCC(C)O 1458a_100000739377_100012276601 [0,1,0,0,0,0|2,0,1]=4 580 B15R1.124 Cc1cccc(c1I)C(=O)NCC(=O)N 11a_100000711301_100000739377 [0,1,0,0,0,0|3,0,0]=4 581 B15R1.124 Cc1cccc(c1I)C(=O)NCC(=O)N 240690a_100000711301_100000739377 [0,1,0,0,0,0|3,0,0]=4 582 B15R1.124 Cc1cccc(c1I)C(=O)NCC(=O)N 527a_100000711301_100000739377 [0,1,0,0,0,0|3,0,0]=4 583 B15R1.124 Cc1cccc(c1O)C(=O)CCC(C)C 1458a_100000183896_100000210312 [0,1,0,0,0,0|2,0,1]=4 584 B15R1.124 Cc1cccc(c1O)C(=O)CCC(C)O 1458a_100000183896_100012276601 [0,1,0,0,0,0|1,0,1]=3 585 B15R1.124 Cc1cccc(c1O)C(=O)NCC(=O)N 240690a_100000711301_100000183896 [0,1,0,0,0,0|2,0,0]=3 586 B15R1.124 Cc1cccc(c1O)C(=O)NCC(=O)N 527a_100000711301_100000183896 [0,1,0,0,0,0|2,0,0]=3 587 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)O 240690a_100000210904_100000183896 [0,1,0,0,0,0|2,0,1]=4 588 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)O 527a_100000210904_100000183896 [0,1,0,0,0,0|2,0,1]=4 589 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)Br 11a_100000711301_100012360534 [0,1,0,0,0,0|3,0,0]=4 590 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)Br 240690a_100000711301_100012360534 [0,1,0,0,0,0|3,0,0]=4 591 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)Br 527a_100000711301_100012360534 [0,1,0,0,0,0|3,0,0]=4 592 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)Cl 11a_100000711301_100012339722 [0,1,0,0,0,0|3,0,0]=4 593 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)Cl 240690a_100000711301_100012339722 [0,1,0,0,0,0|3,0,0]=4 594 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)Cl 527a_100000711301_100012339722 [0,1,0,0,0,0|3,0,0]=4 595 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)F 11a_100000711301_100011217547 [0,1,0,0,0,0|3,0,0]=4 596 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)F 240690a_100000711301_100011217547 [0,1,0,0,0,0|3,0,0]=4 597 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)F 527a_100000711301_100011217547 [0,1,0,0,0,0|3,0,0]=4 598 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)I 11a_100000711301_100010232522 [0,1,0,0,0,0|3,0,0]=4 599 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)I 240690a_100000711301_100010232522 [0,1,0,0,0,0|3,0,0]=4 600 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)I 527a_100000711301_100010232522 [0,1,0,0,0,0|3,0,0]=4 601 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)O 240690a_100000711301_100010230362 [0,1,0,0,0,0|3,0,0]=4 602 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Br)O 527a_100000711301_100010230362 [0,1,0,0,0,0|3,0,0]=4 603 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)Br 11a_100000711301_100000760540 [0,1,0,0,0,0|3,0,0]=4 604 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)Br 240690a_100000711301_100000760540 [0,1,0,0,0,0|3,0,0]=4 605 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)Br 527a_100000711301_100000760540 [0,1,0,0,0,0|3,0,0]=4 606 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)Cl 11a_100000711301_100000183631 [0,1,0,0,0,0|3,0,0]=4 607 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)Cl 240690a_100000711301_100000183631 [0,1,0,0,0,0|3,0,0]=4 608 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)Cl 527a_100000711301_100000183631 [0,1,0,0,0,0|3,0,0]=4 609 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)F 11a_100000711301_100000759904 [0,1,0,0,0,0|3,0,0]=4 610 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)F 240690a_100000711301_100000759904 [0,1,0,0,0,0|3,0,0]=4 611 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)F 527a_100000711301_100000759904 [0,1,0,0,0,0|3,0,0]=4 612 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)I 11a_100000711301_100010176783 [0,1,0,0,0,0|3,0,0]=4 613 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)I 240690a_100000711301_100010176783 [0,1,0,0,0,0|3,0,0]=4 614 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)I 527a_100000711301_100010176783 [0,1,0,0,0,0|3,0,0]=4 615 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)O 240690a_100000711301_100000092362 [0,1,0,0,0,0|3,0,0]=4 616 B15R1.124 NC(=O)CNC(=O)c1cccc(c1Cl)O 527a_100000711301_100000092362 [0,1,0,0,0,0|3,0,0]=4 617 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)Br 11a_100000711301_100000756403 [0,1,0,0,0,0|3,0,0]=4 618 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)Br 240690a_100000711301_100000756403 [0,1,0,0,0,0|3,0,0]=4 619 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)Br 527a_100000711301_100000756403 [0,1,0,0,0,0|3,0,0]=4 620 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)Cl 11a_100000711301_100000688816 [0,1,0,0,0,0|3,0,0]=4 621 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)Cl 240690a_100000711301_100000688816 [0,1,0,0,0,0|3,0,0]=4 622 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)Cl 527a_100000711301_100000688816 [0,1,0,0,0,0|3,0,0]=4 623 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)F 11a_100000711301_100000748134 [0,1,0,0,0,0|3,0,0]=4 624 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)F 240690a_100000711301_100000748134 [0,1,0,0,0,0|3,0,0]=4 625 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)F 527a_100000711301_100000748134 [0,1,0,0,0,0|3,0,0]=4 626 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)I 11a_100000711301_100010185205 [0,1,0,0,0,0|3,0,0]=4 627 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)I 240690a_100000711301_100010185205 [0,1,0,0,0,0|3,0,0]=4 628 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)I 527a_100000711301_100010185205 [0,1,0,0,0,0|3,0,0]=4 629 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)O 240690a_100000711301_100000037433 [0,1,0,0,0,0|3,0,0]=4 630 B15R1.124 NC(=O)CNC(=O)c1cccc(c1F)O 527a_100000711301_100000037433 [0,1,0,0,0,0|3,0,0]=4 631 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)Br 11a_100000711301_100000688019 [0,1,0,0,0,0|3,0,0]=4 632 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)Br 240690a_100000711301_100000688019 [0,1,0,0,0,0|3,0,0]=4 633 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)Br 527a_100000711301_100000688019 [0,1,0,0,0,0|3,0,0]=4 634 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)Cl 11a_100000711301_100010176784 [0,1,0,0,0,0|3,0,0]=4 635 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)Cl 240690a_100000711301_100010176784 [0,1,0,0,0,0|3,0,0]=4 636 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)Cl 527a_100000711301_100010176784 [0,1,0,0,0,0|3,0,0]=4 637 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)F 11a_100000711301_100000690930 [0,1,0,0,0,0|3,0,0]=4 638 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)F 240690a_100000711301_100000690930 [0,1,0,0,0,0|3,0,0]=4 639 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)F 527a_100000711301_100000690930 [0,1,0,0,0,0|3,0,0]=4 640 B15R1.124 NC(=O)CNC(=O)c1cccc(c1I)O 527a_100000711301_100010084636 [0,1,0,0,0,0|3,0,0]=4 641 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)Br 240690a_100000711301_100000752940 [0,1,0,0,0,0|2,0,0]=3 642 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)Br 527a_100000711301_100000752940 [0,1,0,0,0,0|2,0,0]=3 643 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)Cl 240690a_100000711301_100000742801 [0,1,0,0,0,0|2,0,0]=3 644 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)Cl 527a_100000711301_100000742801 [0,1,0,0,0,0|2,0,0]=3 645 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)F 240690a_100000711301_100011217230 [0,1,0,0,0,0|2,0,0]=3 646 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)F 527a_100000711301_100011217230 [0,1,0,0,0,0|2,0,0]=3 647 B15R1.124 NC(=O)CNC(=O)c1cccc(c1O)O 527a_100000711301_100000690420 [0,1,0,0,0,0|2,0,0]=3 648 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1Br 1458a_100000188424_100009818208 [0,1,0,0,0,0|3,0,0]=4 649 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1C 1458a_100000212026_100009818208 [0,1,0,0,0,0|3,0,0]=4 650 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100009818208 [0,1,0,0,0,0|3,0,0]=4 651 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1F 1458a_100000188656_100009818208 [0,1,0,0,0,0|3,0,0]=4 652 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1I 1458a_100000187884_100009818208 [0,1,0,0,0,0|3,0,0]=4 653 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1O 1458a_100015234032_100009818208 [0,1,0,0,0,0|2,0,0]=3 654 B15R1.5792 CC(=O)OC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100009818208 [0,1,0,0,0,0|2,0,1]=4 655 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1O 1458a_100015234032_100000731052 [0,1,0,0,0,0|2,0,1]=4 656 B15R1.5792 CC(O)CN(C)C(=O)c1ccccc1O 240690a_100000227577_100015234032 [0,1,0,0,0,0|2,0,1]=4 657 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1Br 11a_100000739694_100000188424 [0,1,0,0,0,0|3,0,0]=4 658 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1Br 527a_100000739694_100000188424 [0,1,0,0,0,0|3,0,0]=4 659 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1Cl 11a_100000739694_100000185844 [0,1,0,0,0,0|3,0,0]=4 660 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1Cl 527a_100000739694_100000185844 [0,1,0,0,0,0|3,0,0]=4 661 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1F 11a_100000739694_100000188656 [0,1,0,0,0,0|3,0,0]=4 662 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1F 527a_100000739694_100000188656 [0,1,0,0,0,0|3,0,0]=4 663 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1I 11a_100000739694_100000187884 [0,1,0,0,0,0|3,0,0]=4 664 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1I 527a_100000739694_100000187884 [0,1,0,0,0,0|3,0,0]=4 665 B15R1.5792 CN(CC(=O)N)C(=O)c1ccccc1[O-] 527a_100000739694_100009911694 [0,1,0,0,0,0|2,0,1]=4 666 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(=O)N 11a_100000739694_100000212026 [0,1,0,0,0,0|3,0,0]=4 667 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(=O)N 527a_100000739694_100000212026 [0,1,0,0,0,0|3,0,0]=4 668 B15R1.5793 C=C(C)C(=O)CC(=O)c1ccccc1O 1458a_100000185857_100000188908 [0,1,0,0,0,0|2,0,1]=4 669 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100011261029 [0,1,0,0,0,0|2,0,1]=4 670 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1C 1458a_100000212026_100011261029 [0,1,0,0,0,0|2,0,1]=4 671 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011261029 [0,1,0,0,0,0|2,0,1]=4 672 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1F 1458a_100000188656_100011261029 [0,1,0,0,0,0|2,0,1]=4 673 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1I 1458a_100000187884_100011261029 [0,1,0,0,0,0|2,0,1]=4 674 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1O 1458a_100015234032_100011261029 [0,1,0,0,0,0|1,0,1]=3 675 B15R1.5793 CC(=O)C(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011261029 [0,1,0,0,0,0|1,0,2]=4 676 B15R1.5793 CC(=O)C(C)NC(=O)c1ccccc1Cl 1458a_100000183269_200000210301 [0,1,0,0,0,0|3,0,0]=4 677 B15R1.5793 CC(NC(=O)c1ccccc1Cl)C(=O)[13CH3] 1458a_100000183269_200025704644 [0,1,0,0,0,0|3,0,0]=4 678 B15R1.5793 C[C@@H](NC(=O)c1ccccc1Br)C(=O)N 11a_100000119354_100000188424 [0,1,0,0,0,0|3,0,0]=4 679 B15R1.5793 C[C@@H](NC(=O)c1ccccc1Br)C(=O)N 240690a_100000119354_100000188424 [0,1,0,0,0,0|3,0,0]=4 680 B15R1.5793 C[C@@H](NC(=O)c1ccccc1Br)C(=O)N 527a_100000119354_100000188424 [0,1,0,0,0,0|3,0,0]=4 681 B15R1.5793 C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N 11a_100000119354_100000185844 [0,1,0,0,0,0|3,0,0]=4 682 B15R1.5793 C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N 240690a_100000119354_100000185844 [0,1,0,0,0,0|3,0,0]=4 683 B15R1.5793 C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N 527a_100000119354_100000185844 [0,1,0,0,0,0|3,0,0]=4 684 B15R1.5793 C[C@@H](NC(=O)c1ccccc1F)C(=O)N 11a_100000119354_100000188656 [0,1,0,0,0,0|3,0,0]=4 685 B15R1.5793 C[C@@H](NC(=O)c1ccccc1F)C(=O)N 240690a_100000119354_100000188656 [0,1,0,0,0,0|3,0,0]=4 686 B15R1.5793 C[C@@H](NC(=O)c1ccccc1F)C(=O)N 527a_100000119354_100000188656 [0,1,0,0,0,0|3,0,0]=4 687 B15R1.5793 C[C@@H](NC(=O)c1ccccc1I)C(=O)N 11a_100000119354_100000187884 [0,1,0,0,0,0|3,0,0]=4 688 B15R1.5793 C[C@@H](NC(=O)c1ccccc1I)C(=O)N 240690a_100000119354_100000187884 [0,1,0,0,0,0|3,0,0]=4 689 B15R1.5793 C[C@@H](NC(=O)c1ccccc1I)C(=O)N 527a_100000119354_100000187884 [0,1,0,0,0,0|3,0,0]=4 690 B15R1.5793 C[C@@H](NC(=O)c1ccccc1O)C(=O)N 240690a_100000119354_100015234032 [0,1,0,0,0,0|2,0,0]=3 691 B15R1.5793 C[C@@H](NC(=O)c1ccccc1[O-])C(=O)N 240690a_100000119354_100009911694 [0,1,0,0,0,0|2,0,1]=4 692 B15R1.5793 C[C@@H](NC(=O)c1ccccc1[O-])C(=O)N 527a_100000119354_100009911694 [0,1,0,0,0,0|2,0,1]=4 693 B15R1.5793 C[C@@H](O)C(=O)CC(=O)c1ccccc1O 1458a_100000717761_100000188908 [0,1,0,0,0,0|1,0,2]=4 694 B15R1.5793 C[C@H](O)C(=O)CC(=O)c1ccccc1O 1458a_217856618621_100000188908 [0,1,0,0,0,0|1,0,2]=4 695 B15R1.5793 Cc1ccccc1C(=O)N[C@H](C)C(=O)N 11a_100000119354_100000212026 [0,1,0,0,0,0|3,0,0]=4 696 B15R1.5793 Cc1ccccc1C(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000212026 [0,1,0,0,0,0|3,0,0]=4 697 B15R1.5793 Cc1ccccc1C(=O)N[C@H](C)C(=O)N 527a_100000119354_100000212026 [0,1,0,0,0,0|3,0,0]=4 698 B15R1.5793 O=C(CC(=O)C(O)O)c1ccccc1O 1458a_100000233687_100000188908 [0,1,0,0,0,0|0,0,3]=4 699 B15R1.5815 C#CC(=O)CCC(=O)c1ccccc1F 1458a_100000211873_100000086012 [0,1,0,0,0,0|2,0,0]=3 700 B15R1.5815 C=CC(=O)CCC(=O)c1ccccc1F 1458a_100000185746_100000086012 [0,1,0,0,0,0|2,0,0]=3 701 B15R1.5815 CC(CO)CNC(=O)c1ccccc1O 240690a_100000744482_100015234032 [0,1,0,0,0,0|2,0,1]=4 702 B15R1.5815 CC(CO)SCC(=O)c1ccccc1O 62a_100012180447_100000188908 [0,1,0,0,0,0|2,0,1]=4 703 B15R1.5815 CCC(=O)CCC(=O)c1ccccc1F 1458a_100000210414_100000086012 [0,1,0,0,0,0|2,0,0]=3 704 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_100000210202 [0,1,0,0,0,0|3,0,0]=4 705 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_100000210202 [0,1,0,0,0,0|3,0,0]=4 706 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1F 1458a_100000182453_100000210202 [0,1,0,0,0,0|3,0,0]=4 707 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1I 1458a_100000194700_100000210202 [0,1,0,0,0,0|3,0,0]=4 708 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000210202 [0,1,0,0,0,0|2,0,0]=3 709 B15R1.5815 CCC(=O)NNC(=O)c1ccccc1O 22a_100000183195_100015234032 [0,1,0,0,0,0|3,0,0]=4 710 B15R1.5815 CCC(O)CNC(=O)c1ccccc1O 240690a_100011218483_100015234032 [0,1,0,0,0,0|2,0,1]=4 711 B15R1.5815 CCN(C)CCC(=O)c1ccccc1O 269982a_100000225621_100009873196 [0,1,0,0,0,0|3,0,0]=4 712 B15R1.5815 CNC(=O)CCN(C)c1ccccc1O 269982a_100000033821_100000737683 [0,1,0,0,0,0|3,0,0]=4 713 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Br 11a_100000693194_100000188424 [0,1,0,0,0,0|3,0,0]=4 714 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Br 240690a_100000693194_100000188424 [0,1,0,0,0,0|3,0,0]=4 715 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Br 527a_100000693194_100000188424 [0,1,0,0,0,0|3,0,0]=4 716 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1C 11a_100000693194_100000212026 [0,1,0,0,0,0|3,0,0]=4 717 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1C 11a_106832991635_100000184812 [0,1,0,0,0,0|3,0,0]=4 718 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1C 240690a_100000693194_100000212026 [0,1,0,0,0,0|3,0,0]=4 719 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1C 240690a_100102657272_100000184812 [0,1,0,0,0,0|3,0,0]=4 720 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1C 527a_100000693194_100000212026 [0,1,0,0,0,0|3,0,0]=4 721 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1C 527a_100102657272_100000184812 [0,1,0,0,0,0|3,0,0]=4 722 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Cl 11a_100000693194_100000185844 [0,1,0,0,0,0|3,0,0]=4 723 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Cl 240690a_100000693194_100000185844 [0,1,0,0,0,0|3,0,0]=4 724 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Cl 240690a_100102657272_100000182550 [0,1,0,0,0,0|3,0,0]=4 725 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Cl 527a_100000693194_100000185844 [0,1,0,0,0,0|3,0,0]=4 726 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1Cl 527a_100102657272_100000182550 [0,1,0,0,0,0|3,0,0]=4 727 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1F 11a_100000693194_100000188656 [0,1,0,0,0,0|3,0,0]=4 728 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1F 11a_106832991635_100000182453 [0,1,0,0,0,0|3,0,0]=4 729 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1F 240690a_100000693194_100000188656 [0,1,0,0,0,0|3,0,0]=4 730 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1F 240690a_100102657272_100000182453 [0,1,0,0,0,0|3,0,0]=4 731 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1F 527a_100000693194_100000188656 [0,1,0,0,0,0|3,0,0]=4 732 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1F 527a_100102657272_100000182453 [0,1,0,0,0,0|3,0,0]=4 733 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1I 11a_100000693194_100000187884 [0,1,0,0,0,0|3,0,0]=4 734 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1I 1626a_100102657272_100000194700 [0,1,0,0,0,0|3,0,0]=4 735 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1I 240690a_100000693194_100000187884 [0,1,0,0,0,0|3,0,0]=4 736 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1I 240690a_100102657272_100000194700 [0,1,0,0,0,0|3,0,0]=4 737 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1I 527a_100000693194_100000187884 [0,1,0,0,0,0|3,0,0]=4 738 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1I 527a_100102657272_100000194700 [0,1,0,0,0,0|3,0,0]=4 739 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1O 240690a_100000693194_100015234032 [0,1,0,0,0,0|2,0,0]=3 740 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1O 240690a_100102657272_100011193979 [0,1,0,0,0,0|2,0,0]=3 741 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1O 527a_100102657272_100011193979 [0,1,0,0,0,0|2,0,0]=3 742 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1[O-] 240690a_100000693194_100009911694 [0,1,0,0,0,0|2,0,1]=4 743 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1[O-] 527a_100000693194_100009911694 [0,1,0,0,0,0|2,0,1]=4 744 B15R1.5815 COC(=O)CCN(C)c1ccccc1Br 2230a_100020606079_100000204255 [0,1,0,0,0,0|3,0,0]=4 745 B15R1.5815 COC(=O)CCN(C)c1ccccc1Br 269982a_100020606079_100000204255 [0,1,0,0,0,0|3,0,0]=4 746 B15R1.5815 COC(=O)CCN(C)c1ccccc1Br 34a_100020606079_100000742370 [0,1,0,0,0,0|3,0,0]=4 747 B15R1.5815 COC(=O)CCN(C)c1ccccc1C 2230a_100000219699_100000204255 [0,1,0,0,0,0|3,0,0]=4 748 B15R1.5815 COC(=O)CCN(C)c1ccccc1C 269982a_100000219699_100000204255 [0,1,0,0,0,0|3,0,0]=4 749 B15R1.5815 COC(=O)CCN(C)c1ccccc1C 34a_100000219699_100000742370 [0,1,0,0,0,0|3,0,0]=4 750 B15R1.5815 COC(=O)CCN(C)c1ccccc1Cl 2230a_100000219374_100000204255 [0,1,0,0,0,0|3,0,0]=4 751 B15R1.5815 COC(=O)CCN(C)c1ccccc1Cl 269982a_100000219374_100000204255 [0,1,0,0,0,0|3,0,0]=4 752 B15R1.5815 COC(=O)CCN(C)c1ccccc1Cl 34a_100000219374_100000742370 [0,1,0,0,0,0|3,0,0]=4 753 B15R1.5815 COC(=O)CCN(C)c1ccccc1F 2230a_100000220357_100000204255 [0,1,0,0,0,0|3,0,0]=4 754 B15R1.5815 COC(=O)CCN(C)c1ccccc1F 269982a_100000220357_100000204255 [0,1,0,0,0,0|3,0,0]=4 755 B15R1.5815 COC(=O)CCN(C)c1ccccc1F 34a_100000220357_100000742370 [0,1,0,0,0,0|3,0,0]=4 756 B15R1.5815 COC(=O)CCN(C)c1ccccc1F 38a_100000220357_100000742370 [0,1,0,0,0,0|3,0,0]=4 757 B15R1.5815 COC(=O)CCN(C)c1ccccc1O 269982a_100000033821_100000204255 [0,1,0,0,0,0|2,0,0]=3 758 B15R1.5815 COC(=O)CNC(=O)c1ccccc1Br 188690a_100000185156_100000188424 [0,1,0,0,0,0|2,0,0]=3 759 B15R1.5815 COC(=O)CNC(=O)c1ccccc1C 188690a_100000185156_100000212026 [0,1,0,0,0,0|2,0,0]=3 760 B15R1.5815 COC(=O)CNC(=O)c1ccccc1Cl 188690a_100000185156_100000185844 [0,1,0,0,0,0|2,0,0]=3 761 B15R1.5815 COC(=O)CNC(=O)c1ccccc1I 188690a_100000185156_100000187884 [0,1,0,0,0,0|2,0,0]=3 762 B15R1.5815 COC(=O)CNC(=O)c1ccccc1O 188690a_100000185156_100015234032 [0,1,0,0,0,0|1,0,0]=2 763 B15R1.5815 COC(=O)CNC(=O)c1ccccc1[O-] 188690a_100000185156_100009911694 [0,1,0,0,0,0|1,0,1]=3 764 B15R1.5815 COC(=O)CN[C@H](C)c1ccccc1O 2230a_100025703389_100000747449 [0,1,0,0,0,0|2,0,1]=4 765 B15R1.5815 COC(C)SCC(=O)c1ccccc1O 62a_100000188908_100009879195 [0,1,0,0,0,0|2,0,1]=4 766 B15R1.5815 COC(C)SCC(=O)c1ccccc1O 62a_100009879195_100000188908 [0,1,0,0,0,0|2,0,1]=4 767 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1O 240690a_100020591295_100015234032 [0,1,0,0,0,0|2,0,1]=4 768 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1O 62a_100000188908_100016084084 [0,1,0,0,0,0|2,0,1]=4 769 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1O 62a_100016084084_100000188908 [0,1,0,0,0,0|2,0,1]=4 770 B15R1.5815 Cc1ccccc1C(=O)NCC(=O)CF 1458a_100000184812_100015361967 [0,1,0,0,0,0|3,0,0]=4 771 B15R1.5815 Cc1ccccc1C(=O)NNC(=O)CO 22a_100000181371_100000210174 [0,1,0,0,0,0|3,0,0]=4 772 B15R1.5815 O=C(CF)CNC(=O)c1ccccc1Cl 1458a_100000182550_100015361967 [0,1,0,0,0,0|3,0,0]=4 773 B15R1.5815 O=C(CF)CNC(=O)c1ccccc1F 1458a_100000182453_100015361967 [0,1,0,0,0,0|3,0,0]=4 774 B15R1.5815 O=C(CF)CNC(=O)c1ccccc1I 1458a_100000194700_100015361967 [0,1,0,0,0,0|3,0,0]=4 775 B15R1.5815 O=C(CF)CNC(=O)c1ccccc1O 1458a_100011193979_100015361967 [0,1,0,0,0,0|2,0,0]=3 776 B15R1.5815 O=C(CO)CCC(=O)c1ccccc1F 1458a_100000210174_100000086012 [0,1,0,0,0,0|1,0,0]=2 777 B15R1.5815 O=C(CO)NNC(=O)c1ccccc1Br 22a_100000183644_100000210174 [0,1,0,0,0,0|3,0,0]=4 778 B15R1.5815 O=C(CO)NNC(=O)c1ccccc1Cl 22a_100000186534_100000210174 [0,1,0,0,0,0|3,0,0]=4 779 B15R1.5815 O=C(CO)NNC(=O)c1ccccc1F 22a_100000183521_100000210174 [0,1,0,0,0,0|3,0,0]=4 780 B15R1.5815 O=C(CO)NNC(=O)c1ccccc1I 22a_100000190081_100000210174 [0,1,0,0,0,0|3,0,0]=4 781 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1O 240690a_100015665980_100015234032 [0,1,0,0,0,0|2,0,1]=4 782 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1O 240690a_100020644852_100015234032 [0,1,0,0,0,0|1,0,2]=4 783 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000730704 [0,1,0,0,0,0|3,0,0]=4 784 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000730704 [0,1,0,0,0,0|3,0,0]=4 785 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000730704 [0,1,0,0,0,0|3,0,0]=4 786 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000730704 [0,1,0,0,0,0|3,0,0]=4 787 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000730704 [0,1,0,0,0,0|3,0,0]=4 788 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000730704 [0,1,0,0,0,0|3,0,0]=4 789 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000730704 [0,1,0,0,0,0|3,0,0]=4 790 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000730704 [0,1,0,0,0,0|3,0,0]=4 791 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000730704 [0,1,0,0,0,0|3,0,0]=4 792 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000730704 [0,1,0,0,0,0|3,0,0]=4 793 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000730704 [0,1,0,0,0,0|3,0,0]=4 794 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000730704 [0,1,0,0,0,0|3,0,0]=4 795 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000730704 [0,1,0,0,0,0|3,0,0]=4 796 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000730704 [0,1,0,0,0,0|3,0,0]=4 797 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000730704 [0,1,0,0,0,0|3,0,0]=4 798 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000730704 [0,1,0,0,0,0|3,0,0]=4 799 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000730704 [0,1,0,0,0,0|3,0,0]=4 800 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000730704 [0,1,0,0,0,0|3,0,0]=4 801 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000730704 [0,1,0,0,0,0|3,0,0]=4 802 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000730704 [0,1,0,0,0,0|3,0,0]=4 803 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000730704 [0,1,0,0,0,0|3,0,0]=4 804 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000730704 [0,1,0,0,0,0|3,0,0]=4 805 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000730704 [0,1,0,0,0,0|3,0,0]=4 806 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000730704 [0,1,0,0,0,0|3,0,0]=4 807 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000730704 [0,1,0,0,0,0|3,0,0]=4 808 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000730704 [0,1,0,0,0,0|3,0,0]=4 809 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000730704 [0,1,0,0,0,0|3,0,0]=4 810 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000730704 [0,1,0,0,0,0|3,0,0]=4 811 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000730704 [0,1,0,0,0,0|2,0,0]=3 812 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000730704 [0,1,0,0,0,0|2,0,0]=3 813 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000730704 [0,1,0,0,0,0|2,0,0]=3 814 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000730704 [0,1,0,0,0,0|2,0,0]=3 815 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000730704 [0,1,0,0,0,0|2,0,0]=3 816 B15R1.5822 C=C(C)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000730704 [0,1,0,0,0,0|2,0,0]=3 817 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Br 240690a_100000765925_100000744433 [0,1,0,0,0,0|3,0,0]=4 818 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Br 527a_100000765925_100000744433 [0,1,0,0,0,0|3,0,0]=4 819 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)C 1626a_100000765925_100000212137 [0,1,0,0,0,0|3,0,0]=4 820 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)C 240690a_100000765925_100000212137 [0,1,0,0,0,0|3,0,0]=4 821 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)C 527a_100000765925_100000212137 [0,1,0,0,0,0|3,0,0]=4 822 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Cl 11a_100000765925_100000188622 [0,1,0,0,0,0|3,0,0]=4 823 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Cl 240690a_100000765925_100000188622 [0,1,0,0,0,0|3,0,0]=4 824 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Cl 527a_100000765925_100000188622 [0,1,0,0,0,0|3,0,0]=4 825 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)F 240690a_100000765925_100000746061 [0,1,0,0,0,0|3,0,0]=4 826 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)F 527a_100000765925_100000746061 [0,1,0,0,0,0|3,0,0]=4 827 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)I 240690a_100000765925_100000091984 [0,1,0,0,0,0|3,0,0]=4 828 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)I 527a_100000765925_100000091984 [0,1,0,0,0,0|3,0,0]=4 829 B15R1.5822 CC(=CCC(=O)c1ccc(cc1O)Br)C 1458a_100000744433_100000761012 [0,1,0,0,0,0|2,0,1]=4 830 B15R1.5822 CC(=CCC(=O)c1ccc(cc1O)C)C 1458a_100000212137_100000761012 [0,1,0,0,0,0|2,0,1]=4 831 B15R1.5822 CC(=CCC(=O)c1ccc(cc1O)Cl)C 1458a_100000188622_100000761012 [0,1,0,0,0,0|2,0,1]=4 832 B15R1.5822 CC(=CCC(=O)c1ccc(cc1O)F)C 1458a_100000746061_100000761012 [0,1,0,0,0,0|2,0,1]=4 833 B15R1.5822 CC(=CCC(=O)c1ccc(cc1O)I)C 1458a_100000091984_100000761012 [0,1,0,0,0,0|2,0,1]=4 834 B15R1.5822 CC(=CCC(=O)c1ccc(cc1O)O)C 1458a_100000212172_100000761012 [0,1,0,0,0,0|2,0,1]=4 835 B15R1.5822 CC(=O)CCC(=O)c1ccc(cc1F)Br 1458a_100000070787_100010339771 [0,1,0,0,0,0|2,0,0]=3 836 B15R1.5822 CC(=O)CNC(=O)c1ccc(cc1Cl)Cl 1458a_100000182489_200000210301 [0,1,0,0,0,0|3,0,0]=4 837 B15R1.5822 CC(=O)CNC(=O)c1ccc(cc1F)F 1458a_100000194603_200000210301 [0,1,0,0,0,0|3,0,0]=4 838 B15R1.5822 CC(=O)COC(=O)c1ccc(cc1Cl)Cl 1458a_100000070787_100010978946 [0,1,0,0,0,0|3,0,0]=4 839 B15R1.5822 CC(=O)NNC(=O)c1ccc(cc1O)Br 22a_100000189765_100000744433 [0,1,0,0,0,0|3,0,0]=4 840 B15R1.5822 CC(=O)NNC(=O)c1ccc(cc1O)C 22a_100000189765_100000212137 [0,1,0,0,0,0|3,0,0]=4 841 B15R1.5822 CC(=O)NNC(=O)c1ccc(cc1O)Cl 22a_100000189765_100000188622 [0,1,0,0,0,0|3,0,0]=4 842 B15R1.5822 CC(=O)NNC(=O)c1ccc(cc1O)F 22a_100000189765_100000746061 [0,1,0,0,0,0|3,0,0]=4 843 B15R1.5822 CC(=O)NNC(=O)c1ccc(cc1O)I 22a_100000189765_100000091984 [0,1,0,0,0,0|3,0,0]=4 844 B15R1.5822 CC(=O)NNC(=O)c1ccc(cc1O)O 22a_100000189765_100000212172 [0,1,0,0,0,0|3,0,0]=4 845 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210312 [0,1,0,0,0,0|2,0,1]=4 846 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210312 [0,1,0,0,0,0|2,0,1]=4 847 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210312 [0,1,0,0,0,0|2,0,1]=4 848 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210312 [0,1,0,0,0,0|2,0,1]=4 849 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210312 [0,1,0,0,0,0|2,0,1]=4 850 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100012276601 [0,1,0,0,0,0|2,0,1]=4 851 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100012276601 [0,1,0,0,0,0|2,0,1]=4 852 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100012276601 [0,1,0,0,0,0|2,0,1]=4 853 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100012276601 [0,1,0,0,0,0|2,0,1]=4 854 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100012276601 [0,1,0,0,0,0|2,0,1]=4 855 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100012276601 [0,1,0,0,0,0|2,0,1]=4 856 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100012276601 [0,1,0,0,0,0|2,0,1]=4 857 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100012276601 [0,1,0,0,0,0|2,0,1]=4 858 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100012276601 [0,1,0,0,0,0|2,0,1]=4 859 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100012276601 [0,1,0,0,0,0|2,0,1]=4 860 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100012276601 [0,1,0,0,0,0|2,0,1]=4 861 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100012276601 [0,1,0,0,0,0|2,0,1]=4 862 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100012276601 [0,1,0,0,0,0|2,0,1]=4 863 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100012276601 [0,1,0,0,0,0|2,0,1]=4 864 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100012276601 [0,1,0,0,0,0|2,0,1]=4 865 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100012276601 [0,1,0,0,0,0|2,0,1]=4 866 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100012276601 [0,1,0,0,0,0|2,0,1]=4 867 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100012276601 [0,1,0,0,0,0|2,0,1]=4 868 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100012276601 [0,1,0,0,0,0|1,0,1]=3 869 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100012276601 [0,1,0,0,0,0|1,0,1]=3 870 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100012276601 [0,1,0,0,0,0|1,0,1]=3 871 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100012276601 [0,1,0,0,0,0|1,0,1]=3 872 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100012276601 [0,1,0,0,0,0|1,0,1]=3 873 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Br 240690a_100000210904_100000744433 [0,1,0,0,0,0|2,0,1]=4 874 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Br 527a_100000210904_100000744433 [0,1,0,0,0,0|2,0,1]=4 875 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 11a_100000210904_100000188622 [0,1,0,0,0,0|2,0,1]=4 876 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 240690a_100000210904_100000188622 [0,1,0,0,0,0|2,0,1]=4 877 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 527a_100000210904_100000188622 [0,1,0,0,0,0|2,0,1]=4 878 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)F 240690a_100000210904_100000746061 [0,1,0,0,0,0|2,0,1]=4 879 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)F 527a_100000210904_100000746061 [0,1,0,0,0,0|2,0,1]=4 880 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)I 240690a_100000210904_100000091984 [0,1,0,0,0,0|2,0,1]=4 881 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)I 527a_100000210904_100000091984 [0,1,0,0,0,0|2,0,1]=4 882 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Br 1458a_100000741311_100012276601 [0,1,0,0,0,0|2,0,1]=4 883 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Cl 1458a_100000688705_100012276601 [0,1,0,0,0,0|2,0,1]=4 884 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)F 1458a_100000686989_100012276601 [0,1,0,0,0,0|2,0,1]=4 885 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)I 1458a_100010189873_100012276601 [0,1,0,0,0,0|2,0,1]=4 886 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)O 1458a_100000692822_100012276601 [0,1,0,0,0,0|2,0,1]=4 887 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Br 11a_100000711301_100000741311 [0,1,0,0,0,0|3,0,0]=4 888 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Br 240690a_100000711301_100000741311 [0,1,0,0,0,0|3,0,0]=4 889 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Br 527a_100000711301_100000741311 [0,1,0,0,0,0|3,0,0]=4 890 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Cl 11a_100000711301_100000688705 [0,1,0,0,0,0|3,0,0]=4 891 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000688705 [0,1,0,0,0,0|3,0,0]=4 892 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Cl 527a_100000711301_100000688705 [0,1,0,0,0,0|3,0,0]=4 893 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)F 11a_100000711301_100000686989 [0,1,0,0,0,0|3,0,0]=4 894 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)F 240690a_100000711301_100000686989 [0,1,0,0,0,0|3,0,0]=4 895 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)F 527a_100000711301_100000686989 [0,1,0,0,0,0|3,0,0]=4 896 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)I 11a_100000711301_100010189873 [0,1,0,0,0,0|3,0,0]=4 897 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)I 240690a_100000711301_100010189873 [0,1,0,0,0,0|3,0,0]=4 898 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)I 527a_100000711301_100010189873 [0,1,0,0,0,0|3,0,0]=4 899 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)O 240690a_100000711301_100000692822 [0,1,0,0,0,0|3,0,0]=4 900 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)O 527a_100000711301_100000692822 [0,1,0,0,0,0|3,0,0]=4 901 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)CCC(C)O 1458a_100000685072_100012276601 [0,1,0,0,0,0|2,0,1]=4 902 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(=O)N 11a_100000711301_100000685072 [0,1,0,0,0,0|3,0,0]=4 903 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(=O)N 240690a_100000711301_100000685072 [0,1,0,0,0,0|3,0,0]=4 904 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(=O)N 527a_100000711301_100000685072 [0,1,0,0,0,0|3,0,0]=4 905 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CCC(C)O 1458a_100000211164_100012276601 [0,1,0,0,0,0|2,0,1]=4 906 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(=O)N 11a_100000711301_100000211164 [0,1,0,0,0,0|3,0,0]=4 907 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(=O)N 240690a_100000711301_100000211164 [0,1,0,0,0,0|3,0,0]=4 908 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(=O)N 527a_100000711301_100000211164 [0,1,0,0,0,0|3,0,0]=4 909 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)CCC(C)O 1458a_100000766932_100012276601 [0,1,0,0,0,0|2,0,1]=4 910 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(=O)N 11a_100000711301_100000766932 [0,1,0,0,0,0|3,0,0]=4 911 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(=O)N 240690a_100000711301_100000766932 [0,1,0,0,0,0|3,0,0]=4 912 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(=O)N 527a_100000711301_100000766932 [0,1,0,0,0,0|3,0,0]=4 913 B15R1.5822 Cc1ccc(c(c1)F)C(=O)CCC(C)O 1458a_100000766033_100012276601 [0,1,0,0,0,0|2,0,1]=4 914 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(=O)N 11a_100000711301_100000766033 [0,1,0,0,0,0|3,0,0]=4 915 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(=O)N 240690a_100000711301_100000766033 [0,1,0,0,0,0|3,0,0]=4 916 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(=O)N 527a_100000711301_100000766033 [0,1,0,0,0,0|3,0,0]=4 917 B15R1.5822 Cc1ccc(c(c1)I)C(=O)CCC(C)O 1458a_100009999607_100012276601 [0,1,0,0,0,0|2,0,1]=4 918 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(=O)N 11a_100000711301_100009999607 [0,1,0,0,0,0|3,0,0]=4 919 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(=O)N 240690a_100000711301_100009999607 [0,1,0,0,0,0|3,0,0]=4 920 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(=O)N 527a_100000711301_100009999607 [0,1,0,0,0,0|3,0,0]=4 921 B15R1.5822 Cc1ccc(c(c1)O)C(=O)CCC(C)C 1458a_100000212137_100000210312 [0,1,0,0,0,0|2,0,1]=4 922 B15R1.5822 Cc1ccc(c(c1)O)C(=O)CCC(C)O 1458a_100000212137_100012276601 [0,1,0,0,0,0|1,0,1]=3 923 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(=O)N 240690a_100000711301_100000212137 [0,1,0,0,0,0|2,0,0]=3 924 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(=O)N 527a_100000711301_100000212137 [0,1,0,0,0,0|2,0,0]=3 925 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)O 240690a_100000210904_100000212137 [0,1,0,0,0,0|2,0,1]=4 926 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)O 527a_100000210904_100000212137 [0,1,0,0,0,0|2,0,1]=4 927 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Br 11a_100000711301_100000762965 [0,1,0,0,0,0|3,0,0]=4 928 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Br 240690a_100000711301_100000762965 [0,1,0,0,0,0|3,0,0]=4 929 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Br 527a_100000711301_100000762965 [0,1,0,0,0,0|3,0,0]=4 930 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Cl 11a_100000711301_100000766353 [0,1,0,0,0,0|3,0,0]=4 931 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000711301_100000766353 [0,1,0,0,0,0|3,0,0]=4 932 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Cl 527a_100000711301_100000766353 [0,1,0,0,0,0|3,0,0]=4 933 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)F 11a_100000711301_100000212304 [0,1,0,0,0,0|3,0,0]=4 934 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)F 240690a_100000711301_100000212304 [0,1,0,0,0,0|3,0,0]=4 935 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)F 527a_100000711301_100000212304 [0,1,0,0,0,0|3,0,0]=4 936 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)I 11a_100000711301_100012360512 [0,1,0,0,0,0|3,0,0]=4 937 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)I 240690a_100000711301_100012360512 [0,1,0,0,0,0|3,0,0]=4 938 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)I 527a_100000711301_100012360512 [0,1,0,0,0,0|3,0,0]=4 939 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)O 240690a_100000711301_100012344906 [0,1,0,0,0,0|3,0,0]=4 940 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)O 527a_100000711301_100012344906 [0,1,0,0,0,0|3,0,0]=4 941 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Br 11a_100000711301_100000741628 [0,1,0,0,0,0|3,0,0]=4 942 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Br 240690a_100000711301_100000741628 [0,1,0,0,0,0|3,0,0]=4 943 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Br 527a_100000711301_100000741628 [0,1,0,0,0,0|3,0,0]=4 944 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000711301_100000185840 [0,1,0,0,0,0|3,0,0]=4 945 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000711301_100000185840 [0,1,0,0,0,0|3,0,0]=4 946 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000711301_100000185840 [0,1,0,0,0,0|3,0,0]=4 947 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)F 11a_100000711301_100000211397 [0,1,0,0,0,0|3,0,0]=4 948 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)F 240690a_100000711301_100000211397 [0,1,0,0,0,0|3,0,0]=4 949 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)F 527a_100000711301_100000211397 [0,1,0,0,0,0|3,0,0]=4 950 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)I 11a_100000711301_100000751301 [0,1,0,0,0,0|3,0,0]=4 951 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)I 240690a_100000711301_100000751301 [0,1,0,0,0,0|3,0,0]=4 952 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)I 527a_100000711301_100000751301 [0,1,0,0,0,0|3,0,0]=4 953 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)O 240690a_100000711301_100000702456 [0,1,0,0,0,0|3,0,0]=4 954 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)O 527a_100000711301_100000702456 [0,1,0,0,0,0|3,0,0]=4 955 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Br 11a_100000711301_100000214689 [0,1,0,0,0,0|3,0,0]=4 956 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Br 240690a_100000711301_100000214689 [0,1,0,0,0,0|3,0,0]=4 957 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Br 527a_100000711301_100000214689 [0,1,0,0,0,0|3,0,0]=4 958 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Cl 11a_100000711301_100000212326 [0,1,0,0,0,0|3,0,0]=4 959 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Cl 240690a_100000711301_100000212326 [0,1,0,0,0,0|3,0,0]=4 960 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Cl 527a_100000711301_100000212326 [0,1,0,0,0,0|3,0,0]=4 961 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)F 11a_100000711301_100000211022 [0,1,0,0,0,0|3,0,0]=4 962 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)F 240690a_100000711301_100000211022 [0,1,0,0,0,0|3,0,0]=4 963 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)F 527a_100000711301_100000211022 [0,1,0,0,0,0|3,0,0]=4 964 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)I 11a_100000711301_100000037189 [0,1,0,0,0,0|3,0,0]=4 965 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)I 240690a_100000711301_100000037189 [0,1,0,0,0,0|3,0,0]=4 966 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)I 527a_100000711301_100000037189 [0,1,0,0,0,0|3,0,0]=4 967 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)O 240690a_100000711301_100000689029 [0,1,0,0,0,0|3,0,0]=4 968 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)O 527a_100000711301_100000689029 [0,1,0,0,0,0|3,0,0]=4 969 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Br 11a_100000711301_100000751167 [0,1,0,0,0,0|3,0,0]=4 970 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Br 240690a_100000711301_100000751167 [0,1,0,0,0,0|3,0,0]=4 971 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Br 527a_100000711301_100000751167 [0,1,0,0,0,0|3,0,0]=4 972 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Cl 11a_100000711301_100000739380 [0,1,0,0,0,0|3,0,0]=4 973 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Cl 240690a_100000711301_100000739380 [0,1,0,0,0,0|3,0,0]=4 974 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Cl 527a_100000711301_100000739380 [0,1,0,0,0,0|3,0,0]=4 975 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)F 11a_100000711301_100000739341 [0,1,0,0,0,0|3,0,0]=4 976 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)F 240690a_100000711301_100000739341 [0,1,0,0,0,0|3,0,0]=4 977 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)F 527a_100000711301_100000739341 [0,1,0,0,0,0|3,0,0]=4 978 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Br 240690a_100000711301_100000744433 [0,1,0,0,0,0|2,0,0]=3 979 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Br 527a_100000711301_100000744433 [0,1,0,0,0,0|2,0,0]=3 980 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Cl 11a_100000711301_100000188622 [0,1,0,0,0,0|2,0,0]=3 981 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Cl 240690a_100000711301_100000188622 [0,1,0,0,0,0|2,0,0]=3 982 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Cl 527a_100000711301_100000188622 [0,1,0,0,0,0|2,0,0]=3 983 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)F 240690a_100000711301_100000746061 [0,1,0,0,0,0|2,0,0]=3 984 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)F 527a_100000711301_100000746061 [0,1,0,0,0,0|2,0,0]=3 985 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)I 240690a_100000711301_100000091984 [0,1,0,0,0,0|2,0,0]=3 986 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)I 527a_100000711301_100000091984 [0,1,0,0,0,0|2,0,0]=3 987 B15R1.5822 [13CH3]C(=O)CNC(=O)c1ccc(cc1Cl)Cl 1458a_100000182489_200025704644 [0,1,0,0,0,0|3,0,0]=4 988 B15R1.5822 [13CH3]C(=O)CNC(=O)c1ccc(cc1F)F 1458a_100000194603_200025704644 [0,1,0,0,0,0|3,0,0]=4 989 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000755188 [0,1,0,0,0,0|2,0,1]=4 990 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1O 240690a_100000751335_100015234032 [0,1,0,0,0,0|2,0,1]=4 991 B15R1.8018 CS(=O)(=O)CCC(=O)c1ccccc1Br 1458a_100000188424_100000731031 [0,1,0,0,0,0|2,0,1]=4 992 B15R1.8018 CS(=O)(=O)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000731031 [0,1,0,0,0,0|2,0,1]=4 993 B15R1.8018 CS(=O)(=O)CCC(=O)c1ccccc1F 1458a_100000188656_100000731031 [0,1,0,0,0,0|2,0,1]=4 994 B15R1.8018 CS(=O)(=O)CCC(=O)c1ccccc1I 1458a_100000187884_100000731031 [0,1,0,0,0,0|2,0,1]=4 995 B15R1.8018 CS(=O)(=O)CCC(=O)c1ccccc1O 1458a_100015234032_100000731031 [0,1,0,0,0,0|1,0,1]=3 996 B15R1.8018 CS(=O)(=O)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000731031 [0,1,0,0,0,0|1,0,2]=4 997 B15R1.8018 C[N+](C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000085578 [0,1,0,0,0,0|3,0,0]=4 998 B15R1.8018 C[Si](C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_200000733723 [0,1,0,0,0,0|2,1,0]=4 999 B15R1.8018 Cc1ccccc1C(=O)CCS(=O)(=O)C 1458a_100000212026_100000731031 [0,1,0,0,0,0|2,0,1]=4 1000 B15R1.8018 Cc1ccccc1C(=O)CCS(=O)(=O)[O-] 1458a_100000212026_100000762736 [0,1,0,0,0,0|2,0,1]=4 1001 B15R1.8018 O=C(CCC(F)(F)F)c1ccccc1O 1458a_100015234032_100011219754 [0,1,0,0,0,0|2,0,1]=4 1002 B15R1.8018 O=C(CCS(=O)(=O)[O-])c1ccccc1Br 1458a_100000188424_100000762736 [0,1,0,0,0,0|2,0,1]=4 1003 B15R1.8018 O=C(CCS(=O)(=O)[O-])c1ccccc1Cl 1458a_100000185844_100000762736 [0,1,0,0,0,0|2,0,1]=4 1004 B15R1.8018 O=C(CCS(=O)(=O)[O-])c1ccccc1F 1458a_100000188656_100000762736 [0,1,0,0,0,0|2,0,1]=4 1005 B15R1.8018 O=C(CCS(=O)(=O)[O-])c1ccccc1I 1458a_100000187884_100000762736 [0,1,0,0,0,0|2,0,1]=4 1006 B15R1.8018 O=C(CCS(=O)(=O)[O-])c1ccccc1O 1458a_100015234032_100000762736 [0,1,0,0,0,0|1,0,1]=3 1007 B15R1.8018 O=C(CCS(=O)(=O)[O-])c1ccccc1[O-] 1458a_100009911694_100000762736 [0,1,0,0,0,0|1,0,2]=4 1008 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000730704 [0,1,0,0,0,0|3,0,0]=4 1009 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000730704 [0,1,0,0,0,0|3,0,0]=4 1010 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000730704 [0,1,0,0,0,0|3,0,0]=4 1011 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000730704 [0,1,0,0,0,0|3,0,0]=4 1012 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000730704 [0,1,0,0,0,0|2,0,0]=3 1013 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1C)C 1458a_100000758298_100000730704 [0,1,0,0,0,0|3,0,0]=4 1014 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000730704 [0,1,0,0,0,0|3,0,0]=4 1015 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000730704 [0,1,0,0,0,0|3,0,0]=4 1016 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000730704 [0,1,0,0,0,0|3,0,0]=4 1017 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000730704 [0,1,0,0,0,0|2,0,0]=3 1018 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1F)C 1458a_100000762013_100000730704 [0,1,0,0,0,0|3,0,0]=4 1019 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1F)F 1458a_100000210804_100000730704 [0,1,0,0,0,0|3,0,0]=4 1020 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000730704 [0,1,0,0,0,0|2,0,0]=3 1021 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000730704 [0,1,0,0,0,0|3,0,0]=4 1022 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1I)C 1458a_100000688020_100000730704 [0,1,0,0,0,0|3,0,0]=4 1023 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000730704 [0,1,0,0,0,0|3,0,0]=4 1024 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1I)F 1458a_100000023732_100000730704 [0,1,0,0,0,0|3,0,0]=4 1025 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000730704 [0,1,0,0,0,0|2,0,0]=3 1026 B15R1.8312 C=C(C)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000730704 [0,1,0,0,0,0|2,0,0]=3 1027 B15R1.8312 C=C(C)CNC(=O)c1c(cccc1Br)O 240690a_100000765925_100011935254 [0,1,0,0,0,0|3,0,0]=4 1028 B15R1.8312 C=C(C)CNC(=O)c1c(cccc1Br)O 527a_100000765925_100011935254 [0,1,0,0,0,0|3,0,0]=4 1029 B15R1.8312 C=C(C)CNC(=O)c1c(cccc1Cl)O 240690a_100000765925_100000745519 [0,1,0,0,0,0|3,0,0]=4 1030 B15R1.8312 C=C(C)CNC(=O)c1c(cccc1Cl)O 527a_100000765925_100000745519 [0,1,0,0,0,0|3,0,0]=4 1031 B15R1.8312 C=C(C)CNC(=O)c1c(cccc1F)O 527a_100000765925_100000763259 [0,1,0,0,0,0|3,0,0]=4 1032 B15R1.8312 C=C(C)CNC(=O)c1c(cccc1O)O 527a_100000765925_100000755285 [0,1,0,0,0,0|3,0,0]=4 1033 B15R1.8312 CC(=CCC(=O)c1c(cccc1Br)O)C 1458a_100011935254_100000761012 [0,1,0,0,0,0|2,0,1]=4 1034 B15R1.8312 CC(=CCC(=O)c1c(cccc1Cl)O)C 1458a_100000745519_100000761012 [0,1,0,0,0,0|2,0,1]=4 1035 B15R1.8312 CC(=CCC(=O)c1c(cccc1F)O)C 1458a_100000763259_100000761012 [0,1,0,0,0,0|2,0,1]=4 1036 B15R1.8312 CC(=CCC(=O)c1c(cccc1O)C)C 1458a_100011934116_100000761012 [0,1,0,0,0,0|2,0,1]=4 1037 B15R1.8312 CC(=CCC(=O)c1c(cccc1O)O)C 1458a_100000755285_100000761012 [0,1,0,0,0,0|2,0,1]=4 1038 B15R1.8312 CC(=O)CNC(=O)c1c(cccc1Cl)F 1458a_100000194584_200000210301 [0,1,0,0,0,0|3,0,0]=4 1039 B15R1.8312 CC(=O)NNC(=O)c1c(cccc1Br)O 22a_100000189765_100011935254 [0,1,0,0,0,0|3,0,0]=4 1040 B15R1.8312 CC(=O)NNC(=O)c1c(cccc1Cl)O 22a_100000189765_100000745519 [0,1,0,0,0,0|3,0,0]=4 1041 B15R1.8312 CC(=O)NNC(=O)c1c(cccc1F)O 22a_100000189765_100000763259 [0,1,0,0,0,0|3,0,0]=4 1042 B15R1.8312 CC(=O)NNC(=O)c1c(cccc1O)C 22a_100000189765_100011934116 [0,1,0,0,0,0|3,0,0]=4 1043 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210312 [0,1,0,0,0,0|2,0,1]=4 1044 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210312 [0,1,0,0,0,0|2,0,1]=4 1045 B15R1.8312 CC(C)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210312 [0,1,0,0,0,0|2,0,1]=4 1046 B15R1.8312 CC(C)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210312 [0,1,0,0,0,0|2,0,1]=4 1047 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100012276601 [0,1,0,0,0,0|2,0,1]=4 1048 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100012276601 [0,1,0,0,0,0|2,0,1]=4 1049 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100012276601 [0,1,0,0,0,0|2,0,1]=4 1050 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100012276601 [0,1,0,0,0,0|1,0,1]=3 1051 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100012276601 [0,1,0,0,0,0|2,0,1]=4 1052 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100012276601 [0,1,0,0,0,0|2,0,1]=4 1053 B15R1.8312 CC(O)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100012276601 [0,1,0,0,0,0|1,0,1]=3 1054 B15R1.8312 CC(O)CCC(=O)c1c(cccc1F)F 1458a_100000210804_100012276601 [0,1,0,0,0,0|2,0,1]=4 1055 B15R1.8312 CC(O)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100012276601 [0,1,0,0,0,0|1,0,1]=3 1056 B15R1.8312 CC(O)CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100012276601 [0,1,0,0,0,0|2,0,1]=4 1057 B15R1.8312 CC(O)CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100012276601 [0,1,0,0,0,0|2,0,1]=4 1058 B15R1.8312 CC(O)CCC(=O)c1c(cccc1I)F 1458a_100000023732_100012276601 [0,1,0,0,0,0|2,0,1]=4 1059 B15R1.8312 CC(O)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100012276601 [0,1,0,0,0,0|1,0,1]=3 1060 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)O 240690a_100000210904_100011935254 [0,1,0,0,0,0|2,0,1]=4 1061 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Br)O 527a_100000210904_100011935254 [0,1,0,0,0,0|2,0,1]=4 1062 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)O 240690a_100000210904_100000745519 [0,1,0,0,0,0|2,0,1]=4 1063 B15R1.8312 CC(O)CNC(=O)c1c(cccc1Cl)O 527a_100000210904_100000745519 [0,1,0,0,0,0|2,0,1]=4 1064 B15R1.8312 CC(O)CNC(=O)c1c(cccc1F)O 527a_100000210904_100000763259 [0,1,0,0,0,0|2,0,1]=4 1065 B15R1.8312 CC(O)CNC(=O)c1c(cccc1O)O 527a_100000210904_100000755285 [0,1,0,0,0,0|2,0,1]=4 1066 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)O 1458a_100011934116_100000210312 [0,1,0,0,0,0|2,0,1]=4 1067 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)Br 1458a_100000701904_100012276601 [0,1,0,0,0,0|2,0,1]=4 1068 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)C 1458a_100000758298_100012276601 [0,1,0,0,0,0|2,0,1]=4 1069 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)Cl 1458a_100000692601_100012276601 [0,1,0,0,0,0|2,0,1]=4 1070 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)F 1458a_100000762013_100012276601 [0,1,0,0,0,0|2,0,1]=4 1071 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)I 1458a_100000688020_100012276601 [0,1,0,0,0,0|2,0,1]=4 1072 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)O 1458a_100011934116_100012276601 [0,1,0,0,0,0|1,0,1]=3 1073 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)Br 11a_100000711301_100000701904 [0,1,0,0,0,0|3,0,0]=4 1074 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)Br 240690a_100000711301_100000701904 [0,1,0,0,0,0|3,0,0]=4 1075 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)Br 527a_100000711301_100000701904 [0,1,0,0,0,0|3,0,0]=4 1076 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)C 11a_100000711301_100000758298 [0,1,0,0,0,0|3,0,0]=4 1077 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)C 240690a_100000711301_100000758298 [0,1,0,0,0,0|3,0,0]=4 1078 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)Cl 11a_100000711301_100000692601 [0,1,0,0,0,0|3,0,0]=4 1079 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000692601 [0,1,0,0,0,0|3,0,0]=4 1080 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)F 11a_100000711301_100000762013 [0,1,0,0,0,0|3,0,0]=4 1081 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)F 240690a_100000711301_100000762013 [0,1,0,0,0,0|3,0,0]=4 1082 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)F 527a_100000711301_100000762013 [0,1,0,0,0,0|3,0,0]=4 1083 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)I 11a_100000711301_100000688020 [0,1,0,0,0,0|3,0,0]=4 1084 B15R1.8312 Cc1cccc(c1C(=O)NCC(=O)N)I 240690a_100000711301_100000688020 [0,1,0,0,0,0|3,0,0]=4 1085 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)Br 11a_100000711301_100000690891 [0,1,0,0,0,0|3,0,0]=4 1086 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)Br 240690a_100000711301_100000690891 [0,1,0,0,0,0|3,0,0]=4 1087 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)Br 527a_100000711301_100000690891 [0,1,0,0,0,0|3,0,0]=4 1088 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)Cl 11a_100000711301_100011253703 [0,1,0,0,0,0|3,0,0]=4 1089 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)Cl 240690a_100000711301_100011253703 [0,1,0,0,0,0|3,0,0]=4 1090 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)Cl 527a_100000711301_100011253703 [0,1,0,0,0,0|3,0,0]=4 1091 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)F 11a_100000711301_100000752694 [0,1,0,0,0,0|3,0,0]=4 1092 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)F 240690a_100000711301_100000752694 [0,1,0,0,0,0|3,0,0]=4 1093 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)F 527a_100000711301_100000752694 [0,1,0,0,0,0|3,0,0]=4 1094 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)O 240690a_100000711301_100011935254 [0,1,0,0,0,0|2,0,0]=3 1095 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Br)O 527a_100000711301_100011935254 [0,1,0,0,0,0|2,0,0]=3 1096 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)Cl 11a_100000711301_100000210656 [0,1,0,0,0,0|3,0,0]=4 1097 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)Cl 240690a_100000711301_100000210656 [0,1,0,0,0,0|3,0,0]=4 1098 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)F 11a_100000711301_100000210369 [0,1,0,0,0,0|3,0,0]=4 1099 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)F 240690a_100000711301_100000210369 [0,1,0,0,0,0|3,0,0]=4 1100 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)F 527a_100000711301_100000210369 [0,1,0,0,0,0|3,0,0]=4 1101 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)O 240690a_100000711301_100000745519 [0,1,0,0,0,0|2,0,0]=3 1102 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1Cl)O 527a_100000711301_100000745519 [0,1,0,0,0,0|2,0,0]=3 1103 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1F)F 11a_100000711301_100000210804 [0,1,0,0,0,0|3,0,0]=4 1104 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1F)F 240690a_100000711301_100000210804 [0,1,0,0,0,0|3,0,0]=4 1105 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1F)F 527a_100000711301_100000210804 [0,1,0,0,0,0|3,0,0]=4 1106 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1F)O 527a_100000711301_100000763259 [0,1,0,0,0,0|2,0,0]=3 1107 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)Br 11a_100000711301_100010232521 [0,1,0,0,0,0|3,0,0]=4 1108 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)Br 240690a_100000711301_100010232521 [0,1,0,0,0,0|3,0,0]=4 1109 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)Br 527a_100000711301_100010232521 [0,1,0,0,0,0|3,0,0]=4 1110 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)Cl 11a_100000711301_100000702859 [0,1,0,0,0,0|3,0,0]=4 1111 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)Cl 240690a_100000711301_100000702859 [0,1,0,0,0,0|3,0,0]=4 1112 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)Cl 527a_100000711301_100000702859 [0,1,0,0,0,0|3,0,0]=4 1113 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)F 11a_100000711301_100000023732 [0,1,0,0,0,0|3,0,0]=4 1114 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1I)F 240690a_100000711301_100000023732 [0,1,0,0,0,0|3,0,0]=4 1115 B15R1.8312 NC(=O)CNC(=O)c1c(cccc1O)O 527a_100000711301_100000755285 [0,1,0,0,0,0|2,0,0]=3 1116 B15R1.8312 [13CH3]C(=O)CNC(=O)c1c(cccc1Cl)F 1458a_100000194584_200025704644 [0,1,0,0,0,0|3,0,0]=4 1117 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000730704 [0,1,0,0,0,0|3,0,0]=4 1118 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000730704 [0,1,0,0,0,0|3,0,0]=4 1119 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000730704 [0,1,0,0,0,0|3,0,0]=4 1120 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000730704 [0,1,0,0,0,0|3,0,0]=4 1121 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000730704 [0,1,0,0,0,0|3,0,0]=4 1122 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000730704 [0,1,0,0,0,0|3,0,0]=4 1123 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000730704 [0,1,0,0,0,0|3,0,0]=4 1124 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000730704 [0,1,0,0,0,0|3,0,0]=4 1125 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000730704 [0,1,0,0,0,0|3,0,0]=4 1126 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000730704 [0,1,0,0,0,0|3,0,0]=4 1127 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000730704 [0,1,0,0,0,0|3,0,0]=4 1128 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000730704 [0,1,0,0,0,0|3,0,0]=4 1129 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000730704 [0,1,0,0,0,0|3,0,0]=4 1130 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000730704 [0,1,0,0,0,0|3,0,0]=4 1131 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000730704 [0,1,0,0,0,0|3,0,0]=4 1132 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000730704 [0,1,0,0,0,0|3,0,0]=4 1133 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000730704 [0,1,0,0,0,0|3,0,0]=4 1134 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000730704 [0,1,0,0,0,0|3,0,0]=4 1135 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000730704 [0,1,0,0,0,0|3,0,0]=4 1136 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000730704 [0,1,0,0,0,0|3,0,0]=4 1137 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000730704 [0,1,0,0,0,0|3,0,0]=4 1138 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000730704 [0,1,0,0,0,0|3,0,0]=4 1139 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000730704 [0,1,0,0,0,0|3,0,0]=4 1140 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000730704 [0,1,0,0,0,0|3,0,0]=4 1141 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000730704 [0,1,0,0,0,0|3,0,0]=4 1142 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000730704 [0,1,0,0,0,0|3,0,0]=4 1143 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000730704 [0,1,0,0,0,0|3,0,0]=4 1144 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000730704 [0,1,0,0,0,0|3,0,0]=4 1145 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000730704 [0,1,0,0,0,0|3,0,0]=4 1146 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000730704 [0,1,0,0,0,0|3,0,0]=4 1147 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000730704 [0,1,0,0,0,0|2,0,0]=3 1148 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000730704 [0,1,0,0,0,0|2,0,0]=3 1149 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000730704 [0,1,0,0,0,0|2,0,0]=3 1150 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000730704 [0,1,0,0,0,0|2,0,0]=3 1151 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000730704 [0,1,0,0,0,0|2,0,0]=3 1152 B15R1.8420 C=C(C)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000730704 [0,1,0,0,0,0|2,0,0]=3 1153 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Br 1626a_100000765925_100000212140 [0,1,0,0,0,0|3,0,0]=4 1154 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Br 240690a_100000765925_100000212140 [0,1,0,0,0,0|3,0,0]=4 1155 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Br 527a_100000765925_100000212140 [0,1,0,0,0,0|3,0,0]=4 1156 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)C 240690a_100000765925_100000229998 [0,1,0,0,0,0|3,0,0]=4 1157 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)C 527a_100000765925_100000229998 [0,1,0,0,0,0|3,0,0]=4 1158 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Cl 11a_100000765925_100000212143 [0,1,0,0,0,0|3,0,0]=4 1159 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Cl 1626a_100000765925_100000212143 [0,1,0,0,0,0|3,0,0]=4 1160 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Cl 240690a_100000765925_100000212143 [0,1,0,0,0,0|3,0,0]=4 1161 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)Cl 527a_100000765925_100000212143 [0,1,0,0,0,0|3,0,0]=4 1162 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)F 240690a_100000765925_100000742286 [0,1,0,0,0,0|3,0,0]=4 1163 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)F 527a_100000765925_100000742286 [0,1,0,0,0,0|3,0,0]=4 1164 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)I 240690a_100000765925_100000212111 [0,1,0,0,0,0|3,0,0]=4 1165 B15R1.8420 C=C(C)CNC(=O)c1cc(ccc1O)I 527a_100000765925_100000212111 [0,1,0,0,0,0|3,0,0]=4 1166 B15R1.8420 CC(=CCC(=O)c1cc(ccc1O)Br)C 1458a_100000212140_100000761012 [0,1,0,0,0,0|2,0,1]=4 1167 B15R1.8420 CC(=CCC(=O)c1cc(ccc1O)C)C 1458a_100000229998_100000761012 [0,1,0,0,0,0|2,0,1]=4 1168 B15R1.8420 CC(=CCC(=O)c1cc(ccc1O)Cl)C 1458a_100000212143_100000761012 [0,1,0,0,0,0|2,0,1]=4 1169 B15R1.8420 CC(=CCC(=O)c1cc(ccc1O)F)C 1458a_100000742286_100000761012 [0,1,0,0,0,0|2,0,1]=4 1170 B15R1.8420 CC(=CCC(=O)c1cc(ccc1O)I)C 1458a_100000212111_100000761012 [0,1,0,0,0,0|2,0,1]=4 1171 B15R1.8420 CC(=CCC(=O)c1cc(ccc1O)O)C 1458a_100000758025_100000761012 [0,1,0,0,0,0|2,0,1]=4 1172 B15R1.8420 CC(=O)CCS(=O)c1cc(ccc1Cl)Cl 1458a_100000070787_100000047736 [0,1,0,0,0,0|3,0,0]=4 1173 B15R1.8420 CC(=O)CNC(=O)c1cc(ccc1Cl)Cl 1458a_100000189190_200000210301 [0,1,0,0,0,0|3,0,0]=4 1174 B15R1.8420 CC(=O)CNC(=O)c1cc(ccc1O)O 1458a_100011219787_200000210301 [0,1,0,0,0,0|2,0,0]=3 1175 B15R1.8420 CC(=O)NNC(=O)c1cc(ccc1O)Br 22a_100000189765_100000212140 [0,1,0,0,0,0|3,0,0]=4 1176 B15R1.8420 CC(=O)NNC(=O)c1cc(ccc1O)C 22a_100000189765_100000229998 [0,1,0,0,0,0|3,0,0]=4 1177 B15R1.8420 CC(=O)NNC(=O)c1cc(ccc1O)Cl 22a_100000189765_100000212143 [0,1,0,0,0,0|3,0,0]=4 1178 B15R1.8420 CC(=O)NNC(=O)c1cc(ccc1O)F 22a_100000189765_100000742286 [0,1,0,0,0,0|3,0,0]=4 1179 B15R1.8420 CC(=O)NNC(=O)c1cc(ccc1O)I 22a_100000189765_100000212111 [0,1,0,0,0,0|3,0,0]=4 1180 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210312 [0,1,0,0,0,0|2,0,1]=4 1181 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210312 [0,1,0,0,0,0|2,0,1]=4 1182 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210312 [0,1,0,0,0,0|2,0,1]=4 1183 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210312 [0,1,0,0,0,0|2,0,1]=4 1184 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210312 [0,1,0,0,0,0|2,0,1]=4 1185 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100012276601 [0,1,0,0,0,0|2,0,1]=4 1186 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100012276601 [0,1,0,0,0,0|2,0,1]=4 1187 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100012276601 [0,1,0,0,0,0|2,0,1]=4 1188 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100012276601 [0,1,0,0,0,0|2,0,1]=4 1189 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100012276601 [0,1,0,0,0,0|2,0,1]=4 1190 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100012276601 [0,1,0,0,0,0|2,0,1]=4 1191 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100012276601 [0,1,0,0,0,0|2,0,1]=4 1192 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100012276601 [0,1,0,0,0,0|2,0,1]=4 1193 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100012276601 [0,1,0,0,0,0|2,0,1]=4 1194 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100012276601 [0,1,0,0,0,0|2,0,1]=4 1195 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100012276601 [0,1,0,0,0,0|2,0,1]=4 1196 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100012276601 [0,1,0,0,0,0|2,0,1]=4 1197 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100012276601 [0,1,0,0,0,0|2,0,1]=4 1198 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100012276601 [0,1,0,0,0,0|2,0,1]=4 1199 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100012276601 [0,1,0,0,0,0|2,0,1]=4 1200 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100012276601 [0,1,0,0,0,0|2,0,1]=4 1201 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100012276601 [0,1,0,0,0,0|2,0,1]=4 1202 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100012276601 [0,1,0,0,0,0|2,0,1]=4 1203 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100012276601 [0,1,0,0,0,0|2,0,1]=4 1204 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100012276601 [0,1,0,0,0,0|2,0,1]=4 1205 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100012276601 [0,1,0,0,0,0|1,0,1]=3 1206 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100012276601 [0,1,0,0,0,0|1,0,1]=3 1207 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100012276601 [0,1,0,0,0,0|1,0,1]=3 1208 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100012276601 [0,1,0,0,0,0|1,0,1]=3 1209 B15R1.8420 CC(O)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100012276601 [0,1,0,0,0,0|1,0,1]=3 1210 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Br 240690a_100000210904_100000212140 [0,1,0,0,0,0|2,0,1]=4 1211 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Br 527a_100000210904_100000212140 [0,1,0,0,0,0|2,0,1]=4 1212 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Cl 11a_100000210904_100000212143 [0,1,0,0,0,0|2,0,1]=4 1213 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Cl 240690a_100000210904_100000212143 [0,1,0,0,0,0|2,0,1]=4 1214 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)Cl 527a_100000210904_100000212143 [0,1,0,0,0,0|2,0,1]=4 1215 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)F 240690a_100000210904_100000742286 [0,1,0,0,0,0|2,0,1]=4 1216 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)F 527a_100000210904_100000742286 [0,1,0,0,0,0|2,0,1]=4 1217 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)I 240690a_100000210904_100000212111 [0,1,0,0,0,0|2,0,1]=4 1218 B15R1.8420 CC(O)CNC(=O)c1cc(ccc1O)I 527a_100000210904_100000212111 [0,1,0,0,0,0|2,0,1]=4 1219 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)O 1458a_100000229998_100000210312 [0,1,0,0,0,0|2,0,1]=4 1220 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)Br 1458a_100000689033_100012276601 [0,1,0,0,0,0|2,0,1]=4 1221 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)C 1458a_100000195421_100012276601 [0,1,0,0,0,0|2,0,1]=4 1222 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)Cl 1458a_100011290873_100012276601 [0,1,0,0,0,0|2,0,1]=4 1223 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)F 1458a_100000749327_100012276601 [0,1,0,0,0,0|2,0,1]=4 1224 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)I 1458a_100000057929_100012276601 [0,1,0,0,0,0|2,0,1]=4 1225 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)O 1458a_100000229998_100012276601 [0,1,0,0,0,0|1,0,1]=3 1226 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)Br 11a_100000711301_100000689033 [0,1,0,0,0,0|3,0,0]=4 1227 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)Br 240690a_100000711301_100000689033 [0,1,0,0,0,0|3,0,0]=4 1228 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)Br 527a_100000711301_100000689033 [0,1,0,0,0,0|3,0,0]=4 1229 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)C 11a_100000711301_100000195421 [0,1,0,0,0,0|3,0,0]=4 1230 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)C 240690a_100000711301_100000195421 [0,1,0,0,0,0|3,0,0]=4 1231 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)C 527a_100000711301_100000195421 [0,1,0,0,0,0|3,0,0]=4 1232 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)Cl 11a_100000711301_100011290873 [0,1,0,0,0,0|3,0,0]=4 1233 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)Cl 240690a_100000711301_100011290873 [0,1,0,0,0,0|3,0,0]=4 1234 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)Cl 527a_100000711301_100011290873 [0,1,0,0,0,0|3,0,0]=4 1235 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)F 11a_100000711301_100000749327 [0,1,0,0,0,0|3,0,0]=4 1236 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)F 240690a_100000711301_100000749327 [0,1,0,0,0,0|3,0,0]=4 1237 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)F 527a_100000711301_100000749327 [0,1,0,0,0,0|3,0,0]=4 1238 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)I 11a_100000711301_100000057929 [0,1,0,0,0,0|3,0,0]=4 1239 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)I 240690a_100000711301_100000057929 [0,1,0,0,0,0|3,0,0]=4 1240 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)I 527a_100000711301_100000057929 [0,1,0,0,0,0|3,0,0]=4 1241 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)O 240690a_100000711301_100000229998 [0,1,0,0,0,0|2,0,0]=3 1242 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(=O)N)O 527a_100000711301_100000229998 [0,1,0,0,0,0|2,0,0]=3 1243 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)O 240690a_100000210904_100000229998 [0,1,0,0,0,0|2,0,1]=4 1244 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)O 527a_100000210904_100000229998 [0,1,0,0,0,0|2,0,1]=4 1245 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)Br 1458a_100000759961_100012276601 [0,1,0,0,0,0|2,0,1]=4 1246 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)Cl 1458a_100000692595_100012276601 [0,1,0,0,0,0|2,0,1]=4 1247 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)F 1458a_100000240043_100012276601 [0,1,0,0,0,0|2,0,1]=4 1248 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)I 1458a_100000688012_100012276601 [0,1,0,0,0,0|2,0,1]=4 1249 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)O 1458a_100000687834_100012276601 [0,1,0,0,0,0|2,0,1]=4 1250 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)Br 11a_100000711301_100000759961 [0,1,0,0,0,0|3,0,0]=4 1251 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)Br 240690a_100000711301_100000759961 [0,1,0,0,0,0|3,0,0]=4 1252 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)Br 527a_100000711301_100000759961 [0,1,0,0,0,0|3,0,0]=4 1253 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)Cl 11a_100000711301_100000692595 [0,1,0,0,0,0|3,0,0]=4 1254 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000692595 [0,1,0,0,0,0|3,0,0]=4 1255 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)Cl 527a_100000711301_100000692595 [0,1,0,0,0,0|3,0,0]=4 1256 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)F 11a_100000711301_100000240043 [0,1,0,0,0,0|3,0,0]=4 1257 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)F 240690a_100000711301_100000240043 [0,1,0,0,0,0|3,0,0]=4 1258 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)F 527a_100000711301_100000240043 [0,1,0,0,0,0|3,0,0]=4 1259 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)I 11a_100000711301_100000688012 [0,1,0,0,0,0|3,0,0]=4 1260 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)I 240690a_100000711301_100000688012 [0,1,0,0,0,0|3,0,0]=4 1261 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)I 527a_100000711301_100000688012 [0,1,0,0,0,0|3,0,0]=4 1262 B15R1.8420 Cc1ccc(cc1C(=O)NCC(=O)N)O 240690a_100000711301_100000687834 [0,1,0,0,0,0|3,0,0]=4 1263 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)Br 11a_100000711301_100000690610 [0,1,0,0,0,0|3,0,0]=4 1264 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)Br 240690a_100000711301_100000690610 [0,1,0,0,0,0|3,0,0]=4 1265 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)Br 527a_100000711301_100000690610 [0,1,0,0,0,0|3,0,0]=4 1266 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)Cl 11a_100000711301_100000736951 [0,1,0,0,0,0|3,0,0]=4 1267 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)Cl 240690a_100000711301_100000736951 [0,1,0,0,0,0|3,0,0]=4 1268 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)Cl 527a_100000711301_100000736951 [0,1,0,0,0,0|3,0,0]=4 1269 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)F 11a_100000711301_100000212315 [0,1,0,0,0,0|3,0,0]=4 1270 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)F 240690a_100000711301_100000212315 [0,1,0,0,0,0|3,0,0]=4 1271 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)F 527a_100000711301_100000212315 [0,1,0,0,0,0|3,0,0]=4 1272 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)I 11a_100000711301_100000698340 [0,1,0,0,0,0|3,0,0]=4 1273 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)I 240690a_100000711301_100000698340 [0,1,0,0,0,0|3,0,0]=4 1274 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)I 527a_100000711301_100000698340 [0,1,0,0,0,0|3,0,0]=4 1275 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)O 240690a_100000711301_100012352043 [0,1,0,0,0,0|3,0,0]=4 1276 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Br)O 527a_100000711301_100012352043 [0,1,0,0,0,0|3,0,0]=4 1277 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)Br 11a_100000711301_100000211212 [0,1,0,0,0,0|3,0,0]=4 1278 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)Br 240690a_100000711301_100000211212 [0,1,0,0,0,0|3,0,0]=4 1279 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)Br 527a_100000711301_100000211212 [0,1,0,0,0,0|3,0,0]=4 1280 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)Cl 11a_100000711301_100000210642 [0,1,0,0,0,0|3,0,0]=4 1281 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)Cl 240690a_100000711301_100000210642 [0,1,0,0,0,0|3,0,0]=4 1282 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)Cl 527a_100000711301_100000210642 [0,1,0,0,0,0|3,0,0]=4 1283 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)F 11a_100000711301_100011219680 [0,1,0,0,0,0|3,0,0]=4 1284 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)F 240690a_100000711301_100011219680 [0,1,0,0,0,0|3,0,0]=4 1285 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)F 527a_100000711301_100011219680 [0,1,0,0,0,0|3,0,0]=4 1286 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)I 11a_100000711301_100000688013 [0,1,0,0,0,0|3,0,0]=4 1287 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)I 240690a_100000711301_100000688013 [0,1,0,0,0,0|3,0,0]=4 1288 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)I 527a_100000711301_100000688013 [0,1,0,0,0,0|3,0,0]=4 1289 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)O 240690a_100000711301_100000719527 [0,1,0,0,0,0|3,0,0]=4 1290 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1Cl)O 527a_100000711301_100000719527 [0,1,0,0,0,0|3,0,0]=4 1291 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)Br 11a_100000711301_100000212322 [0,1,0,0,0,0|3,0,0]=4 1292 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)Br 240690a_100000711301_100000212322 [0,1,0,0,0,0|3,0,0]=4 1293 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)Br 527a_100000711301_100000212322 [0,1,0,0,0,0|3,0,0]=4 1294 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)Cl 11a_100000711301_100000214954 [0,1,0,0,0,0|3,0,0]=4 1295 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)Cl 240690a_100000711301_100000214954 [0,1,0,0,0,0|3,0,0]=4 1296 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)Cl 527a_100000711301_100000214954 [0,1,0,0,0,0|3,0,0]=4 1297 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)F 11a_100000711301_100000198512 [0,1,0,0,0,0|3,0,0]=4 1298 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)F 240690a_100000711301_100000198512 [0,1,0,0,0,0|3,0,0]=4 1299 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)F 527a_100000711301_100000198512 [0,1,0,0,0,0|3,0,0]=4 1300 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)I 11a_100000711301_100000688014 [0,1,0,0,0,0|3,0,0]=4 1301 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)I 240690a_100000711301_100000688014 [0,1,0,0,0,0|3,0,0]=4 1302 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)I 527a_100000711301_100000688014 [0,1,0,0,0,0|3,0,0]=4 1303 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)O 240690a_100000711301_100000037260 [0,1,0,0,0,0|3,0,0]=4 1304 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1F)O 527a_100000711301_100000037260 [0,1,0,0,0,0|3,0,0]=4 1305 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)Br 11a_100000711301_100000183945 [0,1,0,0,0,0|3,0,0]=4 1306 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)Br 240690a_100000711301_100000183945 [0,1,0,0,0,0|3,0,0]=4 1307 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)Cl 11a_100000711301_100000739379 [0,1,0,0,0,0|3,0,0]=4 1308 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)Cl 240690a_100000711301_100000739379 [0,1,0,0,0,0|3,0,0]=4 1309 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)Cl 527a_100000711301_100000739379 [0,1,0,0,0,0|3,0,0]=4 1310 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)F 11a_100000711301_100000748905 [0,1,0,0,0,0|3,0,0]=4 1311 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)F 240690a_100000711301_100000748905 [0,1,0,0,0,0|3,0,0]=4 1312 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)F 527a_100000711301_100000748905 [0,1,0,0,0,0|3,0,0]=4 1313 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)I 11a_100000711301_100000750460 [0,1,0,0,0,0|3,0,0]=4 1314 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)I 240690a_100000711301_100000750460 [0,1,0,0,0,0|3,0,0]=4 1315 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)I 527a_100000711301_100000750460 [0,1,0,0,0,0|3,0,0]=4 1316 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)O 240690a_100000711301_200009995701 [0,1,0,0,0,0|3,0,0]=4 1317 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1I)O 527a_100000711301_200009995701 [0,1,0,0,0,0|3,0,0]=4 1318 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)Br 240690a_100000711301_100000212140 [0,1,0,0,0,0|2,0,0]=3 1319 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)Br 527a_100000711301_100000212140 [0,1,0,0,0,0|2,0,0]=3 1320 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)Cl 11a_100000711301_100000212143 [0,1,0,0,0,0|2,0,0]=3 1321 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)Cl 240690a_100000711301_100000212143 [0,1,0,0,0,0|2,0,0]=3 1322 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)Cl 527a_100000711301_100000212143 [0,1,0,0,0,0|2,0,0]=3 1323 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)F 240690a_100000711301_100000742286 [0,1,0,0,0,0|2,0,0]=3 1324 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)F 527a_100000711301_100000742286 [0,1,0,0,0,0|2,0,0]=3 1325 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)I 240690a_100000711301_100000212111 [0,1,0,0,0,0|2,0,0]=3 1326 B15R1.8420 NC(=O)CNC(=O)c1cc(ccc1O)I 527a_100000711301_100000212111 [0,1,0,0,0,0|2,0,0]=3 1327 B15R1.8420 [13CH3]C(=O)CNC(=O)c1cc(ccc1Cl)Cl 1458a_100000189190_200025704644 [0,1,0,0,0,0|3,0,0]=4 1328 B15R1.8420 [13CH3]C(=O)CNC(=O)c1cc(ccc1O)O 1458a_100011219787_200025704644 [0,1,0,0,0,0|2,0,0]=3 1329 B15R1.10019 CCN(CCC(=O)C)c1ccccc1O 269982a_103624766699_100000053229 [0,1,0,0,0,0|3,0,0]=4 1330 B15R1.10019 CCN(CCC(=O)N)c1ccccc1O 269982a_103624766699_100000744528 [0,1,0,0,0,0|3,0,0]=4 1331 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000070787_100011218569 [0,0,0,1,0,0|3,0,0]=4 1332 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200000210301 [0,0,0,1,0,0|3,0,0]=4 1333 B15R2.6 NC(=O)CSc1coc2c1cccc2 62a_100000747473_100009812202 [0,0,0,1,0,0|3,0,0]=4 1334 B15R2.6 NC(=O)CSc1noc2c1cccc2 62a_100000747473_200000703156 [0,0,0,1,0,0|3,0,0]=4 1335 B15R2.6 NC(=O)CSc1noc2c1cccc2 62a_200000703156_100000747473 [0,0,0,1,0,0|3,0,0]=4 1336 B15R2.6 O=C([O-])CSc1coc2c1cccc2 62a_100020667443_100009812202 [0,0,0,1,0,0|2,0,1]=4 1337 B15R2.6 O=C([O-])CSc1noc2c1cccc2 62a_100020667443_200000703156 [0,0,0,1,0,0|2,0,1]=4 1338 B15R2.6 O=C([O-])CSc1noc2c1cccc2 62a_200000703156_100020667443 [0,0,0,1,0,0|2,0,1]=4 1339 B15R2.6 [13CH3]C(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200025704644 [0,0,0,1,0,0|3,0,0]=4 1340 B15R2.308 Oc1ccccc1C2=CCC(CC2)O 271570a_100010254553_100000739446 [0,0,0,1,0,0|2,0,1]=4 1341 B15R2.629 CC(=O)CN1Cc2ccccc2C1=O 1458a_100000752569_200000210301 [0,0,0,1,0,0|3,0,0]=4 1342 B15R2.629 [13CH3]C(=O)CN1Cc2ccccc2C1=O 1458a_100000752569_200025704644 [0,0,0,1,0,0|3,0,0]=4 1343 B15R2.7432 CN(c1ccccc1O)C2CC(=O)C2 269982a_100000033821_100009894365 [0,0,0,1,0,0|3,0,0]=4 1344 B15R2.7432 O=C(c1ccccc1O)N2CC(C2)O 240690a_100000749847_100015234032 [0,0,0,1,0,0|2,0,1]=4 1345 B15R2.8805 Cc1ccccc1C(=O)CCC2CO2 1458a_100000212026_100000732470 [0,0,0,1,0,0|2,0,1]=4 1346 B15R2.8805 O=C(CCC1CC1)c2ccccc2O 1458a_100015234032_100000694398 [0,0,0,1,0,0|2,0,1]=4 1347 B15R2.8805 O=C(CCC1CO1)c2ccccc2Br 1458a_100000188424_100000732470 [0,0,0,1,0,0|2,0,1]=4 1348 B15R2.8805 O=C(CCC1CO1)c2ccccc2Cl 1458a_100000185844_100000732470 [0,0,0,1,0,0|2,0,1]=4 1349 B15R2.8805 O=C(CCC1CO1)c2ccccc2F 1458a_100000188656_100000732470 [0,0,0,1,0,0|2,0,1]=4 1350 B15R2.8805 O=C(CCC1CO1)c2ccccc2I 1458a_100000187884_100000732470 [0,0,0,1,0,0|2,0,1]=4 1351 B15R2.8805 O=C(CCC1CO1)c2ccccc2O 1458a_100015234032_100000732470 [0,0,0,1,0,0|1,0,1]=3 1352 B15R2.8805 O=C(CCC1CO1)c2ccccc2[O-] 1458a_100009911694_100000732470 [0,0,0,1,0,0|1,0,2]=4 1353 B13R1.201 C=C(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748629 [0,0,0,0,1,0|3,0,0]=4 1354 B13R1.201 C=C(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748629 [0,0,0,0,1,0|3,0,0]=4 1355 B13R1.201 C=C(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748629 [0,0,0,0,1,0|3,0,0]=4 1356 B13R1.201 C=C(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748629 [0,0,0,0,1,0|3,0,0]=4 1357 B13R1.201 C=C(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748629 [0,0,0,0,1,0|3,0,0]=4 1358 B13R1.201 C=C(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748629 [0,0,0,0,1,0|2,0,0]=3 1359 B13R1.201 C=C(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748629 [0,0,0,0,1,0|2,0,1]=4 1360 B13R1.201 C=C(F)CC(=O)c1ccccc1Br 1458a_100000188424_100009893438 [0,0,0,0,1,0|3,0,0]=4 1361 B13R1.201 C=C(F)CC(=O)c1ccccc1C 1458a_100000212026_100009893438 [0,0,0,0,1,0|3,0,0]=4 1362 B13R1.201 C=C(F)CC(=O)c1ccccc1Cl 1458a_100000185844_100009893438 [0,0,0,0,1,0|3,0,0]=4 1363 B13R1.201 C=C(F)CC(=O)c1ccccc1F 1458a_100000188656_100009893438 [0,0,0,0,1,0|3,0,0]=4 1364 B13R1.201 C=C(F)CC(=O)c1ccccc1I 1458a_100000187884_100009893438 [0,0,0,0,1,0|3,0,0]=4 1365 B13R1.201 C=C(F)CC(=O)c1ccccc1O 1458a_100015234032_100009893438 [0,0,0,0,1,0|2,0,0]=3 1366 B13R1.201 C=C(F)CC(=O)c1ccccc1[O-] 1458a_100009911694_100009893438 [0,0,0,0,1,0|2,0,1]=4 1367 B13R1.201 CC(=O)CC(=O)c1ccccc1Br 1458a_100000070787_100000199116 [0,0,0,0,1,0|2,0,0]=3 1368 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [0,0,0,0,1,0|2,0,0]=3 1369 B13R1.201 CC(=O)CC(=O)c1ccccc1Cl 1458a_100000070787_100000211432 [0,0,0,0,1,0|2,0,0]=3 1370 B13R1.201 CC(=O)CC(=O)c1ccccc1F 1458a_100000070787_100000204681 [0,0,0,0,1,0|2,0,0]=3 1371 B13R1.201 CC(=O)CC(=O)c1ccccc1O 1458a_100000070787_100000188908 [0,0,0,0,1,0|1,0,0]=2 1372 B13R1.201 CC(=O)CC(=O)c1ccccc1O 271570a_203496583355_200011243946 [0,0,0,0,1,0|1,0,0]=2 1373 B13R1.201 CC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000210624 [0,0,0,0,1,0|2,0,1]=4 1374 B13R1.201 CC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218427 [0,0,0,0,1,0|2,0,1]=4 1375 B13R1.201 CC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218427 [0,0,0,0,1,0|2,0,1]=4 1376 B13R1.201 CC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218427 [0,0,0,0,1,0|2,0,1]=4 1377 B13R1.201 CC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218427 [0,0,0,0,1,0|2,0,1]=4 1378 B13R1.201 CC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218427 [0,0,0,0,1,0|1,0,1]=3 1379 B13R1.201 CC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218427 [0,0,0,0,1,0|1,0,2]=4 1380 B13R1.201 CN(C)CC(=O)c1ccccc1O 269982a_100102631434_100000188908 [0,0,0,0,1,0|3,0,0]=4 1381 B13R1.201 CN(CC(=O)N)c1ccccc1O 269982a_100000033821_100000187820 [0,0,0,0,1,0|3,0,0]=4 1382 B13R1.201 CN(CC(=O)O)c1ccccc1Cl 269956a_100000742597_200000210301 [0,0,0,0,1,0|3,0,0]=4 1383 B13R1.201 CN(CC(=O)O)c1ccccc1F 269956a_200011202418_200000210301 [0,0,0,0,1,0|3,0,0]=4 1384 B13R1.201 CN(CC(=O)[O-])c1ccccc1O 269982a_100000033821_100020667443 [0,0,0,0,1,0|2,0,1]=4 1385 B13R1.201 Cc1ccccc1C(=O)CC(=O)N 1458a_100000212026_100000187820 [0,0,0,0,1,0|2,0,0]=3 1386 B13R1.201 Cc1ccccc1C(=O)CC(=O)[O-] 1458a_100000212026_100020667443 [0,0,0,0,1,0|1,0,1]=3 1387 B13R1.201 Cc1ccccc1C(=O)CC(C)O 1458a_100000212026_100011218427 [0,0,0,0,1,0|2,0,1]=4 1388 B13R1.201 Cc1ccccc1C(=O)C[N+](=O)[O-] 1458a_100000212026_100000761209 [0,0,0,0,1,0|2,0,1]=4 1389 B13R1.201 Cc1ccccc1N(C)CC(=O)O 269956a_200011202413_200000210301 [0,0,0,0,1,0|3,0,0]=4 1390 B13R1.201 Cc1ccccc1N([13CH3])CC(=O)O 269956a_200011202413_200025704644 [0,0,0,0,1,0|3,0,0]=4 1391 B13R1.201 NC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000187820 [0,0,0,0,1,0|2,0,0]=3 1392 B13R1.201 NC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000187820 [0,0,0,0,1,0|2,0,0]=3 1393 B13R1.201 NC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000187820 [0,0,0,0,1,0|2,0,0]=3 1394 B13R1.201 NC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000187820 [0,0,0,0,1,0|2,0,0]=3 1395 B13R1.201 NC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000187820 [0,0,0,0,1,0|1,0,0]=2 1396 B13R1.201 NC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000187820 [0,0,0,0,1,0|1,0,1]=3 1397 B13R1.201 O=C(CC(F)F)c1ccccc1O 1458a_100015234032_100011934356 [0,0,0,0,1,0|2,0,1]=4 1398 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1Br 1458a_100000188424_100000761209 [0,0,0,0,1,0|2,0,1]=4 1399 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1Cl 1458a_100000185844_100000761209 [0,0,0,0,1,0|2,0,1]=4 1400 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1F 1458a_100000188656_100000761209 [0,0,0,0,1,0|2,0,1]=4 1401 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1I 1458a_100000187884_100000761209 [0,0,0,0,1,0|2,0,1]=4 1402 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1O 1458a_100015234032_100000761209 [0,0,0,0,1,0|1,0,1]=3 1403 B13R1.201 O=C(C[N+](=O)[O-])c1ccccc1[O-] 1458a_100009911694_100000761209 [0,0,0,0,1,0|1,0,2]=4 1404 B13R1.201 O=C([O-])CC(=O)c1ccccc1Br 1458a_100000188424_100020667443 [0,0,0,0,1,0|1,0,1]=3 1405 B13R1.201 O=C([O-])CC(=O)c1ccccc1Cl 1458a_100000185844_100020667443 [0,0,0,0,1,0|1,0,1]=3 1406 B13R1.201 O=C([O-])CC(=O)c1ccccc1F 1458a_100000188656_100020667443 [0,0,0,0,1,0|1,0,1]=3 1407 B13R1.201 O=C([O-])CC(=O)c1ccccc1I 1458a_100000187884_100020667443 [0,0,0,0,1,0|1,0,1]=3 1408 B13R1.201 O=C([O-])CC(=O)c1ccccc1O 1458a_100015234032_100020667443 [0,0,0,0,1,0|0,0,1]=2 1409 B13R1.201 O=C([O-])CC(=O)c1ccccc1[O-] 1458a_100009911694_100020667443 [0,0,0,0,1,0|0,0,2]=3 1410 B13R1.201 [13CH3]N(CC(=O)O)c1ccccc1Cl 269956a_100000742597_200025704644 [0,0,0,0,1,0|3,0,0]=4 1411 B13R1.201 [13CH3]N(CC(=O)O)c1ccccc1F 269956a_200011202418_200025704644 [0,0,0,0,1,0|3,0,0]=4 1412 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000730704 [0,0,0,0,0,1|3,0,0]=4 1413 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1Br 1458a_200000688413_100000184730 [0,0,0,0,0,1|3,0,0]=4 1414 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1C 1458a_100000212180_100000730704 [0,0,0,0,0,1|3,0,0]=4 1415 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1C 1458a_200000688413_100000211839 [0,0,0,0,0,1|3,0,0]=4 1416 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000730704 [0,0,0,0,0,1|3,0,0]=4 1417 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1Cl 1458a_200000688413_100000187162 [0,0,0,0,0,1|3,0,0]=4 1418 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1F 1458a_100000212012_100000730704 [0,0,0,0,0,1|3,0,0]=4 1419 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1F 1458a_200000688413_100000187165 [0,0,0,0,0,1|3,0,0]=4 1420 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1I 1458a_100000036491_100000730704 [0,0,0,0,0,1|3,0,0]=4 1421 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1I 1458a_200000688413_100011216222 [0,0,0,0,0,1|3,0,0]=4 1422 B15R1.256 C=C(C)CCC(=O)Cc1ccccc1O 1458a_100000743006_100000730704 [0,0,0,0,0,1|2,0,0]=3 1423 B15R1.256 C=C(C)CCC(=O)Cc1ncccc1O 1458a_200000688413_200020655725 [0,0,0,0,0,1|3,0,0]=4 1424 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1Br 11a_100000210017_200000688413 [0,0,0,0,0,1|3,0,0]=4 1425 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1Br 1626a_100000210017_200000688413 [0,0,0,0,0,1|3,0,0]=4 1426 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1C 11a_100015192222_200000688413 [0,0,0,0,0,1|3,0,0]=4 1427 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1C 1626a_100015192222_200000688413 [0,0,0,0,0,1|3,0,0]=4 1428 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1C 22a_100015192222_200000688413 [0,0,0,0,0,1|3,0,0]=4 1429 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1C 527a_100015192222_200000688413 [0,0,0,0,0,1|3,0,0]=4 1430 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1Cl 11a_100000185783_200000688413 [0,0,0,0,0,1|3,0,0]=4 1431 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_200000688413 [0,0,0,0,0,1|3,0,0]=4 1432 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1Cl 22a_100000185783_200000688413 [0,0,0,0,0,1|3,0,0]=4 1433 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1Cl 527a_100000185783_200000688413 [0,0,0,0,0,1|3,0,0]=4 1434 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1F 11a_100000210422_200000688413 [0,0,0,0,0,1|3,0,0]=4 1435 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1F 1626a_100000210422_200000688413 [0,0,0,0,0,1|3,0,0]=4 1436 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1F 22a_100000210422_200000688413 [0,0,0,0,0,1|3,0,0]=4 1437 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1F 527a_100000210422_200000688413 [0,0,0,0,0,1|3,0,0]=4 1438 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1I 11a_100000210053_200000688413 [0,0,0,0,0,1|3,0,0]=4 1439 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1I 1626a_100000210053_200000688413 [0,0,0,0,0,1|3,0,0]=4 1440 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1O 22a_100000185747_200000688413 [0,0,0,0,0,1|2,0,0]=3 1441 B15R1.256 C=C(C)CCC(=O)Nc1ccccc1O 527a_100000185747_200000688413 [0,0,0,0,0,1|2,0,0]=3 1442 B15R1.256 C=C(C)CNC(=O)Cc1ccccc1O 240690a_100000765925_100000743006 [0,0,0,0,0,1|3,0,0]=4 1443 B15R1.256 C=C(C)CNC(=O)Cc1ccccc1O 527a_100000765925_100000743006 [0,0,0,0,0,1|3,0,0]=4 1444 B15R1.256 C=C(C)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000765925 [0,0,0,0,0,1|3,0,0]=4 1445 B15R1.256 CC(=CCC(=O)Cc1ccccc1O)C 1458a_100000743006_100000761012 [0,0,0,0,0,1|2,0,1]=4 1446 B15R1.256 CC(=CCC(=O)Nc1ccccc1O)C 22a_100000185747_100011220947 [0,0,0,0,0,1|2,0,1]=4 1447 B15R1.256 CC(=CCC(=O)Nc1ccccc1O)C 527a_100000185747_100011220947 [0,0,0,0,0,1|2,0,1]=4 1448 B15R1.256 CC(=O)CCC(=O)Nc1ccccc1C 1458a_200000180964_200000210301 [0,0,0,0,0,1|2,0,0]=3 1449 B15R1.256 CC(=O)CCC(=O)Nc1ccccc1O 1458a_100000011731_200000210301 [0,0,0,0,0,1|1,0,0]=2 1450 B15R1.256 CC(=O)CCN(C)Cc1ccccc1O 269982a_100015189988_100000053229 [0,0,0,0,0,1|3,0,0]=4 1451 B15R1.256 CC(=O)NCC(=O)Cc1ccccc1Br 1458a_100000194580_100000184730 [0,0,0,0,0,1|3,0,0]=4 1452 B15R1.256 CC(=O)NCC(=O)Cc1ccccc1C 1458a_100000194580_100000211839 [0,0,0,0,0,1|3,0,0]=4 1453 B15R1.256 CC(=O)NCC(=O)Cc1ccccc1Cl 1458a_100000194580_100000187162 [0,0,0,0,0,1|3,0,0]=4 1454 B15R1.256 CC(=O)NCC(=O)Cc1ccccc1F 1458a_100000194580_100000187165 [0,0,0,0,0,1|3,0,0]=4 1455 B15R1.256 CC(=O)NCC(=O)Cc1ccccc1I 1458a_100000194580_100011216222 [0,0,0,0,0,1|3,0,0]=4 1456 B15R1.256 CC(=O)NCC(=O)Cc1ncccc1O 1458a_100000194580_200020655725 [0,0,0,0,0,1|3,0,0]=4 1457 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Br 11a_100000210017_100000194580 [0,0,0,0,0,1|3,0,0]=4 1458 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Br 11a_100000683505_100015343762 [0,0,0,0,0,1|3,0,0]=4 1459 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Br 1626a_100000210017_100000194580 [0,0,0,0,0,1|3,0,0]=4 1460 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Br 1626a_100000683505_100015343762 [0,0,0,0,0,1|3,0,0]=4 1461 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Br 240690a_100000683505_100015343762 [0,0,0,0,0,1|3,0,0]=4 1462 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Br 527a_100000683505_100103153847 [0,0,0,0,0,1|3,0,0]=4 1463 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 11a_100015186652_100015343762 [0,0,0,0,0,1|3,0,0]=4 1464 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 11a_100015192222_100000194580 [0,0,0,0,0,1|3,0,0]=4 1465 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 1626a_100015186652_100015343762 [0,0,0,0,0,1|3,0,0]=4 1466 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 1626a_100015192222_100000194580 [0,0,0,0,0,1|3,0,0]=4 1467 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 22a_100015192222_100000194580 [0,0,0,0,0,1|3,0,0]=4 1468 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 240690a_100015186652_100015343762 [0,0,0,0,0,1|3,0,0]=4 1469 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 527a_100015186652_100103153847 [0,0,0,0,0,1|3,0,0]=4 1470 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1C 527a_100015192222_100000194580 [0,0,0,0,0,1|3,0,0]=4 1471 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Cl 11a_100000185783_100000194580 [0,0,0,0,0,1|3,0,0]=4 1472 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000194580 [0,0,0,0,0,1|3,0,0]=4 1473 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Cl 22a_100000185783_100000194580 [0,0,0,0,0,1|3,0,0]=4 1474 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1Cl 527a_100000185783_100000194580 [0,0,0,0,0,1|3,0,0]=4 1475 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1F 11a_100000210422_100000194580 [0,0,0,0,0,1|3,0,0]=4 1476 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1F 1626a_100000210422_100000194580 [0,0,0,0,0,1|3,0,0]=4 1477 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1F 22a_100000210422_100000194580 [0,0,0,0,0,1|3,0,0]=4 1478 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1F 527a_100000210422_100000194580 [0,0,0,0,0,1|3,0,0]=4 1479 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1I 11a_100000210053_100000194580 [0,0,0,0,0,1|3,0,0]=4 1480 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1I 1626a_100000210053_100000194580 [0,0,0,0,0,1|3,0,0]=4 1481 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1O 22a_100000185747_100000194580 [0,0,0,0,0,1|2,0,0]=3 1482 B15R1.256 CC(=O)NCC(=O)Nc1ccccc1O 527a_100000185747_100000194580 [0,0,0,0,0,1|2,0,0]=3 1483 B15R1.256 CC(=O)NNC(=O)Cc1ccccc1O 22a_100000189765_100000743006 [0,0,0,0,0,1|3,0,0]=4 1484 B15R1.256 CC(=O)OCC(=O)Cc1ccccc1Br 1458a_100000183556_100000184730 [0,0,0,0,0,1|3,0,0]=4 1485 B15R1.256 CC(=O)OCC(=O)Cc1ccccc1C 1458a_100000183556_100000211839 [0,0,0,0,0,1|3,0,0]=4 1486 B15R1.256 CC(=O)OCC(=O)Cc1ccccc1Cl 1458a_100000183556_100000187162 [0,0,0,0,0,1|3,0,0]=4 1487 B15R1.256 CC(=O)OCC(=O)Cc1ccccc1F 1458a_100000183556_100000187165 [0,0,0,0,0,1|3,0,0]=4 1488 B15R1.256 CC(=O)OCC(=O)Cc1ccccc1I 1458a_100000183556_100011216222 [0,0,0,0,0,1|3,0,0]=4 1489 B15R1.256 CC(=O)OCC(=O)Cc1ncccc1O 1458a_100000183556_200020655725 [0,0,0,0,0,1|3,0,0]=4 1490 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1Br 1626a_100000210017_100000183556 [0,0,0,0,0,1|3,0,0]=4 1491 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1C 1626a_100015192222_100000183556 [0,0,0,0,0,1|3,0,0]=4 1492 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1C 22a_100015192222_100000183556 [0,0,0,0,0,1|3,0,0]=4 1493 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1C 527a_100015192222_100000183556 [0,0,0,0,0,1|3,0,0]=4 1494 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000183556 [0,0,0,0,0,1|3,0,0]=4 1495 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1Cl 22a_100000185783_100000183556 [0,0,0,0,0,1|3,0,0]=4 1496 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1Cl 527a_100000185783_100000183556 [0,0,0,0,0,1|3,0,0]=4 1497 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1F 1626a_100000210422_100000183556 [0,0,0,0,0,1|3,0,0]=4 1498 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1F 22a_100000210422_100000183556 [0,0,0,0,0,1|3,0,0]=4 1499 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1F 527a_100000210422_100000183556 [0,0,0,0,0,1|3,0,0]=4 1500 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1I 1626a_100000210053_100000183556 [0,0,0,0,0,1|3,0,0]=4 1501 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1O 22a_100000185747_100000183556 [0,0,0,0,0,1|2,0,0]=3 1502 B15R1.256 CC(=O)OCC(=O)Nc1ccccc1O 527a_100000185747_100000183556 [0,0,0,0,0,1|2,0,0]=3 1503 B15R1.256 CC(=O)SCC(=O)Cc1ccccc1Br 1458a_100000049016_100000184730 [0,0,0,0,0,1|3,0,0]=4 1504 B15R1.256 CC(=O)SCC(=O)Cc1ccccc1C 1458a_100000049016_100000211839 [0,0,0,0,0,1|3,0,0]=4 1505 B15R1.256 CC(=O)SCC(=O)Cc1ccccc1Cl 1458a_100000049016_100000187162 [0,0,0,0,0,1|3,0,0]=4 1506 B15R1.256 CC(=O)SCC(=O)Cc1ccccc1F 1458a_100000049016_100000187165 [0,0,0,0,0,1|3,0,0]=4 1507 B15R1.256 CC(=O)SCC(=O)Cc1ccccc1I 1458a_100000049016_100011216222 [0,0,0,0,0,1|3,0,0]=4 1508 B15R1.256 CC(=O)SCC(=O)Cc1ncccc1O 1458a_100000049016_200020655725 [0,0,0,0,0,1|3,0,0]=4 1509 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1Br 11a_100000210017_100000049016 [0,0,0,0,0,1|3,0,0]=4 1510 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1Br 1626a_100000210017_100000049016 [0,0,0,0,0,1|3,0,0]=4 1511 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1C 11a_100015192222_100000049016 [0,0,0,0,0,1|3,0,0]=4 1512 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1C 1626a_100015192222_100000049016 [0,0,0,0,0,1|3,0,0]=4 1513 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1Cl 11a_100000185783_100000049016 [0,0,0,0,0,1|3,0,0]=4 1514 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000049016 [0,0,0,0,0,1|3,0,0]=4 1515 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1F 11a_100000210422_100000049016 [0,0,0,0,0,1|3,0,0]=4 1516 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1F 1626a_100000210422_100000049016 [0,0,0,0,0,1|3,0,0]=4 1517 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1I 11a_100000210053_100000049016 [0,0,0,0,0,1|3,0,0]=4 1518 B15R1.256 CC(=O)SCC(=O)Nc1ccccc1I 1626a_100000210053_100000049016 [0,0,0,0,0,1|3,0,0]=4 1519 B15R1.256 CC(C)CCC(=O)Cc1ccccc1O 1458a_100000743006_100000210312 [0,0,0,0,0,1|2,0,1]=4 1520 B15R1.256 CC(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000181311 [0,0,0,0,0,1|2,0,1]=4 1521 B15R1.256 CC(C)CCC(=O)Nc1ccccc1O 527a_100000185747_100000181311 [0,0,0,0,0,1|2,0,1]=4 1522 B15R1.256 CC(O)CCC(=O)Cc1ccccc1Br 1458a_100000751119_100012276601 [0,0,0,0,0,1|2,0,1]=4 1523 B15R1.256 CC(O)CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100012276601 [0,0,0,0,0,1|2,0,1]=4 1524 B15R1.256 CC(O)CCC(=O)Cc1ccccc1F 1458a_100000212012_100012276601 [0,0,0,0,0,1|2,0,1]=4 1525 B15R1.256 CC(O)CCC(=O)Cc1ccccc1I 1458a_100000036491_100012276601 [0,0,0,0,0,1|2,0,1]=4 1526 B15R1.256 CC(O)CCC(=O)Cc1ccccc1O 1458a_100000743006_100012276601 [0,0,0,0,0,1|1,0,1]=3 1527 B15R1.256 CC(O)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000718519 [0,0,0,0,0,1|2,0,1]=4 1528 B15R1.256 CC(O)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000718519 [0,0,0,0,0,1|2,0,1]=4 1529 B15R1.256 CC(O)CCC(=O)Nc1ccccc1F 1626a_100000210422_100000718519 [0,0,0,0,0,1|2,0,1]=4 1530 B15R1.256 CC(O)CCC(=O)Nc1ccccc1I 1626a_100000210053_100000718519 [0,0,0,0,0,1|2,0,1]=4 1531 B15R1.256 CC(O)CNC(=O)Cc1ccccc1O 240690a_100000210904_100000743006 [0,0,0,0,0,1|2,0,1]=4 1532 B15R1.256 CC(O)CNC(=O)Cc1ccccc1O 527a_100000210904_100000743006 [0,0,0,0,0,1|2,0,1]=4 1533 B15R1.256 CC(O)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000210904 [0,0,0,0,0,1|2,0,1]=4 1534 B15R1.256 CN(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000689311 [0,0,0,0,0,1|3,0,0]=4 1535 B15R1.256 CN(C)CCC(=O)Nc1ccccc1O 527a_100000185747_100000689311 [0,0,0,0,0,1|3,0,0]=4 1536 B15R1.256 CN(CCC(=O)N)Cc1ccccc1O 2230a_100015189988_100000744528 [0,0,0,0,0,1|3,0,0]=4 1537 B15R1.256 CN(CCC(=O)N)Cc1ccccc1O 269982a_100015189988_100000744528 [0,0,0,0,0,1|3,0,0]=4 1538 B15R1.256 C[S+](C)CCC(=O)Nc1ccccc1O 22a_100000185747_100009452791 [0,0,0,0,0,1|3,0,0]=4 1539 B15R1.256 Cc1ccccc1CC(=O)CCC(=O)N 1458a_100011215257_100000211839 [0,0,0,0,0,1|2,0,0]=3 1540 B15R1.256 Cc1ccccc1CC(=O)CCC(C)O 1458a_100000212180_100012276601 [0,0,0,0,0,1|2,0,1]=4 1541 B15R1.256 Cc1ccccc1CC(=O)CC[N+](=O)[O-] 1458a_200000064761_100000211839 [0,0,0,0,0,1|2,0,1]=4 1542 B15R1.256 Cc1ccccc1CC(=O)CNC(=O)N 1458a_100000184981_100000211839 [0,0,0,0,0,1|3,0,0]=4 1543 B15R1.256 Cc1ccccc1CC(=O)NCC(=O)N 11a_100000711301_100000212180 [0,0,0,0,0,1|3,0,0]=4 1544 B15R1.256 Cc1ccccc1CC(=O)NCC(=O)N 240690a_100000711301_100000212180 [0,0,0,0,0,1|3,0,0]=4 1545 B15R1.256 Cc1ccccc1CC(=O)NCC(=O)N 527a_100000711301_100000212180 [0,0,0,0,0,1|3,0,0]=4 1546 B15R1.256 Cc1ccccc1NC(=O)CCC(=O)N 22a_100015192222_100011215257 [0,0,0,0,0,1|2,0,0]=3 1547 B15R1.256 Cc1ccccc1NC(=O)CCC(=O)N 527a_100015192222_100011215257 [0,0,0,0,0,1|2,0,0]=3 1548 B15R1.256 Cc1ccccc1NC(=O)CCC(=O)[13CH3] 1458a_200000180964_200025704644 [0,0,0,0,0,1|2,0,0]=3 1549 B15R1.256 Cc1ccccc1NC(=O)CCC(C)O 1626a_100015192222_100000718519 [0,0,0,0,0,1|2,0,1]=4 1550 B15R1.256 Cc1ccccc1NC(=O)CC[N+](=O)[O-] 11a_100015192222_200000064761 [0,0,0,0,0,1|2,0,1]=4 1551 B15R1.256 Cc1ccccc1NC(=O)CC[N+](=O)[O-] 1626a_100015192222_200000064761 [0,0,0,0,0,1|2,0,1]=4 1552 B15R1.256 Cc1ccccc1NC(=O)CNC(=O)N 22a_100015192222_100000184981 [0,0,0,0,0,1|3,0,0]=4 1553 B15R1.256 Cc1ccccc1NC(=O)CNC(=O)N 527a_100015192222_100000184981 [0,0,0,0,0,1|3,0,0]=4 1554 B15R1.256 Cc1ccccc1NC(=O)NCC(=O)N 2430a_100015192222_100000711301 [0,0,0,0,0,1|3,0,0]=4 1555 B15R1.256 Cc1cccnc1CC(=O)CCC(=O)N 1458a_100011215257_100000696600 [0,0,0,0,0,1|3,0,0]=4 1556 B15R1.256 Cc1ccncc1CC(=O)CCC(=O)N 1458a_100011215257_100000690890 [0,0,0,0,0,1|3,0,0]=4 1557 B15R1.256 Cc1cnccc1CC(=O)CCC(=O)N 1458a_100011215257_100020672808 [0,0,0,0,0,1|3,0,0]=4 1558 B15R1.256 Cc1ncccc1CC(=O)CCC(=O)N 1458a_100011215257_100000732876 [0,0,0,0,0,1|3,0,0]=4 1559 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1Br 1458a_100011215257_100000184730 [0,0,0,0,0,1|2,0,0]=3 1560 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1Cl 1458a_100011215257_100000187162 [0,0,0,0,0,1|2,0,0]=3 1561 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1F 1458a_100011215257_100000187165 [0,0,0,0,0,1|2,0,0]=3 1562 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1I 1458a_100011215257_100011216222 [0,0,0,0,0,1|2,0,0]=3 1563 B15R1.256 NC(=O)CCC(=O)Cc1cccnc1Br 1458a_100011215257_100010140945 [0,0,0,0,0,1|3,0,0]=4 1564 B15R1.256 NC(=O)CCC(=O)Cc1cccnc1Cl 1458a_100011215257_100000045678 [0,0,0,0,0,1|3,0,0]=4 1565 B15R1.256 NC(=O)CCC(=O)Cc1cccnc1F 1458a_100011215257_100000099810 [0,0,0,0,0,1|3,0,0]=4 1566 B15R1.256 NC(=O)CCC(=O)Cc1ccncc1Cl 1458a_100011215257_100000763264 [0,0,0,0,0,1|3,0,0]=4 1567 B15R1.256 NC(=O)CCC(=O)Cc1ncccc1Br 1458a_100011215257_100025702911 [0,0,0,0,0,1|3,0,0]=4 1568 B15R1.256 NC(=O)CCC(=O)Cc1ncccc1Cl 1458a_100011215257_100000099807 [0,0,0,0,0,1|3,0,0]=4 1569 B15R1.256 NC(=O)CCC(=O)Cc1ncccc1F 1458a_100011215257_100000104219 [0,0,0,0,0,1|3,0,0]=4 1570 B15R1.256 NC(=O)CCC(=O)Cc1ncccc1O 1458a_100011215257_200020655725 [0,0,0,0,0,1|2,0,0]=3 1571 B15R1.256 NC(=O)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100011215257 [0,0,0,0,0,1|2,0,0]=3 1572 B15R1.256 NC(=O)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100011215257 [0,0,0,0,0,1|2,0,0]=3 1573 B15R1.256 NC(=O)CCC(=O)Nc1ccccc1F 22a_100000210422_100011215257 [0,0,0,0,0,1|2,0,0]=3 1574 B15R1.256 NC(=O)CCC(=O)Nc1ccccc1F 527a_100000210422_100011215257 [0,0,0,0,0,1|2,0,0]=3 1575 B15R1.256 NC(=O)CCC(=O)Nc1ccccc1O 22a_100000185747_100011215257 [0,0,0,0,0,1|1,0,0]=2 1576 B15R1.256 NC(=O)CCC(=O)Nc1ccccc1O 527a_100000185747_100011215257 [0,0,0,0,0,1|1,0,0]=2 1577 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1Br 11a_100000711301_100000751119 [0,0,0,0,0,1|3,0,0]=4 1578 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1Br 240690a_100000711301_100000751119 [0,0,0,0,0,1|3,0,0]=4 1579 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1Br 527a_100000711301_100000751119 [0,0,0,0,0,1|3,0,0]=4 1580 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1Cl 11a_100000711301_100000183793 [0,0,0,0,0,1|3,0,0]=4 1581 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1Cl 240690a_100000711301_100000183793 [0,0,0,0,0,1|3,0,0]=4 1582 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1Cl 527a_100000711301_100000183793 [0,0,0,0,0,1|3,0,0]=4 1583 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1F 11a_100000711301_100000212012 [0,0,0,0,0,1|3,0,0]=4 1584 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1F 240690a_100000711301_100000212012 [0,0,0,0,0,1|3,0,0]=4 1585 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1F 527a_100000711301_100000212012 [0,0,0,0,0,1|3,0,0]=4 1586 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1I 11a_100000711301_100000036491 [0,0,0,0,0,1|3,0,0]=4 1587 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1I 240690a_100000711301_100000036491 [0,0,0,0,0,1|3,0,0]=4 1588 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1I 527a_100000711301_100000036491 [0,0,0,0,0,1|3,0,0]=4 1589 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1O 240690a_100000711301_100000743006 [0,0,0,0,0,1|2,0,0]=3 1590 B15R1.256 NC(=O)CNC(=O)Cc1ccccc1O 527a_100000711301_100000743006 [0,0,0,0,0,1|2,0,0]=3 1591 B15R1.256 NC(=O)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100000711301 [0,0,0,0,0,1|3,0,0]=4 1592 B15R1.256 NC(=O)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000711301 [0,0,0,0,0,1|3,0,0]=4 1593 B15R1.256 NC(=O)CNC(=O)Nc1ccccc1F 2430a_100000210422_100000711301 [0,0,0,0,0,1|3,0,0]=4 1594 B15R1.256 NC(=O)CNC(=O)Nc1ccccc1I 2430a_100000210053_100000711301 [0,0,0,0,0,1|3,0,0]=4 1595 B15R1.256 NC(=O)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000711301 [0,0,0,0,0,1|2,0,0]=3 1596 B15R1.256 NC(=O)NCC(=O)Cc1ccccc1Br 1458a_100000184981_100000184730 [0,0,0,0,0,1|3,0,0]=4 1597 B15R1.256 NC(=O)NCC(=O)Cc1ccccc1Cl 1458a_100000184981_100000187162 [0,0,0,0,0,1|3,0,0]=4 1598 B15R1.256 NC(=O)NCC(=O)Cc1ccccc1F 1458a_100000184981_100000187165 [0,0,0,0,0,1|3,0,0]=4 1599 B15R1.256 NC(=O)NCC(=O)Cc1ccccc1I 1458a_100000184981_100011216222 [0,0,0,0,0,1|3,0,0]=4 1600 B15R1.256 NC(=O)NCC(=O)Cc1ncccc1O 1458a_100000184981_200020655725 [0,0,0,0,0,1|3,0,0]=4 1601 B15R1.256 NC(=O)NCC(=O)Nc1ccccc1Cl 22a_100000185783_100000184981 [0,0,0,0,0,1|3,0,0]=4 1602 B15R1.256 NC(=O)NCC(=O)Nc1ccccc1Cl 527a_100000185783_100000184981 [0,0,0,0,0,1|3,0,0]=4 1603 B15R1.256 NC(=O)NCC(=O)Nc1ccccc1F 22a_100000210422_100000184981 [0,0,0,0,0,1|3,0,0]=4 1604 B15R1.256 NC(=O)NCC(=O)Nc1ccccc1F 527a_100000210422_100000184981 [0,0,0,0,0,1|3,0,0]=4 1605 B15R1.256 NC(=O)NCC(=O)Nc1ccccc1O 22a_100000185747_100000184981 [0,0,0,0,0,1|2,0,0]=3 1606 B15R1.256 NC(=O)NCC(=O)Nc1ccccc1O 527a_100000185747_100000184981 [0,0,0,0,0,1|2,0,0]=3 1607 B15R1.256 O=C(CC[N+](=O)[O-])Cc1ccccc1Br 1458a_200000064761_100000184730 [0,0,0,0,0,1|2,0,1]=4 1608 B15R1.256 O=C(CC[N+](=O)[O-])Cc1ccccc1Cl 1458a_200000064761_100000187162 [0,0,0,0,0,1|2,0,1]=4 1609 B15R1.256 O=C(CC[N+](=O)[O-])Cc1ccccc1F 1458a_200000064761_100000187165 [0,0,0,0,0,1|2,0,1]=4 1610 B15R1.256 O=C(CC[N+](=O)[O-])Cc1ccccc1I 1458a_200000064761_100011216222 [0,0,0,0,0,1|2,0,1]=4 1611 B15R1.256 O=C(CC[N+](=O)[O-])Cc1ncccc1O 1458a_200000064761_200020655725 [0,0,0,0,0,1|2,0,1]=4 1612 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1Br 11a_100000210017_200000064761 [0,0,0,0,0,1|2,0,1]=4 1613 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1Br 1626a_100000210017_200000064761 [0,0,0,0,0,1|2,0,1]=4 1614 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1Cl 11a_100000185783_200000064761 [0,0,0,0,0,1|2,0,1]=4 1615 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1Cl 1626a_100000185783_200000064761 [0,0,0,0,0,1|2,0,1]=4 1616 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1F 11a_100000210422_200000064761 [0,0,0,0,0,1|2,0,1]=4 1617 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1F 1626a_100000210422_200000064761 [0,0,0,0,0,1|2,0,1]=4 1618 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1I 11a_100000210053_200000064761 [0,0,0,0,0,1|2,0,1]=4 1619 B15R1.256 O=C(CC[N+](=O)[O-])Nc1ccccc1I 1626a_100000210053_200000064761 [0,0,0,0,0,1|2,0,1]=4 1620 B15R1.256 [13CH3]C(=O)CCC(=O)Nc1ccccc1O 1458a_100000011731_200025704644 [0,0,0,0,0,1|1,0,0]=2 1621 B15R1.8019 C=C(C)CNNC(=O)c1ccccc1O 22a_100000729518_100015234032 [0,0,0,0,0,1|3,0,0]=4 1622 B15R1.8019 C=C(C)COCC(=O)c1ccccc1Br 34a_100000210245_100000199116 [0,0,0,0,0,1|3,0,0]=4 1623 B15R1.8019 C=C(C)COCC(=O)c1ccccc1C 34a_100000210245_100000741374 [0,0,0,0,0,1|3,0,0]=4 1624 B15R1.8019 C=C(C)COCC(=O)c1ccccc1Cl 34a_100000210245_100000211432 [0,0,0,0,0,1|3,0,0]=4 1625 B15R1.8019 C=C(C)COCC(=O)c1ccccc1F 34a_100000210245_100000204681 [0,0,0,0,0,1|3,0,0]=4 1626 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1Br 62a_100000199116_100000211660 [0,0,0,0,0,1|3,0,0]=4 1627 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1C 62a_100000741374_100000211660 [0,0,0,0,0,1|3,0,0]=4 1628 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1C 62a_100000748629_100000741374 [0,0,0,0,0,1|3,0,0]=4 1629 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000211660 [0,0,0,0,0,1|3,0,0]=4 1630 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1Cl 62a_100000748629_100000211432 [0,0,0,0,0,1|3,0,0]=4 1631 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1F 62a_100000204681_100000211660 [0,0,0,0,0,1|3,0,0]=4 1632 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1F 62a_100000748629_100000204681 [0,0,0,0,0,1|3,0,0]=4 1633 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000211660 [0,0,0,0,0,1|2,0,0]=3 1634 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1O 62a_100000748629_100000188908 [0,0,0,0,0,1|2,0,0]=3 1635 B15R1.8019 C=C(F)COCC(=O)c1ccccc1Br 34a_200010262243_100000199116 [0,0,0,0,0,1|3,0,0]=4 1636 B15R1.8019 C=C(F)COCC(=O)c1ccccc1C 34a_200010262243_100000741374 [0,0,0,0,0,1|3,0,0]=4 1637 B15R1.8019 C=C(F)COCC(=O)c1ccccc1Cl 34a_200010262243_100000211432 [0,0,0,0,0,1|3,0,0]=4 1638 B15R1.8019 C=C(F)COCC(=O)c1ccccc1F 34a_200010262243_100000204681 [0,0,0,0,0,1|3,0,0]=4 1639 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1Br 62a_100000199116_100000042424 [0,0,0,0,0,1|3,0,0]=4 1640 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1C 62a_100000042424_100000741374 [0,0,0,0,0,1|3,0,0]=4 1641 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1C 62a_100000741374_100000042424 [0,0,0,0,0,1|3,0,0]=4 1642 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1Cl 62a_100000042424_100000211432 [0,0,0,0,0,1|3,0,0]=4 1643 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000042424 [0,0,0,0,0,1|3,0,0]=4 1644 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1F 62a_100000042424_100000204681 [0,0,0,0,0,1|3,0,0]=4 1645 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1F 62a_100000204681_100000042424 [0,0,0,0,0,1|3,0,0]=4 1646 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1O 62a_100000042424_100000188908 [0,0,0,0,0,1|2,0,0]=3 1647 B15R1.8019 C=C(F)CSCC(=O)c1ccccc1O 62a_100000188908_100000042424 [0,0,0,0,0,1|2,0,0]=3 1648 B15R1.8019 CC(=CCCC(=O)c1ccccc1Br)C 1458a_100000188424_100011217483 [0,0,0,0,0,1|3,0,0]=4 1649 B15R1.8019 CC(=CCCC(=O)c1ccccc1C)C 1458a_100000212026_100011217483 [0,0,0,0,0,1|3,0,0]=4 1650 B15R1.8019 CC(=CCCC(=O)c1ccccc1Cl)C 1458a_100000185844_100011217483 [0,0,0,0,0,1|3,0,0]=4 1651 B15R1.8019 CC(=CCCC(=O)c1ccccc1F)C 1458a_100000188656_100011217483 [0,0,0,0,0,1|3,0,0]=4 1652 B15R1.8019 CC(=CCCC(=O)c1ccccc1I)C 1458a_100000187884_100011217483 [0,0,0,0,0,1|3,0,0]=4 1653 B15R1.8019 CC(=CCCC(=O)c1ccccc1O)C 1458a_100015234032_100011217483 [0,0,0,0,0,1|2,0,0]=3 1654 B15R1.8019 CC(=CCCC(=O)c1ccccc1[O-])C 1458a_100009911694_100011217483 [0,0,0,0,0,1|2,0,1]=4 1655 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215641 [0,0,0,0,0,1|2,0,0]=3 1656 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1C 1458a_100000212026_100011215641 [0,0,0,0,0,1|2,0,0]=3 1657 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215641 [0,0,0,0,0,1|2,0,0]=3 1658 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100011215641 [0,0,0,0,0,1|2,0,0]=3 1659 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100011215641 [0,0,0,0,0,1|2,0,0]=3 1660 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100011215641 [0,0,0,0,0,1|1,0,0]=2 1661 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215641 [0,0,0,0,0,1|1,0,1]=3 1662 B15R1.8019 CC(=O)CCCN(C)c1ccccc1O 269982a_100000033821_100011215641 [0,0,0,0,0,1|3,0,0]=4 1663 B15R1.8019 CC(=O)CCNC(=O)c1ccccc1C 1458a_100000195313_200000210301 [0,0,0,0,0,1|2,0,0]=3 1664 B15R1.8019 CC(=O)CCNC(=O)c1ccccc1Cl 1458a_100000182440_200000210301 [0,0,0,0,0,1|2,0,0]=3 1665 B15R1.8019 CC(=O)COCC(=O)c1ccccc1Br 34a_100000211253_100000199116 [0,0,0,0,0,1|2,0,0]=3 1666 B15R1.8019 CC(=O)COCC(=O)c1ccccc1C 34a_100000211253_100000741374 [0,0,0,0,0,1|2,0,0]=3 1667 B15R1.8019 CC(=O)COCC(=O)c1ccccc1Cl 34a_100000211253_100000211432 [0,0,0,0,0,1|2,0,0]=3 1668 B15R1.8019 CC(=O)COCC(=O)c1ccccc1F 34a_100000211253_100000204681 [0,0,0,0,0,1|2,0,0]=3 1669 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1Br 1458a_100000188424_100000189650 [0,0,0,0,0,1|2,0,0]=3 1670 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1C 1458a_100000212026_100000189650 [0,0,0,0,0,1|2,0,0]=3 1671 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1Cl 1458a_100000185844_100000189650 [0,0,0,0,0,1|2,0,0]=3 1672 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1F 1458a_100000188656_100000189650 [0,0,0,0,0,1|2,0,0]=3 1673 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1I 1458a_100000187884_100000189650 [0,0,0,0,0,1|2,0,0]=3 1674 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1O 1458a_100015234032_100000189650 [0,0,0,0,0,1|1,0,0]=2 1675 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000189650 [0,0,0,0,0,1|1,0,1]=3 1676 B15R1.8019 CC(=O)NCCN(C)c1ccccc1O 269982a_100000033821_100000189650 [0,0,0,0,0,1|3,0,0]=4 1677 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1Br 1458a_100000188424_100009814007 [0,0,0,0,0,1|2,0,0]=3 1678 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1C 1458a_100000212026_100009814007 [0,0,0,0,0,1|2,0,0]=3 1679 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1Cl 1458a_100000185844_100009814007 [0,0,0,0,0,1|2,0,0]=3 1680 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1F 1458a_100000188656_100009814007 [0,0,0,0,0,1|2,0,0]=3 1681 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1I 1458a_100000187884_100009814007 [0,0,0,0,0,1|2,0,0]=3 1682 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1O 1458a_100015234032_100009814007 [0,0,0,0,0,1|1,0,0]=2 1683 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_100009814007 [0,0,0,0,0,1|1,0,1]=3 1684 B15R1.8019 CC(=O)OCCN(C)c1ccccc1O 269982a_100000033821_100009814007 [0,0,0,0,0,1|3,0,0]=4 1685 B15R1.8019 CC(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100011214892 [0,0,0,0,0,1|2,0,1]=4 1686 B15R1.8019 CC(C)CCNC(=O)c1ccccc1O 240690a_100000210545_100015234032 [0,0,0,0,0,1|2,0,1]=4 1687 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000210760 [0,0,0,0,0,1|2,0,1]=4 1688 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000210624_100000188908 [0,0,0,0,0,1|2,0,1]=4 1689 B15R1.8019 CC(C)OCCC(=O)c1ccccc1O 1458a_100015234032_100000211751 [0,0,0,0,0,1|2,0,1]=4 1690 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 1458a_100015234032_100000730970 [0,0,0,0,0,1|2,0,1]=4 1691 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 62a_100000210206_100009873196 [0,0,0,0,0,1|2,0,1]=4 1692 B15R1.8019 CC(O)CCCC(=O)c1ccccc1Br 1458a_100000188424_200000718107 [0,0,0,0,0,1|2,0,1]=4 1693 B15R1.8019 CC(O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_200000718107 [0,0,0,0,0,1|2,0,1]=4 1694 B15R1.8019 CC(O)CCCC(=O)c1ccccc1F 1458a_100000188656_200000718107 [0,0,0,0,0,1|2,0,1]=4 1695 B15R1.8019 CC(O)CCCC(=O)c1ccccc1I 1458a_100000187884_200000718107 [0,0,0,0,0,1|2,0,1]=4 1696 B15R1.8019 CC(O)CCCC(=O)c1ccccc1O 1458a_100015234032_200000718107 [0,0,0,0,0,1|1,0,1]=3 1697 B15R1.8019 CC(O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_200000718107 [0,0,0,0,0,1|1,0,2]=4 1698 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Br 240690a_200000755665_100000188424 [0,0,0,0,0,1|2,0,1]=4 1699 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Br 527a_200000755665_100000188424 [0,0,0,0,0,1|2,0,1]=4 1700 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Cl 240690a_200000755665_100000185844 [0,0,0,0,0,1|2,0,1]=4 1701 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Cl 527a_200000755665_100000185844 [0,0,0,0,0,1|2,0,1]=4 1702 B15R1.8019 CC(O)CCNC(=O)c1ccccc1F 240690a_200000755665_100000188656 [0,0,0,0,0,1|2,0,1]=4 1703 B15R1.8019 CC(O)CCNC(=O)c1ccccc1F 527a_200000755665_100000188656 [0,0,0,0,0,1|2,0,1]=4 1704 B15R1.8019 CC(O)CCNC(=O)c1ccccc1I 240690a_200000755665_100000187884 [0,0,0,0,0,1|2,0,1]=4 1705 B15R1.8019 CC(O)CCNC(=O)c1ccccc1I 527a_200000755665_100000187884 [0,0,0,0,0,1|2,0,1]=4 1706 B15R1.8019 CC(O)CCNC(=O)c1ccccc1O 240690a_200000755665_100015234032 [0,0,0,0,0,1|1,0,1]=3 1707 B15R1.8019 CC(O)CCNC(=O)c1ccccc1[O-] 240690a_200000755665_100009911694 [0,0,0,0,0,1|1,0,2]=4 1708 B15R1.8019 CC(O)CCNC(=O)c1ccccc1[O-] 527a_200000755665_100009911694 [0,0,0,0,0,1|1,0,2]=4 1709 B15R1.8019 CC(O)CNCC(=O)c1ccccc1Br 34a_100000210904_100000199116 [0,0,0,0,0,1|2,0,1]=4 1710 B15R1.8019 CC(O)CNCC(=O)c1ccccc1Cl 34a_100000210904_100000211432 [0,0,0,0,0,1|2,0,1]=4 1711 B15R1.8019 CC(O)CNCC(=O)c1ccccc1F 34a_100000210904_100000204681 [0,0,0,0,0,1|2,0,1]=4 1712 B15R1.8019 CC(O)CNNC(=O)c1ccccc1O 22a_200000730056_100015234032 [0,0,0,0,0,1|2,0,1]=4 1713 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Br 62a_100000199116_100011218427 [0,0,0,0,0,1|2,0,1]=4 1714 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100011218427 [0,0,0,0,0,1|2,0,1]=4 1715 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Cl 62a_100011218427_100000211432 [0,0,0,0,0,1|2,0,1]=4 1716 B15R1.8019 CC(O)CSCC(=O)c1ccccc1F 62a_100000204681_100011218427 [0,0,0,0,0,1|2,0,1]=4 1717 B15R1.8019 CC(O)CSCC(=O)c1ccccc1F 62a_100011218427_100000204681 [0,0,0,0,0,1|2,0,1]=4 1718 B15R1.8019 CC(O)CSCC(=O)c1ccccc1O 62a_100000188908_100011218427 [0,0,0,0,0,1|1,0,1]=3 1719 B15R1.8019 CC(O)CSCC(=O)c1ccccc1O 62a_100011218427_100000188908 [0,0,0,0,0,1|1,0,1]=3 1720 B15R1.8019 CN(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100000695564 [0,0,0,0,0,1|3,0,0]=4 1721 B15R1.8019 CN(C)CCNC(=O)c1ccccc1O 240690a_100000210585_100015234032 [0,0,0,0,0,1|3,0,0]=4 1722 B15R1.8019 CN(CCCC(=O)N)c1ccccc1O 269982a_100000033821_100102525003 [0,0,0,0,0,1|3,0,0]=4 1723 B15R1.8019 CN(CCNC(=O)N)c1ccccc1O 269982a_100000033821_200000034859 [0,0,0,0,0,1|3,0,0]=4 1724 B15R1.8019 CN(CCOC(=O)N)c1ccccc1O 269982a_100000033821_200011214921 [0,0,0,0,0,1|3,0,0]=4 1725 B15R1.8019 C[C@@H](NCCC(=O)N)c1ccccc1O 2230a_100025703389_100000744528 [0,0,0,0,0,1|2,0,1]=4 1726 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Br 62a_100000199116_100009817552 [0,0,0,0,0,1|2,0,1]=4 1727 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100009817552 [0,0,0,0,0,1|2,0,1]=4 1728 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Cl 62a_100009817552_100000211432 [0,0,0,0,0,1|2,0,1]=4 1729 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1F 62a_100000204681_100009817552 [0,0,0,0,0,1|2,0,1]=4 1730 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1F 62a_100009817552_100000204681 [0,0,0,0,0,1|2,0,1]=4 1731 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1O 62a_100000188908_100009817552 [0,0,0,0,0,1|1,0,1]=3 1732 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1O 62a_100009817552_100000188908 [0,0,0,0,0,1|1,0,1]=3 1733 B15R1.8019 Cc1ccccc1C(=O)CCC=C(F)F 1458a_100000212026_200009816681 [0,0,0,0,0,1|3,0,0]=4 1734 B15R1.8019 Cc1ccccc1C(=O)CCCC(=O)N 1458a_100000212026_100102525003 [0,0,0,0,0,1|2,0,0]=3 1735 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)O 1458a_100000212026_200000718107 [0,0,0,0,0,1|2,0,1]=4 1736 B15R1.8019 Cc1ccccc1C(=O)CCNC(=O)N 1458a_100000212026_200000034859 [0,0,0,0,0,1|2,0,0]=3 1737 B15R1.8019 Cc1ccccc1C(=O)CCOC(=O)N 1458a_100000212026_200011214921 [0,0,0,0,0,1|2,0,0]=3 1738 B15R1.8019 Cc1ccccc1C(=O)CNCC(=O)N 2230a_100000711301_100000741374 [0,0,0,0,0,1|2,0,0]=3 1739 B15R1.8019 Cc1ccccc1C(=O)CNCC(=O)O 269956a_100016091260_100000741374 [0,0,0,0,0,1|1,0,0]=2 1740 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 2230a_100000210904_100000741374 [0,0,0,0,0,1|2,0,1]=4 1741 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000741374 [0,0,0,0,0,1|2,0,1]=4 1742 B15R1.8019 Cc1ccccc1C(=O)CSCC(=O)N 62a_100000741374_100000747473 [0,0,0,0,0,1|2,0,0]=3 1743 B15R1.8019 Cc1ccccc1C(=O)CSCC(=O)N 62a_100000747473_100000741374 [0,0,0,0,0,1|2,0,0]=3 1744 B15R1.8019 Cc1ccccc1C(=O)CSCC(=O)[O-] 62a_100000741374_100020667443 [0,0,0,0,0,1|1,0,1]=3 1745 B15R1.8019 Cc1ccccc1C(=O)CSCC(=O)[O-] 62a_100020667443_100000741374 [0,0,0,0,0,1|1,0,1]=3 1746 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100000741374_100011218427 [0,0,0,0,0,1|2,0,1]=4 1747 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100011218427_100000741374 [0,0,0,0,0,1|2,0,1]=4 1748 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000741374_100009817552 [0,0,0,0,0,1|2,0,1]=4 1749 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100009817552_100000741374 [0,0,0,0,0,1|2,0,1]=4 1750 B15R1.8019 Cc1ccccc1C(=O)CSC[N+](=O)[O-] 62a_100000741374_100000761209 [0,0,0,0,0,1|2,0,1]=4 1751 B15R1.8019 Cc1ccccc1C(=O)NCCC(=O)N 11a_100000740010_100000212026 [0,0,0,0,0,1|2,0,0]=3 1752 B15R1.8019 Cc1ccccc1C(=O)NCCC(=O)N 240690a_100000740010_100000212026 [0,0,0,0,0,1|2,0,0]=3 1753 B15R1.8019 Cc1ccccc1C(=O)NCCC(=O)N 527a_100000740010_100000212026 [0,0,0,0,0,1|2,0,0]=3 1754 B15R1.8019 Cc1ccccc1C(=O)NCCC(=O)[13CH3] 1458a_100000195313_200025704644 [0,0,0,0,0,1|2,0,0]=3 1755 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000212026 [0,0,0,0,0,1|2,0,1]=4 1756 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000212026 [0,0,0,0,0,1|2,0,1]=4 1757 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100102525003 [0,0,0,0,0,1|2,0,0]=3 1758 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100102525003 [0,0,0,0,0,1|2,0,0]=3 1759 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100102525003 [0,0,0,0,0,1|2,0,0]=3 1760 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100102525003 [0,0,0,0,0,1|2,0,0]=3 1761 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100102525003 [0,0,0,0,0,1|1,0,0]=2 1762 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100102525003 [0,0,0,0,0,1|1,0,1]=3 1763 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Br 11a_100000740010_100000188424 [0,0,0,0,0,1|2,0,0]=3 1764 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Br 240690a_100000740010_100000188424 [0,0,0,0,0,1|2,0,0]=3 1765 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Br 527a_100000740010_100000188424 [0,0,0,0,0,1|2,0,0]=3 1766 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Cl 11a_100000740010_100000185844 [0,0,0,0,0,1|2,0,0]=3 1767 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Cl 240690a_100000740010_100000185844 [0,0,0,0,0,1|2,0,0]=3 1768 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1Cl 527a_100000740010_100000185844 [0,0,0,0,0,1|2,0,0]=3 1769 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1F 11a_100000740010_100000188656 [0,0,0,0,0,1|2,0,0]=3 1770 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1F 240690a_100000740010_100000188656 [0,0,0,0,0,1|2,0,0]=3 1771 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1F 527a_100000740010_100000188656 [0,0,0,0,0,1|2,0,0]=3 1772 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1I 11a_100000740010_100000187884 [0,0,0,0,0,1|2,0,0]=3 1773 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1I 240690a_100000740010_100000187884 [0,0,0,0,0,1|2,0,0]=3 1774 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1I 527a_100000740010_100000187884 [0,0,0,0,0,1|2,0,0]=3 1775 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1O 240690a_100000740010_100015234032 [0,0,0,0,0,1|1,0,0]=2 1776 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1[O-] 240690a_100000740010_100009911694 [0,0,0,0,0,1|1,0,1]=3 1777 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1[O-] 527a_100000740010_100009911694 [0,0,0,0,0,1|1,0,1]=3 1778 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1Br 62a_100000199116_100000747473 [0,0,0,0,0,1|2,0,0]=3 1779 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000747473 [0,0,0,0,0,1|2,0,0]=3 1780 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1Cl 62a_100000747473_100000211432 [0,0,0,0,0,1|2,0,0]=3 1781 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1F 62a_100000204681_100000747473 [0,0,0,0,0,1|2,0,0]=3 1782 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1F 62a_100000747473_100000204681 [0,0,0,0,0,1|2,0,0]=3 1783 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1O 62a_100000188908_100000747473 [0,0,0,0,0,1|1,0,0]=2 1784 B15R1.8019 NC(=O)CSCC(=O)c1ccccc1O 62a_100000747473_100000188908 [0,0,0,0,0,1|1,0,0]=2 1785 B15R1.8019 NC(=O)NCCC(=O)c1ccccc1Br 1458a_100000188424_200000034859 [0,0,0,0,0,1|2,0,0]=3 1786 B15R1.8019 NC(=O)NCCC(=O)c1ccccc1Cl 1458a_100000185844_200000034859 [0,0,0,0,0,1|2,0,0]=3 1787 B15R1.8019 NC(=O)NCCC(=O)c1ccccc1F 1458a_100000188656_200000034859 [0,0,0,0,0,1|2,0,0]=3 1788 B15R1.8019 NC(=O)NCCC(=O)c1ccccc1I 1458a_100000187884_200000034859 [0,0,0,0,0,1|2,0,0]=3 1789 B15R1.8019 NC(=O)NCCC(=O)c1ccccc1O 1458a_100015234032_200000034859 [0,0,0,0,0,1|1,0,0]=2 1790 B15R1.8019 NC(=O)NCCC(=O)c1ccccc1[O-] 1458a_100009911694_200000034859 [0,0,0,0,0,1|1,0,1]=3 1791 B15R1.8019 NC(=O)OCCC(=O)c1ccccc1Br 1458a_100000188424_200011214921 [0,0,0,0,0,1|2,0,0]=3 1792 B15R1.8019 NC(=O)OCCC(=O)c1ccccc1Cl 1458a_100000185844_200011214921 [0,0,0,0,0,1|2,0,0]=3 1793 B15R1.8019 NC(=O)OCCC(=O)c1ccccc1F 1458a_100000188656_200011214921 [0,0,0,0,0,1|2,0,0]=3 1794 B15R1.8019 NC(=O)OCCC(=O)c1ccccc1I 1458a_100000187884_200011214921 [0,0,0,0,0,1|2,0,0]=3 1795 B15R1.8019 NC(=O)OCCC(=O)c1ccccc1O 1458a_100015234032_200011214921 [0,0,0,0,0,1|1,0,0]=2 1796 B15R1.8019 NC(=O)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_200011214921 [0,0,0,0,0,1|1,0,1]=3 1797 B15R1.8019 O=C(C/C=C/B(O)O)c1ccccc1O 1458a_100015234032_100016262062 [0,0,0,0,0,1|1,0,2]=4 1798 B15R1.8019 O=C(CCC=C(F)F)c1ccccc1Br 1458a_100000188424_200009816681 [0,0,0,0,0,1|3,0,0]=4 1799 B15R1.8019 O=C(CCC=C(F)F)c1ccccc1Cl 1458a_100000185844_200009816681 [0,0,0,0,0,1|3,0,0]=4 1800 B15R1.8019 O=C(CCC=C(F)F)c1ccccc1F 1458a_100000188656_200009816681 [0,0,0,0,0,1|3,0,0]=4 1801 B15R1.8019 O=C(CCC=C(F)F)c1ccccc1I 1458a_100000187884_200009816681 [0,0,0,0,0,1|3,0,0]=4 1802 B15R1.8019 O=C(CCC=C(F)F)c1ccccc1O 1458a_100015234032_200009816681 [0,0,0,0,0,1|2,0,0]=3 1803 B15R1.8019 O=C(CCC=C(F)F)c1ccccc1[O-] 1458a_100009911694_200009816681 [0,0,0,0,0,1|2,0,1]=4 1804 B15R1.8019 O=C(CSCC(F)F)c1ccccc1O 62a_100000188908_100011934356 [0,0,0,0,0,1|2,0,1]=4 1805 B15R1.8019 O=C(CSCC(F)F)c1ccccc1O 62a_100011934356_100000188908 [0,0,0,0,0,1|2,0,1]=4 1806 B15R1.8019 O=C(CSC[N+](=O)[O-])c1ccccc1Br 62a_100000199116_100000761209 [0,0,0,0,0,1|2,0,1]=4 1807 B15R1.8019 O=C(CSC[N+](=O)[O-])c1ccccc1Cl 62a_100000211432_100000761209 [0,0,0,0,0,1|2,0,1]=4 1808 B15R1.8019 O=C(CSC[N+](=O)[O-])c1ccccc1F 62a_100000204681_100000761209 [0,0,0,0,0,1|2,0,1]=4 1809 B15R1.8019 O=C(CSC[N+](=O)[O-])c1ccccc1O 62a_100000188908_100000761209 [0,0,0,0,0,1|1,0,1]=3 1810 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1Br 269956a_100016091260_100000199116 [0,0,0,0,0,1|1,0,0]=2 1811 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1Cl 269956a_100016091260_100000211432 [0,0,0,0,0,1|1,0,0]=2 1812 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1F 269956a_100016091260_100000204681 [0,0,0,0,0,1|1,0,0]=2 1813 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1O 269956a_100016091260_100000188908 [0,0,0,0,0,1|0,0,0]=1 1814 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1Br 62a_100000199116_100020667443 [0,0,0,0,0,1|1,0,1]=3 1815 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1Cl 62a_100000211432_100020667443 [0,0,0,0,0,1|1,0,1]=3 1816 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1Cl 62a_100020667443_100000211432 [0,0,0,0,0,1|1,0,1]=3 1817 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1F 62a_100000204681_100020667443 [0,0,0,0,0,1|1,0,1]=3 1818 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1F 62a_100020667443_100000204681 [0,0,0,0,0,1|1,0,1]=3 1819 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1O 62a_100000188908_100020667443 [0,0,0,0,0,1|0,0,1]=2 1820 B15R1.8019 O=C([O-])CSCC(=O)c1ccccc1O 62a_100020667443_100000188908 [0,0,0,0,0,1|0,0,1]=2 1821 B15R1.8019 [13CH3]C(=O)CCNC(=O)c1ccccc1Cl 1458a_100000182440_200025704644 [0,0,0,0,0,1|2,0,0]=3 1822 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [2,0,0,0,0,0|1,0,1]=4 1823 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [2,0,0,0,0,0|1,0,1]=4 1824 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [2,0,0,0,0,0|1,0,0]=3 1825 B12R1.30 C=CCNC(=O)c1ccccc1 1626a_100020586998_100000185807 [2,0,0,0,0,0|2,0,0]=4 1826 B12R1.30 C=CCNC(=O)c1ccccc1 240690a_100020586998_100000185807 [2,0,0,0,0,0|2,0,0]=4 1827 B12R1.30 C=CCNC(=O)c1ccccc1 527a_100020586998_100000185807 [2,0,0,0,0,0|2,0,0]=4 1828 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [2,0,0,0,0,0|1,0,1]=4 1829 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [2,0,0,0,0,0|1,0,1]=4 1830 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [2,0,0,0,0,0|2,0,0]=4 1831 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [2,0,0,0,0,0|2,0,0]=4 1832 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [2,0,0,0,0,0|2,0,0]=4 1833 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [2,0,0,0,0,0|2,0,0]=4 1834 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [2,0,0,0,0,0|2,0,0]=4 1835 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [2,0,0,0,0,0|2,0,0]=4 1836 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [2,0,0,0,0,0|1,0,1]=4 1837 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [2,0,0,0,0,0|1,0,1]=4 1838 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [2,0,0,0,0,0|0,0,1]=3 1839 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [2,0,0,0,0,0|1,0,1]=4 1840 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [2,0,0,0,0,0|1,0,1]=4 1841 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [2,0,0,0,0,0|2,0,0]=4 1842 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [2,0,0,0,0,0|2,0,0]=4 1843 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [2,0,0,0,0,0|1,0,1]=4 1844 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [2,0,0,0,0,0|1,0,1]=4 1845 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100000070787_100000211621 [2,0,0,0,0,0|1,0,1]=4 1846 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100011207963_200000210301 [2,0,0,0,0,0|1,0,1]=4 1847 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000070787_100000184471 [2,0,0,0,0,0|2,0,0]=4 1848 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000182761_200000210301 [2,0,0,0,0,0|2,0,0]=4 1849 B12R1.252 CC(=O)CCOc1ccccc1 7a_100000210340_100000053229 [2,0,0,0,0,0|2,0,0]=4 1850 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000070787_100000246102 [2,0,0,0,0,0|2,0,0]=4 1851 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000182436_200000210301 [2,0,0,0,0,0|2,0,0]=4 1852 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000053229_100000041952 [2,0,0,0,0,0|2,0,0]=4 1853 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000719477_100000053229 [2,0,0,0,0,0|2,0,0]=4 1854 B12R1.252 NC(=O)CCNc1ccccc1 34a_100000106764_100000731001 [2,0,0,0,0,0|2,0,0]=4 1855 B12R1.252 NC(=O)CCOc1ccccc1 34a_100000210340_100000731001 [2,0,0,0,0,0|2,0,0]=4 1856 B12R1.252 NC(=O)CCOc1ccccc1 7a_100000210340_100000744528 [2,0,0,0,0,0|2,0,0]=4 1857 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000719477_100000744528 [2,0,0,0,0,0|2,0,0]=4 1858 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000744528_100000041952 [2,0,0,0,0,0|2,0,0]=4 1859 B12R1.252 O=C(O)CNCc1ccccc1 269956a_100016091260_100015291786 [2,0,0,0,0,0|1,0,1]=4 1860 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [2,0,0,0,0,0|1,0,1]=4 1861 B12R1.252 [13CH3]C(=O)CCCc1ccccc1 1458a_100011207963_200025704644 [2,0,0,0,0,0|1,0,1]=4 1862 B12R1.252 [13CH3]C(=O)CCOc1ccccc1 1458a_100000182761_200025704644 [2,0,0,0,0,0|2,0,0]=4 1863 B12R1.252 [13CH3]C(=O)CCSc1ccccc1 1458a_100000182436_200025704644 [2,0,0,0,0,0|2,0,0]=4 1864 B12R1.267 C=CCCNc1ccccc1O 34a_100000185747_100000754431 [2,0,0,0,0,0|2,0,0]=4 1865 B12R1.267 C=CCCSc1ccccc1O 62a_100000739446_100000754431 [2,0,0,0,0,0|2,0,0]=4 1866 B12R1.267 C=CCCSc1ccccc1O 62a_100000754431_100000739446 [2,0,0,0,0,0|2,0,0]=4 1867 B12R1.267 O=CCNCc1ccccc1O 34a_100000185550_200009817547 [2,0,0,0,0,0|1,0,1]=4 1868 B12R1.267 OCCCCc1ccccc1O 271570a_203496583355_100012092669 [2,0,0,0,0,0|0,0,2]=4 1869 B12R1.267 OCCCNc1ccccc1O 34a_100000185747_100000230001 [2,0,0,0,0,0|1,0,1]=4 1870 B12R1.267 OCCCSc1ccccc1O 62a_100000739446_100011215043 [2,0,0,0,0,0|1,0,1]=4 1871 B12R1.267 OCCCSc1ccccc1O 62a_100011215043_100000739446 [2,0,0,0,0,0|1,0,1]=4 1872 B12R1.308 C#CCC(=O)c1ccccc1O 1458a_100015234032_100000184674 [2,0,0,0,0,0|0,0,2]=4 1873 B12R1.308 C=CCC(=O)c1ccccc1Br 1458a_100000188424_100000210623 [2,0,0,0,0,0|1,0,1]=4 1874 B12R1.308 C=CCC(=O)c1ccccc1C 1458a_100000212026_100000210623 [2,0,0,0,0,0|1,0,1]=4 1875 B12R1.308 C=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210623 [2,0,0,0,0,0|1,0,1]=4 1876 B12R1.308 C=CCC(=O)c1ccccc1F 1458a_100000188656_100000210623 [2,0,0,0,0,0|1,0,1]=4 1877 B12R1.308 C=CCC(=O)c1ccccc1I 1458a_100000187884_100000210623 [2,0,0,0,0,0|1,0,1]=4 1878 B12R1.308 C=CCC(=O)c1ccccc1O 1458a_100015234032_100000210623 [2,0,0,0,0,0|0,0,1]=3 1879 B12R1.308 C=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210623 [2,0,0,0,0,0|0,0,2]=4 1880 B12R1.308 CCCC(=O)c1ccccc1Br 1458a_100000188424_100000210303 [2,0,0,0,0,0|1,0,1]=4 1881 B12R1.308 CCCC(=O)c1ccccc1C 1458a_100000212026_100000210303 [2,0,0,0,0,0|1,0,1]=4 1882 B12R1.308 CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210303 [2,0,0,0,0,0|1,0,1]=4 1883 B12R1.308 CCCC(=O)c1ccccc1F 1458a_100000188656_100000210303 [2,0,0,0,0,0|1,0,1]=4 1884 B12R1.308 CCCC(=O)c1ccccc1I 1458a_100000187884_100000210303 [2,0,0,0,0,0|1,0,1]=4 1885 B12R1.308 CCCC(=O)c1ccccc1O 1458a_100015234032_100000210303 [2,0,0,0,0,0|0,0,1]=3 1886 B12R1.308 CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210303 [2,0,0,0,0,0|0,0,2]=4 1887 B12R1.308 CCNC(=O)c1ccccc1O 240690a_100015525214_100015234032 [2,0,0,0,0,0|1,0,1]=4 1888 B12R1.308 CCNC(=O)c1ccccc1O 271570a_203496583355_200000155173 [2,0,0,0,0,0|1,0,1]=4 1889 B12R1.308 CCOC(=O)c1ccccc1O 271570a_203496583355_100000169879 [2,0,0,0,0,0|1,0,1]=4 1890 B12R1.308 CN(CC=O)c1ccccc1O 269982a_100000033821_200015260668 [2,0,0,0,0,0|2,0,0]=4 1891 B12R1.308 CN(CCO)c1ccccc1O 269982a_100000033821_100000211926 [2,0,0,0,0,0|2,0,0]=4 1892 B12R1.308 CNCC(=O)c1ccccc1O 7a_106832991635_100000188908 [2,0,0,0,0,0|1,0,1]=4 1893 B12R1.308 CSCC(=O)c1ccccc1O 62a_100000188908_200000210301 [2,0,0,0,0,0|1,0,1]=4 1894 B12R1.308 CSCC(=O)c1ccccc1O 62a_200000210301_100000188908 [2,0,0,0,0,0|1,0,1]=4 1895 B12R1.308 Cc1ccccc1C(=O)CCF 1458a_100000212026_100011217306 [2,0,0,0,0,0|2,0,0]=4 1896 B12R1.308 Cc1ccccc1C(=O)CCO 1458a_100000212026_100000211926 [2,0,0,0,0,0|1,0,0]=3 1897 B12R1.308 N#CCC(=O)c1ccccc1O 1458a_100015234032_100011214920 [2,0,0,0,0,0|1,0,1]=4 1898 B12R1.308 N#CCC(=O)c1ccccc1O 271570a_203496583355_100011225204 [2,0,0,0,0,0|1,0,1]=4 1899 B12R1.308 O=C(CCF)c1ccccc1Br 1458a_100000188424_100011217306 [2,0,0,0,0,0|2,0,0]=4 1900 B12R1.308 O=C(CCF)c1ccccc1Cl 1458a_100000185844_100011217306 [2,0,0,0,0,0|2,0,0]=4 1901 B12R1.308 O=C(CCF)c1ccccc1F 1458a_100000188656_100011217306 [2,0,0,0,0,0|2,0,0]=4 1902 B12R1.308 O=C(CCF)c1ccccc1I 1458a_100000187884_100011217306 [2,0,0,0,0,0|2,0,0]=4 1903 B12R1.308 O=C(CCF)c1ccccc1O 1458a_100015234032_100011217306 [2,0,0,0,0,0|1,0,0]=3 1904 B12R1.308 O=C(CCF)c1ccccc1[O-] 1458a_100009911694_100011217306 [2,0,0,0,0,0|1,0,1]=4 1905 B12R1.308 O=C(CCO)c1ccccc1Br 1458a_100000188424_100000211926 [2,0,0,0,0,0|1,0,0]=3 1906 B12R1.308 O=C(CCO)c1ccccc1Cl 1458a_100000185844_100000211926 [2,0,0,0,0,0|1,0,0]=3 1907 B12R1.308 O=C(CCO)c1ccccc1F 1458a_100000188656_100000211926 [2,0,0,0,0,0|1,0,0]=3 1908 B12R1.308 O=C(CCO)c1ccccc1I 1458a_100000187884_100000211926 [2,0,0,0,0,0|1,0,0]=3 1909 B12R1.308 O=C(CCO)c1ccccc1O 1458a_100015234032_100000211926 [2,0,0,0,0,0|0,0,0]=2 1910 B12R1.308 O=C(CCO)c1ccccc1[O-] 1458a_100009911694_100000211926 [2,0,0,0,0,0|0,0,1]=3 1911 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_100000188908_200025704644 [2,0,0,0,0,0|1,0,1]=4 1912 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_200025704644_100000188908 [2,0,0,0,0,0|1,0,1]=4 1913 B14R0.449 C=CC=CC(=O)CC(=O)CCC(=O)OC 1458a_100016291481_100000691467 [0,1,1,0,0,0|0,0,2]=4 1914 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000730704 [1,1,0,0,0,0|2,0,0]=4 1915 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)C 1458a_100000189346_100000730704 [1,1,0,0,0,0|2,0,0]=4 1916 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000730704 [1,1,0,0,0,0|2,0,0]=4 1917 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)F 1458a_100000210950_100000730704 [1,1,0,0,0,0|2,0,0]=4 1918 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)I 1458a_100000184098_100000730704 [1,1,0,0,0,0|2,0,0]=4 1919 B14R1.149 C=C(C)CCC(=O)c1cccc(c1)O 1458a_100000183914_100000730704 [1,1,0,0,0,0|2,0,0]=4 1920 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Br 1458a_100000179737_200000210301 [1,1,0,0,0,0|2,0,0]=4 1921 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)C 1458a_100000182573_200000210301 [1,1,0,0,0,0|2,0,0]=4 1922 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)Cl 1458a_100000182572_200000210301 [1,1,0,0,0,0|2,0,0]=4 1923 B14R1.149 CC(=O)CNC(=O)c1cccc(c1)F 1458a_100000183068_200000210301 [1,1,0,0,0,0|2,0,0]=4 1924 B14R1.149 CC(O)CCC(=O)c1cccc(c1)Br 1458a_100000210664_100012276601 [1,1,0,0,0,0|1,0,1]=4 1925 B14R1.149 CC(O)CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100012276601 [1,1,0,0,0,0|1,0,1]=4 1926 B14R1.149 CC(O)CCC(=O)c1cccc(c1)F 1458a_100000210950_100012276601 [1,1,0,0,0,0|1,0,1]=4 1927 B14R1.149 CC(O)CCC(=O)c1cccc(c1)I 1458a_100000184098_100012276601 [1,1,0,0,0,0|1,0,1]=4 1928 B14R1.149 CC(O)CCC(=O)c1cccc(c1)O 1458a_100000183914_100012276601 [1,1,0,0,0,0|1,0,1]=4 1929 B14R1.149 CN(CCC(=O)O)c1cccc(c1)F 269956a_200011244148_200000210301 [1,1,0,0,0,0|2,0,0]=4 1930 B14R1.149 Cc1cccc(c1)C(=O)CCC(C)O 1458a_100000189346_100012276601 [1,1,0,0,0,0|1,0,1]=4 1931 B14R1.149 Cc1cccc(c1)C(=O)NCC(=O)N 11a_100000711301_100000189346 [1,1,0,0,0,0|2,0,0]=4 1932 B14R1.149 Cc1cccc(c1)C(=O)NCC(=O)N 240690a_100000711301_100000189346 [1,1,0,0,0,0|2,0,0]=4 1933 B14R1.149 Cc1cccc(c1)C(=O)NCC(=O)N 527a_100000711301_100000189346 [1,1,0,0,0,0|2,0,0]=4 1934 B14R1.149 Cc1cccc(c1)C(=O)NCC(=O)[13CH3] 1458a_100000182573_200025704644 [1,1,0,0,0,0|2,0,0]=4 1935 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)Br 11a_100000711301_100000210664 [1,1,0,0,0,0|2,0,0]=4 1936 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)Br 240690a_100000711301_100000210664 [1,1,0,0,0,0|2,0,0]=4 1937 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)Br 527a_100000711301_100000210664 [1,1,0,0,0,0|2,0,0]=4 1938 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)Cl 11a_100000711301_100000210390 [1,1,0,0,0,0|2,0,0]=4 1939 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)Cl 240690a_100000711301_100000210390 [1,1,0,0,0,0|2,0,0]=4 1940 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)Cl 527a_100000711301_100000210390 [1,1,0,0,0,0|2,0,0]=4 1941 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)F 11a_100000711301_100000210950 [1,1,0,0,0,0|2,0,0]=4 1942 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)F 240690a_100000711301_100000210950 [1,1,0,0,0,0|2,0,0]=4 1943 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)F 527a_100000711301_100000210950 [1,1,0,0,0,0|2,0,0]=4 1944 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)I 11a_100000711301_100000184098 [1,1,0,0,0,0|2,0,0]=4 1945 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)I 240690a_100000711301_100000184098 [1,1,0,0,0,0|2,0,0]=4 1946 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)I 527a_100000711301_100000184098 [1,1,0,0,0,0|2,0,0]=4 1947 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)O 240690a_100000711301_100000183914 [1,1,0,0,0,0|2,0,0]=4 1948 B14R1.149 NC(=O)CNC(=O)c1cccc(c1)O 527a_100000711301_100000183914 [1,1,0,0,0,0|2,0,0]=4 1949 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)Br 1458a_100000179737_200025704644 [1,1,0,0,0,0|2,0,0]=4 1950 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)Cl 1458a_100000182572_200025704644 [1,1,0,0,0,0|2,0,0]=4 1951 B14R1.149 [13CH3]C(=O)CNC(=O)c1cccc(c1)F 1458a_100000183068_200025704644 [1,1,0,0,0,0|2,0,0]=4 1952 B14R1.149 [13CH3]N(CCC(=O)O)c1cccc(c1)F 269956a_200011244148_200025704644 [1,1,0,0,0,0|2,0,0]=4 1953 B14R1.163 C#CC(=O)CCC(=O)c1ccccc1 1458a_100000211873_100000750707 [1,1,0,0,0,0|1,0,0]=3 1954 B14R1.163 C#CC(=O)COC(=O)c1ccccc1 1458a_100000211873_100000073877 [1,1,0,0,0,0|2,0,0]=4 1955 B14R1.163 C=CC(=O)CCC(=O)c1ccccc1 1458a_100000185746_100000750707 [1,1,0,0,0,0|1,0,0]=3 1956 B14R1.163 C=CC(=O)COC(=O)c1ccccc1 1458a_100000185746_100000073877 [1,1,0,0,0,0|2,0,0]=4 1957 B14R1.163 CC(CCC(=O)c1ccccc1)O[13CH3] 7a_200012571355_200025704644 [1,1,0,0,0,0|1,0,1]=4 1958 B14R1.163 CCC(=O)CCC(=O)c1ccccc1 1458a_100000210414_100000750707 [1,1,0,0,0,0|1,0,0]=3 1959 B14R1.163 CCC(=O)CNC(=O)c1ccccc1 1458a_100000182045_100000210202 [1,1,0,0,0,0|2,0,0]=4 1960 B14R1.163 CCC(=O)COC(=O)c1ccccc1 1458a_100000210414_100000073877 [1,1,0,0,0,0|2,0,0]=4 1961 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 11a_100000693194_100000185807 [1,1,0,0,0,0|2,0,0]=4 1962 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 11a_106832991635_100000182045 [1,1,0,0,0,0|2,0,0]=4 1963 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 1626a_100102657272_100000182045 [1,1,0,0,0,0|2,0,0]=4 1964 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 240690a_100000693194_100000185807 [1,1,0,0,0,0|2,0,0]=4 1965 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 240690a_100102657272_100000182045 [1,1,0,0,0,0|2,0,0]=4 1966 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 527a_100000693194_100000185807 [1,1,0,0,0,0|2,0,0]=4 1967 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 527a_100102657272_100000182045 [1,1,0,0,0,0|2,0,0]=4 1968 B14R1.163 COC(=O)CCN(C)c1ccccc1 2230a_100000210012_100000204255 [1,1,0,0,0,0|2,0,0]=4 1969 B14R1.163 COC(=O)CCN(C)c1ccccc1 269982a_100000210012_100000204255 [1,1,0,0,0,0|2,0,0]=4 1970 B14R1.163 COC(=O)CCN(C)c1ccccc1 269982a_100011203847_200000210301 [1,1,0,0,0,0|2,0,0]=4 1971 B14R1.163 COC(=O)CCN(C)c1ccccc1 34a_100000210012_100000742370 [1,1,0,0,0,0|2,0,0]=4 1972 B14R1.163 COC(=O)CCN(C)c1ccccc1 34a_100011203847_200000210301 [1,1,0,0,0,0|2,0,0]=4 1973 B14R1.163 COC(=O)CCN([13CH3])c1ccccc1 269982a_100011203847_200025704644 [1,1,0,0,0,0|2,0,0]=4 1974 B14R1.163 COC(=O)CCN([13CH3])c1ccccc1 34a_100011203847_200025704644 [1,1,0,0,0,0|2,0,0]=4 1975 B14R1.163 COC(=O)CNC(=O)c1ccccc1 188690a_100000185156_100000185807 [1,1,0,0,0,0|1,0,0]=3 1976 B14R1.163 COC(C)CCC(=O)c1ccccc1 7a_200012571355_200000210301 [1,1,0,0,0,0|1,0,1]=4 1977 B14R1.163 O=C(CF)CNC(=O)c1ccccc1 1458a_100000182045_100015361967 [1,1,0,0,0,0|2,0,0]=4 1978 B14R1.163 O=C(CO)CCC(=O)c1ccccc1 1458a_100000210174_100000750707 [1,1,0,0,0,0|0,0,0]=2 1979 B14R1.163 O=C(CO)CC[C@@H](O)c1ccccc1 1458a_100000210174_100000729684 [1,1,0,0,0,0|0,0,2]=4 1980 B14R1.163 O=C(CO)COC(=O)c1ccccc1 1458a_100000210174_100000073877 [1,1,0,0,0,0|1,0,0]=3 1981 B14R1.163 O=C(CO)NNC(=O)c1ccccc1 22a_100000184135_100000210174 [1,1,0,0,0,0|2,0,0]=4 1982 B14R1.415 CC(=O)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100011261029 [1,1,0,0,0,0|1,0,1]=4 1983 B14R1.415 CC(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200000210301 [1,1,0,0,0,0|2,0,0]=4 1984 B14R1.415 CC(=O)[C@@H](C)NC(=O)c1ccccc1 1458a_100011504567_200000210301 [1,1,0,0,0,0|2,0,0]=4 1985 B14R1.415 CC(=O)[C@@H](C)OC(=O)c1ccccc1 1458a_200035542198_200000210301 [1,1,0,0,0,0|2,0,0]=4 1986 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)N 11a_100000119354_100000185807 [1,1,0,0,0,0|2,0,0]=4 1987 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)N 240690a_100000119354_100000185807 [1,1,0,0,0,0|2,0,0]=4 1988 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)N 527a_100000119354_100000185807 [1,1,0,0,0,0|2,0,0]=4 1989 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)[13CH3] 1458a_100011504567_200025704644 [1,1,0,0,0,0|2,0,0]=4 1990 B14R1.415 C[C@@H](OC(=O)c1ccccc1)C(=O)[13CH3] 1458a_200035542198_200025704644 [1,1,0,0,0,0|2,0,0]=4 1991 B14R1.415 [13CH3]C(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200025704644 [1,1,0,0,0,0|2,0,0]=4 1992 B14R1.417 CC(=O)CN(C)C(=O)c1ccccc1 1458a_100000194983_200000210301 [1,1,0,0,0,0|2,0,0]=4 1993 B14R1.417 CC(=O)OC(C)C(=O)c1ccccc1 1458a_100000185807_100009818208 [1,1,0,0,0,0|2,0,0]=4 1994 B14R1.417 CN(CC(=O)N)C(=O)c1ccccc1 11a_100000739694_100000185807 [1,1,0,0,0,0|2,0,0]=4 1995 B14R1.417 CN(CC(=O)N)C(=O)c1ccccc1 527a_100000739694_100000185807 [1,1,0,0,0,0|2,0,0]=4 1996 B14R1.417 CN(CC(=O)[13CH3])C(=O)c1ccccc1 1458a_100000194983_200025704644 [1,1,0,0,0,0|2,0,0]=4 1997 B14R1.540 CN[C@H](CCC(=O)O)c1ccccc1 269956a_100020634680_200000210301 [1,1,0,0,0,0|1,0,1]=4 1998 B14R1.540 [13CH3]N[C@H](CCC(=O)O)c1ccccc1 269956a_100020634680_200025704644 [1,1,0,0,0,0|1,0,1]=4 1999 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000730704 [1,1,0,0,0,0|2,0,0]=4 2000 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000730704 [1,1,0,0,0,0|2,0,0]=4 2001 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000730704 [1,1,0,0,0,0|2,0,0]=4 2002 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000730704 [1,1,0,0,0,0|2,0,0]=4 2003 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000730704 [1,1,0,0,0,0|2,0,0]=4 2004 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000730704 [1,1,0,0,0,0|2,0,0]=4 2005 B14R1.678 CC(=O)CCC(=O)c1ccc(cc1)C 1458a_100000070787_100000701375 [1,1,0,0,0,0|1,0,0]=3 2006 B14R1.678 CC(=O)CCC(=O)c1ccc(cc1)F 1458a_100000070787_100000211231 [1,1,0,0,0,0|1,0,0]=3 2007 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)C 1458a_100000183637_200000210301 [1,1,0,0,0,0|2,0,0]=4 2008 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_200000210301 [1,1,0,0,0,0|2,0,0]=4 2009 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_200000210301 [1,1,0,0,0,0|2,0,0]=4 2010 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_200000210301 [1,1,0,0,0,0|2,0,0]=4 2011 B14R1.678 CC(=O)COC(=O)c1ccc(cc1)O 271570a_203496583355_200027936475 [1,1,0,0,0,0|2,0,0]=4 2012 B14R1.678 CC(=O)OCC(=O)c1ccc(cc1)O 271570a_203496583355_100009811547 [1,1,0,0,0,0|2,0,0]=4 2013 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100012276601 [1,1,0,0,0,0|1,0,1]=4 2014 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100012276601 [1,1,0,0,0,0|1,0,1]=4 2015 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100012276601 [1,1,0,0,0,0|1,0,1]=4 2016 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100012276601 [1,1,0,0,0,0|1,0,1]=4 2017 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100012276601 [1,1,0,0,0,0|1,0,1]=4 2018 B14R1.678 Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100000188618_100012276601 [1,1,0,0,0,0|1,0,1]=4 2019 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)N 11a_100000711301_100000188618 [1,1,0,0,0,0|2,0,0]=4 2020 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)N 240690a_100000711301_100000188618 [1,1,0,0,0,0|2,0,0]=4 2021 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)N 527a_100000711301_100000188618 [1,1,0,0,0,0|2,0,0]=4 2022 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)[13CH3] 1458a_100000183637_200025704644 [1,1,0,0,0,0|2,0,0]=4 2023 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Br 11a_100000711301_100000185839 [1,1,0,0,0,0|2,0,0]=4 2024 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Br 240690a_100000711301_100000185839 [1,1,0,0,0,0|2,0,0]=4 2025 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Br 527a_100000711301_100000185839 [1,1,0,0,0,0|2,0,0]=4 2026 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Cl 11a_100000711301_100000210187 [1,1,0,0,0,0|2,0,0]=4 2027 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Cl 240690a_100000711301_100000210187 [1,1,0,0,0,0|2,0,0]=4 2028 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Cl 527a_100000711301_100000210187 [1,1,0,0,0,0|2,0,0]=4 2029 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)F 11a_100000711301_100000187176 [1,1,0,0,0,0|2,0,0]=4 2030 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)F 240690a_100000711301_100000187176 [1,1,0,0,0,0|2,0,0]=4 2031 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)F 527a_100000711301_100000187176 [1,1,0,0,0,0|2,0,0]=4 2032 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)I 11a_100000711301_100000187904 [1,1,0,0,0,0|2,0,0]=4 2033 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)I 240690a_100000711301_100000187904 [1,1,0,0,0,0|2,0,0]=4 2034 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)I 527a_100000711301_100000187904 [1,1,0,0,0,0|2,0,0]=4 2035 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)O 240690a_100000711301_100000212099 [1,1,0,0,0,0|2,0,0]=4 2036 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)O 527a_100000711301_100000212099 [1,1,0,0,0,0|2,0,0]=4 2037 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_200025704644 [1,1,0,0,0,0|2,0,0]=4 2038 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_200025704644 [1,1,0,0,0,0|2,0,0]=4 2039 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_200025704644 [1,1,0,0,0,0|2,0,0]=4 2040 B14R1.813 CC(=O)CCS(=O)(=O)c1ccccc1 1458a_100000070787_100000229977 [1,1,0,0,0,0|2,0,0]=4 2041 B14R1.813 CC(=O)CCS(=O)(=O)c1ccccc1 1458a_100000183054_200000210301 [1,1,0,0,0,0|2,0,0]=4 2042 B14R1.813 [13CH3]C(=O)CCS(=O)(=O)c1ccccc1 1458a_100000183054_200025704644 [1,1,0,0,0,0|2,0,0]=4 2043 B14R1.3098 CS(=O)(=O)CCC(=O)c1ccccc1 1458a_100000185807_100000731031 [1,1,0,0,0,0|1,0,1]=4 2044 B14R1.3098 O=C(CCS(=O)(=O)[O-])c1ccccc1 1458a_100000185807_100000762736 [1,1,0,0,0,0|1,0,1]=4 2045 B14R1.96 CC(=O)CCSc1ccccc1CO 62a_100000053229_100000187465 [1,1,0,0,0,0|2,0,0]=4 2046 B14R1.96 CC(=O)CCSc1ccccc1CO 62a_100000187465_100000053229 [1,1,0,0,0,0|2,0,0]=4 2047 B14R1.96 COc1ccccc1CNCC(=O)O 269956a_100016091260_100000210004 [1,1,0,0,0,0|1,0,1]=4 2048 B14R1.96 COc1ccccc1NCCC(=O)N 34a_100000210025_100000731001 [1,1,0,0,0,0|2,0,0]=4 2049 B14R1.96 COc1ccccc1OCCC(=O)C 1458a_100000070787_100000188471 [1,1,0,0,0,0|2,0,0]=4 2050 B14R1.96 COc1ccccc1OCCC(=O)C 1458a_100000182669_200000210301 [1,1,0,0,0,0|2,0,0]=4 2051 B14R1.96 COc1ccccc1OCCC(=O)N 34a_100000210385_100000731001 [1,1,0,0,0,0|2,0,0]=4 2052 B14R1.96 COc1ccccc1OCCC(=O)[13CH3] 1458a_100000182669_200025704644 [1,1,0,0,0,0|2,0,0]=4 2053 B14R1.96 COc1ccccc1SCCC(=O)C 62a_100000053229_100000210334 [1,1,0,0,0,0|2,0,0]=4 2054 B14R1.96 COc1ccccc1SCCC(=O)C 62a_100000210334_100000053229 [1,1,0,0,0,0|2,0,0]=4 2055 B14R1.96 COc1ccccc1SCCC(=O)N 62a_100000210334_100000744528 [1,1,0,0,0,0|2,0,0]=4 2056 B14R1.96 COc1ccccc1SCCC(=O)N 62a_100000744528_100000210334 [1,1,0,0,0,0|2,0,0]=4 2057 B14R1.96 NC(=O)CCNc1ccccc1CO 34a_100000212039_100000731001 [1,1,0,0,0,0|2,0,0]=4 2058 B14R1.96 NC(=O)CCOc1ccccc1CO 34a_100011216872_100000731001 [1,1,0,0,0,0|2,0,0]=4 2059 B14R1.96 NC(=O)CCSc1ccccc1CO 62a_100000187465_100000744528 [1,1,0,0,0,0|2,0,0]=4 2060 B14R1.96 NC(=O)CCSc1ccccc1CO 62a_100000744528_100000187465 [1,1,0,0,0,0|2,0,0]=4 2061 B14R1.96 O=C(O)CNCc1ccccc1CO 269956a_100016091260_100009816955 [1,1,0,0,0,0|1,0,1]=4 2062 B14R1.154 CC(=O)CCSc1cccc(c1O)Br 62a_100000053229_100010084509 [1,1,0,0,0,0|2,0,0]=4 2063 B14R1.154 CC(=O)CCSc1cccc(c1O)Br 62a_100010084509_100000053229 [1,1,0,0,0,0|2,0,0]=4 2064 B14R1.154 CC(=O)CCSc1cccc(c1O)C 62a_100000053229_100009817157 [1,1,0,0,0,0|2,0,0]=4 2065 B14R1.154 CC(=O)CCSc1cccc(c1O)C 62a_100009817157_100000053229 [1,1,0,0,0,0|2,0,0]=4 2066 B14R1.154 CC(=O)CCSc1cccc(c1O)Cl 62a_100000053229_100010202889 [1,1,0,0,0,0|2,0,0]=4 2067 B14R1.154 CC(=O)CCSc1cccc(c1O)Cl 62a_100010202889_100000053229 [1,1,0,0,0,0|2,0,0]=4 2068 B14R1.154 CC(=O)CCSc1cccc(c1O)F 62a_100000053229_100009813666 [1,1,0,0,0,0|2,0,0]=4 2069 B14R1.154 CC(=O)CCSc1cccc(c1O)F 62a_100009813666_100000053229 [1,1,0,0,0,0|2,0,0]=4 2070 B14R1.154 CC(=O)CCSc1cccc(c1O)N 62a_100000053229_100010084371 [1,1,0,0,0,0|2,0,0]=4 2071 B14R1.154 CC(=O)CCSc1cccc(c1O)N 62a_100011934915_100000053229 [1,1,0,0,0,0|2,0,0]=4 2072 B14R1.154 CC(=O)CCSc1cccc(c1O)O 62a_100000053229_100009815950 [1,1,0,0,0,0|2,0,0]=4 2073 B14R1.154 Cc1cccc(c1O)NCCC(=O)N 34a_100000756359_100000731001 [1,1,0,0,0,0|2,0,0]=4 2074 B14R1.154 Cc1cccc(c1O)SCCC(=O)N 62a_100000744528_100009817157 [1,1,0,0,0,0|2,0,0]=4 2075 B14R1.154 Cc1cccc(c1O)SCCC(=O)N 62a_100009817157_100000744528 [1,1,0,0,0,0|2,0,0]=4 2076 B14R1.154 NC(=O)CCNc1cccc(c1O)Br 34a_100011934915_100000731001 [1,1,0,0,0,0|2,0,0]=4 2077 B14R1.154 NC(=O)CCNc1cccc(c1O)Cl 34a_100000754742_100000731001 [1,1,0,0,0,0|2,0,0]=4 2078 B14R1.154 NC(=O)CCNc1cccc(c1O)F 34a_100011934987_100000731001 [1,1,0,0,0,0|2,0,0]=4 2079 B14R1.154 NC(=O)CCSc1cccc(c1O)Br 62a_100000744528_100010084509 [1,1,0,0,0,0|2,0,0]=4 2080 B14R1.154 NC(=O)CCSc1cccc(c1O)Br 62a_100010084509_100000744528 [1,1,0,0,0,0|2,0,0]=4 2081 B14R1.154 NC(=O)CCSc1cccc(c1O)Cl 62a_100000744528_100010202889 [1,1,0,0,0,0|2,0,0]=4 2082 B14R1.154 NC(=O)CCSc1cccc(c1O)Cl 62a_100010202889_100000744528 [1,1,0,0,0,0|2,0,0]=4 2083 B14R1.154 NC(=O)CCSc1cccc(c1O)F 62a_100000744528_100009813666 [1,1,0,0,0,0|2,0,0]=4 2084 B14R1.154 NC(=O)CCSc1cccc(c1O)F 62a_100009813666_100000744528 [1,1,0,0,0,0|2,0,0]=4 2085 B14R1.154 NC(=O)CCSc1cccc(c1O)N 62a_100000744528_100010084371 [1,1,0,0,0,0|2,0,0]=4 2086 B14R1.154 NC(=O)CCSc1cccc(c1O)N 62a_100011934915_100000744528 [1,1,0,0,0,0|2,0,0]=4 2087 B14R1.154 NC(=O)CCSc1cccc(c1O)O 62a_100000744528_100009815950 [1,1,0,0,0,0|2,0,0]=4 2088 B14R1.837 CCC(=O)CCCc1ccccc1O 1458a_100009859317_100000210202 [1,1,0,0,0,0|1,0,1]=4 2089 B14R1.837 CNC(=O)CCCc1ccccc1O 240690a_100102657272_100009859317 [1,1,0,0,0,0|1,0,1]=4 2090 B14R1.837 CNC(=O)CCCc1ccccc1O 527a_100102657272_100009859317 [1,1,0,0,0,0|1,0,1]=4 2091 B14R1.837 CNC(=O)CCNc1ccccc1O 34a_100000185747_100012179268 [1,1,0,0,0,0|2,0,0]=4 2092 B14R1.837 CNC(=O)CCSc1ccccc1O 62a_100000737683_100000739446 [1,1,0,0,0,0|2,0,0]=4 2093 B14R1.837 CNC(=O)CCSc1ccccc1O 62a_100000739446_100000737683 [1,1,0,0,0,0|2,0,0]=4 2094 B14R1.837 COC(=O)CCNc1ccccc1Br 34a_100000210017_100000742370 [1,1,0,0,0,0|2,0,0]=4 2095 B14R1.837 COC(=O)CCNc1ccccc1C 34a_100015192222_100000742370 [1,1,0,0,0,0|2,0,0]=4 2096 B14R1.837 COC(=O)CCNc1ccccc1Cl 34a_100000185783_100000742370 [1,1,0,0,0,0|2,0,0]=4 2097 B14R1.837 COC(=O)CCNc1ccccc1F 34a_100000210422_100000742370 [1,1,0,0,0,0|2,0,0]=4 2098 B14R1.837 COC(=O)CCNc1ccccc1I 34a_100000210053_100000742370 [1,1,0,0,0,0|2,0,0]=4 2099 B14R1.837 COC(=O)CCNc1ccccc1O 34a_100000185747_100000742370 [1,1,0,0,0,0|1,0,0]=3 2100 B14R1.837 COC(=O)CCOc1ccccc1Br 34a_100000181306_100000742370 [1,1,0,0,0,0|2,0,0]=4 2101 B14R1.837 COC(=O)CCOc1ccccc1Br 7a_100000181306_100000204255 [1,1,0,0,0,0|2,0,0]=4 2102 B14R1.837 COC(=O)CCOc1ccccc1C 34a_100000210338_100000742370 [1,1,0,0,0,0|2,0,0]=4 2103 B14R1.837 COC(=O)CCOc1ccccc1C 7a_100000210338_100000204255 [1,1,0,0,0,0|2,0,0]=4 2104 B14R1.837 COC(=O)CCOc1ccccc1Cl 34a_100000210172_100000742370 [1,1,0,0,0,0|2,0,0]=4 2105 B14R1.837 COC(=O)CCOc1ccccc1Cl 7a_100000210172_100000204255 [1,1,0,0,0,0|2,0,0]=4 2106 B14R1.837 COC(=O)CCOc1ccccc1F 34a_100000210171_100000742370 [1,1,0,0,0,0|2,0,0]=4 2107 B14R1.837 COC(=O)CCOc1ccccc1F 7a_100000210171_100000204255 [1,1,0,0,0,0|2,0,0]=4 2108 B14R1.837 COC(=O)CCOc1ccccc1I 34a_100000739446_100000742370 [1,1,0,0,0,0|2,0,0]=4 2109 B14R1.837 COC(=O)CCOc1ccccc1I 7a_100000739446_100000204255 [1,1,0,0,0,0|2,0,0]=4 2110 B14R1.837 COC(=O)CCOc1ccccc1N 34a_100000185747_100000742370 [1,1,0,0,0,0|2,0,0]=4 2111 B14R1.837 COC(=O)CCOc1ccccc1N 7a_100000185747_100000204255 [1,1,0,0,0,0|2,0,0]=4 2112 B14R1.837 COC(=O)CCSc1ccccc1Br 62a_100000204255_100000695589 [1,1,0,0,0,0|2,0,0]=4 2113 B14R1.837 COC(=O)CCSc1ccccc1Br 62a_100000695589_100000204255 [1,1,0,0,0,0|2,0,0]=4 2114 B14R1.837 COC(=O)CCSc1ccccc1C 62a_100000204255_100000210755 [1,1,0,0,0,0|2,0,0]=4 2115 B14R1.837 COC(=O)CCSc1ccccc1C 62a_100000210755_100000204255 [1,1,0,0,0,0|2,0,0]=4 2116 B14R1.837 COC(=O)CCSc1ccccc1Cl 62a_100000204255_100000764095 [1,1,0,0,0,0|2,0,0]=4 2117 B14R1.837 COC(=O)CCSc1ccccc1Cl 62a_100000764095_100000204255 [1,1,0,0,0,0|2,0,0]=4 2118 B14R1.837 COC(=O)CCSc1ccccc1F 62a_100000204255_100011215700 [1,1,0,0,0,0|2,0,0]=4 2119 B14R1.837 COC(=O)CCSc1ccccc1F 62a_100011215700_100000204255 [1,1,0,0,0,0|2,0,0]=4 2120 B14R1.837 COC(=O)CCSc1ccccc1N 62a_100000204255_100000210017 [1,1,0,0,0,0|2,0,0]=4 2121 B14R1.837 COC(=O)CCSc1ccccc1N 62a_100000210017_100000204255 [1,1,0,0,0,0|2,0,0]=4 2122 B14R1.837 COC(=O)CCSc1ccccc1O 62a_100000204255_100000739446 [1,1,0,0,0,0|1,0,0]=3 2123 B14R1.837 COC(=O)CCSc1ccccc1O 62a_100000739446_100000204255 [1,1,0,0,0,0|1,0,0]=3 2124 B14R1.837 COC(=O)CCSc1cccnc1O 62a_100000204255_100000760158 [1,1,0,0,0,0|2,0,0]=4 2125 B14R1.837 COC(=O)CCSc1cccnc1O 62a_100000760158_100000204255 [1,1,0,0,0,0|2,0,0]=4 2126 B14R1.837 COC(=O)CCSc1ccncc1O 62a_100000204255_100009817591 [1,1,0,0,0,0|2,0,0]=4 2127 B14R1.837 COC(=O)CCSc1ccncc1O 62a_100009817591_100000204255 [1,1,0,0,0,0|2,0,0]=4 2128 B14R1.837 COC(=O)CCSc1ncccc1O 62a_100000034122_100000204255 [1,1,0,0,0,0|2,0,0]=4 2129 B14R1.837 COC(=O)CCSc1ncccc1O 62a_100000204255_100000034122 [1,1,0,0,0,0|2,0,0]=4 2130 B14R1.837 COC(=O)CNCc1ccccc1O 34a_100000185550_100000747449 [1,1,0,0,0,0|1,0,1]=4 2131 B14R1.837 COC(=O)OCSc1ccccc1O 62a_100000739446_100000139417 [1,1,0,0,0,0|2,0,0]=4 2132 B14R1.837 Cc1ccccc1OCCC(=O)CO 1458a_100000210174_100000184434 [1,1,0,0,0,0|2,0,0]=4 2133 B14R1.837 O=C(CF)CCCc1ccccc1O 1458a_100009859317_100015361967 [1,1,0,0,0,0|1,0,1]=4 2134 B14R1.837 O=C(CO)CCCc1ccccc1Br 1458a_100000210174_200011713681 [1,1,0,0,0,0|1,0,1]=4 2135 B14R1.837 O=C(CO)CCOc1ccccc1Br 1458a_100000210174_100000695877 [1,1,0,0,0,0|2,0,0]=4 2136 B14R1.837 O=C(CO)CCOc1ccccc1F 1458a_100000210174_100000183290 [1,1,0,0,0,0|2,0,0]=4 2137 B14R1.837 O=C(CO)NCCc1ccccc1O 240690a_100011207237_100000210174 [1,1,0,0,0,0|1,0,1]=4 2138 B14R1.837 O=C(CO)NCCc1ccccc1O 527a_100011207237_100000210174 [1,1,0,0,0,0|1,0,1]=4 2139 B14R1.4464 CC(=O)CCSc1ccc(cc1O)Br 62a_100000053229_100012344904 [1,1,0,0,0,0|2,0,0]=4 2140 B14R1.4464 CC(=O)CCSc1ccc(cc1O)Br 62a_100012344904_100000053229 [1,1,0,0,0,0|2,0,0]=4 2141 B14R1.4464 CC(=O)CCSc1ccc(cc1O)C 62a_100000053229_100012002257 [1,1,0,0,0,0|2,0,0]=4 2142 B14R1.4464 CC(=O)CCSc1ccc(cc1O)C 62a_100012002257_100000053229 [1,1,0,0,0,0|2,0,0]=4 2143 B14R1.4464 CC(=O)CCSc1ccc(cc1O)Cl 62a_100000050036_100000053229 [1,1,0,0,0,0|2,0,0]=4 2144 B14R1.4464 CC(=O)CCSc1ccc(cc1O)Cl 62a_100000053229_100000050036 [1,1,0,0,0,0|2,0,0]=4 2145 B14R1.4464 CC(=O)CCSc1ccc(cc1O)F 62a_100000053229_100000690578 [1,1,0,0,0,0|2,0,0]=4 2146 B14R1.4464 CC(=O)CCSc1ccc(cc1O)F 62a_100000690578_100000053229 [1,1,0,0,0,0|2,0,0]=4 2147 B14R1.4464 CC(=O)CCSc1ccc(cc1O)O 62a_100000053229_100009813921 [1,1,0,0,0,0|2,0,0]=4 2148 B14R1.4464 Cc1ccc(c(c1)O)NCCC(=O)N 34a_100000211527_100000731001 [1,1,0,0,0,0|2,0,0]=4 2149 B14R1.4464 Cc1ccc(c(c1)O)SCCC(=O)N 62a_100000744528_100012002257 [1,1,0,0,0,0|2,0,0]=4 2150 B14R1.4464 Cc1ccc(c(c1)O)SCCC(=O)N 62a_100012002257_100000744528 [1,1,0,0,0,0|2,0,0]=4 2151 B14R1.4464 NC(=O)CCNc1ccc(cc1O)Br 34a_100000739049_100000731001 [1,1,0,0,0,0|2,0,0]=4 2152 B14R1.4464 NC(=O)CCNc1ccc(cc1O)Cl 34a_100000185728_100000731001 [1,1,0,0,0,0|2,0,0]=4 2153 B14R1.4464 NC(=O)CCNc1ccc(cc1O)F 34a_100000753323_100000731001 [1,1,0,0,0,0|2,0,0]=4 2154 B14R1.4464 NC(=O)CCNc1ccc(cc1O)O 34a_100000106777_100000731001 [1,1,0,0,0,0|2,0,0]=4 2155 B14R1.4464 NC(=O)CCSc1ccc(cc1O)Br 62a_100000744528_100012344904 [1,1,0,0,0,0|2,0,0]=4 2156 B14R1.4464 NC(=O)CCSc1ccc(cc1O)Br 62a_100012344904_100000744528 [1,1,0,0,0,0|2,0,0]=4 2157 B14R1.4464 NC(=O)CCSc1ccc(cc1O)Cl 62a_100000050036_100000744528 [1,1,0,0,0,0|2,0,0]=4 2158 B14R1.4464 NC(=O)CCSc1ccc(cc1O)Cl 62a_100000744528_100000050036 [1,1,0,0,0,0|2,0,0]=4 2159 B14R1.4464 NC(=O)CCSc1ccc(cc1O)F 62a_100000690578_100000744528 [1,1,0,0,0,0|2,0,0]=4 2160 B14R1.4464 NC(=O)CCSc1ccc(cc1O)F 62a_100000744528_100000690578 [1,1,0,0,0,0|2,0,0]=4 2161 B14R1.4464 NC(=O)CCSc1ccc(cc1O)O 62a_100000744528_100009813921 [1,1,0,0,0,0|2,0,0]=4 2162 B14R1.4920 CC(=O)CCSc1c(cccc1Br)O 62a_100000053229_100010187912 [1,1,0,0,0,0|2,0,0]=4 2163 B14R1.4920 CC(=O)CCSc1c(cccc1Br)O 62a_100010187912_100000053229 [1,1,0,0,0,0|2,0,0]=4 2164 B14R1.4920 CC(=O)CCSc1c(cccc1Cl)O 62a_100000053229_100000050174 [1,1,0,0,0,0|2,0,0]=4 2165 B14R1.4920 CC(=O)CCSc1c(cccc1F)O 62a_100000053229_100009820682 [1,1,0,0,0,0|2,0,0]=4 2166 B14R1.4920 CC(=O)CCSc1c(cccc1F)O 62a_100009820682_100000053229 [1,1,0,0,0,0|2,0,0]=4 2167 B14R1.4920 CC(=O)CCSc1c(cccc1O)C 62a_100000053229_100000686692 [1,1,0,0,0,0|2,0,0]=4 2168 B14R1.4920 CC(=O)CCSc1c(cccc1O)C 62a_100000686692_100000053229 [1,1,0,0,0,0|2,0,0]=4 2169 B14R1.4920 CC(=O)CCSc1c(cccc1O)N 62a_100000053229_100012183704 [1,1,0,0,0,0|2,0,0]=4 2170 B14R1.4920 CC(=O)CCSc1c(cccc1O)N 62a_100012183704_100000053229 [1,1,0,0,0,0|2,0,0]=4 2171 B14R1.4920 CC(=O)CCSc1c(cccc1O)O 62a_100000053229_100010205330 [1,1,0,0,0,0|2,0,0]=4 2172 B14R1.4920 Cc1cccc(c1NCCC(=O)N)O 34a_100000743429_100000731001 [1,1,0,0,0,0|2,0,0]=4 2173 B14R1.4920 Cc1cccc(c1SCCC(=O)N)O 62a_100000686692_100000744528 [1,1,0,0,0,0|2,0,0]=4 2174 B14R1.4920 Cc1cccc(c1SCCC(=O)N)O 62a_100000744528_100000686692 [1,1,0,0,0,0|2,0,0]=4 2175 B14R1.4920 NC(=O)CCNc1c(cccc1Br)O 34a_100011934926_100000731001 [1,1,0,0,0,0|2,0,0]=4 2176 B14R1.4920 NC(=O)CCNc1c(cccc1Cl)O 34a_100012022510_100000731001 [1,1,0,0,0,0|2,0,0]=4 2177 B14R1.4920 NC(=O)CCNc1c(cccc1F)O 34a_100020591140_100000731001 [1,1,0,0,0,0|2,0,0]=4 2178 B14R1.4920 NC(=O)CCSc1c(cccc1Br)O 62a_100000744528_100010187912 [1,1,0,0,0,0|2,0,0]=4 2179 B14R1.4920 NC(=O)CCSc1c(cccc1Br)O 62a_100010187912_100000744528 [1,1,0,0,0,0|2,0,0]=4 2180 B14R1.4920 NC(=O)CCSc1c(cccc1Cl)O 62a_100000744528_100000050174 [1,1,0,0,0,0|2,0,0]=4 2181 B14R1.4920 NC(=O)CCSc1c(cccc1F)O 62a_100000744528_100009820682 [1,1,0,0,0,0|2,0,0]=4 2182 B14R1.4920 NC(=O)CCSc1c(cccc1F)O 62a_100009820682_100000744528 [1,1,0,0,0,0|2,0,0]=4 2183 B14R1.4920 NC(=O)CCSc1c(cccc1O)N 62a_100000744528_100012183704 [1,1,0,0,0,0|2,0,0]=4 2184 B14R1.4920 NC(=O)CCSc1c(cccc1O)N 62a_100012183704_100000744528 [1,1,0,0,0,0|2,0,0]=4 2185 B14R1.4920 NC(=O)CCSc1c(cccc1O)O 62a_100000744528_100010205330 [1,1,0,0,0,0|2,0,0]=4 2186 B14R1.6072 CC(=O)CCSc1cc(ccc1O)Br 62a_100000053229_100012355227 [1,1,0,0,0,0|2,0,0]=4 2187 B14R1.6072 CC(=O)CCSc1cc(ccc1O)Br 62a_100012355227_100000053229 [1,1,0,0,0,0|2,0,0]=4 2188 B14R1.6072 CC(=O)CCSc1cc(ccc1O)C 62a_100000053229_100000765521 [1,1,0,0,0,0|2,0,0]=4 2189 B14R1.6072 CC(=O)CCSc1cc(ccc1O)C 62a_100000765521_100000053229 [1,1,0,0,0,0|2,0,0]=4 2190 B14R1.6072 CC(=O)CCSc1cc(ccc1O)Cl 62a_100000053229_100011356953 [1,1,0,0,0,0|2,0,0]=4 2191 B14R1.6072 CC(=O)CCSc1cc(ccc1O)Cl 62a_100011356953_100000053229 [1,1,0,0,0,0|2,0,0]=4 2192 B14R1.6072 CC(=O)CCSc1cc(ccc1O)F 62a_100000053229_100000211999 [1,1,0,0,0,0|2,0,0]=4 2193 B14R1.6072 CC(=O)CCSc1cc(ccc1O)F 62a_100000211999_100000053229 [1,1,0,0,0,0|2,0,0]=4 2194 B14R1.6072 CC(=O)CCSc1cc(ccc1O)N 62a_100000053229_100011534360 [1,1,0,0,0,0|2,0,0]=4 2195 B14R1.6072 CC(=O)CCSc1cc(ccc1O)N 62a_100011534360_100000053229 [1,1,0,0,0,0|2,0,0]=4 2196 B14R1.6072 CC(=O)CCSc1cc(ccc1O)O 62a_100000053229_100009813629 [1,1,0,0,0,0|2,0,0]=4 2197 B14R1.6072 Cc1ccc(c(c1)NCCC(=O)N)O 34a_100011215204_100000731001 [1,1,0,0,0,0|2,0,0]=4 2198 B14R1.6072 Cc1ccc(c(c1)SCCC(=O)N)O 62a_100000744528_100000765521 [1,1,0,0,0,0|2,0,0]=4 2199 B14R1.6072 Cc1ccc(c(c1)SCCC(=O)N)O 62a_100000765521_100000744528 [1,1,0,0,0,0|2,0,0]=4 2200 B14R1.6072 NC(=O)CCNc1cc(ccc1O)Br 34a_100000752626_100000731001 [1,1,0,0,0,0|2,0,0]=4 2201 B14R1.6072 NC(=O)CCNc1cc(ccc1O)Cl 34a_100000210500_100000731001 [1,1,0,0,0,0|2,0,0]=4 2202 B14R1.6072 NC(=O)CCNc1cc(ccc1O)F 34a_100000759472_100000731001 [1,1,0,0,0,0|2,0,0]=4 2203 B14R1.6072 NC(=O)CCSc1cc(ccc1O)Br 62a_100000744528_100012355227 [1,1,0,0,0,0|2,0,0]=4 2204 B14R1.6072 NC(=O)CCSc1cc(ccc1O)Br 62a_100012355227_100000744528 [1,1,0,0,0,0|2,0,0]=4 2205 B14R1.6072 NC(=O)CCSc1cc(ccc1O)Cl 62a_100000744528_100011356953 [1,1,0,0,0,0|2,0,0]=4 2206 B14R1.6072 NC(=O)CCSc1cc(ccc1O)Cl 62a_100011356953_100000744528 [1,1,0,0,0,0|2,0,0]=4 2207 B14R1.6072 NC(=O)CCSc1cc(ccc1O)F 62a_100000211999_100000744528 [1,1,0,0,0,0|2,0,0]=4 2208 B14R1.6072 NC(=O)CCSc1cc(ccc1O)F 62a_100000744528_100000211999 [1,1,0,0,0,0|2,0,0]=4 2209 B14R1.6072 NC(=O)CCSc1cc(ccc1O)N 62a_100000744528_100011534360 [1,1,0,0,0,0|2,0,0]=4 2210 B14R1.6072 NC(=O)CCSc1cc(ccc1O)N 62a_100011534360_100000744528 [1,1,0,0,0,0|2,0,0]=4 2211 B14R1.6072 NC(=O)CCSc1cc(ccc1O)O 62a_100000744528_100009813629 [1,1,0,0,0,0|2,0,0]=4 2212 B14R1.6072 O=C(O)CNCc1cc(ccc1O)F 269956a_100016091260_100010161318 [1,1,0,0,0,0|1,0,1]=4 2213 B14R1.16 C#CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000753159 [1,1,0,0,0,0|1,0,1]=4 2214 B14R1.16 C#CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000753159 [1,1,0,0,0,0|1,0,1]=4 2215 B14R1.16 C#CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000753159 [1,1,0,0,0,0|1,0,1]=4 2216 B14R1.16 C#CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000753159 [1,1,0,0,0,0|1,0,1]=4 2217 B14R1.16 C#CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000753159 [1,1,0,0,0,0|1,0,1]=4 2218 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)Br 1458a_100000752940_100102629194 [1,1,0,0,0,0|1,0,1]=4 2219 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)C 1458a_100000183896_100102629194 [1,1,0,0,0,0|1,0,1]=4 2220 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100102629194 [1,1,0,0,0,0|1,0,1]=4 2221 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)F 1458a_100011217230_100102629194 [1,1,0,0,0,0|1,0,1]=4 2222 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)O 1458a_100000690420_100102629194 [1,1,0,0,0,0|1,0,1]=4 2223 B14R1.16 C=CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000754431 [1,1,0,0,0,0|2,0,0]=4 2224 B14R1.16 C=CCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000754431 [1,1,0,0,0,0|2,0,0]=4 2225 B14R1.16 C=CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000754431 [1,1,0,0,0,0|2,0,0]=4 2226 B14R1.16 C=CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000754431 [1,1,0,0,0,0|2,0,0]=4 2227 B14R1.16 C=CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000754431 [1,1,0,0,0,0|2,0,0]=4 2228 B14R1.16 C=CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000754431 [1,1,0,0,0,0|2,0,0]=4 2229 B14R1.16 C=CCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000754431 [1,1,0,0,0,0|2,0,0]=4 2230 B14R1.16 C=CCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000754431 [1,1,0,0,0,0|2,0,0]=4 2231 B14R1.16 C=CCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000754431 [1,1,0,0,0,0|2,0,0]=4 2232 B14R1.16 C=CCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000754431 [1,1,0,0,0,0|2,0,0]=4 2233 B14R1.16 C=CCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000754431 [1,1,0,0,0,0|2,0,0]=4 2234 B14R1.16 C=CCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000754431 [1,1,0,0,0,0|2,0,0]=4 2235 B14R1.16 C=CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000754431 [1,1,0,0,0,0|2,0,0]=4 2236 B14R1.16 C=CCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000754431 [1,1,0,0,0,0|2,0,0]=4 2237 B14R1.16 C=CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000754431 [1,1,0,0,0,0|2,0,0]=4 2238 B14R1.16 C=CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000754431 [1,1,0,0,0,0|2,0,0]=4 2239 B14R1.16 C=CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000754431 [1,1,0,0,0,0|2,0,0]=4 2240 B14R1.16 C=CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000754431 [1,1,0,0,0,0|2,0,0]=4 2241 B14R1.16 C=CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000754431 [1,1,0,0,0,0|2,0,0]=4 2242 B14R1.16 C=CCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000754431 [1,1,0,0,0,0|2,0,0]=4 2243 B14R1.16 C=CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000754431 [1,1,0,0,0,0|2,0,0]=4 2244 B14R1.16 C=CCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000754431 [1,1,0,0,0,0|2,0,0]=4 2245 B14R1.16 C=CCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000754431 [1,1,0,0,0,0|2,0,0]=4 2246 B14R1.16 C=CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000754431 [1,1,0,0,0,0|2,0,0]=4 2247 B14R1.16 C=CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000754431 [1,1,0,0,0,0|2,0,0]=4 2248 B14R1.16 C=CCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000754431 [1,1,0,0,0,0|2,0,0]=4 2249 B14R1.16 C=CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000754431 [1,1,0,0,0,0|2,0,0]=4 2250 B14R1.16 C=CCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000754431 [1,1,0,0,0,0|2,0,0]=4 2251 B14R1.16 C=CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000754431 [1,1,0,0,0,0|2,0,0]=4 2252 B14R1.16 C=CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000754431 [1,1,0,0,0,0|1,0,0]=3 2253 B14R1.16 C=CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000754431 [1,1,0,0,0,0|1,0,0]=3 2254 B14R1.16 C=CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000754431 [1,1,0,0,0,0|1,0,0]=3 2255 B14R1.16 C=CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000754431 [1,1,0,0,0,0|1,0,0]=3 2256 B14R1.16 C=CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000754431 [1,1,0,0,0,0|1,0,0]=3 2257 B14R1.16 C=CCNC(=O)c1cccc(c1O)Br 240690a_100020586998_100000752940 [1,1,0,0,0,0|2,0,0]=4 2258 B14R1.16 C=CCNC(=O)c1cccc(c1O)Br 527a_100020586998_100000752940 [1,1,0,0,0,0|2,0,0]=4 2259 B14R1.16 C=CCNC(=O)c1cccc(c1O)C 240690a_100020586998_100000183896 [1,1,0,0,0,0|2,0,0]=4 2260 B14R1.16 C=CCNC(=O)c1cccc(c1O)C 527a_100020586998_100000183896 [1,1,0,0,0,0|2,0,0]=4 2261 B14R1.16 C=CCNC(=O)c1cccc(c1O)Cl 240690a_100020586998_100000742801 [1,1,0,0,0,0|2,0,0]=4 2262 B14R1.16 C=CCNC(=O)c1cccc(c1O)Cl 527a_100020586998_100000742801 [1,1,0,0,0,0|2,0,0]=4 2263 B14R1.16 C=CCNC(=O)c1cccc(c1O)F 240690a_100020586998_100011217230 [1,1,0,0,0,0|2,0,0]=4 2264 B14R1.16 C=CCNC(=O)c1cccc(c1O)F 527a_100020586998_100011217230 [1,1,0,0,0,0|2,0,0]=4 2265 B14R1.16 C=CCNC(=O)c1cccc(c1O)O 527a_100020586998_100000690420 [1,1,0,0,0,0|2,0,0]=4 2266 B14R1.16 CC=CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000070051 [1,1,0,0,0,0|1,0,1]=4 2267 B14R1.16 CC=CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000070051 [1,1,0,0,0,0|1,0,1]=4 2268 B14R1.16 CC=CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000070051 [1,1,0,0,0,0|1,0,1]=4 2269 B14R1.16 CC=CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000070051 [1,1,0,0,0,0|1,0,1]=4 2270 B14R1.16 CC=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000070051 [1,1,0,0,0,0|1,0,1]=4 2271 B14R1.16 CCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210211 [1,1,0,0,0,0|1,0,1]=4 2272 B14R1.16 CCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210211 [1,1,0,0,0,0|1,0,1]=4 2273 B14R1.16 CCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210211 [1,1,0,0,0,0|1,0,1]=4 2274 B14R1.16 CCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210211 [1,1,0,0,0,0|1,0,1]=4 2275 B14R1.16 CCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210211 [1,1,0,0,0,0|1,0,1]=4 2276 B14R1.16 COCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000233755 [1,1,0,0,0,0|2,0,0]=4 2277 B14R1.16 COCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000233755 [1,1,0,0,0,0|2,0,0]=4 2278 B14R1.16 COCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000233755 [1,1,0,0,0,0|2,0,0]=4 2279 B14R1.16 COCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000233755 [1,1,0,0,0,0|2,0,0]=4 2280 B14R1.16 COCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000233755 [1,1,0,0,0,0|2,0,0]=4 2281 B14R1.16 CSCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000751147 [1,1,0,0,0,0|2,0,0]=4 2282 B14R1.16 CSCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000751147 [1,1,0,0,0,0|2,0,0]=4 2283 B14R1.16 CSCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000751147 [1,1,0,0,0,0|2,0,0]=4 2284 B14R1.16 CSCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000751147 [1,1,0,0,0,0|2,0,0]=4 2285 B14R1.16 CSCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000751147 [1,1,0,0,0,0|2,0,0]=4 2286 B14R1.16 Cc1c(cccc1C(=O)CCCO)Br 1458a_100000760464_100011215043 [1,1,0,0,0,0|1,0,1]=4 2287 B14R1.16 Cc1c(cccc1C(=O)CCCO)Cl 1458a_100000690184_100011215043 [1,1,0,0,0,0|1,0,1]=4 2288 B14R1.16 Cc1c(cccc1C(=O)CCCO)F 1458a_100011218272_100011215043 [1,1,0,0,0,0|1,0,1]=4 2289 B14R1.16 Cc1c(cccc1C(=O)CCCO)I 1458a_100000751865_100011215043 [1,1,0,0,0,0|1,0,1]=4 2290 B14R1.16 Cc1c(cccc1C(=O)CCCO)O 1458a_100000766327_100011215043 [1,1,0,0,0,0|1,0,1]=4 2291 B14R1.16 Cc1cccc(c1Br)C(=O)CCCO 1458a_100000692419_100011215043 [1,1,0,0,0,0|1,0,1]=4 2292 B14R1.16 Cc1cccc(c1C)C(=O)CCCO 1458a_100000183679_100011215043 [1,1,0,0,0,0|1,0,1]=4 2293 B14R1.16 Cc1cccc(c1Cl)C(=O)CCCO 1458a_100000693142_100011215043 [1,1,0,0,0,0|1,0,1]=4 2294 B14R1.16 Cc1cccc(c1F)C(=O)CCCO 1458a_100000766181_100011215043 [1,1,0,0,0,0|1,0,1]=4 2295 B14R1.16 Cc1cccc(c1I)C(=O)CCCO 1458a_100000739377_100011215043 [1,1,0,0,0,0|1,0,1]=4 2296 B14R1.16 Cc1cccc(c1O)C(=O)CCC#N 1458a_100000183896_100011215226 [1,1,0,0,0,0|1,0,1]=4 2297 B14R1.16 Cc1cccc(c1O)C(=O)CCCF 1458a_100000183896_100011934791 [1,1,0,0,0,0|1,0,1]=4 2298 B14R1.16 Cc1cccc(c1O)C(=O)CCCO 1458a_100000183896_100011215043 [1,1,0,0,0,0|0,0,1]=3 2299 B14R1.16 Cc1cccc(c1O)C(=O)NCCO 240690a_100000210304_100000183896 [1,1,0,0,0,0|1,0,1]=4 2300 B14R1.16 Cc1cccc(c1O)C(=O)NCCO 527a_100000210304_100000183896 [1,1,0,0,0,0|1,0,1]=4 2301 B14R1.16 N#CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215226 [1,1,0,0,0,0|1,0,1]=4 2302 B14R1.16 N#CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215226 [1,1,0,0,0,0|1,0,1]=4 2303 B14R1.16 N#CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215226 [1,1,0,0,0,0|1,0,1]=4 2304 B14R1.16 N#CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215226 [1,1,0,0,0,0|1,0,1]=4 2305 B14R1.16 O=C(CCCF)c1cccc(c1O)Br 1458a_100000752940_100011934791 [1,1,0,0,0,0|1,0,1]=4 2306 B14R1.16 O=C(CCCF)c1cccc(c1O)Cl 1458a_100000742801_100011934791 [1,1,0,0,0,0|1,0,1]=4 2307 B14R1.16 O=C(CCCF)c1cccc(c1O)F 1458a_100011217230_100011934791 [1,1,0,0,0,0|1,0,1]=4 2308 B14R1.16 O=C(CCCF)c1cccc(c1O)O 1458a_100000690420_100011934791 [1,1,0,0,0,0|1,0,1]=4 2309 B14R1.16 O=C(CCCO)c1cccc(c1Br)Br 1458a_100012360534_100011215043 [1,1,0,0,0,0|1,0,1]=4 2310 B14R1.16 O=C(CCCO)c1cccc(c1Br)Cl 1458a_100012339722_100011215043 [1,1,0,0,0,0|1,0,1]=4 2311 B14R1.16 O=C(CCCO)c1cccc(c1Br)F 1458a_100011217547_100011215043 [1,1,0,0,0,0|1,0,1]=4 2312 B14R1.16 O=C(CCCO)c1cccc(c1Br)I 1458a_100010232522_100011215043 [1,1,0,0,0,0|1,0,1]=4 2313 B14R1.16 O=C(CCCO)c1cccc(c1Br)O 1458a_100010230362_100011215043 [1,1,0,0,0,0|1,0,1]=4 2314 B14R1.16 O=C(CCCO)c1cccc(c1Cl)Br 1458a_100000760540_100011215043 [1,1,0,0,0,0|1,0,1]=4 2315 B14R1.16 O=C(CCCO)c1cccc(c1Cl)Cl 1458a_100000183631_100011215043 [1,1,0,0,0,0|1,0,1]=4 2316 B14R1.16 O=C(CCCO)c1cccc(c1Cl)F 1458a_100000759904_100011215043 [1,1,0,0,0,0|1,0,1]=4 2317 B14R1.16 O=C(CCCO)c1cccc(c1Cl)I 1458a_100010176783_100011215043 [1,1,0,0,0,0|1,0,1]=4 2318 B14R1.16 O=C(CCCO)c1cccc(c1Cl)O 1458a_100000092362_100011215043 [1,1,0,0,0,0|1,0,1]=4 2319 B14R1.16 O=C(CCCO)c1cccc(c1F)Br 1458a_100000756403_100011215043 [1,1,0,0,0,0|1,0,1]=4 2320 B14R1.16 O=C(CCCO)c1cccc(c1F)Cl 1458a_100000688816_100011215043 [1,1,0,0,0,0|1,0,1]=4 2321 B14R1.16 O=C(CCCO)c1cccc(c1F)F 1458a_100000748134_100011215043 [1,1,0,0,0,0|1,0,1]=4 2322 B14R1.16 O=C(CCCO)c1cccc(c1F)I 1458a_100010185205_100011215043 [1,1,0,0,0,0|1,0,1]=4 2323 B14R1.16 O=C(CCCO)c1cccc(c1F)O 1458a_100000037433_100011215043 [1,1,0,0,0,0|1,0,1]=4 2324 B14R1.16 O=C(CCCO)c1cccc(c1I)Br 1458a_100000688019_100011215043 [1,1,0,0,0,0|1,0,1]=4 2325 B14R1.16 O=C(CCCO)c1cccc(c1I)Cl 1458a_100010176784_100011215043 [1,1,0,0,0,0|1,0,1]=4 2326 B14R1.16 O=C(CCCO)c1cccc(c1I)F 1458a_100000690930_100011215043 [1,1,0,0,0,0|1,0,1]=4 2327 B14R1.16 O=C(CCCO)c1cccc(c1I)O 1458a_100010084636_100011215043 [1,1,0,0,0,0|1,0,1]=4 2328 B14R1.16 O=C(CCCO)c1cccc(c1O)Br 1458a_100000752940_100011215043 [1,1,0,0,0,0|0,0,1]=3 2329 B14R1.16 O=C(CCCO)c1cccc(c1O)Cl 1458a_100000742801_100011215043 [1,1,0,0,0,0|0,0,1]=3 2330 B14R1.16 O=C(CCCO)c1cccc(c1O)F 1458a_100011217230_100011215043 [1,1,0,0,0,0|0,0,1]=3 2331 B14R1.16 O=C(CCCO)c1cccc(c1O)O 1458a_100000690420_100011215043 [1,1,0,0,0,0|0,0,1]=3 2332 B14R1.16 O=C(NCCO)c1cccc(c1O)Br 240690a_100000210304_100000752940 [1,1,0,0,0,0|1,0,1]=4 2333 B14R1.16 O=C(NCCO)c1cccc(c1O)Br 527a_100000210304_100000752940 [1,1,0,0,0,0|1,0,1]=4 2334 B14R1.16 O=C(NCCO)c1cccc(c1O)Cl 240690a_100000210304_100000742801 [1,1,0,0,0,0|1,0,1]=4 2335 B14R1.16 O=C(NCCO)c1cccc(c1O)Cl 527a_100000210304_100000742801 [1,1,0,0,0,0|1,0,1]=4 2336 B14R1.16 O=C(NCCO)c1cccc(c1O)F 240690a_100000210304_100011217230 [1,1,0,0,0,0|1,0,1]=4 2337 B14R1.16 O=C(NCCO)c1cccc(c1O)F 527a_100000210304_100011217230 [1,1,0,0,0,0|1,0,1]=4 2338 B14R1.16 O=C(NCCO)c1cccc(c1O)O 527a_100000210304_100000690420 [1,1,0,0,0,0|1,0,1]=4 2339 B14R1.587 C=CC(=O)CC(=O)c1ccccc1O 1458a_100000185746_100000188908 [1,1,0,0,0,0|1,0,1]=4 2340 B14R1.587 CCC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748023 [1,1,0,0,0,0|1,0,1]=4 2341 B14R1.587 CCC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218378 [1,1,0,0,0,0|1,0,1]=4 2342 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1O 1458a_100015234032_100009816398 [1,1,0,0,0,0|1,0,1]=4 2343 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1Br 1458a_100000188424_100000059175 [1,1,0,0,0,0|1,0,1]=4 2344 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1Cl 1458a_100000185844_100000059175 [1,1,0,0,0,0|1,0,1]=4 2345 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1F 1458a_100000188656_100000059175 [1,1,0,0,0,0|1,0,1]=4 2346 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1I 1458a_100000187884_100000059175 [1,1,0,0,0,0|1,0,1]=4 2347 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1O 1458a_100015234032_100000059175 [1,1,0,0,0,0|0,0,1]=3 2348 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000059175 [1,1,0,0,0,0|0,0,2]=4 2349 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1O 240690a_100000737577_100015234032 [1,1,0,0,0,0|1,0,1]=4 2350 B14R1.587 Cc1ccccc1C(=O)C[C@@H](C)CO 1458a_100000212026_100000059175 [1,1,0,0,0,0|1,0,1]=4 2351 B14R1.587 O=C(CO)CC(=O)c1ccccc1O 1458a_100000210174_100000188908 [1,1,0,0,0,0|0,0,2]=4 2352 B14R1.918 C#CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000753159 [1,1,0,0,0,0|1,0,1]=4 2353 B14R1.918 C#CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000753159 [1,1,0,0,0,0|1,0,1]=4 2354 B14R1.918 C#CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000753159 [1,1,0,0,0,0|1,0,1]=4 2355 B14R1.918 C#CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000753159 [1,1,0,0,0,0|1,0,1]=4 2356 B14R1.918 C#CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000753159 [1,1,0,0,0,0|1,0,1]=4 2357 B14R1.918 C#CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000753159 [1,1,0,0,0,0|1,0,1]=4 2358 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100102629194 [1,1,0,0,0,0|1,0,1]=4 2359 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)C 1458a_100000229998_100102629194 [1,1,0,0,0,0|1,0,1]=4 2360 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100102629194 [1,1,0,0,0,0|1,0,1]=4 2361 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)F 1458a_100000742286_100102629194 [1,1,0,0,0,0|1,0,1]=4 2362 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)I 1458a_100000212111_100102629194 [1,1,0,0,0,0|1,0,1]=4 2363 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)O 1458a_100000758025_100102629194 [1,1,0,0,0,0|1,0,1]=4 2364 B14R1.918 C=CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000754431 [1,1,0,0,0,0|2,0,0]=4 2365 B14R1.918 C=CCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000754431 [1,1,0,0,0,0|2,0,0]=4 2366 B14R1.918 C=CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000754431 [1,1,0,0,0,0|2,0,0]=4 2367 B14R1.918 C=CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000754431 [1,1,0,0,0,0|2,0,0]=4 2368 B14R1.918 C=CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000754431 [1,1,0,0,0,0|2,0,0]=4 2369 B14R1.918 C=CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000754431 [1,1,0,0,0,0|2,0,0]=4 2370 B14R1.918 C=CCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000754431 [1,1,0,0,0,0|2,0,0]=4 2371 B14R1.918 C=CCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000754431 [1,1,0,0,0,0|2,0,0]=4 2372 B14R1.918 C=CCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000754431 [1,1,0,0,0,0|2,0,0]=4 2373 B14R1.918 C=CCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000754431 [1,1,0,0,0,0|2,0,0]=4 2374 B14R1.918 C=CCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000754431 [1,1,0,0,0,0|2,0,0]=4 2375 B14R1.918 C=CCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000754431 [1,1,0,0,0,0|2,0,0]=4 2376 B14R1.918 C=CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000754431 [1,1,0,0,0,0|2,0,0]=4 2377 B14R1.918 C=CCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000754431 [1,1,0,0,0,0|2,0,0]=4 2378 B14R1.918 C=CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000754431 [1,1,0,0,0,0|2,0,0]=4 2379 B14R1.918 C=CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000754431 [1,1,0,0,0,0|2,0,0]=4 2380 B14R1.918 C=CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000754431 [1,1,0,0,0,0|2,0,0]=4 2381 B14R1.918 C=CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000754431 [1,1,0,0,0,0|2,0,0]=4 2382 B14R1.918 C=CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000754431 [1,1,0,0,0,0|2,0,0]=4 2383 B14R1.918 C=CCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000754431 [1,1,0,0,0,0|2,0,0]=4 2384 B14R1.918 C=CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000754431 [1,1,0,0,0,0|2,0,0]=4 2385 B14R1.918 C=CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000754431 [1,1,0,0,0,0|2,0,0]=4 2386 B14R1.918 C=CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000754431 [1,1,0,0,0,0|2,0,0]=4 2387 B14R1.918 C=CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000754431 [1,1,0,0,0,0|2,0,0]=4 2388 B14R1.918 C=CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000754431 [1,1,0,0,0,0|2,0,0]=4 2389 B14R1.918 C=CCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000754431 [1,1,0,0,0,0|2,0,0]=4 2390 B14R1.918 C=CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000754431 [1,1,0,0,0,0|2,0,0]=4 2391 B14R1.918 C=CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000754431 [1,1,0,0,0,0|2,0,0]=4 2392 B14R1.918 C=CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000754431 [1,1,0,0,0,0|2,0,0]=4 2393 B14R1.918 C=CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000754431 [1,1,0,0,0,0|2,0,0]=4 2394 B14R1.918 C=CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000754431 [1,1,0,0,0,0|1,0,0]=3 2395 B14R1.918 C=CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000754431 [1,1,0,0,0,0|1,0,0]=3 2396 B14R1.918 C=CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000754431 [1,1,0,0,0,0|1,0,0]=3 2397 B14R1.918 C=CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000754431 [1,1,0,0,0,0|1,0,0]=3 2398 B14R1.918 C=CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000754431 [1,1,0,0,0,0|1,0,0]=3 2399 B14R1.918 C=CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000754431 [1,1,0,0,0,0|1,0,0]=3 2400 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Br 1626a_100020586998_100000212140 [1,1,0,0,0,0|2,0,0]=4 2401 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Br 240690a_100020586998_100000212140 [1,1,0,0,0,0|2,0,0]=4 2402 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Br 527a_100020586998_100000212140 [1,1,0,0,0,0|2,0,0]=4 2403 B14R1.918 C=CCNC(=O)c1cc(ccc1O)C 240690a_100020586998_100000229998 [1,1,0,0,0,0|2,0,0]=4 2404 B14R1.918 C=CCNC(=O)c1cc(ccc1O)C 527a_100020586998_100000229998 [1,1,0,0,0,0|2,0,0]=4 2405 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Cl 1626a_100020586998_100000212143 [1,1,0,0,0,0|2,0,0]=4 2406 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Cl 240690a_100020586998_100000212143 [1,1,0,0,0,0|2,0,0]=4 2407 B14R1.918 C=CCNC(=O)c1cc(ccc1O)Cl 527a_100020586998_100000212143 [1,1,0,0,0,0|2,0,0]=4 2408 B14R1.918 C=CCNC(=O)c1cc(ccc1O)F 240690a_100020586998_100000742286 [1,1,0,0,0,0|2,0,0]=4 2409 B14R1.918 C=CCNC(=O)c1cc(ccc1O)F 527a_100020586998_100000742286 [1,1,0,0,0,0|2,0,0]=4 2410 B14R1.918 C=CCNC(=O)c1cc(ccc1O)I 240690a_100020586998_100000212111 [1,1,0,0,0,0|2,0,0]=4 2411 B14R1.918 C=CCNC(=O)c1cc(ccc1O)I 527a_100020586998_100000212111 [1,1,0,0,0,0|2,0,0]=4 2412 B14R1.918 CC=CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000070051 [1,1,0,0,0,0|1,0,1]=4 2413 B14R1.918 CC=CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000070051 [1,1,0,0,0,0|1,0,1]=4 2414 B14R1.918 CC=CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000070051 [1,1,0,0,0,0|1,0,1]=4 2415 B14R1.918 CC=CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000070051 [1,1,0,0,0,0|1,0,1]=4 2416 B14R1.918 CC=CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000070051 [1,1,0,0,0,0|1,0,1]=4 2417 B14R1.918 CC=CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000070051 [1,1,0,0,0,0|1,0,1]=4 2418 B14R1.918 CCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210211 [1,1,0,0,0,0|1,0,1]=4 2419 B14R1.918 CCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210211 [1,1,0,0,0,0|1,0,1]=4 2420 B14R1.918 CCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210211 [1,1,0,0,0,0|1,0,1]=4 2421 B14R1.918 CCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210211 [1,1,0,0,0,0|1,0,1]=4 2422 B14R1.918 CCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210211 [1,1,0,0,0,0|1,0,1]=4 2423 B14R1.918 CCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210211 [1,1,0,0,0,0|1,0,1]=4 2424 B14R1.918 COCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000233755 [1,1,0,0,0,0|2,0,0]=4 2425 B14R1.918 COCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000233755 [1,1,0,0,0,0|2,0,0]=4 2426 B14R1.918 COCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000233755 [1,1,0,0,0,0|2,0,0]=4 2427 B14R1.918 COCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000233755 [1,1,0,0,0,0|2,0,0]=4 2428 B14R1.918 COCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000233755 [1,1,0,0,0,0|2,0,0]=4 2429 B14R1.918 COCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000233755 [1,1,0,0,0,0|2,0,0]=4 2430 B14R1.918 CSCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000751147 [1,1,0,0,0,0|2,0,0]=4 2431 B14R1.918 CSCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000751147 [1,1,0,0,0,0|2,0,0]=4 2432 B14R1.918 CSCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000751147 [1,1,0,0,0,0|2,0,0]=4 2433 B14R1.918 CSCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000751147 [1,1,0,0,0,0|2,0,0]=4 2434 B14R1.918 CSCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000751147 [1,1,0,0,0,0|2,0,0]=4 2435 B14R1.918 CSCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000751147 [1,1,0,0,0,0|2,0,0]=4 2436 B14R1.918 Cc1ccc(c(c1)C(=O)CCC#N)O 1458a_100000229998_100011215226 [1,1,0,0,0,0|1,0,1]=4 2437 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)O 1458a_100000229998_100011934791 [1,1,0,0,0,0|1,0,1]=4 2438 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)Br 1458a_100000689033_100011215043 [1,1,0,0,0,0|1,0,1]=4 2439 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)C 1458a_100000195421_100011215043 [1,1,0,0,0,0|1,0,1]=4 2440 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)Cl 1458a_100011290873_100011215043 [1,1,0,0,0,0|1,0,1]=4 2441 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)F 1458a_100000749327_100011215043 [1,1,0,0,0,0|1,0,1]=4 2442 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)I 1458a_100000057929_100011215043 [1,1,0,0,0,0|1,0,1]=4 2443 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)O 1458a_100000229998_100011215043 [1,1,0,0,0,0|0,0,1]=3 2444 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)O 240690a_100000210304_100000229998 [1,1,0,0,0,0|1,0,1]=4 2445 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)O 527a_100000210304_100000229998 [1,1,0,0,0,0|1,0,1]=4 2446 B14R1.918 Cc1ccc(cc1C(=O)CCCO)Br 1458a_100000759961_100011215043 [1,1,0,0,0,0|1,0,1]=4 2447 B14R1.918 Cc1ccc(cc1C(=O)CCCO)Cl 1458a_100000692595_100011215043 [1,1,0,0,0,0|1,0,1]=4 2448 B14R1.918 Cc1ccc(cc1C(=O)CCCO)F 1458a_100000240043_100011215043 [1,1,0,0,0,0|1,0,1]=4 2449 B14R1.918 Cc1ccc(cc1C(=O)CCCO)I 1458a_100000688012_100011215043 [1,1,0,0,0,0|1,0,1]=4 2450 B14R1.918 Cc1ccc(cc1C(=O)CCCO)O 1458a_100000687834_100011215043 [1,1,0,0,0,0|1,0,1]=4 2451 B14R1.918 N#CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215226 [1,1,0,0,0,0|1,0,1]=4 2452 B14R1.918 N#CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215226 [1,1,0,0,0,0|1,0,1]=4 2453 B14R1.918 N#CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215226 [1,1,0,0,0,0|1,0,1]=4 2454 B14R1.918 N#CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215226 [1,1,0,0,0,0|1,0,1]=4 2455 B14R1.918 N#CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215226 [1,1,0,0,0,0|1,0,1]=4 2456 B14R1.918 O=C(CCCF)c1cc(ccc1O)Br 1458a_100000212140_100011934791 [1,1,0,0,0,0|1,0,1]=4 2457 B14R1.918 O=C(CCCF)c1cc(ccc1O)Cl 1458a_100000212143_100011934791 [1,1,0,0,0,0|1,0,1]=4 2458 B14R1.918 O=C(CCCF)c1cc(ccc1O)F 1458a_100000742286_100011934791 [1,1,0,0,0,0|1,0,1]=4 2459 B14R1.918 O=C(CCCF)c1cc(ccc1O)I 1458a_100000212111_100011934791 [1,1,0,0,0,0|1,0,1]=4 2460 B14R1.918 O=C(CCCF)c1cc(ccc1O)O 1458a_100000758025_100011934791 [1,1,0,0,0,0|1,0,1]=4 2461 B14R1.918 O=C(CCCO)c1cc(ccc1Br)Br 1458a_100000690610_100011215043 [1,1,0,0,0,0|1,0,1]=4 2462 B14R1.918 O=C(CCCO)c1cc(ccc1Br)Cl 1458a_100000736951_100011215043 [1,1,0,0,0,0|1,0,1]=4 2463 B14R1.918 O=C(CCCO)c1cc(ccc1Br)F 1458a_100000212315_100011215043 [1,1,0,0,0,0|1,0,1]=4 2464 B14R1.918 O=C(CCCO)c1cc(ccc1Br)I 1458a_100000698340_100011215043 [1,1,0,0,0,0|1,0,1]=4 2465 B14R1.918 O=C(CCCO)c1cc(ccc1Br)O 1458a_100012352043_100011215043 [1,1,0,0,0,0|1,0,1]=4 2466 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)Br 1458a_100000211212_100011215043 [1,1,0,0,0,0|1,0,1]=4 2467 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100011215043 [1,1,0,0,0,0|1,0,1]=4 2468 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)F 1458a_100011219680_100011215043 [1,1,0,0,0,0|1,0,1]=4 2469 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)I 1458a_100000688013_100011215043 [1,1,0,0,0,0|1,0,1]=4 2470 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)O 1458a_100000719527_100011215043 [1,1,0,0,0,0|1,0,1]=4 2471 B14R1.918 O=C(CCCO)c1cc(ccc1F)Br 1458a_100000212322_100011215043 [1,1,0,0,0,0|1,0,1]=4 2472 B14R1.918 O=C(CCCO)c1cc(ccc1F)Cl 1458a_100000214954_100011215043 [1,1,0,0,0,0|1,0,1]=4 2473 B14R1.918 O=C(CCCO)c1cc(ccc1F)F 1458a_100000198512_100011215043 [1,1,0,0,0,0|1,0,1]=4 2474 B14R1.918 O=C(CCCO)c1cc(ccc1F)I 1458a_100000688014_100011215043 [1,1,0,0,0,0|1,0,1]=4 2475 B14R1.918 O=C(CCCO)c1cc(ccc1F)O 1458a_100000037260_100011215043 [1,1,0,0,0,0|1,0,1]=4 2476 B14R1.918 O=C(CCCO)c1cc(ccc1I)Br 1458a_100000183945_100011215043 [1,1,0,0,0,0|1,0,1]=4 2477 B14R1.918 O=C(CCCO)c1cc(ccc1I)Cl 1458a_100000739379_100011215043 [1,1,0,0,0,0|1,0,1]=4 2478 B14R1.918 O=C(CCCO)c1cc(ccc1I)F 1458a_100000748905_100011215043 [1,1,0,0,0,0|1,0,1]=4 2479 B14R1.918 O=C(CCCO)c1cc(ccc1I)I 1458a_100000750460_100011215043 [1,1,0,0,0,0|1,0,1]=4 2480 B14R1.918 O=C(CCCO)c1cc(ccc1I)O 1458a_200009995701_100011215043 [1,1,0,0,0,0|1,0,1]=4 2481 B14R1.918 O=C(CCCO)c1cc(ccc1O)Br 1458a_100000212140_100011215043 [1,1,0,0,0,0|0,0,1]=3 2482 B14R1.918 O=C(CCCO)c1cc(ccc1O)Cl 1458a_100000212143_100011215043 [1,1,0,0,0,0|0,0,1]=3 2483 B14R1.918 O=C(CCCO)c1cc(ccc1O)F 1458a_100000742286_100011215043 [1,1,0,0,0,0|0,0,1]=3 2484 B14R1.918 O=C(CCCO)c1cc(ccc1O)I 1458a_100000212111_100011215043 [1,1,0,0,0,0|0,0,1]=3 2485 B14R1.918 O=C(CCCO)c1cc(ccc1O)O 1458a_100000758025_100011215043 [1,1,0,0,0,0|0,0,1]=3 2486 B14R1.918 O=C(NCCO)c1cc(ccc1O)Br 240690a_100000210304_100000212140 [1,1,0,0,0,0|1,0,1]=4 2487 B14R1.918 O=C(NCCO)c1cc(ccc1O)Br 527a_100000210304_100000212140 [1,1,0,0,0,0|1,0,1]=4 2488 B14R1.918 O=C(NCCO)c1cc(ccc1O)Cl 240690a_100000210304_100000212143 [1,1,0,0,0,0|1,0,1]=4 2489 B14R1.918 O=C(NCCO)c1cc(ccc1O)Cl 527a_100000210304_100000212143 [1,1,0,0,0,0|1,0,1]=4 2490 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 240690a_100000210304_100000742286 [1,1,0,0,0,0|1,0,1]=4 2491 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 271570a_203496583355_200000206141 [1,1,0,0,0,0|1,0,1]=4 2492 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 527a_100000210304_100000742286 [1,1,0,0,0,0|1,0,1]=4 2493 B14R1.918 O=C(NCCO)c1cc(ccc1O)I 240690a_100000210304_100000212111 [1,1,0,0,0,0|1,0,1]=4 2494 B14R1.918 O=C(NCCO)c1cc(ccc1O)I 527a_100000210304_100000212111 [1,1,0,0,0,0|1,0,1]=4 2495 B14R1.939 C#CCCC(=O)c1ccccc1CO 1458a_100011301526_100000753159 [1,1,0,0,0,0|1,0,1]=4 2496 B14R1.939 C#CCCC(=O)c1ccccc1OC 1458a_100000185835_100000753159 [1,1,0,0,0,0|1,0,1]=4 2497 B14R1.939 C#Cc1ccccc1C(=O)CCC=C 1458a_100011243808_100000754431 [1,1,0,0,0,0|2,0,0]=4 2498 B14R1.939 C#Cc1ccccc1C(=O)CCCO 1458a_100011243808_100011215043 [1,1,0,0,0,0|1,0,1]=4 2499 B14R1.939 C/C=C/CC(=O)c1ccccc1CO 1458a_100011301526_100102629194 [1,1,0,0,0,0|1,0,1]=4 2500 B14R1.939 C/C=C/CC(=O)c1ccccc1OC 1458a_100000185835_100102629194 [1,1,0,0,0,0|1,0,1]=4 2501 B14R1.939 C=CCCC(=O)c1ccccc1C#N 1458a_100000742908_100000754431 [1,1,0,0,0,0|2,0,0]=4 2502 B14R1.939 C=CCCC(=O)c1ccccc1C=C 1458a_100011830265_100000754431 [1,1,0,0,0,0|2,0,0]=4 2503 B14R1.939 C=CCCC(=O)c1ccccc1CC 1458a_100000689120_100000754431 [1,1,0,0,0,0|2,0,0]=4 2504 B14R1.939 C=CCCC(=O)c1ccccc1CO 1458a_100011301526_100000754431 [1,1,0,0,0,0|1,0,0]=3 2505 B14R1.939 C=CCCC(=O)c1ccccc1I=O 1458a_100000032414_100000754431 [1,1,0,0,0,0|1,0,1]=4 2506 B14R1.939 C=CCCC(=O)c1ccccc1OC 1458a_100000185835_100000754431 [1,1,0,0,0,0|1,0,0]=3 2507 B14R1.939 C=CCCC(=O)c1ccccc1SC 1458a_100000183967_100000754431 [1,1,0,0,0,0|1,1,0]=4 2508 B14R1.939 C=CCNC(=O)c1ccccc1OC 1626a_100020586998_100000185835 [1,1,0,0,0,0|2,0,0]=4 2509 B14R1.939 C=CCNC(=O)c1ccccc1OC 240690a_100020586998_100000185835 [1,1,0,0,0,0|2,0,0]=4 2510 B14R1.939 C=CCNC(=O)c1ccccc1OC 527a_100020586998_100000185835 [1,1,0,0,0,0|2,0,0]=4 2511 B14R1.939 C=Cc1ccccc1C(=O)CCCO 1458a_100011830265_100011215043 [1,1,0,0,0,0|1,0,1]=4 2512 B14R1.939 CC=CCC(=O)c1ccccc1CO 1458a_100011301526_100000070051 [1,1,0,0,0,0|1,0,1]=4 2513 B14R1.939 CC=CCC(=O)c1ccccc1OC 1458a_100000185835_100000070051 [1,1,0,0,0,0|1,0,1]=4 2514 B14R1.939 CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000210211 [1,1,0,0,0,0|1,0,1]=4 2515 B14R1.939 CCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210211 [1,1,0,0,0,0|1,0,1]=4 2516 B14R1.939 CCc1ccccc1C(=O)CCCO 1458a_100000689120_100011215043 [1,1,0,0,0,0|1,0,1]=4 2517 B14R1.939 COCCC(=O)c1ccccc1CO 1458a_100011301526_100000233755 [1,1,0,0,0,0|2,0,0]=4 2518 B14R1.939 COCCC(=O)c1ccccc1OC 1458a_100000185835_100000233755 [1,1,0,0,0,0|2,0,0]=4 2519 B14R1.939 COc1ccccc1C(=O)CCC#N 1458a_100000185835_100011215226 [1,1,0,0,0,0|1,0,1]=4 2520 B14R1.939 COc1ccccc1C(=O)CCCF 1458a_100000185835_100011934791 [1,1,0,0,0,0|1,0,1]=4 2521 B14R1.939 COc1ccccc1C(=O)CCCO 1458a_100000185835_100011215043 [1,1,0,0,0,0|0,0,1]=3 2522 B14R1.939 COc1ccccc1C(=O)CCSC 1458a_100000185835_100000751147 [1,1,0,0,0,0|2,0,0]=4 2523 B14R1.939 COc1ccccc1C(=O)NCCO 240690a_100000210304_100000185835 [1,1,0,0,0,0|1,0,1]=4 2524 B14R1.939 COc1ccccc1C(=O)NCCO 527a_100000210304_100000185835 [1,1,0,0,0,0|1,0,1]=4 2525 B14R1.939 COc1ccccc1C(=O)OCCO 7a_100000229999_200000210301 [1,1,0,0,0,0|1,0,1]=4 2526 B14R1.939 CSCCC(=O)c1ccccc1CO 1458a_100011301526_100000751147 [1,1,0,0,0,0|2,0,0]=4 2527 B14R1.939 CSc1ccccc1C(=O)CCCO 1458a_100000183967_100011215043 [1,1,0,0,0,0|0,1,1]=4 2528 B14R1.939 N#CCCC(=O)c1ccccc1CO 1458a_100011301526_100011215226 [1,1,0,0,0,0|1,0,1]=4 2529 B14R1.939 N#Cc1ccccc1C(=O)CCCO 1458a_100000742908_100011215043 [1,1,0,0,0,0|1,0,1]=4 2530 B14R1.939 O=C(CCCF)c1ccccc1CO 1458a_100011301526_100011934791 [1,1,0,0,0,0|1,0,1]=4 2531 B14R1.939 O=C(CCCO)c1ccccc1CO 1458a_100011301526_100011215043 [1,1,0,0,0,0|0,0,1]=3 2532 B14R1.939 O=Ic1ccccc1C(=O)CCCO 1458a_100000032414_100011215043 [1,1,0,0,0,0|0,0,2]=4 2533 B14R1.939 [13CH3]Oc1ccccc1C(=O)OCCO 7a_100000229999_200025704644 [1,1,0,0,0,0|1,0,1]=4 2534 B14R1.1035 C#CCCCC(=O)c1ccccc1O 1458a_100015234032_100000731252 [1,1,0,0,0,0|1,0,1]=4 2535 B14R1.1035 C#CCCNC(=O)c1ccccc1O 240690a_100000755551_100015234032 [1,1,0,0,0,0|1,0,1]=4 2536 B14R1.1035 C#CCSCC(=O)c1ccccc1O 62a_100000038162_100000188908 [1,1,0,0,0,0|1,0,1]=4 2537 B14R1.1035 C=CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000757094 [1,1,0,0,0,0|2,0,0]=4 2538 B14R1.1035 C=CCCCC(=O)c1ccccc1C 1458a_100000212026_100000757094 [1,1,0,0,0,0|2,0,0]=4 2539 B14R1.1035 C=CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000757094 [1,1,0,0,0,0|2,0,0]=4 2540 B14R1.1035 C=CCCCC(=O)c1ccccc1F 1458a_100000188656_100000757094 [1,1,0,0,0,0|2,0,0]=4 2541 B14R1.1035 C=CCCCC(=O)c1ccccc1I 1458a_100000187884_100000757094 [1,1,0,0,0,0|2,0,0]=4 2542 B14R1.1035 C=CCCCC(=O)c1ccccc1O 1458a_100015234032_100000757094 [1,1,0,0,0,0|1,0,0]=3 2543 B14R1.1035 C=CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000757094 [1,1,0,0,0,0|1,0,1]=4 2544 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 11a_100015191253_100000188424 [1,1,0,0,0,0|2,0,0]=4 2545 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 1626a_100015191253_100000188424 [1,1,0,0,0,0|2,0,0]=4 2546 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 240690a_100015191253_100000188424 [1,1,0,0,0,0|2,0,0]=4 2547 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 527a_100015191253_100000188424 [1,1,0,0,0,0|2,0,0]=4 2548 B14R1.1035 C=CCCNC(=O)c1ccccc1C 11a_100015191253_100000212026 [1,1,0,0,0,0|2,0,0]=4 2549 B14R1.1035 C=CCCNC(=O)c1ccccc1C 1626a_100015191253_100000212026 [1,1,0,0,0,0|2,0,0]=4 2550 B14R1.1035 C=CCCNC(=O)c1ccccc1C 240690a_100015191253_100000212026 [1,1,0,0,0,0|2,0,0]=4 2551 B14R1.1035 C=CCCNC(=O)c1ccccc1C 527a_100015191253_100000212026 [1,1,0,0,0,0|2,0,0]=4 2552 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 11a_100015191253_100000185844 [1,1,0,0,0,0|2,0,0]=4 2553 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 1626a_100015191253_100000185844 [1,1,0,0,0,0|2,0,0]=4 2554 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 240690a_100015191253_100000185844 [1,1,0,0,0,0|2,0,0]=4 2555 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 527a_100015191253_100000185844 [1,1,0,0,0,0|2,0,0]=4 2556 B14R1.1035 C=CCCNC(=O)c1ccccc1F 11a_100015191253_100000188656 [1,1,0,0,0,0|2,0,0]=4 2557 B14R1.1035 C=CCCNC(=O)c1ccccc1F 1626a_100015191253_100000188656 [1,1,0,0,0,0|2,0,0]=4 2558 B14R1.1035 C=CCCNC(=O)c1ccccc1F 240690a_100015191253_100000188656 [1,1,0,0,0,0|2,0,0]=4 2559 B14R1.1035 C=CCCNC(=O)c1ccccc1F 527a_100015191253_100000188656 [1,1,0,0,0,0|2,0,0]=4 2560 B14R1.1035 C=CCCNC(=O)c1ccccc1I 11a_100015191253_100000187884 [1,1,0,0,0,0|2,0,0]=4 2561 B14R1.1035 C=CCCNC(=O)c1ccccc1I 1626a_100015191253_100000187884 [1,1,0,0,0,0|2,0,0]=4 2562 B14R1.1035 C=CCCNC(=O)c1ccccc1I 240690a_100015191253_100000187884 [1,1,0,0,0,0|2,0,0]=4 2563 B14R1.1035 C=CCCNC(=O)c1ccccc1I 527a_100015191253_100000187884 [1,1,0,0,0,0|2,0,0]=4 2564 B14R1.1035 C=CCCNC(=O)c1ccccc1O 240690a_100015191253_100015234032 [1,1,0,0,0,0|1,0,0]=3 2565 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 1626a_100015191253_100009911694 [1,1,0,0,0,0|1,0,1]=4 2566 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 240690a_100015191253_100009911694 [1,1,0,0,0,0|1,0,1]=4 2567 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 527a_100015191253_100009911694 [1,1,0,0,0,0|1,0,1]=4 2568 B14R1.1035 C=CCNCC(=O)c1ccccc1C 2230a_100020586998_100000741374 [1,1,0,0,0,0|2,0,0]=4 2569 B14R1.1035 C=CCNNC(=O)c1ccccc1O 22a_100020588587_100015234032 [1,1,0,0,0,0|2,0,0]=4 2570 B14R1.1035 C=CCOCC(=O)c1ccccc1Br 34a_200000210373_100000199116 [1,1,0,0,0,0|2,0,0]=4 2571 B14R1.1035 C=CCOCC(=O)c1ccccc1C 34a_200000210373_100000741374 [1,1,0,0,0,0|2,0,0]=4 2572 B14R1.1035 C=CCOCC(=O)c1ccccc1Cl 34a_200000210373_100000211432 [1,1,0,0,0,0|2,0,0]=4 2573 B14R1.1035 C=CCOCC(=O)c1ccccc1F 34a_200000210373_100000204681 [1,1,0,0,0,0|2,0,0]=4 2574 B14R1.1035 C=CCSCC(=O)c1ccccc1Br 62a_100000199116_100000210623 [1,1,0,0,0,0|2,0,0]=4 2575 B14R1.1035 C=CCSCC(=O)c1ccccc1C 62a_100000210623_100000741374 [1,1,0,0,0,0|2,0,0]=4 2576 B14R1.1035 C=CCSCC(=O)c1ccccc1C 62a_100000741374_100000210623 [1,1,0,0,0,0|2,0,0]=4 2577 B14R1.1035 C=CCSCC(=O)c1ccccc1Cl 62a_100000210623_100000211432 [1,1,0,0,0,0|2,0,0]=4 2578 B14R1.1035 C=CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210623 [1,1,0,0,0,0|2,0,0]=4 2579 B14R1.1035 C=CCSCC(=O)c1ccccc1F 62a_100000204681_100000210623 [1,1,0,0,0,0|2,0,0]=4 2580 B14R1.1035 C=CCSCC(=O)c1ccccc1F 62a_100000210623_100000204681 [1,1,0,0,0,0|2,0,0]=4 2581 B14R1.1035 C=CCSCC(=O)c1ccccc1O 62a_100000188908_100000210623 [1,1,0,0,0,0|1,0,0]=3 2582 B14R1.1035 C=CCSCC(=O)c1ccccc1O 62a_100000210623_100000188908 [1,1,0,0,0,0|1,0,0]=3 2583 B14R1.1035 C=COCCC(=O)c1ccccc1Br 1458a_100000188424_100000039644 [1,1,0,0,0,0|2,0,0]=4 2584 B14R1.1035 C=COCCC(=O)c1ccccc1C 1458a_100000212026_100000039644 [1,1,0,0,0,0|2,0,0]=4 2585 B14R1.1035 C=COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000039644 [1,1,0,0,0,0|2,0,0]=4 2586 B14R1.1035 C=COCCC(=O)c1ccccc1F 1458a_100000188656_100000039644 [1,1,0,0,0,0|2,0,0]=4 2587 B14R1.1035 C=COCCC(=O)c1ccccc1I 1458a_100000187884_100000039644 [1,1,0,0,0,0|2,0,0]=4 2588 B14R1.1035 C=COCCC(=O)c1ccccc1O 1458a_100015234032_100000039644 [1,1,0,0,0,0|1,0,0]=3 2589 B14R1.1035 C=COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000039644 [1,1,0,0,0,0|1,0,1]=4 2590 B14R1.1035 CC/C=C\CC(=O)c1ccccc1O 1458a_100015234032_100103147603 [1,1,0,0,0,0|1,0,1]=4 2591 B14R1.1035 CCCCCC(=O)c1ccccc1O 1458a_100015234032_100000210326 [1,1,0,0,0,0|1,0,1]=4 2592 B14R1.1035 CCCCNC(=O)c1ccccc1O 240690a_100000102301_100015234032 [1,1,0,0,0,0|1,0,1]=4 2593 B14R1.1035 CCCCNC(=O)c1ccccc1O 271570a_203496583355_200000154865 [1,1,0,0,0,0|1,0,1]=4 2594 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000188908_100000210303 [1,1,0,0,0,0|1,0,1]=4 2595 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000210303_100000188908 [1,1,0,0,0,0|1,0,1]=4 2596 B14R1.1035 CCOCCC(=O)c1ccccc1O 1458a_100015234032_100011215890 [1,1,0,0,0,0|1,0,1]=4 2597 B14R1.1035 CCSCCC(=O)c1ccccc1O 1458a_100015234032_100000757381 [1,1,0,0,0,0|1,0,1]=4 2598 B14R1.1035 CCSCCC(=O)c1ccccc1O 62a_100000210202_100009873196 [1,1,0,0,0,0|1,0,1]=4 2599 B14R1.1035 CN(CCCC=O)c1ccccc1O 269982a_100000033821_200011292268 [1,1,0,0,0,0|2,0,0]=4 2600 B14R1.1035 COCCCC(=O)c1ccccc1Br 1458a_100000188424_100000740836 [1,1,0,0,0,0|1,0,1]=4 2601 B14R1.1035 COCCCC(=O)c1ccccc1C 1458a_100000212026_100000740836 [1,1,0,0,0,0|1,0,1]=4 2602 B14R1.1035 COCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000740836 [1,1,0,0,0,0|1,0,1]=4 2603 B14R1.1035 COCCCC(=O)c1ccccc1F 1458a_100000188656_100000740836 [1,1,0,0,0,0|1,0,1]=4 2604 B14R1.1035 COCCCC(=O)c1ccccc1I 1458a_100000187884_100000740836 [1,1,0,0,0,0|1,0,1]=4 2605 B14R1.1035 COCCCC(=O)c1ccccc1O 1458a_100015234032_100000740836 [1,1,0,0,0,0|0,0,1]=3 2606 B14R1.1035 COCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000740836 [1,1,0,0,0,0|0,0,2]=4 2607 B14R1.1035 COCCNC(=O)c1ccccc1O 240690a_100000209980_100015234032 [1,1,0,0,0,0|1,0,1]=4 2608 B14R1.1035 COCSCC(=O)c1ccccc1O 62a_100000188908_100000766300 [1,1,0,0,0,0|1,0,1]=4 2609 B14R1.1035 COCSCC(=O)c1ccccc1O 62a_100000766300_100000188908 [1,1,0,0,0,0|1,0,1]=4 2610 B14R1.1035 CSCCNC(=O)c1ccccc1O 240690a_100020590264_100015234032 [1,1,0,0,0,0|2,0,0]=4 2611 B14R1.1035 CSCSCC(=O)c1ccccc1O 62a_100000188908_100011218213 [1,1,0,0,0,0|2,0,0]=4 2612 B14R1.1035 CSCSCC(=O)c1ccccc1O 62a_100011218213_100000188908 [1,1,0,0,0,0|2,0,0]=4 2613 B14R1.1035 Cc1ccccc1C(=O)CCCCO 1458a_100000212026_100000210776 [1,1,0,0,0,0|1,0,1]=4 2614 B14R1.1035 Cc1ccccc1C(=O)CNCCO 2230a_100016997473_100000741374 [1,1,0,0,0,0|1,0,1]=4 2615 B14R1.1035 Cc1ccccc1C(=O)CNCCO 34a_100016990907_100000741374 [1,1,0,0,0,0|1,0,1]=4 2616 B14R1.1035 Cc1ccccc1C(=O)CSCC=O 62a_100000741374_200015260668 [1,1,0,0,0,0|1,0,0]=3 2617 B14R1.1035 Cc1ccccc1C(=O)CSCC=O 62a_200015260668_100000741374 [1,1,0,0,0,0|1,0,0]=3 2618 B14R1.1035 Cc1ccccc1C(=O)CSCCO 62a_100000211926_100000741374 [1,1,0,0,0,0|1,0,1]=4 2619 B14R1.1035 Cc1ccccc1C(=O)CSCCO 62a_100000741374_100000211926 [1,1,0,0,0,0|1,0,1]=4 2620 B14R1.1035 Cc1ccccc1C(=O)NCCCO 240690a_100000182051_100000212026 [1,1,0,0,0,0|1,0,1]=4 2621 B14R1.1035 Cc1ccccc1C(=O)NCCCO 527a_100000182051_100000212026 [1,1,0,0,0,0|1,0,1]=4 2622 B14R1.1035 N#CCCCC(=O)c1ccccc1O 1458a_100015234032_100000211468 [1,1,0,0,0,0|1,0,1]=4 2623 B14R1.1035 N#CCCNC(=O)c1ccccc1O 240690a_100000720768_100015234032 [1,1,0,0,0,0|1,0,1]=4 2624 B14R1.1035 N#CCSCC(=O)c1ccccc1O 62a_100000188908_100011215382 [1,1,0,0,0,0|1,0,1]=4 2625 B14R1.1035 N#CCSCC(=O)c1ccccc1O 62a_100011215382_100000188908 [1,1,0,0,0,0|1,0,1]=4 2626 B14R1.1035 O=C(CC#CCO)c1ccccc1O 1458a_100015234032_200000047223 [1,1,0,0,0,0|0,0,2]=4 2627 B14R1.1035 O=C(CCCCF)c1ccccc1O 1458a_100015234032_100000729493 [1,1,0,0,0,0|1,0,1]=4 2628 B14R1.1035 O=C(CCCCO)c1ccccc1Br 1458a_100000188424_100000210776 [1,1,0,0,0,0|1,0,1]=4 2629 B14R1.1035 O=C(CCCCO)c1ccccc1Cl 1458a_100000185844_100000210776 [1,1,0,0,0,0|1,0,1]=4 2630 B14R1.1035 O=C(CCCCO)c1ccccc1F 1458a_100000188656_100000210776 [1,1,0,0,0,0|1,0,1]=4 2631 B14R1.1035 O=C(CCCCO)c1ccccc1I 1458a_100000187884_100000210776 [1,1,0,0,0,0|1,0,1]=4 2632 B14R1.1035 O=C(CCCCO)c1ccccc1O 1458a_100015234032_100000210776 [1,1,0,0,0,0|0,0,1]=3 2633 B14R1.1035 O=C(CCCCO)c1ccccc1[O-] 1458a_100009911694_100000210776 [1,1,0,0,0,0|0,0,2]=4 2634 B14R1.1035 O=C(CCSCF)c1ccccc1O 62a_100015361967_100009873196 [1,1,0,0,0,0|1,0,1]=4 2635 B14R1.1035 O=C(CNCCO)c1ccccc1Br 34a_100016990907_100000199116 [1,1,0,0,0,0|1,0,1]=4 2636 B14R1.1035 O=C(CNCCO)c1ccccc1Cl 34a_100016990907_100000211432 [1,1,0,0,0,0|1,0,1]=4 2637 B14R1.1035 O=C(CNCCO)c1ccccc1F 34a_100016990907_100000204681 [1,1,0,0,0,0|1,0,1]=4 2638 B14R1.1035 O=C(CSCCF)c1ccccc1O 62a_100000188908_100011217306 [1,1,0,0,0,0|1,0,1]=4 2639 B14R1.1035 O=C(CSCCF)c1ccccc1O 62a_100011217306_100000188908 [1,1,0,0,0,0|1,0,1]=4 2640 B14R1.1035 O=C(CSCCO)c1ccccc1Br 62a_100000199116_100000211926 [1,1,0,0,0,0|1,0,1]=4 2641 B14R1.1035 O=C(CSCCO)c1ccccc1Cl 62a_100000211432_100000211926 [1,1,0,0,0,0|1,0,1]=4 2642 B14R1.1035 O=C(CSCCO)c1ccccc1Cl 62a_100000211926_100000211432 [1,1,0,0,0,0|1,0,1]=4 2643 B14R1.1035 O=C(CSCCO)c1ccccc1F 62a_100000204681_100000211926 [1,1,0,0,0,0|1,0,1]=4 2644 B14R1.1035 O=C(CSCCO)c1ccccc1F 62a_100000211926_100000204681 [1,1,0,0,0,0|1,0,1]=4 2645 B14R1.1035 O=C(CSCCO)c1ccccc1O 62a_100000188908_100000211926 [1,1,0,0,0,0|0,0,1]=3 2646 B14R1.1035 O=C(CSCCO)c1ccccc1O 62a_100000211926_100000188908 [1,1,0,0,0,0|0,0,1]=3 2647 B14R1.1035 O=C(NCCCF)c1ccccc1O 240690a_100015189416_100015234032 [1,1,0,0,0,0|1,0,1]=4 2648 B14R1.1035 O=C(NCCCO)c1ccccc1Br 240690a_100000182051_100000188424 [1,1,0,0,0,0|1,0,1]=4 2649 B14R1.1035 O=C(NCCCO)c1ccccc1Br 527a_100000182051_100000188424 [1,1,0,0,0,0|1,0,1]=4 2650 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 240690a_100000182051_100000185844 [1,1,0,0,0,0|1,0,1]=4 2651 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 527a_100000182051_100000185844 [1,1,0,0,0,0|1,0,1]=4 2652 B14R1.1035 O=C(NCCCO)c1ccccc1F 240690a_100000182051_100000188656 [1,1,0,0,0,0|1,0,1]=4 2653 B14R1.1035 O=C(NCCCO)c1ccccc1F 527a_100000182051_100000188656 [1,1,0,0,0,0|1,0,1]=4 2654 B14R1.1035 O=C(NCCCO)c1ccccc1I 240690a_100000182051_100000187884 [1,1,0,0,0,0|1,0,1]=4 2655 B14R1.1035 O=C(NCCCO)c1ccccc1I 527a_100000182051_100000187884 [1,1,0,0,0,0|1,0,1]=4 2656 B14R1.1035 O=C(NCCCO)c1ccccc1O 240690a_100000182051_100015234032 [1,1,0,0,0,0|0,0,1]=3 2657 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 240690a_100000182051_100009911694 [1,1,0,0,0,0|0,0,2]=4 2658 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 527a_100000182051_100009911694 [1,1,0,0,0,0|0,0,2]=4 2659 B14R1.1035 O=C(NNCCO)c1ccccc1O 22a_100000210001_100015234032 [1,1,0,0,0,0|1,0,1]=4 2660 B14R1.1035 O=CCSCC(=O)c1ccccc1Br 62a_100000199116_200015260668 [1,1,0,0,0,0|1,0,0]=3 2661 B14R1.1035 O=CCSCC(=O)c1ccccc1Cl 62a_100000211432_200015260668 [1,1,0,0,0,0|1,0,0]=3 2662 B14R1.1035 O=CCSCC(=O)c1ccccc1Cl 62a_200015260668_100000211432 [1,1,0,0,0,0|1,0,0]=3 2663 B14R1.1035 O=CCSCC(=O)c1ccccc1F 62a_100000204681_200015260668 [1,1,0,0,0,0|1,0,0]=3 2664 B14R1.1035 O=CCSCC(=O)c1ccccc1F 62a_200015260668_100000204681 [1,1,0,0,0,0|1,0,0]=3 2665 B14R1.1035 O=CCSCC(=O)c1ccccc1O 62a_100000188908_200015260668 [1,1,0,0,0,0|0,0,0]=2 2666 B14R1.1035 O=CCSCC(=O)c1ccccc1O 62a_200015260668_100000188908 [1,1,0,0,0,0|0,0,0]=2 2667 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000753159 [1,1,0,0,0,0|1,0,1]=4 2668 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000753159 [1,1,0,0,0,0|1,0,1]=4 2669 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000753159 [1,1,0,0,0,0|1,0,1]=4 2670 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000753159 [1,1,0,0,0,0|1,0,1]=4 2671 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000753159 [1,1,0,0,0,0|1,0,1]=4 2672 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000753159 [1,1,0,0,0,0|1,0,1]=4 2673 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100102629194 [1,1,0,0,0,0|1,0,1]=4 2674 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)C 1458a_100000212137_100102629194 [1,1,0,0,0,0|1,0,1]=4 2675 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100102629194 [1,1,0,0,0,0|1,0,1]=4 2676 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)F 1458a_100000746061_100102629194 [1,1,0,0,0,0|1,0,1]=4 2677 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)I 1458a_100000091984_100102629194 [1,1,0,0,0,0|1,0,1]=4 2678 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)O 1458a_100000212172_100102629194 [1,1,0,0,0,0|1,0,1]=4 2679 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000754431 [1,1,0,0,0,0|2,0,0]=4 2680 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000754431 [1,1,0,0,0,0|2,0,0]=4 2681 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000754431 [1,1,0,0,0,0|2,0,0]=4 2682 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000754431 [1,1,0,0,0,0|2,0,0]=4 2683 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000754431 [1,1,0,0,0,0|2,0,0]=4 2684 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000754431 [1,1,0,0,0,0|2,0,0]=4 2685 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000754431 [1,1,0,0,0,0|2,0,0]=4 2686 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000754431 [1,1,0,0,0,0|2,0,0]=4 2687 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000754431 [1,1,0,0,0,0|2,0,0]=4 2688 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000754431 [1,1,0,0,0,0|2,0,0]=4 2689 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000754431 [1,1,0,0,0,0|2,0,0]=4 2690 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000754431 [1,1,0,0,0,0|2,0,0]=4 2691 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000754431 [1,1,0,0,0,0|2,0,0]=4 2692 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000754431 [1,1,0,0,0,0|2,0,0]=4 2693 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000754431 [1,1,0,0,0,0|2,0,0]=4 2694 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000754431 [1,1,0,0,0,0|2,0,0]=4 2695 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000754431 [1,1,0,0,0,0|2,0,0]=4 2696 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000754431 [1,1,0,0,0,0|2,0,0]=4 2697 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000754431 [1,1,0,0,0,0|2,0,0]=4 2698 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000754431 [1,1,0,0,0,0|2,0,0]=4 2699 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000754431 [1,1,0,0,0,0|2,0,0]=4 2700 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000754431 [1,1,0,0,0,0|2,0,0]=4 2701 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000754431 [1,1,0,0,0,0|2,0,0]=4 2702 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000754431 [1,1,0,0,0,0|2,0,0]=4 2703 B14R1.2523 C=CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000754431 [1,1,0,0,0,0|2,0,0]=4 2704 B14R1.2523 C=CCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000754431 [1,1,0,0,0,0|2,0,0]=4 2705 B14R1.2523 C=CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000754431 [1,1,0,0,0,0|2,0,0]=4 2706 B14R1.2523 C=CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000754431 [1,1,0,0,0,0|2,0,0]=4 2707 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000754431 [1,1,0,0,0,0|1,0,0]=3 2708 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000754431 [1,1,0,0,0,0|1,0,0]=3 2709 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000754431 [1,1,0,0,0,0|1,0,0]=3 2710 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000754431 [1,1,0,0,0,0|1,0,0]=3 2711 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000754431 [1,1,0,0,0,0|1,0,0]=3 2712 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000754431 [1,1,0,0,0,0|1,0,0]=3 2713 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Br 240690a_100020586998_100000744433 [1,1,0,0,0,0|2,0,0]=4 2714 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Br 527a_100020586998_100000744433 [1,1,0,0,0,0|2,0,0]=4 2715 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 1626a_100020586998_100000212137 [1,1,0,0,0,0|2,0,0]=4 2716 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 240690a_100020586998_100000212137 [1,1,0,0,0,0|2,0,0]=4 2717 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 527a_100020586998_100000212137 [1,1,0,0,0,0|2,0,0]=4 2718 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Cl 240690a_100020586998_100000188622 [1,1,0,0,0,0|2,0,0]=4 2719 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Cl 527a_100020586998_100000188622 [1,1,0,0,0,0|2,0,0]=4 2720 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)F 240690a_100020586998_100000746061 [1,1,0,0,0,0|2,0,0]=4 2721 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)F 527a_100020586998_100000746061 [1,1,0,0,0,0|2,0,0]=4 2722 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)I 240690a_100020586998_100000091984 [1,1,0,0,0,0|2,0,0]=4 2723 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)I 527a_100020586998_100000091984 [1,1,0,0,0,0|2,0,0]=4 2724 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000070051 [1,1,0,0,0,0|1,0,1]=4 2725 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000070051 [1,1,0,0,0,0|1,0,1]=4 2726 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000070051 [1,1,0,0,0,0|1,0,1]=4 2727 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000070051 [1,1,0,0,0,0|1,0,1]=4 2728 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000070051 [1,1,0,0,0,0|1,0,1]=4 2729 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000070051 [1,1,0,0,0,0|1,0,1]=4 2730 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210211 [1,1,0,0,0,0|1,0,1]=4 2731 B14R1.2523 CCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210211 [1,1,0,0,0,0|1,0,1]=4 2732 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210211 [1,1,0,0,0,0|1,0,1]=4 2733 B14R1.2523 CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210211 [1,1,0,0,0,0|1,0,1]=4 2734 B14R1.2523 CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210211 [1,1,0,0,0,0|1,0,1]=4 2735 B14R1.2523 CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210211 [1,1,0,0,0,0|1,0,1]=4 2736 B14R1.2523 COCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000233755 [1,1,0,0,0,0|2,0,0]=4 2737 B14R1.2523 COCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000233755 [1,1,0,0,0,0|2,0,0]=4 2738 B14R1.2523 COCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000233755 [1,1,0,0,0,0|2,0,0]=4 2739 B14R1.2523 COCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000233755 [1,1,0,0,0,0|2,0,0]=4 2740 B14R1.2523 COCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000233755 [1,1,0,0,0,0|2,0,0]=4 2741 B14R1.2523 COCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000233755 [1,1,0,0,0,0|2,0,0]=4 2742 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000751147 [1,1,0,0,0,0|2,0,0]=4 2743 B14R1.2523 CSCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000751147 [1,1,0,0,0,0|2,0,0]=4 2744 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000751147 [1,1,0,0,0,0|2,0,0]=4 2745 B14R1.2523 CSCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000751147 [1,1,0,0,0,0|2,0,0]=4 2746 B14R1.2523 CSCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000751147 [1,1,0,0,0,0|2,0,0]=4 2747 B14R1.2523 CSCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000751147 [1,1,0,0,0,0|2,0,0]=4 2748 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Br 1458a_100000741311_100011215043 [1,1,0,0,0,0|1,0,1]=4 2749 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Cl 1458a_100000688705_100011215043 [1,1,0,0,0,0|1,0,1]=4 2750 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)F 1458a_100000686989_100011215043 [1,1,0,0,0,0|1,0,1]=4 2751 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)I 1458a_100010189873_100011215043 [1,1,0,0,0,0|1,0,1]=4 2752 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)O 1458a_100000692822_100011215043 [1,1,0,0,0,0|1,0,1]=4 2753 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCO 1458a_100000685072_100011215043 [1,1,0,0,0,0|1,0,1]=4 2754 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCO 1458a_100000211164_100011215043 [1,1,0,0,0,0|1,0,1]=4 2755 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100000766932_100011215043 [1,1,0,0,0,0|1,0,1]=4 2756 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCO 1458a_100000766033_100011215043 [1,1,0,0,0,0|1,0,1]=4 2757 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCO 1458a_100009999607_100011215043 [1,1,0,0,0,0|1,0,1]=4 2758 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCC#N 1458a_100000212137_100011215226 [1,1,0,0,0,0|1,0,1]=4 2759 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCF 1458a_100000212137_100011934791 [1,1,0,0,0,0|1,0,1]=4 2760 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCO 1458a_100000212137_100011215043 [1,1,0,0,0,0|0,0,1]=3 2761 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 240690a_100000210304_100000212137 [1,1,0,0,0,0|1,0,1]=4 2762 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 527a_100000210304_100000212137 [1,1,0,0,0,0|1,0,1]=4 2763 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215226 [1,1,0,0,0,0|1,0,1]=4 2764 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215226 [1,1,0,0,0,0|1,0,1]=4 2765 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215226 [1,1,0,0,0,0|1,0,1]=4 2766 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215226 [1,1,0,0,0,0|1,0,1]=4 2767 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215226 [1,1,0,0,0,0|1,0,1]=4 2768 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Br 1458a_100000744433_100011934791 [1,1,0,0,0,0|1,0,1]=4 2769 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Cl 1458a_100000188622_100011934791 [1,1,0,0,0,0|1,0,1]=4 2770 B14R1.2523 O=C(CCCF)c1ccc(cc1O)F 1458a_100000746061_100011934791 [1,1,0,0,0,0|1,0,1]=4 2771 B14R1.2523 O=C(CCCF)c1ccc(cc1O)I 1458a_100000091984_100011934791 [1,1,0,0,0,0|1,0,1]=4 2772 B14R1.2523 O=C(CCCF)c1ccc(cc1O)O 1458a_100000212172_100011934791 [1,1,0,0,0,0|1,0,1]=4 2773 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Br 1458a_100000762965_100011215043 [1,1,0,0,0,0|1,0,1]=4 2774 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100011215043 [1,1,0,0,0,0|1,0,1]=4 2775 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)F 1458a_100000212304_100011215043 [1,1,0,0,0,0|1,0,1]=4 2776 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)I 1458a_100012360512_100011215043 [1,1,0,0,0,0|1,0,1]=4 2777 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)O 1458a_100012344906_100011215043 [1,1,0,0,0,0|1,0,1]=4 2778 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100011215043 [1,1,0,0,0,0|1,0,1]=4 2779 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215043 [1,1,0,0,0,0|1,0,1]=4 2780 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)F 1458a_100000211397_100011215043 [1,1,0,0,0,0|1,0,1]=4 2781 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)I 1458a_100000751301_100011215043 [1,1,0,0,0,0|1,0,1]=4 2782 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)O 1458a_100000702456_100011215043 [1,1,0,0,0,0|1,0,1]=4 2783 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Br 1458a_100000214689_100011215043 [1,1,0,0,0,0|1,0,1]=4 2784 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Cl 1458a_100000212326_100011215043 [1,1,0,0,0,0|1,0,1]=4 2785 B14R1.2523 O=C(CCCO)c1ccc(cc1F)F 1458a_100000211022_100011215043 [1,1,0,0,0,0|1,0,1]=4 2786 B14R1.2523 O=C(CCCO)c1ccc(cc1F)I 1458a_100000037189_100011215043 [1,1,0,0,0,0|1,0,1]=4 2787 B14R1.2523 O=C(CCCO)c1ccc(cc1F)O 1458a_100000689029_100011215043 [1,1,0,0,0,0|1,0,1]=4 2788 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Br 1458a_100000751167_100011215043 [1,1,0,0,0,0|1,0,1]=4 2789 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Cl 1458a_100000739380_100011215043 [1,1,0,0,0,0|1,0,1]=4 2790 B14R1.2523 O=C(CCCO)c1ccc(cc1I)F 1458a_100000739341_100011215043 [1,1,0,0,0,0|1,0,1]=4 2791 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Br 1458a_100000744433_100011215043 [1,1,0,0,0,0|0,0,1]=3 2792 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Cl 1458a_100000188622_100011215043 [1,1,0,0,0,0|0,0,1]=3 2793 B14R1.2523 O=C(CCCO)c1ccc(cc1O)F 1458a_100000746061_100011215043 [1,1,0,0,0,0|0,0,1]=3 2794 B14R1.2523 O=C(CCCO)c1ccc(cc1O)I 1458a_100000091984_100011215043 [1,1,0,0,0,0|0,0,1]=3 2795 B14R1.2523 O=C(CCCO)c1ccc(cc1O)O 1458a_100000212172_100011215043 [1,1,0,0,0,0|0,0,1]=3 2796 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 240690a_100000210304_100000744433 [1,1,0,0,0,0|1,0,1]=4 2797 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 527a_100000210304_100000744433 [1,1,0,0,0,0|1,0,1]=4 2798 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 240690a_100000210304_100000188622 [1,1,0,0,0,0|1,0,1]=4 2799 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 527a_100000210304_100000188622 [1,1,0,0,0,0|1,0,1]=4 2800 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 240690a_100000210304_100000746061 [1,1,0,0,0,0|1,0,1]=4 2801 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 527a_100000210304_100000746061 [1,1,0,0,0,0|1,0,1]=4 2802 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 240690a_100000210304_100000091984 [1,1,0,0,0,0|1,0,1]=4 2803 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 527a_100000210304_100000091984 [1,1,0,0,0,0|1,0,1]=4 2804 B14R1.3348 C=CCN(C)C(=O)c1ccccc1O 240690a_100000225617_100015234032 [1,1,0,0,0,0|2,0,0]=4 2805 B14R1.3348 CC(CC#N)C(=O)c1ccccc1O 1458a_100015234032_100009813641 [1,1,0,0,0,0|1,0,1]=4 2806 B14R1.3348 CC(CCO)C(=O)c1ccccc1Br 1458a_100000188424_100009893172 [1,1,0,0,0,0|1,0,1]=4 2807 B14R1.3348 CC(CCO)C(=O)c1ccccc1Cl 1458a_100000185844_100009893172 [1,1,0,0,0,0|1,0,1]=4 2808 B14R1.3348 CC(CCO)C(=O)c1ccccc1F 1458a_100000188656_100009893172 [1,1,0,0,0,0|1,0,1]=4 2809 B14R1.3348 CC(CCO)C(=O)c1ccccc1I 1458a_100000187884_100009893172 [1,1,0,0,0,0|1,0,1]=4 2810 B14R1.3348 CC(CCO)C(=O)c1ccccc1O 1458a_100015234032_100009893172 [1,1,0,0,0,0|0,0,1]=3 2811 B14R1.3348 CC(CCO)C(=O)c1ccccc1[O-] 1458a_100009911694_100009893172 [1,1,0,0,0,0|0,0,2]=4 2812 B14R1.3348 CCCC(C)C(=O)c1ccccc1O 1458a_100015234032_100000766640 [1,1,0,0,0,0|1,0,1]=4 2813 B14R1.3348 CN(CCO)C(=O)c1ccccc1O 240690a_100000210263_100015234032 [1,1,0,0,0,0|1,0,1]=4 2814 B14R1.3348 COCC(C)C(=O)c1ccccc1O 1458a_100015234032_100000765312 [1,1,0,0,0,0|2,0,0]=4 2815 B14R1.3348 Cc1ccccc1C(=O)C(C)CCO 1458a_100000212026_100009893172 [1,1,0,0,0,0|1,0,1]=4 2816 B14R1.8282 C#CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000753159 [1,1,0,0,0,0|1,0,1]=4 2817 B14R1.8282 C#CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000753159 [1,1,0,0,0,0|1,0,1]=4 2818 B14R1.8282 C#CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000753159 [1,1,0,0,0,0|1,0,1]=4 2819 B14R1.8282 C#CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000753159 [1,1,0,0,0,0|1,0,1]=4 2820 B14R1.8282 C#CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000753159 [1,1,0,0,0,0|1,0,1]=4 2821 B14R1.8282 C/C=C/CC(=O)c1c(cccc1Br)O 1458a_100011935254_100102629194 [1,1,0,0,0,0|1,0,1]=4 2822 B14R1.8282 C/C=C/CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100102629194 [1,1,0,0,0,0|1,0,1]=4 2823 B14R1.8282 C/C=C/CC(=O)c1c(cccc1F)O 1458a_100000763259_100102629194 [1,1,0,0,0,0|1,0,1]=4 2824 B14R1.8282 C/C=C/CC(=O)c1c(cccc1O)C 1458a_100011934116_100102629194 [1,1,0,0,0,0|1,0,1]=4 2825 B14R1.8282 C/C=C/CC(=O)c1c(cccc1O)O 1458a_100000755285_100102629194 [1,1,0,0,0,0|1,0,1]=4 2826 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000754431 [1,1,0,0,0,0|2,0,0]=4 2827 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000754431 [1,1,0,0,0,0|2,0,0]=4 2828 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000754431 [1,1,0,0,0,0|2,0,0]=4 2829 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000754431 [1,1,0,0,0,0|2,0,0]=4 2830 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000754431 [1,1,0,0,0,0|1,0,0]=3 2831 B14R1.8282 C=CCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000754431 [1,1,0,0,0,0|2,0,0]=4 2832 B14R1.8282 C=CCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000754431 [1,1,0,0,0,0|2,0,0]=4 2833 B14R1.8282 C=CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000754431 [1,1,0,0,0,0|2,0,0]=4 2834 B14R1.8282 C=CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000754431 [1,1,0,0,0,0|2,0,0]=4 2835 B14R1.8282 C=CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000754431 [1,1,0,0,0,0|1,0,0]=3 2836 B14R1.8282 C=CCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000754431 [1,1,0,0,0,0|2,0,0]=4 2837 B14R1.8282 C=CCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000754431 [1,1,0,0,0,0|2,0,0]=4 2838 B14R1.8282 C=CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000754431 [1,1,0,0,0,0|1,0,0]=3 2839 B14R1.8282 C=CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000754431 [1,1,0,0,0,0|2,0,0]=4 2840 B14R1.8282 C=CCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000754431 [1,1,0,0,0,0|2,0,0]=4 2841 B14R1.8282 C=CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000754431 [1,1,0,0,0,0|2,0,0]=4 2842 B14R1.8282 C=CCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000754431 [1,1,0,0,0,0|2,0,0]=4 2843 B14R1.8282 C=CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000754431 [1,1,0,0,0,0|1,0,0]=3 2844 B14R1.8282 C=CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000754431 [1,1,0,0,0,0|1,0,0]=3 2845 B14R1.8282 C=CCNC(=O)c1c(cccc1Br)O 240690a_100020586998_100011935254 [1,1,0,0,0,0|2,0,0]=4 2846 B14R1.8282 C=CCNC(=O)c1c(cccc1Br)O 527a_100020586998_100011935254 [1,1,0,0,0,0|2,0,0]=4 2847 B14R1.8282 C=CCNC(=O)c1c(cccc1Cl)O 240690a_100020586998_100000745519 [1,1,0,0,0,0|2,0,0]=4 2848 B14R1.8282 C=CCNC(=O)c1c(cccc1Cl)O 527a_100020586998_100000745519 [1,1,0,0,0,0|2,0,0]=4 2849 B14R1.8282 C=CCNC(=O)c1c(cccc1F)O 527a_100020586998_100000763259 [1,1,0,0,0,0|2,0,0]=4 2850 B14R1.8282 C=CCNC(=O)c1c(cccc1O)O 527a_100020586998_100000755285 [1,1,0,0,0,0|2,0,0]=4 2851 B14R1.8282 CC=CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000070051 [1,1,0,0,0,0|1,0,1]=4 2852 B14R1.8282 CC=CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000070051 [1,1,0,0,0,0|1,0,1]=4 2853 B14R1.8282 CC=CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000070051 [1,1,0,0,0,0|1,0,1]=4 2854 B14R1.8282 CC=CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000070051 [1,1,0,0,0,0|1,0,1]=4 2855 B14R1.8282 CC=CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000070051 [1,1,0,0,0,0|1,0,1]=4 2856 B14R1.8282 CCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210211 [1,1,0,0,0,0|1,0,1]=4 2857 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210211 [1,1,0,0,0,0|1,0,1]=4 2858 B14R1.8282 CCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210211 [1,1,0,0,0,0|1,0,1]=4 2859 B14R1.8282 CCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210211 [1,1,0,0,0,0|1,0,1]=4 2860 B14R1.8282 CCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210211 [1,1,0,0,0,0|1,0,1]=4 2861 B14R1.8282 COCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000233755 [1,1,0,0,0,0|2,0,0]=4 2862 B14R1.8282 COCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000233755 [1,1,0,0,0,0|2,0,0]=4 2863 B14R1.8282 COCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000233755 [1,1,0,0,0,0|2,0,0]=4 2864 B14R1.8282 COCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000233755 [1,1,0,0,0,0|2,0,0]=4 2865 B14R1.8282 COCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000233755 [1,1,0,0,0,0|2,0,0]=4 2866 B14R1.8282 CSCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000751147 [1,1,0,0,0,0|2,0,0]=4 2867 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000751147 [1,1,0,0,0,0|2,0,0]=4 2868 B14R1.8282 CSCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000751147 [1,1,0,0,0,0|2,0,0]=4 2869 B14R1.8282 CSCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000751147 [1,1,0,0,0,0|2,0,0]=4 2870 B14R1.8282 CSCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000751147 [1,1,0,0,0,0|2,0,0]=4 2871 B14R1.8282 Cc1cccc(c1C(=O)CCC#N)O 1458a_100011934116_100011215226 [1,1,0,0,0,0|1,0,1]=4 2872 B14R1.8282 Cc1cccc(c1C(=O)CCCF)O 1458a_100011934116_100011934791 [1,1,0,0,0,0|1,0,1]=4 2873 B14R1.8282 Cc1cccc(c1C(=O)CCCO)Br 1458a_100000701904_100011215043 [1,1,0,0,0,0|1,0,1]=4 2874 B14R1.8282 Cc1cccc(c1C(=O)CCCO)C 1458a_100000758298_100011215043 [1,1,0,0,0,0|1,0,1]=4 2875 B14R1.8282 Cc1cccc(c1C(=O)CCCO)Cl 1458a_100000692601_100011215043 [1,1,0,0,0,0|1,0,1]=4 2876 B14R1.8282 Cc1cccc(c1C(=O)CCCO)F 1458a_100000762013_100011215043 [1,1,0,0,0,0|1,0,1]=4 2877 B14R1.8282 Cc1cccc(c1C(=O)CCCO)I 1458a_100000688020_100011215043 [1,1,0,0,0,0|1,0,1]=4 2878 B14R1.8282 Cc1cccc(c1C(=O)CCCO)O 1458a_100011934116_100011215043 [1,1,0,0,0,0|0,0,1]=3 2879 B14R1.8282 N#CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215226 [1,1,0,0,0,0|1,0,1]=4 2880 B14R1.8282 N#CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215226 [1,1,0,0,0,0|1,0,1]=4 2881 B14R1.8282 N#CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215226 [1,1,0,0,0,0|1,0,1]=4 2882 B14R1.8282 N#CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215226 [1,1,0,0,0,0|1,0,1]=4 2883 B14R1.8282 O=C(CCCF)c1c(cccc1Br)O 1458a_100011935254_100011934791 [1,1,0,0,0,0|1,0,1]=4 2884 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)O 1458a_100000745519_100011934791 [1,1,0,0,0,0|1,0,1]=4 2885 B14R1.8282 O=C(CCCF)c1c(cccc1F)O 1458a_100000763259_100011934791 [1,1,0,0,0,0|1,0,1]=4 2886 B14R1.8282 O=C(CCCF)c1c(cccc1O)O 1458a_100000755285_100011934791 [1,1,0,0,0,0|1,0,1]=4 2887 B14R1.8282 O=C(CCCO)c1c(cccc1Br)Br 1458a_100000690891_100011215043 [1,1,0,0,0,0|1,0,1]=4 2888 B14R1.8282 O=C(CCCO)c1c(cccc1Br)Cl 1458a_100011253703_100011215043 [1,1,0,0,0,0|1,0,1]=4 2889 B14R1.8282 O=C(CCCO)c1c(cccc1Br)F 1458a_100000752694_100011215043 [1,1,0,0,0,0|1,0,1]=4 2890 B14R1.8282 O=C(CCCO)c1c(cccc1Br)O 1458a_100011935254_100011215043 [1,1,0,0,0,0|0,0,1]=3 2891 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)Cl 1458a_100000210656_100011215043 [1,1,0,0,0,0|1,0,1]=4 2892 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)F 1458a_100000210369_100011215043 [1,1,0,0,0,0|1,0,1]=4 2893 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)O 1458a_100000745519_100011215043 [1,1,0,0,0,0|0,0,1]=3 2894 B14R1.8282 O=C(CCCO)c1c(cccc1F)F 1458a_100000210804_100011215043 [1,1,0,0,0,0|1,0,1]=4 2895 B14R1.8282 O=C(CCCO)c1c(cccc1F)O 1458a_100000763259_100011215043 [1,1,0,0,0,0|0,0,1]=3 2896 B14R1.8282 O=C(CCCO)c1c(cccc1I)Br 1458a_100010232521_100011215043 [1,1,0,0,0,0|1,0,1]=4 2897 B14R1.8282 O=C(CCCO)c1c(cccc1I)Cl 1458a_100000702859_100011215043 [1,1,0,0,0,0|1,0,1]=4 2898 B14R1.8282 O=C(CCCO)c1c(cccc1I)F 1458a_100000023732_100011215043 [1,1,0,0,0,0|1,0,1]=4 2899 B14R1.8282 O=C(CCCO)c1c(cccc1O)O 1458a_100000755285_100011215043 [1,1,0,0,0,0|0,0,1]=3 2900 B14R1.8282 O=C(NCCO)c1c(cccc1Br)O 240690a_100000210304_100011935254 [1,1,0,0,0,0|1,0,1]=4 2901 B14R1.8282 O=C(NCCO)c1c(cccc1Br)O 527a_100000210304_100011935254 [1,1,0,0,0,0|1,0,1]=4 2902 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)O 240690a_100000210304_100000745519 [1,1,0,0,0,0|1,0,1]=4 2903 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)O 527a_100000210304_100000745519 [1,1,0,0,0,0|1,0,1]=4 2904 B14R1.8282 O=C(NCCO)c1c(cccc1F)O 527a_100000210304_100000763259 [1,1,0,0,0,0|1,0,1]=4 2905 B14R1.8282 O=C(NCCO)c1c(cccc1O)O 527a_100000210304_100000755285 [1,1,0,0,0,0|1,0,1]=4 2906 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100000748629 [0,1,0,0,1,0|2,0,0]=4 2907 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)C 1458a_100000183896_100000748629 [0,1,0,0,1,0|2,0,0]=4 2908 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000748629 [0,1,0,0,1,0|2,0,0]=4 2909 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)F 1458a_100011217230_100000748629 [0,1,0,0,1,0|2,0,0]=4 2910 B14R1.152 C=C(C)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000748629 [0,1,0,0,1,0|2,0,0]=4 2911 B14R1.152 C=C(F)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100009893438 [0,1,0,0,1,0|2,0,0]=4 2912 B14R1.152 C=C(F)CC(=O)c1cccc(c1O)C 1458a_100000183896_100009893438 [0,1,0,0,1,0|2,0,0]=4 2913 B14R1.152 C=C(F)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100009893438 [0,1,0,0,1,0|2,0,0]=4 2914 B14R1.152 C=C(F)CC(=O)c1cccc(c1O)F 1458a_100011217230_100009893438 [0,1,0,0,1,0|2,0,0]=4 2915 B14R1.152 C=C(F)CC(=O)c1cccc(c1O)O 1458a_100000690420_100009893438 [0,1,0,0,1,0|2,0,0]=4 2916 B14R1.152 CC(=O)CC(=O)c1cccc(c1C)I 1458a_100000070787_100160470822 [0,1,0,0,1,0|2,0,0]=4 2917 B14R1.152 CC(=O)CC(=O)c1cccc(c1F)Br 1458a_100000070787_100012356374 [0,1,0,0,1,0|2,0,0]=4 2918 B14R1.152 CC(=O)CC(=O)c1cccc(c1F)Cl 1458a_100000070787_200012351890 [0,1,0,0,1,0|2,0,0]=4 2919 B14R1.152 CC(O)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100011218427 [0,1,0,0,1,0|1,0,1]=4 2920 B14R1.152 CC(O)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011218427 [0,1,0,0,1,0|1,0,1]=4 2921 B14R1.152 CC(O)CC(=O)c1cccc(c1O)F 1458a_100011217230_100011218427 [0,1,0,0,1,0|1,0,1]=4 2922 B14R1.152 CC(O)CC(=O)c1cccc(c1O)O 1458a_100000690420_100011218427 [0,1,0,0,1,0|1,0,1]=4 2923 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)Br 1458a_100000760464_100000187820 [0,1,0,0,1,0|2,0,0]=4 2924 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)Cl 1458a_100000690184_100000187820 [0,1,0,0,1,0|2,0,0]=4 2925 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)F 1458a_100011218272_100000187820 [0,1,0,0,1,0|2,0,0]=4 2926 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)I 1458a_100000751865_100000187820 [0,1,0,0,1,0|2,0,0]=4 2927 B14R1.152 Cc1c(cccc1C(=O)CC(=O)N)O 1458a_100000766327_100000187820 [0,1,0,0,1,0|2,0,0]=4 2928 B14R1.152 Cc1c(cccc1C(=O)CC(=O)[O-])Br 1458a_100000760464_100020667443 [0,1,0,0,1,0|1,0,1]=4 2929 B14R1.152 Cc1c(cccc1C(=O)CC(=O)[O-])Cl 1458a_100000690184_100020667443 [0,1,0,0,1,0|1,0,1]=4 2930 B14R1.152 Cc1c(cccc1C(=O)CC(=O)[O-])F 1458a_100011218272_100020667443 [0,1,0,0,1,0|1,0,1]=4 2931 B14R1.152 Cc1c(cccc1C(=O)CC(=O)[O-])I 1458a_100000751865_100020667443 [0,1,0,0,1,0|1,0,1]=4 2932 B14R1.152 Cc1c(cccc1C(=O)CC(=O)[O-])O 1458a_100000766327_100020667443 [0,1,0,0,1,0|1,0,1]=4 2933 B14R1.152 Cc1cccc(c1Br)C(=O)CC(=O)N 1458a_100000692419_100000187820 [0,1,0,0,1,0|2,0,0]=4 2934 B14R1.152 Cc1cccc(c1Br)C(=O)CC(=O)[O-] 1458a_100000692419_100020667443 [0,1,0,0,1,0|1,0,1]=4 2935 B14R1.152 Cc1cccc(c1C)C(=O)CC(=O)N 1458a_100000183679_100000187820 [0,1,0,0,1,0|2,0,0]=4 2936 B14R1.152 Cc1cccc(c1C)C(=O)CC(=O)[O-] 1458a_100000183679_100020667443 [0,1,0,0,1,0|1,0,1]=4 2937 B14R1.152 Cc1cccc(c1Cl)C(=O)CC(=O)N 1458a_100000693142_100000187820 [0,1,0,0,1,0|2,0,0]=4 2938 B14R1.152 Cc1cccc(c1Cl)C(=O)CC(=O)[O-] 1458a_100000693142_100020667443 [0,1,0,0,1,0|1,0,1]=4 2939 B14R1.152 Cc1cccc(c1F)C(=O)CC(=O)N 1458a_100000766181_100000187820 [0,1,0,0,1,0|2,0,0]=4 2940 B14R1.152 Cc1cccc(c1F)C(=O)CC(=O)[O-] 1458a_100000766181_100020667443 [0,1,0,0,1,0|1,0,1]=4 2941 B14R1.152 Cc1cccc(c1I)C(=O)CC(=O)N 1458a_100000739377_100000187820 [0,1,0,0,1,0|2,0,0]=4 2942 B14R1.152 Cc1cccc(c1I)C(=O)CC(=O)[O-] 1458a_100000739377_100020667443 [0,1,0,0,1,0|1,0,1]=4 2943 B14R1.152 Cc1cccc(c1O)C(=O)CC(=O)N 1458a_100000183896_100000187820 [0,1,0,0,1,0|1,0,0]=3 2944 B14R1.152 Cc1cccc(c1O)C(=O)CC(=O)[O-] 1458a_100000183896_100020667443 [0,1,0,0,1,0|0,0,1]=3 2945 B14R1.152 Cc1cccc(c1O)C(=O)CC(C)O 1458a_100000183896_100011218427 [0,1,0,0,1,0|1,0,1]=4 2946 B14R1.152 Cc1cccc(c1O)C(=O)C[N+](=O)[O-] 1458a_100000183896_100000761209 [0,1,0,0,1,0|1,0,1]=4 2947 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000187820 [0,1,0,0,1,0|2,0,0]=4 2948 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000187820 [0,1,0,0,1,0|2,0,0]=4 2949 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)F 1458a_100011217547_100000187820 [0,1,0,0,1,0|2,0,0]=4 2950 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)I 1458a_100010232522_100000187820 [0,1,0,0,1,0|2,0,0]=4 2951 B14R1.152 NC(=O)CC(=O)c1cccc(c1Br)O 1458a_100010230362_100000187820 [0,1,0,0,1,0|2,0,0]=4 2952 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000187820 [0,1,0,0,1,0|2,0,0]=4 2953 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000187820 [0,1,0,0,1,0|2,0,0]=4 2954 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000187820 [0,1,0,0,1,0|2,0,0]=4 2955 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000187820 [0,1,0,0,1,0|2,0,0]=4 2956 B14R1.152 NC(=O)CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000187820 [0,1,0,0,1,0|2,0,0]=4 2957 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)Br 1458a_100000756403_100000187820 [0,1,0,0,1,0|2,0,0]=4 2958 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000187820 [0,1,0,0,1,0|2,0,0]=4 2959 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)F 1458a_100000748134_100000187820 [0,1,0,0,1,0|2,0,0]=4 2960 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)I 1458a_100010185205_100000187820 [0,1,0,0,1,0|2,0,0]=4 2961 B14R1.152 NC(=O)CC(=O)c1cccc(c1F)O 1458a_100000037433_100000187820 [0,1,0,0,1,0|2,0,0]=4 2962 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)Br 1458a_100000688019_100000187820 [0,1,0,0,1,0|2,0,0]=4 2963 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000187820 [0,1,0,0,1,0|2,0,0]=4 2964 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)F 1458a_100000690930_100000187820 [0,1,0,0,1,0|2,0,0]=4 2965 B14R1.152 NC(=O)CC(=O)c1cccc(c1I)O 1458a_100010084636_100000187820 [0,1,0,0,1,0|2,0,0]=4 2966 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100000187820 [0,1,0,0,1,0|1,0,0]=3 2967 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000187820 [0,1,0,0,1,0|1,0,0]=3 2968 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)F 1458a_100011217230_100000187820 [0,1,0,0,1,0|1,0,0]=3 2969 B14R1.152 NC(=O)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000187820 [0,1,0,0,1,0|1,0,0]=3 2970 B14R1.152 O=C(C[N+](=O)[O-])c1cccc(c1O)Br 1458a_100000752940_100000761209 [0,1,0,0,1,0|1,0,1]=4 2971 B14R1.152 O=C(C[N+](=O)[O-])c1cccc(c1O)Cl 1458a_100000742801_100000761209 [0,1,0,0,1,0|1,0,1]=4 2972 B14R1.152 O=C(C[N+](=O)[O-])c1cccc(c1O)F 1458a_100011217230_100000761209 [0,1,0,0,1,0|1,0,1]=4 2973 B14R1.152 O=C(C[N+](=O)[O-])c1cccc(c1O)O 1458a_100000690420_100000761209 [0,1,0,0,1,0|1,0,1]=4 2974 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Br)Br 1458a_100012360534_100020667443 [0,1,0,0,1,0|1,0,1]=4 2975 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100020667443 [0,1,0,0,1,0|1,0,1]=4 2976 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Br)F 1458a_100011217547_100020667443 [0,1,0,0,1,0|1,0,1]=4 2977 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Br)I 1458a_100010232522_100020667443 [0,1,0,0,1,0|1,0,1]=4 2978 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Br)O 1458a_100010230362_100020667443 [0,1,0,0,1,0|1,0,1]=4 2979 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100020667443 [0,1,0,0,1,0|1,0,1]=4 2980 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100020667443 [0,1,0,0,1,0|1,0,1]=4 2981 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Cl)F 1458a_100000759904_100020667443 [0,1,0,0,1,0|1,0,1]=4 2982 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Cl)I 1458a_100010176783_100020667443 [0,1,0,0,1,0|1,0,1]=4 2983 B14R1.152 O=C([O-])CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100020667443 [0,1,0,0,1,0|1,0,1]=4 2984 B14R1.152 O=C([O-])CC(=O)c1cccc(c1F)Br 1458a_100000756403_100020667443 [0,1,0,0,1,0|1,0,1]=4 2985 B14R1.152 O=C([O-])CC(=O)c1cccc(c1F)Cl 1458a_100000688816_100020667443 [0,1,0,0,1,0|1,0,1]=4 2986 B14R1.152 O=C([O-])CC(=O)c1cccc(c1F)F 1458a_100000748134_100020667443 [0,1,0,0,1,0|1,0,1]=4 2987 B14R1.152 O=C([O-])CC(=O)c1cccc(c1F)I 1458a_100010185205_100020667443 [0,1,0,0,1,0|1,0,1]=4 2988 B14R1.152 O=C([O-])CC(=O)c1cccc(c1F)O 1458a_100000037433_100020667443 [0,1,0,0,1,0|1,0,1]=4 2989 B14R1.152 O=C([O-])CC(=O)c1cccc(c1I)Br 1458a_100000688019_100020667443 [0,1,0,0,1,0|1,0,1]=4 2990 B14R1.152 O=C([O-])CC(=O)c1cccc(c1I)Cl 1458a_100010176784_100020667443 [0,1,0,0,1,0|1,0,1]=4 2991 B14R1.152 O=C([O-])CC(=O)c1cccc(c1I)F 1458a_100000690930_100020667443 [0,1,0,0,1,0|1,0,1]=4 2992 B14R1.152 O=C([O-])CC(=O)c1cccc(c1I)O 1458a_100010084636_100020667443 [0,1,0,0,1,0|1,0,1]=4 2993 B14R1.152 O=C([O-])CC(=O)c1cccc(c1O)Br 1458a_100000752940_100020667443 [0,1,0,0,1,0|0,0,1]=3 2994 B14R1.152 O=C([O-])CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100020667443 [0,1,0,0,1,0|0,0,1]=3 2995 B14R1.152 O=C([O-])CC(=O)c1cccc(c1O)F 1458a_100011217230_100020667443 [0,1,0,0,1,0|0,0,1]=3 2996 B14R1.152 O=C([O-])CC(=O)c1cccc(c1O)O 1458a_100000690420_100020667443 [0,1,0,0,1,0|0,0,1]=3 2997 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1Br 1458a_100000188424_100000179758 [0,1,0,0,1,0|2,0,0]=4 2998 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1C 1458a_100000212026_100000179758 [0,1,0,0,1,0|2,0,0]=4 2999 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1Cl 1458a_100000070787_100010255250 [0,1,0,0,1,0|2,0,0]=4 3000 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000179758 [0,1,0,0,1,0|2,0,0]=4 3001 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1F 1458a_100000188656_100000179758 [0,1,0,0,1,0|2,0,0]=4 3002 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1I 1458a_100000187884_100000179758 [0,1,0,0,1,0|2,0,0]=4 3003 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1O 1458a_100015234032_100000179758 [0,1,0,0,1,0|1,0,0]=3 3004 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000179758 [0,1,0,0,1,0|1,0,1]=4 3005 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1Br 1458a_100000188424_100000702099 [0,1,0,0,1,0|2,0,0]=4 3006 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1Cl 1458a_100000185844_100000702099 [0,1,0,0,1,0|2,0,0]=4 3007 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1F 1458a_100000188656_100000702099 [0,1,0,0,1,0|2,0,0]=4 3008 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1I 1458a_100000187884_100000702099 [0,1,0,0,1,0|2,0,0]=4 3009 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1O 1458a_100015234032_100000702099 [0,1,0,0,1,0|1,0,0]=3 3010 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1[O-] 1458a_100009911694_100000702099 [0,1,0,0,1,0|1,0,1]=4 3011 B14R1.243 Cc1ccccc1C(=O)C(C)C(=O)N 1458a_100000212026_100000702099 [0,1,0,0,1,0|2,0,0]=4 3012 B14R1.243 Cc1ccccc1C(=O)C(F)C(=O)N 1458a_100000212026_100009813875 [0,1,0,0,1,0|2,0,0]=4 3013 B14R1.243 Cc1ccccc1C(=O)C(F)C(=O)[O-] 1458a_100000212026_100020610796 [0,1,0,0,1,0|1,0,1]=4 3014 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1Br 1458a_100000188424_100009813875 [0,1,0,0,1,0|2,0,0]=4 3015 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1Cl 1458a_100000185844_100009813875 [0,1,0,0,1,0|2,0,0]=4 3016 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1F 1458a_100000188656_100009813875 [0,1,0,0,1,0|2,0,0]=4 3017 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1I 1458a_100000187884_100009813875 [0,1,0,0,1,0|2,0,0]=4 3018 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1O 1458a_100015234032_100009813875 [0,1,0,0,1,0|1,0,0]=3 3019 B14R1.243 NC(=O)C(F)C(=O)c1ccccc1[O-] 1458a_100009911694_100009813875 [0,1,0,0,1,0|1,0,1]=4 3020 B14R1.243 O=C([O-])C(F)C(=O)c1ccccc1Br 1458a_100000188424_100020610796 [0,1,0,0,1,0|1,0,1]=4 3021 B14R1.243 O=C([O-])C(F)C(=O)c1ccccc1Cl 1458a_100000185844_100020610796 [0,1,0,0,1,0|1,0,1]=4 3022 B14R1.243 O=C([O-])C(F)C(=O)c1ccccc1F 1458a_100000188656_100020610796 [0,1,0,0,1,0|1,0,1]=4 3023 B14R1.243 O=C([O-])C(F)C(=O)c1ccccc1I 1458a_100000187884_100020610796 [0,1,0,0,1,0|1,0,1]=4 3024 B14R1.243 O=C([O-])C(F)C(=O)c1ccccc1O 1458a_100015234032_100020610796 [0,1,0,0,1,0|0,0,1]=3 3025 B14R1.243 O=C([O-])C(F)C(=O)c1ccccc1[O-] 1458a_100009911694_100020610796 [0,1,0,0,1,0|0,0,2]=4 3026 B14R1.840 C#Cc1ccccc1C(=O)CC(=O)N 1458a_100011243808_100000187820 [0,1,0,0,1,0|2,0,0]=4 3027 B14R1.840 C#Cc1ccccc1C(=O)CC(=O)[O-] 1458a_100011243808_100020667443 [0,1,0,0,1,0|1,0,1]=4 3028 B14R1.840 C=C(C)CC(=O)c1ccccc1CO 1458a_100011301526_100000748629 [0,1,0,0,1,0|2,0,0]=4 3029 B14R1.840 C=C(C)CC(=O)c1ccccc1OC 1458a_100000185835_100000748629 [0,1,0,0,1,0|2,0,0]=4 3030 B14R1.840 C=C(F)CC(=O)c1ccccc1CO 1458a_100011301526_100009893438 [0,1,0,0,1,0|2,0,0]=4 3031 B14R1.840 C=C(F)CC(=O)c1ccccc1OC 1458a_100000185835_100009893438 [0,1,0,0,1,0|2,0,0]=4 3032 B14R1.840 C=Cc1ccccc1C(=O)CC(=O)C 271570a_100011290941_200011243946 [0,1,0,0,1,0|2,0,0]=4 3033 B14R1.840 C=Cc1ccccc1C(=O)CC(=O)N 1458a_100011830265_100000187820 [0,1,0,0,1,0|2,0,0]=4 3034 B14R1.840 C=Cc1ccccc1C(=O)CC(=O)[O-] 1458a_100011830265_100020667443 [0,1,0,0,1,0|1,0,1]=4 3035 B14R1.840 CC(=O)CC(=O)c1ccccc1S[13CH3] 62a_200011243946_200025704644 [0,1,0,0,1,0|1,1,0]=4 3036 B14R1.840 CC(O)CC(=O)c1ccccc1CO 1458a_100011301526_100011218427 [0,1,0,0,1,0|1,0,1]=4 3037 B14R1.840 CCc1ccccc1C(=O)CC(=O)N 1458a_100000689120_100000187820 [0,1,0,0,1,0|2,0,0]=4 3038 B14R1.840 CCc1ccccc1C(=O)CC(=O)[O-] 1458a_100000689120_100020667443 [0,1,0,0,1,0|1,0,1]=4 3039 B14R1.840 COc1ccccc1C(=O)CC(=O)C 1458a_100000070787_100000195505 [0,1,0,0,1,0|1,0,0]=3 3040 B14R1.840 COc1ccccc1C(=O)CC(=O)N 1458a_100000185835_100000187820 [0,1,0,0,1,0|1,0,0]=3 3041 B14R1.840 COc1ccccc1C(=O)CC(=O)[O-] 1458a_100000185835_100020667443 [0,1,0,0,1,0|0,0,1]=3 3042 B14R1.840 COc1ccccc1C(=O)CC(C)O 1458a_100000185835_100011218427 [0,1,0,0,1,0|1,0,1]=4 3043 B14R1.840 COc1ccccc1C(=O)C[N+](=O)[O-] 1458a_100000185835_100000761209 [0,1,0,0,1,0|1,0,1]=4 3044 B14R1.840 COc1ccccc1N(C)CC(=O)O 269956a_100000744073_200000210301 [0,1,0,0,1,0|2,0,0]=4 3045 B14R1.840 COc1ccccc1N([13CH3])CC(=O)O 269956a_100000744073_200025704644 [0,1,0,0,1,0|2,0,0]=4 3046 B14R1.840 CSc1ccccc1C(=O)CC(=O)C 62a_200011243946_200000210301 [0,1,0,0,1,0|1,1,0]=4 3047 B14R1.840 CSc1ccccc1C(=O)CC(=O)N 1458a_100000183967_100000187820 [0,1,0,0,1,0|1,1,0]=4 3048 B14R1.840 CSc1ccccc1C(=O)CC(=O)[O-] 1458a_100000183967_100020667443 [0,1,0,0,1,0|0,1,1]=4 3049 B14R1.840 N#Cc1ccccc1C(=O)CC(=O)N 1458a_100000742908_100000187820 [0,1,0,0,1,0|2,0,0]=4 3050 B14R1.840 N#Cc1ccccc1C(=O)CC(=O)[O-] 1458a_100000742908_100020667443 [0,1,0,0,1,0|1,0,1]=4 3051 B14R1.840 NC(=O)CC(=O)c1ccccc1CO 1458a_100011301526_100000187820 [0,1,0,0,1,0|1,0,0]=3 3052 B14R1.840 NC(=O)CC(=O)c1ccccc1I=O 1458a_100000032414_100000187820 [0,1,0,0,1,0|1,0,1]=4 3053 B14R1.840 O=C(C[N+](=O)[O-])c1ccccc1CO 1458a_100011301526_100000761209 [0,1,0,0,1,0|1,0,1]=4 3054 B14R1.840 O=C([O-])CC(=O)c1ccccc1CO 1458a_100011301526_100020667443 [0,1,0,0,1,0|0,0,1]=3 3055 B14R1.840 O=Ic1ccccc1C(=O)CC(=O)[O-] 1458a_100000032414_100020667443 [0,1,0,0,1,0|0,0,2]=4 3056 B14R1.4451 NS(=O)(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000741382 [0,1,0,0,1,0|1,0,1]=4 3057 B14R1.4451 O=C(CS(=O)(=O)[O-])c1ccccc1O 1458a_100015234032_100009817235 [0,1,0,0,1,0|1,0,1]=4 3058 B14R1.5958 C=C(C)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100000748629 [0,1,0,0,1,0|2,0,0]=4 3059 B14R1.5958 C=C(C)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000748629 [0,1,0,0,1,0|2,0,0]=4 3060 B14R1.5958 C=C(C)CC(=O)c1c(cccc1F)O 1458a_100000763259_100000748629 [0,1,0,0,1,0|2,0,0]=4 3061 B14R1.5958 C=C(C)CC(=O)c1c(cccc1O)C 1458a_100011934116_100000748629 [0,1,0,0,1,0|2,0,0]=4 3062 B14R1.5958 C=C(C)CC(=O)c1c(cccc1O)O 1458a_100000755285_100000748629 [0,1,0,0,1,0|2,0,0]=4 3063 B14R1.5958 C=C(F)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100009893438 [0,1,0,0,1,0|2,0,0]=4 3064 B14R1.5958 C=C(F)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100009893438 [0,1,0,0,1,0|2,0,0]=4 3065 B14R1.5958 C=C(F)CC(=O)c1c(cccc1F)O 1458a_100000763259_100009893438 [0,1,0,0,1,0|2,0,0]=4 3066 B14R1.5958 C=C(F)CC(=O)c1c(cccc1O)C 1458a_100011934116_100009893438 [0,1,0,0,1,0|2,0,0]=4 3067 B14R1.5958 C=C(F)CC(=O)c1c(cccc1O)O 1458a_100000755285_100009893438 [0,1,0,0,1,0|2,0,0]=4 3068 B14R1.5958 CC(=O)CC(=O)c1c(cccc1Cl)Cl 1458a_100000070787_100012340516 [0,1,0,0,1,0|2,0,0]=4 3069 B14R1.5958 CC(=O)CC(=O)c1c(cccc1Cl)F 1458a_100000070787_100011219195 [0,1,0,0,1,0|2,0,0]=4 3070 B14R1.5958 CC(=O)CC(=O)c1c(cccc1F)F 1458a_100000070787_100000199083 [0,1,0,0,1,0|2,0,0]=4 3071 B14R1.5958 CC(O)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100011218427 [0,1,0,0,1,0|1,0,1]=4 3072 B14R1.5958 CC(O)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011218427 [0,1,0,0,1,0|1,0,1]=4 3073 B14R1.5958 CC(O)CC(=O)c1c(cccc1F)O 1458a_100000763259_100011218427 [0,1,0,0,1,0|1,0,1]=4 3074 B14R1.5958 CC(O)CC(=O)c1c(cccc1O)O 1458a_100000755285_100011218427 [0,1,0,0,1,0|1,0,1]=4 3075 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)Br 1458a_100000701904_100000187820 [0,1,0,0,1,0|2,0,0]=4 3076 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)C 1458a_100000758298_100000187820 [0,1,0,0,1,0|2,0,0]=4 3077 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)Cl 1458a_100000692601_100000187820 [0,1,0,0,1,0|2,0,0]=4 3078 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)F 1458a_100000762013_100000187820 [0,1,0,0,1,0|2,0,0]=4 3079 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)I 1458a_100000688020_100000187820 [0,1,0,0,1,0|2,0,0]=4 3080 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)O 1458a_100011934116_100000187820 [0,1,0,0,1,0|1,0,0]=3 3081 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)[O-])Br 1458a_100000701904_100020667443 [0,1,0,0,1,0|1,0,1]=4 3082 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)[O-])C 1458a_100000758298_100020667443 [0,1,0,0,1,0|1,0,1]=4 3083 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)[O-])Cl 1458a_100000692601_100020667443 [0,1,0,0,1,0|1,0,1]=4 3084 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)[O-])F 1458a_100000762013_100020667443 [0,1,0,0,1,0|1,0,1]=4 3085 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)[O-])I 1458a_100000688020_100020667443 [0,1,0,0,1,0|1,0,1]=4 3086 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)[O-])O 1458a_100011934116_100020667443 [0,1,0,0,1,0|0,0,1]=3 3087 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)O 1458a_100011934116_100011218427 [0,1,0,0,1,0|1,0,1]=4 3088 B14R1.5958 Cc1cccc(c1C(=O)C[N+](=O)[O-])O 1458a_100011934116_100000761209 [0,1,0,0,1,0|1,0,1]=4 3089 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000187820 [0,1,0,0,1,0|2,0,0]=4 3090 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000187820 [0,1,0,0,1,0|2,0,0]=4 3091 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)F 1458a_100000752694_100000187820 [0,1,0,0,1,0|2,0,0]=4 3092 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100000187820 [0,1,0,0,1,0|1,0,0]=3 3093 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000187820 [0,1,0,0,1,0|2,0,0]=4 3094 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000187820 [0,1,0,0,1,0|2,0,0]=4 3095 B14R1.5958 NC(=O)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000187820 [0,1,0,0,1,0|1,0,0]=3 3096 B14R1.5958 NC(=O)CC(=O)c1c(cccc1F)F 1458a_100000210804_100000187820 [0,1,0,0,1,0|2,0,0]=4 3097 B14R1.5958 NC(=O)CC(=O)c1c(cccc1F)O 1458a_100000763259_100000187820 [0,1,0,0,1,0|1,0,0]=3 3098 B14R1.5958 NC(=O)CC(=O)c1c(cccc1I)Br 1458a_100010232521_100000187820 [0,1,0,0,1,0|2,0,0]=4 3099 B14R1.5958 NC(=O)CC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000187820 [0,1,0,0,1,0|2,0,0]=4 3100 B14R1.5958 NC(=O)CC(=O)c1c(cccc1I)F 1458a_100000023732_100000187820 [0,1,0,0,1,0|2,0,0]=4 3101 B14R1.5958 NC(=O)CC(=O)c1c(cccc1O)O 1458a_100000755285_100000187820 [0,1,0,0,1,0|1,0,0]=3 3102 B14R1.5958 O=C(C[N+](=O)[O-])c1c(cccc1Br)O 1458a_100011935254_100000761209 [0,1,0,0,1,0|1,0,1]=4 3103 B14R1.5958 O=C(C[N+](=O)[O-])c1c(cccc1Cl)O 1458a_100000745519_100000761209 [0,1,0,0,1,0|1,0,1]=4 3104 B14R1.5958 O=C(C[N+](=O)[O-])c1c(cccc1F)O 1458a_100000763259_100000761209 [0,1,0,0,1,0|1,0,1]=4 3105 B14R1.5958 O=C(C[N+](=O)[O-])c1c(cccc1O)O 1458a_100000755285_100000761209 [0,1,0,0,1,0|1,0,1]=4 3106 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Br)Br 1458a_100000690891_100020667443 [0,1,0,0,1,0|1,0,1]=4 3107 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100020667443 [0,1,0,0,1,0|1,0,1]=4 3108 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Br)F 1458a_100000752694_100020667443 [0,1,0,0,1,0|1,0,1]=4 3109 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Br)O 1458a_100011935254_100020667443 [0,1,0,0,1,0|0,0,1]=3 3110 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100020667443 [0,1,0,0,1,0|1,0,1]=4 3111 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Cl)F 1458a_100000210369_100020667443 [0,1,0,0,1,0|1,0,1]=4 3112 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100020667443 [0,1,0,0,1,0|0,0,1]=3 3113 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1F)F 1458a_100000210804_100020667443 [0,1,0,0,1,0|1,0,1]=4 3114 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1F)O 1458a_100000763259_100020667443 [0,1,0,0,1,0|0,0,1]=3 3115 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1I)Br 1458a_100010232521_100020667443 [0,1,0,0,1,0|1,0,1]=4 3116 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1I)Cl 1458a_100000702859_100020667443 [0,1,0,0,1,0|1,0,1]=4 3117 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1I)F 1458a_100000023732_100020667443 [0,1,0,0,1,0|1,0,1]=4 3118 B14R1.5958 O=C([O-])CC(=O)c1c(cccc1O)O 1458a_100000755285_100020667443 [0,1,0,0,1,0|0,0,1]=3 3119 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000748629 [0,1,0,0,1,0|2,0,0]=4 3120 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)C 1458a_100000212137_100000748629 [0,1,0,0,1,0|2,0,0]=4 3121 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000748629 [0,1,0,0,1,0|2,0,0]=4 3122 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000748629 [0,1,0,0,1,0|2,0,0]=4 3123 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000748629 [0,1,0,0,1,0|2,0,0]=4 3124 B14R1.6048 C=C(C)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000748629 [0,1,0,0,1,0|2,0,0]=4 3125 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100009893438 [0,1,0,0,1,0|2,0,0]=4 3126 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)C 1458a_100000212137_100009893438 [0,1,0,0,1,0|2,0,0]=4 3127 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100009893438 [0,1,0,0,1,0|2,0,0]=4 3128 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100009893438 [0,1,0,0,1,0|2,0,0]=4 3129 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100009893438 [0,1,0,0,1,0|2,0,0]=4 3130 B14R1.6048 C=C(F)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100009893438 [0,1,0,0,1,0|2,0,0]=4 3131 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1Br)F 1458a_100000070787_100012361341 [0,1,0,0,1,0|2,0,0]=4 3132 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1C)C 1458a_100000070787_100000229959 [0,1,0,0,1,0|2,0,0]=4 3133 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000070787_100000185731 [0,1,0,0,1,0|2,0,0]=4 3134 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1Cl)F 1458a_100000070787_100012056422 [0,1,0,0,1,0|2,0,0]=4 3135 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1F)Br 1458a_100000070787_200012361339 [0,1,0,0,1,0|2,0,0]=4 3136 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1F)Cl 1458a_100000070787_100012351891 [0,1,0,0,1,0|2,0,0]=4 3137 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1F)F 1458a_100000070787_100000229962 [0,1,0,0,1,0|2,0,0]=4 3138 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1O)F 1458a_100000070787_100009817053 [0,1,0,0,1,0|1,0,0]=3 3139 B14R1.6048 CC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000070787_100009814262 [0,1,0,0,1,0|1,0,0]=3 3140 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011218427 [0,1,0,0,1,0|1,0,1]=4 3141 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011218427 [0,1,0,0,1,0|1,0,1]=4 3142 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100011218427 [0,1,0,0,1,0|1,0,1]=4 3143 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100011218427 [0,1,0,0,1,0|1,0,1]=4 3144 B14R1.6048 CC(O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100011218427 [0,1,0,0,1,0|1,0,1]=4 3145 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)Br 1458a_100000741311_100000187820 [0,1,0,0,1,0|2,0,0]=4 3146 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)Cl 1458a_100000688705_100000187820 [0,1,0,0,1,0|2,0,0]=4 3147 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)F 1458a_100000686989_100000187820 [0,1,0,0,1,0|2,0,0]=4 3148 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)I 1458a_100010189873_100000187820 [0,1,0,0,1,0|2,0,0]=4 3149 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)N)O 1458a_100000692822_100000187820 [0,1,0,0,1,0|2,0,0]=4 3150 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)[O-])Br 1458a_100000741311_100020667443 [0,1,0,0,1,0|1,0,1]=4 3151 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)[O-])Cl 1458a_100000688705_100020667443 [0,1,0,0,1,0|1,0,1]=4 3152 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)[O-])F 1458a_100000686989_100020667443 [0,1,0,0,1,0|1,0,1]=4 3153 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)[O-])I 1458a_100010189873_100020667443 [0,1,0,0,1,0|1,0,1]=4 3154 B14R1.6048 Cc1cc(ccc1C(=O)CC(=O)[O-])O 1458a_100000692822_100020667443 [0,1,0,0,1,0|1,0,1]=4 3155 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)CC(=O)N 1458a_100000685072_100000187820 [0,1,0,0,1,0|2,0,0]=4 3156 B14R1.6048 Cc1ccc(c(c1)Br)C(=O)CC(=O)[O-] 1458a_100000685072_100020667443 [0,1,0,0,1,0|1,0,1]=4 3157 B14R1.6048 Cc1ccc(c(c1)C)C(=O)CC(=O)N 1458a_100000211164_100000187820 [0,1,0,0,1,0|2,0,0]=4 3158 B14R1.6048 Cc1ccc(c(c1)C)C(=O)CC(=O)[O-] 1458a_100000211164_100020667443 [0,1,0,0,1,0|1,0,1]=4 3159 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)CC(=O)N 1458a_100000766932_100000187820 [0,1,0,0,1,0|2,0,0]=4 3160 B14R1.6048 Cc1ccc(c(c1)Cl)C(=O)CC(=O)[O-] 1458a_100000766932_100020667443 [0,1,0,0,1,0|1,0,1]=4 3161 B14R1.6048 Cc1ccc(c(c1)F)C(=O)CC(=O)N 1458a_100000766033_100000187820 [0,1,0,0,1,0|2,0,0]=4 3162 B14R1.6048 Cc1ccc(c(c1)F)C(=O)CC(=O)[O-] 1458a_100000766033_100020667443 [0,1,0,0,1,0|1,0,1]=4 3163 B14R1.6048 Cc1ccc(c(c1)I)C(=O)CC(=O)N 1458a_100009999607_100000187820 [0,1,0,0,1,0|2,0,0]=4 3164 B14R1.6048 Cc1ccc(c(c1)I)C(=O)CC(=O)[O-] 1458a_100009999607_100020667443 [0,1,0,0,1,0|1,0,1]=4 3165 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(=O)N 1458a_100000212137_100000187820 [0,1,0,0,1,0|1,0,0]=3 3166 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(=O)[O-] 1458a_100000212137_100020667443 [0,1,0,0,1,0|0,0,1]=3 3167 B14R1.6048 Cc1ccc(c(c1)O)C(=O)CC(C)O 1458a_100000212137_100011218427 [0,1,0,0,1,0|1,0,1]=4 3168 B14R1.6048 Cc1ccc(c(c1)O)C(=O)C[N+](=O)[O-] 1458a_100000212137_100000761209 [0,1,0,0,1,0|1,0,1]=4 3169 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000187820 [0,1,0,0,1,0|2,0,0]=4 3170 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000187820 [0,1,0,0,1,0|2,0,0]=4 3171 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000187820 [0,1,0,0,1,0|2,0,0]=4 3172 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000187820 [0,1,0,0,1,0|2,0,0]=4 3173 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000187820 [0,1,0,0,1,0|2,0,0]=4 3174 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000187820 [0,1,0,0,1,0|2,0,0]=4 3175 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000187820 [0,1,0,0,1,0|2,0,0]=4 3176 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000187820 [0,1,0,0,1,0|2,0,0]=4 3177 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000187820 [0,1,0,0,1,0|2,0,0]=4 3178 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000187820 [0,1,0,0,1,0|2,0,0]=4 3179 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000187820 [0,1,0,0,1,0|2,0,0]=4 3180 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000187820 [0,1,0,0,1,0|2,0,0]=4 3181 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)F 1458a_100000211022_100000187820 [0,1,0,0,1,0|2,0,0]=4 3182 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)I 1458a_100000037189_100000187820 [0,1,0,0,1,0|2,0,0]=4 3183 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1F)O 1458a_100000689029_100000187820 [0,1,0,0,1,0|2,0,0]=4 3184 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000187820 [0,1,0,0,1,0|2,0,0]=4 3185 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000187820 [0,1,0,0,1,0|2,0,0]=4 3186 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1I)F 1458a_100000739341_100000187820 [0,1,0,0,1,0|2,0,0]=4 3187 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000187820 [0,1,0,0,1,0|1,0,0]=3 3188 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000187820 [0,1,0,0,1,0|1,0,0]=3 3189 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000187820 [0,1,0,0,1,0|1,0,0]=3 3190 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000187820 [0,1,0,0,1,0|1,0,0]=3 3191 B14R1.6048 NC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000187820 [0,1,0,0,1,0|1,0,0]=3 3192 B14R1.6048 O=C(C[N+](=O)[O-])c1ccc(cc1O)Br 1458a_100000744433_100000761209 [0,1,0,0,1,0|1,0,1]=4 3193 B14R1.6048 O=C(C[N+](=O)[O-])c1ccc(cc1O)Cl 1458a_100000188622_100000761209 [0,1,0,0,1,0|1,0,1]=4 3194 B14R1.6048 O=C(C[N+](=O)[O-])c1ccc(cc1O)F 1458a_100000746061_100000761209 [0,1,0,0,1,0|1,0,1]=4 3195 B14R1.6048 O=C(C[N+](=O)[O-])c1ccc(cc1O)I 1458a_100000091984_100000761209 [0,1,0,0,1,0|1,0,1]=4 3196 B14R1.6048 O=C(C[N+](=O)[O-])c1ccc(cc1O)O 1458a_100000212172_100000761209 [0,1,0,0,1,0|1,0,1]=4 3197 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100020667443 [0,1,0,0,1,0|1,0,1]=4 3198 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100020667443 [0,1,0,0,1,0|1,0,1]=4 3199 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100020667443 [0,1,0,0,1,0|1,0,1]=4 3200 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100020667443 [0,1,0,0,1,0|1,0,1]=4 3201 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100020667443 [0,1,0,0,1,0|1,0,1]=4 3202 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100020667443 [0,1,0,0,1,0|1,0,1]=4 3203 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100020667443 [0,1,0,0,1,0|1,0,1]=4 3204 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100020667443 [0,1,0,0,1,0|1,0,1]=4 3205 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100020667443 [0,1,0,0,1,0|1,0,1]=4 3206 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100020667443 [0,1,0,0,1,0|1,0,1]=4 3207 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100020667443 [0,1,0,0,1,0|1,0,1]=4 3208 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100020667443 [0,1,0,0,1,0|1,0,1]=4 3209 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1F)F 1458a_100000211022_100020667443 [0,1,0,0,1,0|1,0,1]=4 3210 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1F)I 1458a_100000037189_100020667443 [0,1,0,0,1,0|1,0,1]=4 3211 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1F)O 1458a_100000689029_100020667443 [0,1,0,0,1,0|1,0,1]=4 3212 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100020667443 [0,1,0,0,1,0|1,0,1]=4 3213 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100020667443 [0,1,0,0,1,0|1,0,1]=4 3214 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1I)F 1458a_100000739341_100020667443 [0,1,0,0,1,0|1,0,1]=4 3215 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100020667443 [0,1,0,0,1,0|0,0,1]=3 3216 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100020667443 [0,1,0,0,1,0|0,0,1]=3 3217 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1O)F 1458a_100000746061_100020667443 [0,1,0,0,1,0|0,0,1]=3 3218 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1O)I 1458a_100000091984_100020667443 [0,1,0,0,1,0|0,0,1]=3 3219 B14R1.6048 O=C([O-])CC(=O)c1ccc(cc1O)O 1458a_100000212172_100020667443 [0,1,0,0,1,0|0,0,1]=3 3220 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000748629 [0,1,0,0,1,0|2,0,0]=4 3221 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)C 1458a_100000229998_100000748629 [0,1,0,0,1,0|2,0,0]=4 3222 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000748629 [0,1,0,0,1,0|2,0,0]=4 3223 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100000748629 [0,1,0,0,1,0|2,0,0]=4 3224 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100000748629 [0,1,0,0,1,0|2,0,0]=4 3225 B14R1.6052 C=C(C)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000748629 [0,1,0,0,1,0|2,0,0]=4 3226 B14R1.6052 C=C(F)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100009893438 [0,1,0,0,1,0|2,0,0]=4 3227 B14R1.6052 C=C(F)CC(=O)c1cc(ccc1O)C 1458a_100000229998_100009893438 [0,1,0,0,1,0|2,0,0]=4 3228 B14R1.6052 C=C(F)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100009893438 [0,1,0,0,1,0|2,0,0]=4 3229 B14R1.6052 C=C(F)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100009893438 [0,1,0,0,1,0|2,0,0]=4 3230 B14R1.6052 C=C(F)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100009893438 [0,1,0,0,1,0|2,0,0]=4 3231 B14R1.6052 C=C(F)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100009893438 [0,1,0,0,1,0|2,0,0]=4 3232 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1Br)Cl 1458a_100000070787_100012361344 [0,1,0,0,1,0|2,0,0]=4 3233 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1C)C 1458a_100000070787_100000183774 [0,1,0,0,1,0|2,0,0]=4 3234 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1Cl)Cl 1458a_100000070787_100000183120 [0,1,0,0,1,0|2,0,0]=4 3235 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1Cl)F 1458a_100000070787_200010187420 [0,1,0,0,1,0|2,0,0]=4 3236 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1F)F 1458a_100000070787_100000211571 [0,1,0,0,1,0|2,0,0]=4 3237 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000070787_200009828000 [0,1,0,0,1,0|1,0,0]=3 3238 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000070787_200009816716 [0,1,0,0,1,0|1,0,0]=3 3239 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)F 1458a_100000070787_100000047744 [0,1,0,0,1,0|1,0,0]=3 3240 B14R1.6052 CC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000070787_100009814097 [0,1,0,0,1,0|1,0,0]=3 3241 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011218427 [0,1,0,0,1,0|1,0,1]=4 3242 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011218427 [0,1,0,0,1,0|1,0,1]=4 3243 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100011218427 [0,1,0,0,1,0|1,0,1]=4 3244 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100011218427 [0,1,0,0,1,0|1,0,1]=4 3245 B14R1.6052 CC(O)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100011218427 [0,1,0,0,1,0|1,0,1]=4 3246 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)Br 1458a_100000689033_100000187820 [0,1,0,0,1,0|2,0,0]=4 3247 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)C 1458a_100000195421_100000187820 [0,1,0,0,1,0|2,0,0]=4 3248 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)Cl 1458a_100011290873_100000187820 [0,1,0,0,1,0|2,0,0]=4 3249 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)F 1458a_100000749327_100000187820 [0,1,0,0,1,0|2,0,0]=4 3250 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)I 1458a_100000057929_100000187820 [0,1,0,0,1,0|2,0,0]=4 3251 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)N)O 1458a_100000229998_100000187820 [0,1,0,0,1,0|1,0,0]=3 3252 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)[O-])Br 1458a_100000689033_100020667443 [0,1,0,0,1,0|1,0,1]=4 3253 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)[O-])C 1458a_100000195421_100020667443 [0,1,0,0,1,0|1,0,1]=4 3254 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)[O-])Cl 1458a_100011290873_100020667443 [0,1,0,0,1,0|1,0,1]=4 3255 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)[O-])F 1458a_100000749327_100020667443 [0,1,0,0,1,0|1,0,1]=4 3256 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)[O-])I 1458a_100000057929_100020667443 [0,1,0,0,1,0|1,0,1]=4 3257 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(=O)[O-])O 1458a_100000229998_100020667443 [0,1,0,0,1,0|0,0,1]=3 3258 B14R1.6052 Cc1ccc(c(c1)C(=O)CC(C)O)O 1458a_100000229998_100011218427 [0,1,0,0,1,0|1,0,1]=4 3259 B14R1.6052 Cc1ccc(c(c1)C(=O)C[N+](=O)[O-])O 1458a_100000229998_100000761209 [0,1,0,0,1,0|1,0,1]=4 3260 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)Br 1458a_100000759961_100000187820 [0,1,0,0,1,0|2,0,0]=4 3261 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)Cl 1458a_100000692595_100000187820 [0,1,0,0,1,0|2,0,0]=4 3262 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)F 1458a_100000240043_100000187820 [0,1,0,0,1,0|2,0,0]=4 3263 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)I 1458a_100000688012_100000187820 [0,1,0,0,1,0|2,0,0]=4 3264 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)N)O 1458a_100000687834_100000187820 [0,1,0,0,1,0|2,0,0]=4 3265 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)[O-])Br 1458a_100000759961_100020667443 [0,1,0,0,1,0|1,0,1]=4 3266 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)[O-])Cl 1458a_100000692595_100020667443 [0,1,0,0,1,0|1,0,1]=4 3267 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)[O-])F 1458a_100000240043_100020667443 [0,1,0,0,1,0|1,0,1]=4 3268 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)[O-])I 1458a_100000688012_100020667443 [0,1,0,0,1,0|1,0,1]=4 3269 B14R1.6052 Cc1ccc(cc1C(=O)CC(=O)[O-])O 1458a_100000687834_100020667443 [0,1,0,0,1,0|1,0,1]=4 3270 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000187820 [0,1,0,0,1,0|2,0,0]=4 3271 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000187820 [0,1,0,0,1,0|2,0,0]=4 3272 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000187820 [0,1,0,0,1,0|2,0,0]=4 3273 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000187820 [0,1,0,0,1,0|2,0,0]=4 3274 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000187820 [0,1,0,0,1,0|2,0,0]=4 3275 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000187820 [0,1,0,0,1,0|2,0,0]=4 3276 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000187820 [0,1,0,0,1,0|2,0,0]=4 3277 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000187820 [0,1,0,0,1,0|2,0,0]=4 3278 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000187820 [0,1,0,0,1,0|2,0,0]=4 3279 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000187820 [0,1,0,0,1,0|2,0,0]=4 3280 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000187820 [0,1,0,0,1,0|2,0,0]=4 3281 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000187820 [0,1,0,0,1,0|2,0,0]=4 3282 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)F 1458a_100000198512_100000187820 [0,1,0,0,1,0|2,0,0]=4 3283 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)I 1458a_100000688014_100000187820 [0,1,0,0,1,0|2,0,0]=4 3284 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1F)O 1458a_100000037260_100000187820 [0,1,0,0,1,0|2,0,0]=4 3285 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000187820 [0,1,0,0,1,0|2,0,0]=4 3286 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000187820 [0,1,0,0,1,0|2,0,0]=4 3287 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)F 1458a_100000748905_100000187820 [0,1,0,0,1,0|2,0,0]=4 3288 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)I 1458a_100000750460_100000187820 [0,1,0,0,1,0|2,0,0]=4 3289 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1I)O 1458a_200009995701_100000187820 [0,1,0,0,1,0|2,0,0]=4 3290 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000187820 [0,1,0,0,1,0|1,0,0]=3 3291 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000187820 [0,1,0,0,1,0|1,0,0]=3 3292 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100000187820 [0,1,0,0,1,0|1,0,0]=3 3293 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100000187820 [0,1,0,0,1,0|1,0,0]=3 3294 B14R1.6052 NC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000187820 [0,1,0,0,1,0|1,0,0]=3 3295 B14R1.6052 O=C(C[N+](=O)[O-])c1cc(ccc1O)Br 1458a_100000212140_100000761209 [0,1,0,0,1,0|1,0,1]=4 3296 B14R1.6052 O=C(C[N+](=O)[O-])c1cc(ccc1O)Cl 1458a_100000212143_100000761209 [0,1,0,0,1,0|1,0,1]=4 3297 B14R1.6052 O=C(C[N+](=O)[O-])c1cc(ccc1O)F 1458a_100000742286_100000761209 [0,1,0,0,1,0|1,0,1]=4 3298 B14R1.6052 O=C(C[N+](=O)[O-])c1cc(ccc1O)I 1458a_100000212111_100000761209 [0,1,0,0,1,0|1,0,1]=4 3299 B14R1.6052 O=C(C[N+](=O)[O-])c1cc(ccc1O)O 1458a_100000758025_100000761209 [0,1,0,0,1,0|1,0,1]=4 3300 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100020667443 [0,1,0,0,1,0|1,0,1]=4 3301 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100020667443 [0,1,0,0,1,0|1,0,1]=4 3302 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Br)F 1458a_100000212315_100020667443 [0,1,0,0,1,0|1,0,1]=4 3303 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Br)I 1458a_100000698340_100020667443 [0,1,0,0,1,0|1,0,1]=4 3304 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100020667443 [0,1,0,0,1,0|1,0,1]=4 3305 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100020667443 [0,1,0,0,1,0|1,0,1]=4 3306 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100020667443 [0,1,0,0,1,0|1,0,1]=4 3307 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100020667443 [0,1,0,0,1,0|1,0,1]=4 3308 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100020667443 [0,1,0,0,1,0|1,0,1]=4 3309 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100020667443 [0,1,0,0,1,0|1,0,1]=4 3310 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1F)Br 1458a_100000212322_100020667443 [0,1,0,0,1,0|1,0,1]=4 3311 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100020667443 [0,1,0,0,1,0|1,0,1]=4 3312 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1F)F 1458a_100000198512_100020667443 [0,1,0,0,1,0|1,0,1]=4 3313 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1F)I 1458a_100000688014_100020667443 [0,1,0,0,1,0|1,0,1]=4 3314 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1F)O 1458a_100000037260_100020667443 [0,1,0,0,1,0|1,0,1]=4 3315 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1I)Br 1458a_100000183945_100020667443 [0,1,0,0,1,0|1,0,1]=4 3316 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100020667443 [0,1,0,0,1,0|1,0,1]=4 3317 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1I)F 1458a_100000748905_100020667443 [0,1,0,0,1,0|1,0,1]=4 3318 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1I)I 1458a_100000750460_100020667443 [0,1,0,0,1,0|1,0,1]=4 3319 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1I)O 1458a_200009995701_100020667443 [0,1,0,0,1,0|1,0,1]=4 3320 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100020667443 [0,1,0,0,1,0|0,0,1]=3 3321 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100020667443 [0,1,0,0,1,0|0,0,1]=3 3322 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1O)F 1458a_100000742286_100020667443 [0,1,0,0,1,0|0,0,1]=3 3323 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1O)I 1458a_100000212111_100020667443 [0,1,0,0,1,0|0,0,1]=3 3324 B14R1.6052 O=C([O-])CC(=O)c1cc(ccc1O)O 1458a_100000758025_100020667443 [0,1,0,0,1,0|0,0,1]=3 3325 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)Br 22a_100011934915_200000688413 [0,1,0,0,0,1|2,0,0]=4 3326 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)Br 527a_100011934915_200000688413 [0,1,0,0,0,1|2,0,0]=4 3327 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)C 11a_100000756359_200000688413 [0,1,0,0,0,1|2,0,0]=4 3328 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)C 1626a_100000756359_200000688413 [0,1,0,0,0,1|2,0,0]=4 3329 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)C 22a_100000756359_200000688413 [0,1,0,0,0,1|2,0,0]=4 3330 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)C 527a_100000756359_200000688413 [0,1,0,0,0,1|2,0,0]=4 3331 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_200000688413 [0,1,0,0,0,1|2,0,0]=4 3332 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_200000688413 [0,1,0,0,0,1|2,0,0]=4 3333 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)F 1626a_100011934987_200000688413 [0,1,0,0,0,1|2,0,0]=4 3334 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)F 22a_100011934987_200000688413 [0,1,0,0,0,1|2,0,0]=4 3335 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)F 527a_100011934987_200000688413 [0,1,0,0,0,1|2,0,0]=4 3336 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)I 1626a_100010084371_200000688413 [0,1,0,0,0,1|2,0,0]=4 3337 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)I 22a_100010084371_200000688413 [0,1,0,0,0,1|2,0,0]=4 3338 B16R1.85 C=C(C)CCC(=O)Nc1cccc(c1O)I 527a_100010084371_200000688413 [0,1,0,0,0,1|2,0,0]=4 3339 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000194580 [0,1,0,0,0,1|2,0,0]=4 3340 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000194580 [0,1,0,0,0,1|2,0,0]=4 3341 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000194580 [0,1,0,0,0,1|2,0,0]=4 3342 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000194580 [0,1,0,0,0,1|2,0,0]=4 3343 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000194580 [0,1,0,0,0,1|2,0,0]=4 3344 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000194580 [0,1,0,0,0,1|2,0,0]=4 3345 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000194580 [0,1,0,0,0,1|2,0,0]=4 3346 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000194580 [0,1,0,0,0,1|2,0,0]=4 3347 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000194580 [0,1,0,0,0,1|2,0,0]=4 3348 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000194580 [0,1,0,0,0,1|2,0,0]=4 3349 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000194580 [0,1,0,0,0,1|2,0,0]=4 3350 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000194580 [0,1,0,0,0,1|2,0,0]=4 3351 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000194580 [0,1,0,0,0,1|2,0,0]=4 3352 B16R1.85 CC(=O)NCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000194580 [0,1,0,0,0,1|2,0,0]=4 3353 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000183556 [0,1,0,0,0,1|2,0,0]=4 3354 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000183556 [0,1,0,0,0,1|2,0,0]=4 3355 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000183556 [0,1,0,0,0,1|2,0,0]=4 3356 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000183556 [0,1,0,0,0,1|2,0,0]=4 3357 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000183556 [0,1,0,0,0,1|2,0,0]=4 3358 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000183556 [0,1,0,0,0,1|2,0,0]=4 3359 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000183556 [0,1,0,0,0,1|2,0,0]=4 3360 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000183556 [0,1,0,0,0,1|2,0,0]=4 3361 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000183556 [0,1,0,0,0,1|2,0,0]=4 3362 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000183556 [0,1,0,0,0,1|2,0,0]=4 3363 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000183556 [0,1,0,0,0,1|2,0,0]=4 3364 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000183556 [0,1,0,0,0,1|2,0,0]=4 3365 B16R1.85 CC(=O)OCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000183556 [0,1,0,0,0,1|2,0,0]=4 3366 B16R1.85 CC(=O)SCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000049016 [0,1,0,0,0,1|2,0,0]=4 3367 B16R1.85 CC(=O)SCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000049016 [0,1,0,0,0,1|2,0,0]=4 3368 B16R1.85 CC(=O)SCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000049016 [0,1,0,0,0,1|2,0,0]=4 3369 B16R1.85 CC(=O)SCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000049016 [0,1,0,0,0,1|2,0,0]=4 3370 B16R1.85 CC(O)CCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000718519 [0,1,0,0,0,1|1,0,1]=4 3371 B16R1.85 CC(O)CCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000718519 [0,1,0,0,0,1|1,0,1]=4 3372 B16R1.85 Cc1c(cccc1CC(=O)CCC(=O)N)Br 1458a_100011215257_100000694682 [0,1,0,0,0,1|2,0,0]=4 3373 B16R1.85 Cc1c(cccc1CC(=O)CCC(=O)N)Cl 1458a_100011215257_100012186920 [0,1,0,0,0,1|2,0,0]=4 3374 B16R1.85 Cc1c(cccc1CC(=O)CCC(=O)N)F 1458a_100011215257_100009813626 [0,1,0,0,0,1|2,0,0]=4 3375 B16R1.85 Cc1c(cccc1CC(=O)CCC(=O)N)I 1458a_100011215257_100010150147 [0,1,0,0,0,1|2,0,0]=4 3376 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)Br 22a_100000750434_100011215257 [0,1,0,0,0,1|2,0,0]=4 3377 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)Br 527a_100000750434_100011215257 [0,1,0,0,0,1|2,0,0]=4 3378 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)Cl 22a_100000210441_100011215257 [0,1,0,0,0,1|2,0,0]=4 3379 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)Cl 527a_100000210441_100011215257 [0,1,0,0,0,1|2,0,0]=4 3380 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)F 22a_100000745574_100011215257 [0,1,0,0,0,1|2,0,0]=4 3381 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)F 527a_100000745574_100011215257 [0,1,0,0,0,1|2,0,0]=4 3382 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)I 22a_100000761887_100011215257 [0,1,0,0,0,1|2,0,0]=4 3383 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)I 527a_100000761887_100011215257 [0,1,0,0,0,1|2,0,0]=4 3384 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)O 22a_100011216573_100011215257 [0,1,0,0,0,1|2,0,0]=4 3385 B16R1.85 Cc1c(cccc1NC(=O)CCC(=O)N)O 527a_100011216573_100011215257 [0,1,0,0,0,1|2,0,0]=4 3386 B16R1.85 Cc1cccc(c1Br)CC(=O)CCC(=O)N 1458a_100011215257_200012349612 [0,1,0,0,0,1|2,0,0]=4 3387 B16R1.85 Cc1cccc(c1Br)NC(=O)CCC(=O)N 22a_100000684715_100011215257 [0,1,0,0,0,1|2,0,0]=4 3388 B16R1.85 Cc1cccc(c1C)CC(=O)CCC(=O)N 1458a_100011215257_100011515928 [0,1,0,0,0,1|2,0,0]=4 3389 B16R1.85 Cc1cccc(c1C)NC(=O)CCC(=O)N 22a_100000210026_100011215257 [0,1,0,0,0,1|2,0,0]=4 3390 B16R1.85 Cc1cccc(c1C)NC(=O)CCC(=O)N 527a_100000210026_100011215257 [0,1,0,0,0,1|2,0,0]=4 3391 B16R1.85 Cc1cccc(c1Cl)NC(=O)CCC(=O)N 22a_100000765562_100011215257 [0,1,0,0,0,1|2,0,0]=4 3392 B16R1.85 Cc1cccc(c1F)CC(=O)CCC(=O)N 1458a_100011215257_100011216058 [0,1,0,0,0,1|2,0,0]=4 3393 B16R1.85 Cc1cccc(c1F)NC(=O)CCC(=O)N 527a_100000697159_100011215257 [0,1,0,0,0,1|2,0,0]=4 3394 B16R1.85 Cc1cccc(c1O)NC(=O)CCC(=O)N 22a_100000756359_100011215257 [0,1,0,0,0,1|1,0,0]=3 3395 B16R1.85 Cc1cccc(c1O)NC(=O)CCC(=O)N 527a_100000756359_100011215257 [0,1,0,0,0,1|1,0,0]=3 3396 B16R1.85 Cc1cccc(c1O)NC(=O)CCC(C)O 1626a_100000756359_100000718519 [0,1,0,0,0,1|1,0,1]=4 3397 B16R1.85 Cc1cccc(c1O)NC(=O)CC[N+](=O)[O-] 11a_100000756359_200000064761 [0,1,0,0,0,1|1,0,1]=4 3398 B16R1.85 Cc1cccc(c1O)NC(=O)CC[N+](=O)[O-] 1626a_100000756359_200000064761 [0,1,0,0,0,1|1,0,1]=4 3399 B16R1.85 Cc1cccc(c1O)NC(=O)CNC(=O)N 22a_100000756359_100000184981 [0,1,0,0,0,1|2,0,0]=4 3400 B16R1.85 Cc1cccc(c1O)NC(=O)CNC(=O)N 527a_100000756359_100000184981 [0,1,0,0,0,1|2,0,0]=4 3401 B16R1.85 Cc1cccc(c1O)NC(=O)NCC(=O)N 2430a_100000756359_100000711301 [0,1,0,0,0,1|2,0,0]=4 3402 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1Br)Cl 1458a_100011215257_100010145525 [0,1,0,0,0,1|2,0,0]=4 3403 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1Br)F 1458a_100011215257_100012351116 [0,1,0,0,0,1|2,0,0]=4 3404 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1Br)I 1458a_100011215257_100010254545 [0,1,0,0,0,1|2,0,0]=4 3405 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1Cl)Br 1458a_100011215257_100012349491 [0,1,0,0,0,1|2,0,0]=4 3406 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100011215257_100000720918 [0,1,0,0,0,1|2,0,0]=4 3407 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1Cl)F 1458a_100011215257_100000696688 [0,1,0,0,0,1|2,0,0]=4 3408 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1F)Br 1458a_100011215257_100012356507 [0,1,0,0,0,1|2,0,0]=4 3409 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1F)Cl 1458a_100011215257_100000716733 [0,1,0,0,0,1|2,0,0]=4 3410 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1F)F 1458a_100011215257_100000217499 [0,1,0,0,0,1|2,0,0]=4 3411 B16R1.85 NC(=O)CCC(=O)Cc1cccc(c1I)F 1458a_100011215257_100010149603 [0,1,0,0,0,1|2,0,0]=4 3412 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100011215257 [0,1,0,0,0,1|2,0,0]=4 3413 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100011215257 [0,1,0,0,0,1|2,0,0]=4 3414 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100011215257 [0,1,0,0,0,1|2,0,0]=4 3415 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100011215257 [0,1,0,0,0,1|2,0,0]=4 3416 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1F)Br 22a_100011935091_100011215257 [0,1,0,0,0,1|2,0,0]=4 3417 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1F)Br 527a_100011935091_100011215257 [0,1,0,0,0,1|2,0,0]=4 3418 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100011215257 [0,1,0,0,0,1|2,0,0]=4 3419 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1F)F 22a_100000743855_100011215257 [0,1,0,0,0,1|2,0,0]=4 3420 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100011215257 [0,1,0,0,0,1|1,0,0]=3 3421 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100011215257 [0,1,0,0,0,1|1,0,0]=3 3422 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100011215257 [0,1,0,0,0,1|1,0,0]=3 3423 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100011215257 [0,1,0,0,0,1|1,0,0]=3 3424 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)F 22a_100011934987_100011215257 [0,1,0,0,0,1|1,0,0]=3 3425 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)F 527a_100011934987_100011215257 [0,1,0,0,0,1|1,0,0]=3 3426 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)I 22a_100010084371_100011215257 [0,1,0,0,0,1|1,0,0]=3 3427 B16R1.85 NC(=O)CCC(=O)Nc1cccc(c1O)I 527a_100010084371_100011215257 [0,1,0,0,0,1|1,0,0]=3 3428 B16R1.85 NC(=O)CNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100000711301 [0,1,0,0,0,1|2,0,0]=4 3429 B16R1.85 NC(=O)CNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100000711301 [0,1,0,0,0,1|2,0,0]=4 3430 B16R1.85 NC(=O)CNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100000711301 [0,1,0,0,0,1|2,0,0]=4 3431 B16R1.85 NC(=O)CNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100000711301 [0,1,0,0,0,1|2,0,0]=4 3432 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000184981 [0,1,0,0,0,1|2,0,0]=4 3433 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000184981 [0,1,0,0,0,1|2,0,0]=4 3434 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000184981 [0,1,0,0,0,1|2,0,0]=4 3435 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000184981 [0,1,0,0,0,1|2,0,0]=4 3436 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000184981 [0,1,0,0,0,1|2,0,0]=4 3437 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000184981 [0,1,0,0,0,1|2,0,0]=4 3438 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000184981 [0,1,0,0,0,1|2,0,0]=4 3439 B16R1.85 NC(=O)NCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000184981 [0,1,0,0,0,1|2,0,0]=4 3440 B16R1.85 O=C(CC[N+](=O)[O-])Nc1cccc(c1O)F 1626a_100011934987_200000064761 [0,1,0,0,0,1|1,0,1]=4 3441 B16R1.85 O=C(CC[N+](=O)[O-])Nc1cccc(c1O)I 1626a_100010084371_200000064761 [0,1,0,0,0,1|1,0,1]=4 3442 B16R1.1369 C#Cc1ccccc1NC(=O)CCC(=O)N 22a_100011470550_100011215257 [0,1,0,0,0,1|2,0,0]=4 3443 B16R1.1369 C=C(C)CCC(=O)Cc1ccccc1CO 1458a_200000688413_100009816955 [0,1,0,0,0,1|2,0,0]=4 3444 B16R1.1369 C=C(C)CCC(=O)Cc1ccccc1OC 1458a_100000211604_100000730704 [0,1,0,0,0,1|2,0,0]=4 3445 B16R1.1369 C=C(C)CCC(=O)Cc1ccccc1OC 1458a_200000688413_100000210004 [0,1,0,0,0,1|2,0,0]=4 3446 B16R1.1369 C=C(C)CCC(=O)Nc1ccccc1CO 22a_100000212039_200000688413 [0,1,0,0,0,1|2,0,0]=4 3447 B16R1.1369 C=C(C)CCC(=O)Nc1ccccc1OC 11a_100000210025_200000688413 [0,1,0,0,0,1|2,0,0]=4 3448 B16R1.1369 C=C(C)CCC(=O)Nc1ccccc1OC 1626a_100000210025_200000688413 [0,1,0,0,0,1|2,0,0]=4 3449 B16R1.1369 C=C(C)CCC(=O)Nc1ccccc1OC 22a_100000210025_200000688413 [0,1,0,0,0,1|2,0,0]=4 3450 B16R1.1369 C=C(C)CCC(=O)Nc1ccccc1OC 527a_100000210025_200000688413 [0,1,0,0,0,1|2,0,0]=4 3451 B16R1.1369 C=Cc1ccccc1NC(=O)CCC(=O)N 22a_100012022501_100011215257 [0,1,0,0,0,1|2,0,0]=4 3452 B16R1.1369 CC(=O)NCC(=O)Cc1ccccc1CO 1458a_100000194580_100009816955 [0,1,0,0,0,1|2,0,0]=4 3453 B16R1.1369 CC(=O)NCC(=O)Nc1ccccc1CO 22a_100000212039_100000194580 [0,1,0,0,0,1|2,0,0]=4 3454 B16R1.1369 CC(=O)OCC(=O)Cc1ccccc1CO 1458a_100000183556_100009816955 [0,1,0,0,0,1|2,0,0]=4 3455 B16R1.1369 CC(=O)OCC(=O)Nc1ccccc1CO 22a_100000212039_100000183556 [0,1,0,0,0,1|2,0,0]=4 3456 B16R1.1369 CC(=O)SCC(=O)Cc1ccccc1CO 1458a_100000049016_100009816955 [0,1,0,0,0,1|2,0,0]=4 3457 B16R1.1369 CCc1ccccc1NC(=O)CCC(=O)C 1458a_200000181015_200000210301 [0,1,0,0,0,1|2,0,0]=4 3458 B16R1.1369 CCc1ccccc1NC(=O)CCC(=O)N 22a_100000212081_100011215257 [0,1,0,0,0,1|2,0,0]=4 3459 B16R1.1369 CCc1ccccc1NC(=O)CCC(=O)N 527a_100000212081_100011215257 [0,1,0,0,0,1|2,0,0]=4 3460 B16R1.1369 CCc1ccccc1NC(=O)CCC(=O)[13CH3] 1458a_200000181015_200025704644 [0,1,0,0,0,1|2,0,0]=4 3461 B16R1.1369 COc1ccccc1CC(=O)CCC(=O)N 1458a_100011215257_100000210004 [0,1,0,0,0,1|1,0,0]=3 3462 B16R1.1369 COc1ccccc1CC(=O)CCC(C)O 1458a_100000211604_100012276601 [0,1,0,0,0,1|1,0,1]=4 3463 B16R1.1369 COc1ccccc1CC(=O)CC[N+](=O)[O-] 1458a_200000064761_100000210004 [0,1,0,0,0,1|1,0,1]=4 3464 B16R1.1369 COc1ccccc1CC(=O)CNC(=O)C 1458a_100000194580_100000210004 [0,1,0,0,0,1|2,0,0]=4 3465 B16R1.1369 COc1ccccc1CC(=O)CNC(=O)N 1458a_100000184981_100000210004 [0,1,0,0,0,1|2,0,0]=4 3466 B16R1.1369 COc1ccccc1CC(=O)COC(=O)C 1458a_100000183556_100000210004 [0,1,0,0,0,1|2,0,0]=4 3467 B16R1.1369 COc1ccccc1CC(=O)CSC(=O)C 1458a_100000049016_100000210004 [0,1,0,0,0,1|2,0,0]=4 3468 B16R1.1369 COc1ccccc1CC(=O)NCC(=O)N 11a_100000711301_100000211604 [0,1,0,0,0,1|2,0,0]=4 3469 B16R1.1369 COc1ccccc1CC(=O)NCC(=O)N 240690a_100000711301_100000211604 [0,1,0,0,0,1|2,0,0]=4 3470 B16R1.1369 COc1ccccc1CC(=O)NCC(=O)N 527a_100000711301_100000211604 [0,1,0,0,0,1|2,0,0]=4 3471 B16R1.1369 COc1ccccc1NC(=O)CCC(=O)N 22a_100000210025_100011215257 [0,1,0,0,0,1|1,0,0]=3 3472 B16R1.1369 COc1ccccc1NC(=O)CCC(=O)N 527a_100000210025_100011215257 [0,1,0,0,0,1|1,0,0]=3 3473 B16R1.1369 COc1ccccc1NC(=O)CCC(C)O 1626a_100000210025_100000718519 [0,1,0,0,0,1|1,0,1]=4 3474 B16R1.1369 COc1ccccc1NC(=O)CC[N+](=O)[O-] 11a_100000210025_200000064761 [0,1,0,0,0,1|1,0,1]=4 3475 B16R1.1369 COc1ccccc1NC(=O)CC[N+](=O)[O-] 1626a_100000210025_200000064761 [0,1,0,0,0,1|1,0,1]=4 3476 B16R1.1369 COc1ccccc1NC(=O)CNC(=O)C 11a_100000210025_100000194580 [0,1,0,0,0,1|2,0,0]=4 3477 B16R1.1369 COc1ccccc1NC(=O)CNC(=O)C 1626a_100000210025_100000194580 [0,1,0,0,0,1|2,0,0]=4 3478 B16R1.1369 COc1ccccc1NC(=O)CNC(=O)C 22a_100000210025_100000194580 [0,1,0,0,0,1|2,0,0]=4 3479 B16R1.1369 COc1ccccc1NC(=O)CNC(=O)C 527a_100000210025_100000194580 [0,1,0,0,0,1|2,0,0]=4 3480 B16R1.1369 COc1ccccc1NC(=O)CNC(=O)N 22a_100000210025_100000184981 [0,1,0,0,0,1|2,0,0]=4 3481 B16R1.1369 COc1ccccc1NC(=O)CNC(=O)N 527a_100000210025_100000184981 [0,1,0,0,0,1|2,0,0]=4 3482 B16R1.1369 COc1ccccc1NC(=O)COC(=O)C 1626a_100000210025_100000183556 [0,1,0,0,0,1|2,0,0]=4 3483 B16R1.1369 COc1ccccc1NC(=O)COC(=O)C 22a_100000210025_100000183556 [0,1,0,0,0,1|2,0,0]=4 3484 B16R1.1369 COc1ccccc1NC(=O)COC(=O)C 527a_100000210025_100000183556 [0,1,0,0,0,1|2,0,0]=4 3485 B16R1.1369 COc1ccccc1NC(=O)CSC(=O)C 11a_100000210025_100000049016 [0,1,0,0,0,1|2,0,0]=4 3486 B16R1.1369 COc1ccccc1NC(=O)CSC(=O)C 1626a_100000210025_100000049016 [0,1,0,0,0,1|2,0,0]=4 3487 B16R1.1369 COc1ccccc1NC(=O)NCC(=O)N 2430a_100000210025_100000711301 [0,1,0,0,0,1|2,0,0]=4 3488 B16R1.1369 COc1cnccc1CC(=O)CCC(=O)N 1458a_100011215257_100020635607 [0,1,0,0,0,1|2,0,0]=4 3489 B16R1.1369 COc1ncccc1CC(=O)CCC(=O)N 1458a_100011215257_100020631285 [0,1,0,0,0,1|2,0,0]=4 3490 B16R1.1369 CSc1ccccc1CC(=O)CCC(=O)N 1458a_100011215257_100000699184 [0,1,0,0,0,1|1,1,0]=4 3491 B16R1.1369 CSc1ccccc1NC(=O)CCC(=O)C 1458a_200000181009_200000210301 [0,1,0,0,0,1|1,1,0]=4 3492 B16R1.1369 CSc1ccccc1NC(=O)CCC(=O)N 22a_100000211160_100011215257 [0,1,0,0,0,1|1,1,0]=4 3493 B16R1.1369 CSc1ccccc1NC(=O)CCC(=O)[13CH3] 1458a_200000181009_200025704644 [0,1,0,0,0,1|1,1,0]=4 3494 B16R1.1369 N#Cc1ccccc1CC(=O)CCC(=O)N 1458a_100011215257_100000181865 [0,1,0,0,0,1|2,0,0]=4 3495 B16R1.1369 NC(=O)CCC(=O)Cc1ccccc1C=O 1458a_100011215257_200009853537 [0,1,0,0,0,1|1,0,1]=4 3496 B16R1.1369 NC(=O)CCC(=O)Cc1ccccc1CO 1458a_100011215257_100009816955 [0,1,0,0,0,1|1,0,0]=3 3497 B16R1.1369 NC(=O)CCC(=O)Nc1ccccc1CO 22a_100000212039_100011215257 [0,1,0,0,0,1|1,0,0]=3 3498 B16R1.1369 NC(=O)NCC(=O)Cc1ccccc1CO 1458a_100000184981_100009816955 [0,1,0,0,0,1|2,0,0]=4 3499 B16R1.1369 NC(=O)NCC(=O)Nc1ccccc1CO 22a_100000212039_100000184981 [0,1,0,0,0,1|2,0,0]=4 3500 B16R1.1369 O=C(CC[N+](=O)[O-])Cc1ccccc1CO 1458a_200000064761_100009816955 [0,1,0,0,0,1|1,0,1]=4 3501 B16R1.7412 CC(=O)N[C@H](C)C(=O)Nc1ccccc1O 22a_100000185747_100011504603 [0,1,0,0,0,1|2,0,0]=4 3502 B16R1.7412 CC(=O)N[C@H](C)C(=O)Nc1ccccc1O 527a_100000185747_100011504603 [0,1,0,0,0,1|2,0,0]=4 3503 B16R1.7412 CC(=O)OC(C)C(=O)Cc1ccccc1O 1458a_100000743006_100009818208 [0,1,0,0,0,1|2,0,0]=4 3504 B16R1.7412 CC(=O)O[C@@H](C)C(=O)Nc1ccccc1O 527a_100000185747_100009816467 [0,1,0,0,0,1|2,0,0]=4 3505 B16R1.7412 CN(CC(=O)N)C(=O)Cc1ccccc1O 527a_100000739694_100000743006 [0,1,0,0,0,1|2,0,0]=4 3506 B16R1.7412 CN(CC(=O)N)C(=O)Nc1ccccc1O 2430a_100000185747_100000739694 [0,1,0,0,0,1|2,0,0]=4 3507 B16R1.7413 CC(=O)C(=O)CC(=O)Cc1ccccc1O 1458a_100000743006_100011261029 [0,1,0,0,0,1|1,0,1]=4 3508 B16R1.7413 CC(=O)N(C)CC(=O)Nc1ccccc1O 22a_100000185747_100000194957 [0,1,0,0,0,1|2,0,0]=4 3509 B16R1.7413 CC(=O)N(C)CC(=O)Nc1ccccc1O 527a_100000185747_100000194957 [0,1,0,0,0,1|2,0,0]=4 3510 B16R1.7413 CN(CC(=O)Nc1ccccc1O)C(=O)N 22a_100000185747_100000218718 [0,1,0,0,0,1|2,0,0]=4 3511 B16R1.7413 C[C@@H](NC(=O)Cc1ccccc1O)C(=O)N 240690a_100000119354_100000743006 [0,1,0,0,0,1|2,0,0]=4 3512 B16R1.7413 C[C@@H](NC(=O)Cc1ccccc1O)C(=O)N 527a_100000119354_100000743006 [0,1,0,0,0,1|2,0,0]=4 3513 B16R1.7413 C[C@@H](NC(=O)Nc1ccccc1O)C(=O)N 2430a_100000185747_100000119354 [0,1,0,0,0,1|2,0,0]=4 3514 B16R1.7424 CS(=O)(=O)CCC(=O)Cc1ccccc1O 1458a_100000743006_100000731031 [0,1,0,0,0,1|1,0,1]=4 3515 B16R1.7424 CS(=O)(=O)CCC(=O)Nc1ccccc1O 22a_100000185747_100000737124 [0,1,0,0,0,1|1,0,1]=4 3516 B16R1.7424 CS(=O)(=O)CCC(=O)Nc1ccccc1O 527a_100000185747_100000737124 [0,1,0,0,0,1|1,0,1]=4 3517 B16R1.7424 NS(=O)(=O)CCC(=O)Nc1ccccc1O 22a_100000185747_100000737202 [0,1,0,0,0,1|1,0,1]=4 3518 B16R1.7424 O=C(CCS(=O)(=O)[O-])Cc1ccccc1O 1458a_100000743006_100000762736 [0,1,0,0,0,1|1,0,1]=4 3519 B16R1.7458 C=CC(=O)NCC(=O)Nc1ccccc1O 22a_100000185747_200011222540 [0,1,0,0,0,1|2,0,0]=4 3520 B16R1.7458 C=CC(=O)NCC(=O)Nc1ccccc1O 527a_100000185747_200011222540 [0,1,0,0,0,1|2,0,0]=4 3521 B16R1.7458 CCC(=O)CCC(=O)Nc1ccccc1C 1458a_200000180964_100000210202 [0,1,0,0,0,1|2,0,0]=4 3522 B16R1.7458 CCC(=O)CCC(=O)Nc1ccccc1O 1458a_100000011731_100000210202 [0,1,0,0,0,1|1,0,0]=3 3523 B16R1.7458 CCC(=O)NCC(=O)Nc1ccccc1O 22a_100000185747_100000194589 [0,1,0,0,0,1|2,0,0]=4 3524 B16R1.7458 CCC(=O)NCC(=O)Nc1ccccc1O 527a_100000185747_100000194589 [0,1,0,0,0,1|2,0,0]=4 3525 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1O 22a_100000185747_203496584001 [0,1,0,0,0,1|1,0,1]=4 3526 B16R1.7458 CCS(=O)CCC(=O)Nc1ccccc1O 527a_100000185747_100011387550 [0,1,0,0,0,1|2,0,0]=4 3527 B16R1.7458 CNC(=O)CCC(=O)Cc1ccccc1Br 1458a_100011309844_100000184730 [0,1,0,0,0,1|2,0,0]=4 3528 B16R1.7458 CNC(=O)CCC(=O)Cc1ccccc1C 1458a_100011309844_100000211839 [0,1,0,0,0,1|2,0,0]=4 3529 B16R1.7458 CNC(=O)CCC(=O)Cc1ccccc1Cl 1458a_100011309844_100000187162 [0,1,0,0,0,1|2,0,0]=4 3530 B16R1.7458 CNC(=O)CCC(=O)Cc1ccccc1F 1458a_100011309844_100000187165 [0,1,0,0,0,1|2,0,0]=4 3531 B16R1.7458 CNC(=O)CCC(=O)Cc1ccccc1I 1458a_100011309844_100011216222 [0,1,0,0,0,1|2,0,0]=4 3532 B16R1.7458 CNC(=O)CCC(=O)Cc1ncccc1O 1458a_100011309844_200020655725 [0,1,0,0,0,1|2,0,0]=4 3533 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1Br 11a_100000210017_100011309844 [0,1,0,0,0,1|2,0,0]=4 3534 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100011309844 [0,1,0,0,0,1|2,0,0]=4 3535 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1C 11a_100015192222_100011309844 [0,1,0,0,0,1|2,0,0]=4 3536 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1C 1626a_100015192222_100011309844 [0,1,0,0,0,1|2,0,0]=4 3537 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1C 22a_100015192222_100011309844 [0,1,0,0,0,1|2,0,0]=4 3538 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1C 240690a_100102657272_200000180964 [0,1,0,0,0,1|2,0,0]=4 3539 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1C 527a_100015192222_100011309844 [0,1,0,0,0,1|2,0,0]=4 3540 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100011309844 [0,1,0,0,0,1|2,0,0]=4 3541 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100011309844 [0,1,0,0,0,1|2,0,0]=4 3542 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100011309844 [0,1,0,0,0,1|2,0,0]=4 3543 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100011309844 [0,1,0,0,0,1|2,0,0]=4 3544 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1F 11a_100000210422_100011309844 [0,1,0,0,0,1|2,0,0]=4 3545 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1F 1626a_100000210422_100011309844 [0,1,0,0,0,1|2,0,0]=4 3546 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1F 22a_100000210422_100011309844 [0,1,0,0,0,1|2,0,0]=4 3547 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1F 527a_100000210422_100011309844 [0,1,0,0,0,1|2,0,0]=4 3548 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1I 11a_100000210053_100011309844 [0,1,0,0,0,1|2,0,0]=4 3549 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1I 1626a_100000210053_100011309844 [0,1,0,0,0,1|2,0,0]=4 3550 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1O 22a_100000185747_100011309844 [0,1,0,0,0,1|1,0,0]=3 3551 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1O 240690a_100102657272_100000011731 [0,1,0,0,0,1|1,0,0]=3 3552 B16R1.7458 CNC(=O)CCC(=O)Nc1ccccc1O 527a_100000185747_100011309844 [0,1,0,0,0,1|1,0,0]=3 3553 B16R1.7458 CNC(=O)CNC(=O)Cc1ccccc1O 240690a_100000693194_100000743006 [0,1,0,0,0,1|2,0,0]=4 3554 B16R1.7458 CNC(=O)CNC(=O)Cc1ccccc1O 527a_100000693194_100000743006 [0,1,0,0,0,1|2,0,0]=4 3555 B16R1.7458 CNC(=O)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000693194 [0,1,0,0,0,1|2,0,0]=4 3556 B16R1.7458 COC(=O)C=CC(=O)Nc1ccccc1O 22a_100000185747_100016283253 [0,1,0,0,0,1|0,0,2]=4 3557 B16R1.7458 COC(=O)CCC(=O)Cc1ccccc1Br 1458a_100000187943_100000184730 [0,1,0,0,0,1|1,0,0]=3 3558 B16R1.7458 COC(=O)CCC(=O)Cc1ccccc1C 1458a_100000187943_100000211839 [0,1,0,0,0,1|1,0,0]=3 3559 B16R1.7458 COC(=O)CCC(=O)Cc1ccccc1Cl 1458a_100000187943_100000187162 [0,1,0,0,0,1|1,0,0]=3 3560 B16R1.7458 COC(=O)CCC(=O)Cc1ccccc1F 1458a_100000187943_100000187165 [0,1,0,0,0,1|1,0,0]=3 3561 B16R1.7458 COC(=O)CCC(=O)Cc1ccccc1I 1458a_100000187943_100011216222 [0,1,0,0,0,1|1,0,0]=3 3562 B16R1.7458 COC(=O)CCC(=O)Cc1cccnc1Br 1458a_100000187943_100010140945 [0,1,0,0,0,1|2,0,0]=4 3563 B16R1.7458 COC(=O)CCC(=O)Cc1cccnc1C 1458a_100000187943_100000732876 [0,1,0,0,0,1|2,0,0]=4 3564 B16R1.7458 COC(=O)CCC(=O)Cc1cccnc1Cl 1458a_100000187943_100000045678 [0,1,0,0,0,1|2,0,0]=4 3565 B16R1.7458 COC(=O)CCC(=O)Cc1cccnc1F 1458a_100000187943_100000099810 [0,1,0,0,0,1|2,0,0]=4 3566 B16R1.7458 COC(=O)CCC(=O)Cc1ccncc1C 1458a_100000187943_100020672808 [0,1,0,0,0,1|2,0,0]=4 3567 B16R1.7458 COC(=O)CCC(=O)Cc1ccncc1Cl 1458a_100000187943_100000763264 [0,1,0,0,0,1|2,0,0]=4 3568 B16R1.7458 COC(=O)CCC(=O)Cc1cnccc1C 1458a_100000187943_100000690890 [0,1,0,0,0,1|2,0,0]=4 3569 B16R1.7458 COC(=O)CCC(=O)Cc1ncccc1Br 1458a_100000187943_100025702911 [0,1,0,0,0,1|2,0,0]=4 3570 B16R1.7458 COC(=O)CCC(=O)Cc1ncccc1C 1458a_100000187943_100000696600 [0,1,0,0,0,1|2,0,0]=4 3571 B16R1.7458 COC(=O)CCC(=O)Cc1ncccc1Cl 1458a_100000187943_100000099807 [0,1,0,0,0,1|2,0,0]=4 3572 B16R1.7458 COC(=O)CCC(=O)Cc1ncccc1F 1458a_100000187943_100000104219 [0,1,0,0,0,1|2,0,0]=4 3573 B16R1.7458 COC(=O)CCC(=O)Cc1ncccc1O 1458a_100000187943_200020655725 [0,1,0,0,0,1|1,0,0]=3 3574 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1Br 11a_100000210017_100000187943 [0,1,0,0,0,1|1,0,0]=3 3575 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000187943 [0,1,0,0,0,1|1,0,0]=3 3576 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1C 11a_100015192222_100000187943 [0,1,0,0,0,1|1,0,0]=3 3577 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1C 1626a_100015192222_100000187943 [0,1,0,0,0,1|1,0,0]=3 3578 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1C 527a_100015192222_100000187943 [0,1,0,0,0,1|1,0,0]=3 3579 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000187943 [0,1,0,0,0,1|1,0,0]=3 3580 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000187943 [0,1,0,0,0,1|1,0,0]=3 3581 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000187943 [0,1,0,0,0,1|1,0,0]=3 3582 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1F 11a_100000210422_100000187943 [0,1,0,0,0,1|1,0,0]=3 3583 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1F 1626a_100000210422_100000187943 [0,1,0,0,0,1|1,0,0]=3 3584 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1F 527a_100000210422_100000187943 [0,1,0,0,0,1|1,0,0]=3 3585 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1I 11a_100000210053_100000187943 [0,1,0,0,0,1|1,0,0]=3 3586 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1I 1626a_100000210053_100000187943 [0,1,0,0,0,1|1,0,0]=3 3587 B16R1.7458 COC(=O)CCC(=O)Nc1ccccc1O 527a_100000185747_100000187943 [0,1,0,0,0,1|0,0,0]=2 3588 B16R1.7458 COC(=O)CCN(C)Cc1ccccc1O 2230a_100015189988_100000204255 [0,1,0,0,0,1|2,0,0]=4 3589 B16R1.7458 COC(=O)CCN(C)Cc1ccccc1O 269982a_100015189988_100000204255 [0,1,0,0,0,1|2,0,0]=4 3590 B16R1.7458 COC(=O)CNC(=O)Cc1ccccc1Br 188690a_100000185156_100000751119 [0,1,0,0,0,1|2,0,0]=4 3591 B16R1.7458 COC(=O)CNC(=O)Cc1ccccc1C 188690a_100000185156_100000212180 [0,1,0,0,0,1|2,0,0]=4 3592 B16R1.7458 COC(=O)CNC(=O)Cc1ccccc1Cl 188690a_100000185156_100000183793 [0,1,0,0,0,1|2,0,0]=4 3593 B16R1.7458 COC(=O)CNC(=O)Cc1ccccc1F 188690a_100000185156_100000212012 [0,1,0,0,0,1|2,0,0]=4 3594 B16R1.7458 COC(=O)CNC(=O)Cc1ccccc1I 188690a_100000185156_100000036491 [0,1,0,0,0,1|2,0,0]=4 3595 B16R1.7458 COC(=O)NCC(=O)Cc1ccccc1Br 1458a_100000215747_100000184730 [0,1,0,0,0,1|2,0,0]=4 3596 B16R1.7458 COC(=O)NCC(=O)Cc1ccccc1C 1458a_100000215747_100000211839 [0,1,0,0,0,1|2,0,0]=4 3597 B16R1.7458 COC(=O)NCC(=O)Cc1ccccc1Cl 1458a_100000215747_100000187162 [0,1,0,0,0,1|2,0,0]=4 3598 B16R1.7458 COC(=O)NCC(=O)Cc1ccccc1F 1458a_100000215747_100000187165 [0,1,0,0,0,1|2,0,0]=4 3599 B16R1.7458 COC(=O)NCC(=O)Cc1ccccc1I 1458a_100000215747_100011216222 [0,1,0,0,0,1|2,0,0]=4 3600 B16R1.7458 COC(=O)NCC(=O)Cc1ncccc1O 1458a_100000215747_200020655725 [0,1,0,0,0,1|2,0,0]=4 3601 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1Br 11a_100000210017_100000215747 [0,1,0,0,0,1|2,0,0]=4 3602 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1Br 1626a_100000210017_100000215747 [0,1,0,0,0,1|2,0,0]=4 3603 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1C 11a_100015192222_100000215747 [0,1,0,0,0,1|2,0,0]=4 3604 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1C 1626a_100015192222_100000215747 [0,1,0,0,0,1|2,0,0]=4 3605 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1C 22a_100015192222_100000215747 [0,1,0,0,0,1|2,0,0]=4 3606 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1C 527a_100015192222_100000215747 [0,1,0,0,0,1|2,0,0]=4 3607 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1Cl 11a_100000185783_100000215747 [0,1,0,0,0,1|2,0,0]=4 3608 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000215747 [0,1,0,0,0,1|2,0,0]=4 3609 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1Cl 22a_100000185783_100000215747 [0,1,0,0,0,1|2,0,0]=4 3610 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1Cl 527a_100000185783_100000215747 [0,1,0,0,0,1|2,0,0]=4 3611 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1F 11a_100000210422_100000215747 [0,1,0,0,0,1|2,0,0]=4 3612 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1F 1626a_100000210422_100000215747 [0,1,0,0,0,1|2,0,0]=4 3613 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1F 22a_100000210422_100000215747 [0,1,0,0,0,1|2,0,0]=4 3614 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1F 527a_100000210422_100000215747 [0,1,0,0,0,1|2,0,0]=4 3615 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1I 11a_100000210053_100000215747 [0,1,0,0,0,1|2,0,0]=4 3616 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1I 1626a_100000210053_100000215747 [0,1,0,0,0,1|2,0,0]=4 3617 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1O 22a_100000185747_100000215747 [0,1,0,0,0,1|1,0,0]=3 3618 B16R1.7458 COC(=O)NCC(=O)Nc1ccccc1O 527a_100000185747_100000215747 [0,1,0,0,0,1|1,0,0]=3 3619 B16R1.7458 Cc1ccccc1NC(=O)CCC(=O)CF 1458a_200000180964_100015361967 [0,1,0,0,0,1|2,0,0]=4 3620 B16R1.7458 Cc1ccccc1NC(=O)CNC(=O)CO 240690a_100015186652_100000210174 [0,1,0,0,0,1|2,0,0]=4 3621 B16R1.7458 Cc1ccccc1NC(=O)CNC(=O)CO 527a_100015186652_100000210174 [0,1,0,0,0,1|2,0,0]=4 3622 B16R1.7458 O=C(CF)CCC(=O)Nc1ccccc1O 1458a_100000011731_100015361967 [0,1,0,0,0,1|1,0,0]=3 3623 B16R1.7458 O=C(CO)NCC(=O)Nc1ccccc1Br 240690a_100000683505_100000210174 [0,1,0,0,0,1|2,0,0]=4 3624 B16R1.7458 O=C(CO)NCC(=O)Nc1ccccc1Br 527a_100000683505_100000210174 [0,1,0,0,0,1|2,0,0]=4 3625 B16R1.7488 C=C(C)CCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000730704 [0,1,0,0,0,1|2,0,0]=4 3626 B16R1.7488 C=C(C)CCC(=O)Cc1cc(ccc1O)F 1458a_200000688413_100010161318 [0,1,0,0,0,1|2,0,0]=4 3627 B16R1.7488 C=C(C)CCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000730704 [0,1,0,0,0,1|2,0,0]=4 3628 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_200000688413 [0,1,0,0,0,1|2,0,0]=4 3629 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_200000688413 [0,1,0,0,0,1|2,0,0]=4 3630 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)C 22a_100011215204_200000688413 [0,1,0,0,0,1|2,0,0]=4 3631 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)C 527a_100011215204_200000688413 [0,1,0,0,0,1|2,0,0]=4 3632 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_200000688413 [0,1,0,0,0,1|2,0,0]=4 3633 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_200000688413 [0,1,0,0,0,1|2,0,0]=4 3634 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)F 22a_100000759472_200000688413 [0,1,0,0,0,1|2,0,0]=4 3635 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)F 527a_100000759472_200000688413 [0,1,0,0,0,1|2,0,0]=4 3636 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)I 22a_100000753495_200000688413 [0,1,0,0,0,1|2,0,0]=4 3637 B16R1.7488 C=C(C)CCC(=O)Nc1cc(ccc1O)I 527a_100000753495_200000688413 [0,1,0,0,0,1|2,0,0]=4 3638 B16R1.7488 CC(=O)CCC(=O)Nc1cc(ccc1C)C 1458a_200000180956_200000210301 [0,1,0,0,0,1|2,0,0]=4 3639 B16R1.7488 CC(=O)CCC(=O)Nc1cc(ccc1F)C 1458a_200000234918_200000210301 [0,1,0,0,0,1|2,0,0]=4 3640 B16R1.7488 CC(=O)NCC(=O)Cc1cc(ccc1O)F 1458a_100000194580_100010161318 [0,1,0,0,0,1|2,0,0]=4 3641 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000194580 [0,1,0,0,0,1|2,0,0]=4 3642 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000194580 [0,1,0,0,0,1|2,0,0]=4 3643 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000194580 [0,1,0,0,0,1|2,0,0]=4 3644 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000194580 [0,1,0,0,0,1|2,0,0]=4 3645 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000194580 [0,1,0,0,0,1|2,0,0]=4 3646 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000194580 [0,1,0,0,0,1|2,0,0]=4 3647 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000194580 [0,1,0,0,0,1|2,0,0]=4 3648 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000194580 [0,1,0,0,0,1|2,0,0]=4 3649 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000194580 [0,1,0,0,0,1|2,0,0]=4 3650 B16R1.7488 CC(=O)NCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000194580 [0,1,0,0,0,1|2,0,0]=4 3651 B16R1.7488 CC(=O)OCC(=O)Cc1cc(ccc1O)F 1458a_100000183556_100010161318 [0,1,0,0,0,1|2,0,0]=4 3652 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000183556 [0,1,0,0,0,1|2,0,0]=4 3653 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000183556 [0,1,0,0,0,1|2,0,0]=4 3654 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000183556 [0,1,0,0,0,1|2,0,0]=4 3655 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000183556 [0,1,0,0,0,1|2,0,0]=4 3656 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000183556 [0,1,0,0,0,1|2,0,0]=4 3657 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000183556 [0,1,0,0,0,1|2,0,0]=4 3658 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000183556 [0,1,0,0,0,1|2,0,0]=4 3659 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000183556 [0,1,0,0,0,1|2,0,0]=4 3660 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000183556 [0,1,0,0,0,1|2,0,0]=4 3661 B16R1.7488 CC(=O)OCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000183556 [0,1,0,0,0,1|2,0,0]=4 3662 B16R1.7488 CC(=O)SCC(=O)Cc1cc(ccc1O)F 1458a_100000049016_100010161318 [0,1,0,0,0,1|2,0,0]=4 3663 B16R1.7488 CC(O)CCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100012276601 [0,1,0,0,0,1|1,0,1]=4 3664 B16R1.7488 CC(O)CCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100012276601 [0,1,0,0,0,1|1,0,1]=4 3665 B16R1.7488 Cc1ccc(c(c1)CC(=O)CCC(=O)N)C 1458a_100011215257_100000184699 [0,1,0,0,0,1|2,0,0]=4 3666 B16R1.7488 Cc1ccc(c(c1)CC(=O)CCC(=O)N)Cl 1458a_100011215257_100009871730 [0,1,0,0,0,1|2,0,0]=4 3667 B16R1.7488 Cc1ccc(c(c1)CC(=O)CCC(=O)N)F 1458a_100011215257_100011260760 [0,1,0,0,0,1|2,0,0]=4 3668 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)N)C 22a_100000185781_100011215257 [0,1,0,0,0,1|2,0,0]=4 3669 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)N)Cl 22a_100011215360_100011215257 [0,1,0,0,0,1|2,0,0]=4 3670 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)N)F 22a_100000211285_100011215257 [0,1,0,0,0,1|2,0,0]=4 3671 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)N)F 527a_100000211285_100011215257 [0,1,0,0,0,1|2,0,0]=4 3672 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)N)O 22a_100011215204_100011215257 [0,1,0,0,0,1|1,0,0]=3 3673 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)N)O 527a_100011215204_100011215257 [0,1,0,0,0,1|1,0,0]=3 3674 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)[13CH3])C 1458a_200000180956_200025704644 [0,1,0,0,0,1|2,0,0]=4 3675 B16R1.7488 Cc1ccc(c(c1)NC(=O)CCC(=O)[13CH3])F 1458a_200000234918_200025704644 [0,1,0,0,0,1|2,0,0]=4 3676 B16R1.7488 Cc1ccc(c(c1)NC(=O)CNC(=O)N)O 22a_100011215204_100000184981 [0,1,0,0,0,1|2,0,0]=4 3677 B16R1.7488 Cc1ccc(c(c1)NC(=O)CNC(=O)N)O 527a_100011215204_100000184981 [0,1,0,0,0,1|2,0,0]=4 3678 B16R1.7488 Cc1ccc(c(c1)NC(=O)NCC(=O)N)O 2430a_100011215204_100000711301 [0,1,0,0,0,1|2,0,0]=4 3679 B16R1.7488 Cc1ccc(c(n1)CC(=O)CCC(=O)N)O 1458a_100011215257_100020630696 [0,1,0,0,0,1|2,0,0]=4 3680 B16R1.7488 Cc1ccc(cc1CC(=O)CCC(=O)N)Cl 1458a_100011215257_100012186985 [0,1,0,0,0,1|2,0,0]=4 3681 B16R1.7488 Cc1ccc(cc1CC(=O)CCC(=O)N)F 1458a_100011215257_100000709795 [0,1,0,0,0,1|2,0,0]=4 3682 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)Br 22a_100000741167_100011215257 [0,1,0,0,0,1|2,0,0]=4 3683 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)Br 527a_100000741167_100011215257 [0,1,0,0,0,1|2,0,0]=4 3684 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)Cl 22a_100000211374_100011215257 [0,1,0,0,0,1|2,0,0]=4 3685 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)Cl 527a_100000211374_100011215257 [0,1,0,0,0,1|2,0,0]=4 3686 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)F 22a_100000211107_100011215257 [0,1,0,0,0,1|2,0,0]=4 3687 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)I 22a_100000761890_100011215257 [0,1,0,0,0,1|2,0,0]=4 3688 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)I 527a_100000761890_100011215257 [0,1,0,0,0,1|2,0,0]=4 3689 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)O 22a_100011216113_100011215257 [0,1,0,0,0,1|2,0,0]=4 3690 B16R1.7488 Cc1ccc(cc1NC(=O)CCC(=O)N)O 527a_100011216113_100011215257 [0,1,0,0,0,1|2,0,0]=4 3691 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Br)Br 1458a_100011215257_100011982794 [0,1,0,0,0,1|2,0,0]=4 3692 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100011215257_100000733903 [0,1,0,0,0,1|2,0,0]=4 3693 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Br)F 1458a_100011215257_100000736370 [0,1,0,0,0,1|2,0,0]=4 3694 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Br)I 1458a_100011215257_100012355412 [0,1,0,0,0,1|2,0,0]=4 3695 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011215257_100000763347 [0,1,0,0,0,1|2,0,0]=4 3696 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100011215257_100000754809 [0,1,0,0,0,1|2,0,0]=4 3697 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Cl)F 1458a_100011215257_100000709952 [0,1,0,0,0,1|2,0,0]=4 3698 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1Cl)I 1458a_100011215257_100010188191 [0,1,0,0,0,1|2,0,0]=4 3699 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1F)Br 1458a_100011215257_100000736399 [0,1,0,0,0,1|2,0,0]=4 3700 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1F)Cl 1458a_100011215257_100000716957 [0,1,0,0,0,1|2,0,0]=4 3701 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1F)F 1458a_100011215257_100000741279 [0,1,0,0,0,1|2,0,0]=4 3702 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1F)I 1458a_100011215257_200010149601 [0,1,0,0,0,1|2,0,0]=4 3703 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1I)Br 1458a_100011215257_100012362523 [0,1,0,0,0,1|2,0,0]=4 3704 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1I)Cl 1458a_100011215257_100012348826 [0,1,0,0,0,1|2,0,0]=4 3705 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1I)F 1458a_100011215257_100010149606 [0,1,0,0,0,1|2,0,0]=4 3706 B16R1.7488 NC(=O)CCC(=O)Cc1cc(ccc1O)F 1458a_100011215257_100010161318 [0,1,0,0,0,1|1,0,0]=3 3707 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100011215257 [0,1,0,0,0,1|2,0,0]=4 3708 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100011215257 [0,1,0,0,0,1|2,0,0]=4 3709 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100011215257 [0,1,0,0,0,1|2,0,0]=4 3710 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100011215257 [0,1,0,0,0,1|2,0,0]=4 3711 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100011215257 [0,1,0,0,0,1|2,0,0]=4 3712 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100011215257 [0,1,0,0,0,1|2,0,0]=4 3713 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100011215257 [0,1,0,0,0,1|2,0,0]=4 3714 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100011215257 [0,1,0,0,0,1|2,0,0]=4 3715 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100011215257 [0,1,0,0,0,1|1,0,0]=3 3716 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100011215257 [0,1,0,0,0,1|1,0,0]=3 3717 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100011215257 [0,1,0,0,0,1|1,0,0]=3 3718 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100011215257 [0,1,0,0,0,1|1,0,0]=3 3719 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100011215257 [0,1,0,0,0,1|1,0,0]=3 3720 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100011215257 [0,1,0,0,0,1|1,0,0]=3 3721 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100011215257 [0,1,0,0,0,1|1,0,0]=3 3722 B16R1.7488 NC(=O)CCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100011215257 [0,1,0,0,0,1|1,0,0]=3 3723 B16R1.7488 NC(=O)CNC(=O)Cc1cc(ccc1O)Br 240690a_100000711301_100010072483 [0,1,0,0,0,1|2,0,0]=4 3724 B16R1.7488 NC(=O)CNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100000711301 [0,1,0,0,0,1|2,0,0]=4 3725 B16R1.7488 NC(=O)CNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100000711301 [0,1,0,0,0,1|2,0,0]=4 3726 B16R1.7488 NC(=O)CNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100000711301 [0,1,0,0,0,1|2,0,0]=4 3727 B16R1.7488 NC(=O)CNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100000711301 [0,1,0,0,0,1|2,0,0]=4 3728 B16R1.7488 NC(=O)NCC(=O)Cc1cc(ccc1O)F 1458a_100000184981_100010161318 [0,1,0,0,0,1|2,0,0]=4 3729 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000184981 [0,1,0,0,0,1|2,0,0]=4 3730 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000184981 [0,1,0,0,0,1|2,0,0]=4 3731 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000184981 [0,1,0,0,0,1|2,0,0]=4 3732 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000184981 [0,1,0,0,0,1|2,0,0]=4 3733 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000184981 [0,1,0,0,0,1|2,0,0]=4 3734 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000184981 [0,1,0,0,0,1|2,0,0]=4 3735 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000184981 [0,1,0,0,0,1|2,0,0]=4 3736 B16R1.7488 NC(=O)NCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000184981 [0,1,0,0,0,1|2,0,0]=4 3737 B16R1.7488 O=C(CC[N+](=O)[O-])Cc1cc(ccc1O)F 1458a_200000064761_100010161318 [0,1,0,0,0,1|1,0,1]=4 3738 B16R1.10818 C=C(C)CCC(=O)N(C)c1ccccc1O 22a_100000033821_200000688413 [0,1,0,0,0,1|2,0,0]=4 3739 B16R1.10818 C=C(C)CCC(=O)N(C)c1ccccc1O 527a_100000033821_200000688413 [0,1,0,0,0,1|2,0,0]=4 3740 B16R1.10818 CC(=O)NCC(=O)N(C)c1ccccc1O 22a_100000033821_100000194580 [0,1,0,0,0,1|2,0,0]=4 3741 B16R1.10818 CC(=O)NCC(=O)N(C)c1ccccc1O 527a_100000033821_100000194580 [0,1,0,0,0,1|2,0,0]=4 3742 B16R1.10818 CC(=O)OCC(=O)N(C)c1ccccc1O 22a_100000033821_100000183556 [0,1,0,0,0,1|2,0,0]=4 3743 B16R1.10818 CC(=O)OCC(=O)N(C)c1ccccc1O 527a_100000033821_100000183556 [0,1,0,0,0,1|2,0,0]=4 3744 B16R1.10818 CC(C(=O)CCC(=O)N)c1ccccc1Cl 1458a_100011215257_100000181259 [0,1,0,0,0,1|2,0,0]=4 3745 B16R1.10818 CC(C(=O)CCC(=O)N)c1ccccc1F 1458a_100011215257_200000741388 [0,1,0,0,0,1|2,0,0]=4 3746 B16R1.10818 CN(C(=O)CCC(=O)N)c1ccccc1F 22a_100000220357_100011215257 [0,1,0,0,0,1|2,0,0]=4 3747 B16R1.10818 CN(C(=O)CCC(=O)N)c1ccccc1O 22a_100000033821_100011215257 [0,1,0,0,0,1|1,0,0]=3 3748 B16R1.10818 CN(C(=O)CCC(=O)N)c1ccccc1O 527a_100000033821_100011215257 [0,1,0,0,0,1|1,0,0]=3 3749 B16R1.10818 CN(C(=O)CNC(=O)N)c1ccccc1O 22a_100000033821_100000184981 [0,1,0,0,0,1|2,0,0]=4 3750 B16R1.10818 CN(C(=O)CNC(=O)N)c1ccccc1O 527a_100000033821_100000184981 [0,1,0,0,0,1|2,0,0]=4 3751 B16R1.10818 Cc1ccccc1N(C)C(=O)CCC(=O)N 22a_100000219699_100011215257 [0,1,0,0,0,1|2,0,0]=4 3752 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1Br)O 527a_100011934926_200000688413 [0,1,0,0,0,1|2,0,0]=4 3753 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_200000688413 [0,1,0,0,0,1|2,0,0]=4 3754 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_200000688413 [0,1,0,0,0,1|2,0,0]=4 3755 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1F)O 22a_100020591140_200000688413 [0,1,0,0,0,1|2,0,0]=4 3756 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1F)O 527a_100020591140_200000688413 [0,1,0,0,0,1|2,0,0]=4 3757 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1I)O 22a_200000049512_200000688413 [0,1,0,0,0,1|2,0,0]=4 3758 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1I)O 527a_200000049512_200000688413 [0,1,0,0,0,1|2,0,0]=4 3759 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1O)C 22a_100000743429_200000688413 [0,1,0,0,0,1|2,0,0]=4 3760 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1O)C 527a_100000743429_200000688413 [0,1,0,0,0,1|2,0,0]=4 3761 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1O)O 22a_100011995820_200000688413 [0,1,0,0,0,1|2,0,0]=4 3762 B16R1.11232 C=C(C)CCC(=O)Nc1c(cccc1O)O 527a_100011995820_200000688413 [0,1,0,0,0,1|2,0,0]=4 3763 B16R1.11232 CC(=O)CCC(=O)Nc1c(cccc1C)C 1458a_100000181014_200000210301 [0,1,0,0,0,1|2,0,0]=4 3764 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000194580 [0,1,0,0,0,1|2,0,0]=4 3765 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000194580 [0,1,0,0,0,1|2,0,0]=4 3766 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000194580 [0,1,0,0,0,1|2,0,0]=4 3767 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000194580 [0,1,0,0,0,1|2,0,0]=4 3768 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000194580 [0,1,0,0,0,1|2,0,0]=4 3769 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000194580 [0,1,0,0,0,1|2,0,0]=4 3770 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000194580 [0,1,0,0,0,1|2,0,0]=4 3771 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000194580 [0,1,0,0,0,1|2,0,0]=4 3772 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000194580 [0,1,0,0,0,1|2,0,0]=4 3773 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000194580 [0,1,0,0,0,1|2,0,0]=4 3774 B16R1.11232 CC(=O)NCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000194580 [0,1,0,0,0,1|2,0,0]=4 3775 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000183556 [0,1,0,0,0,1|2,0,0]=4 3776 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000183556 [0,1,0,0,0,1|2,0,0]=4 3777 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000183556 [0,1,0,0,0,1|2,0,0]=4 3778 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000183556 [0,1,0,0,0,1|2,0,0]=4 3779 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000183556 [0,1,0,0,0,1|2,0,0]=4 3780 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000183556 [0,1,0,0,0,1|2,0,0]=4 3781 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000183556 [0,1,0,0,0,1|2,0,0]=4 3782 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000183556 [0,1,0,0,0,1|2,0,0]=4 3783 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000183556 [0,1,0,0,0,1|2,0,0]=4 3784 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000183556 [0,1,0,0,0,1|2,0,0]=4 3785 B16R1.11232 CC(=O)OCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000183556 [0,1,0,0,0,1|2,0,0]=4 3786 B16R1.11232 Cc1cccc(c1CC(=O)CCC(=O)N)Br 1458a_100011215257_100010146847 [0,1,0,0,0,1|2,0,0]=4 3787 B16R1.11232 Cc1cccc(c1CC(=O)CCC(=O)N)C 1458a_100011215257_100000758300 [0,1,0,0,0,1|2,0,0]=4 3788 B16R1.11232 Cc1cccc(c1CC(=O)CCC(=O)N)F 1458a_100011215257_100009814554 [0,1,0,0,0,1|2,0,0]=4 3789 B16R1.11232 Cc1cccc(c1CC(=O)CCC(=O)N)I 1458a_100011215257_100010150146 [0,1,0,0,0,1|2,0,0]=4 3790 B16R1.11232 Cc1cccc(c1NC(=O)CCC(=O)N)C 22a_100000185769_100011215257 [0,1,0,0,0,1|2,0,0]=4 3791 B16R1.11232 Cc1cccc(c1NC(=O)CCC(=O)N)F 22a_100000766463_100011215257 [0,1,0,0,0,1|2,0,0]=4 3792 B16R1.11232 Cc1cccc(c1NC(=O)CCC(=O)N)O 22a_100000743429_100011215257 [0,1,0,0,0,1|1,0,0]=3 3793 B16R1.11232 Cc1cccc(c1NC(=O)CCC(=O)N)O 527a_100000743429_100011215257 [0,1,0,0,0,1|1,0,0]=3 3794 B16R1.11232 Cc1cccc(c1NC(=O)CCC(=O)[13CH3])C 1458a_100000181014_200025704644 [0,1,0,0,0,1|2,0,0]=4 3795 B16R1.11232 Cc1cccc(c1NC(=O)CNC(=O)N)O 22a_100000743429_100000184981 [0,1,0,0,0,1|2,0,0]=4 3796 B16R1.11232 Cc1cccc(c1NC(=O)CNC(=O)N)O 527a_100000743429_100000184981 [0,1,0,0,0,1|2,0,0]=4 3797 B16R1.11232 Cc1cccc(c1NC(=O)NCC(=O)N)O 2430a_100000743429_100000711301 [0,1,0,0,0,1|2,0,0]=4 3798 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1Br)Cl 1458a_100011215257_100010138402 [0,1,0,0,0,1|2,0,0]=4 3799 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1Br)F 1458a_100011215257_100000696636 [0,1,0,0,0,1|2,0,0]=4 3800 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1Cl)Cl 1458a_100011215257_100000187851 [0,1,0,0,0,1|2,0,0]=4 3801 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1Cl)F 1458a_100011215257_100000187852 [0,1,0,0,0,1|2,0,0]=4 3802 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1F)F 1458a_100011215257_100000698325 [0,1,0,0,0,1|2,0,0]=4 3803 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1I)Br 1458a_100011215257_100010146611 [0,1,0,0,0,1|2,0,0]=4 3804 B16R1.11232 NC(=O)CCC(=O)Cc1c(cccc1I)F 1458a_100011215257_100010149602 [0,1,0,0,0,1|2,0,0]=4 3805 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100011215257 [0,1,0,0,0,1|1,0,0]=3 3806 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100011215257 [0,1,0,0,0,1|1,0,0]=3 3807 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100011215257 [0,1,0,0,0,1|1,0,0]=3 3808 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1F)O 22a_100020591140_100011215257 [0,1,0,0,0,1|1,0,0]=3 3809 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1F)O 527a_100020591140_100011215257 [0,1,0,0,0,1|1,0,0]=3 3810 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1I)O 22a_200000049512_100011215257 [0,1,0,0,0,1|1,0,0]=3 3811 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1I)O 527a_200000049512_100011215257 [0,1,0,0,0,1|1,0,0]=3 3812 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1O)O 22a_100011995820_100011215257 [0,1,0,0,0,1|1,0,0]=3 3813 B16R1.11232 NC(=O)CCC(=O)Nc1c(cccc1O)O 527a_100011995820_100011215257 [0,1,0,0,0,1|1,0,0]=3 3814 B16R1.11232 NC(=O)CNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100000711301 [0,1,0,0,0,1|2,0,0]=4 3815 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000184981 [0,1,0,0,0,1|2,0,0]=4 3816 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000184981 [0,1,0,0,0,1|2,0,0]=4 3817 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000184981 [0,1,0,0,0,1|2,0,0]=4 3818 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000184981 [0,1,0,0,0,1|2,0,0]=4 3819 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000184981 [0,1,0,0,0,1|2,0,0]=4 3820 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000184981 [0,1,0,0,0,1|2,0,0]=4 3821 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000184981 [0,1,0,0,0,1|2,0,0]=4 3822 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000184981 [0,1,0,0,0,1|2,0,0]=4 3823 B16R1.11232 NC(=O)NCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000184981 [0,1,0,0,0,1|2,0,0]=4 3824 B16R1.11390 C=C(C)CCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000730704 [0,1,0,0,0,1|2,0,0]=4 3825 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_200000688413 [0,1,0,0,0,1|2,0,0]=4 3826 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_200000688413 [0,1,0,0,0,1|2,0,0]=4 3827 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)C 22a_100000211527_200000688413 [0,1,0,0,0,1|2,0,0]=4 3828 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)C 527a_100000211527_200000688413 [0,1,0,0,0,1|2,0,0]=4 3829 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_200000688413 [0,1,0,0,0,1|2,0,0]=4 3830 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_200000688413 [0,1,0,0,0,1|2,0,0]=4 3831 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)F 22a_100000753323_200000688413 [0,1,0,0,0,1|2,0,0]=4 3832 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)F 527a_100000753323_200000688413 [0,1,0,0,0,1|2,0,0]=4 3833 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)I 22a_100000057187_200000688413 [0,1,0,0,0,1|2,0,0]=4 3834 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)I 527a_100000057187_200000688413 [0,1,0,0,0,1|2,0,0]=4 3835 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)O 22a_100000106777_200000688413 [0,1,0,0,0,1|2,0,0]=4 3836 B16R1.11390 C=C(C)CCC(=O)Nc1ccc(cc1O)O 527a_100000106777_200000688413 [0,1,0,0,0,1|2,0,0]=4 3837 B16R1.11390 CC(=O)CCC(=O)Nc1ccc(cc1F)Cl 1458a_200000181003_200000210301 [0,1,0,0,0,1|2,0,0]=4 3838 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000194580 [0,1,0,0,0,1|2,0,0]=4 3839 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000194580 [0,1,0,0,0,1|2,0,0]=4 3840 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000194580 [0,1,0,0,0,1|2,0,0]=4 3841 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000194580 [0,1,0,0,0,1|2,0,0]=4 3842 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000194580 [0,1,0,0,0,1|2,0,0]=4 3843 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000194580 [0,1,0,0,0,1|2,0,0]=4 3844 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000194580 [0,1,0,0,0,1|2,0,0]=4 3845 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000194580 [0,1,0,0,0,1|2,0,0]=4 3846 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000194580 [0,1,0,0,0,1|2,0,0]=4 3847 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000194580 [0,1,0,0,0,1|2,0,0]=4 3848 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000194580 [0,1,0,0,0,1|2,0,0]=4 3849 B16R1.11390 CC(=O)NCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000194580 [0,1,0,0,0,1|2,0,0]=4 3850 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000183556 [0,1,0,0,0,1|2,0,0]=4 3851 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000183556 [0,1,0,0,0,1|2,0,0]=4 3852 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000183556 [0,1,0,0,0,1|2,0,0]=4 3853 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000183556 [0,1,0,0,0,1|2,0,0]=4 3854 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000183556 [0,1,0,0,0,1|2,0,0]=4 3855 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000183556 [0,1,0,0,0,1|2,0,0]=4 3856 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000183556 [0,1,0,0,0,1|2,0,0]=4 3857 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000183556 [0,1,0,0,0,1|2,0,0]=4 3858 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000183556 [0,1,0,0,0,1|2,0,0]=4 3859 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000183556 [0,1,0,0,0,1|2,0,0]=4 3860 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000183556 [0,1,0,0,0,1|2,0,0]=4 3861 B16R1.11390 CC(=O)OCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000183556 [0,1,0,0,0,1|2,0,0]=4 3862 B16R1.11390 CC(O)CCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100012276601 [0,1,0,0,0,1|1,0,1]=4 3863 B16R1.11390 Cc1cc(ccc1CC(=O)CCC(=O)N)Br 1458a_100011215257_100000708836 [0,1,0,0,0,1|2,0,0]=4 3864 B16R1.11390 Cc1cc(ccc1CC(=O)CCC(=O)N)Cl 1458a_100011215257_100012361307 [0,1,0,0,0,1|2,0,0]=4 3865 B16R1.11390 Cc1cc(ccc1CC(=O)CCC(=O)N)F 1458a_100011215257_100000700533 [0,1,0,0,0,1|2,0,0]=4 3866 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)Br 22a_100000211769_100011215257 [0,1,0,0,0,1|2,0,0]=4 3867 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)Cl 22a_100000210418_100011215257 [0,1,0,0,0,1|2,0,0]=4 3868 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)F 22a_100000211637_100011215257 [0,1,0,0,0,1|2,0,0]=4 3869 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)F 527a_100000211637_100011215257 [0,1,0,0,0,1|2,0,0]=4 3870 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)I 22a_100000184554_100011215257 [0,1,0,0,0,1|2,0,0]=4 3871 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)O 22a_100000756630_100011215257 [0,1,0,0,0,1|2,0,0]=4 3872 B16R1.11390 Cc1cc(ccc1NC(=O)CCC(=O)N)O 527a_100000756630_100011215257 [0,1,0,0,0,1|2,0,0]=4 3873 B16R1.11390 Cc1ccc(c(c1)C)CC(=O)CCC(=O)N 1458a_100011215257_100011219618 [0,1,0,0,0,1|2,0,0]=4 3874 B16R1.11390 Cc1ccc(c(c1)C)NC(=O)CCC(=O)N 22a_100000736561_100011215257 [0,1,0,0,0,1|2,0,0]=4 3875 B16R1.11390 Cc1ccc(c(c1)C)NC(=O)CCC(=O)N 527a_100000736561_100011215257 [0,1,0,0,0,1|2,0,0]=4 3876 B16R1.11390 Cc1ccc(c(c1)Cl)CC(=O)CCC(=O)N 1458a_100011215257_100012349684 [0,1,0,0,0,1|2,0,0]=4 3877 B16R1.11390 Cc1ccc(c(c1)Cl)NC(=O)CCC(=O)N 22a_100000210522_100011215257 [0,1,0,0,0,1|2,0,0]=4 3878 B16R1.11390 Cc1ccc(c(c1)F)CC(=O)CCC(=O)N 1458a_100011215257_100012002367 [0,1,0,0,0,1|2,0,0]=4 3879 B16R1.11390 Cc1ccc(c(c1)F)NC(=O)CCC(=O)N 22a_100000211023_100011215257 [0,1,0,0,0,1|2,0,0]=4 3880 B16R1.11390 Cc1ccc(c(c1)F)NC(=O)CCC(=O)N 527a_100000211023_100011215257 [0,1,0,0,0,1|2,0,0]=4 3881 B16R1.11390 Cc1ccc(c(c1)O)NC(=O)CCC(=O)N 22a_100000211527_100011215257 [0,1,0,0,0,1|1,0,0]=3 3882 B16R1.11390 Cc1ccc(c(c1)O)NC(=O)CCC(=O)N 527a_100000211527_100011215257 [0,1,0,0,0,1|1,0,0]=3 3883 B16R1.11390 Cc1ccc(c(c1)O)NC(=O)CNC(=O)N 22a_100000211527_100000184981 [0,1,0,0,0,1|2,0,0]=4 3884 B16R1.11390 Cc1ccc(c(c1)O)NC(=O)CNC(=O)N 527a_100000211527_100000184981 [0,1,0,0,0,1|2,0,0]=4 3885 B16R1.11390 Cc1ccc(c(c1)O)NC(=O)NCC(=O)N 2430a_100000211527_100000711301 [0,1,0,0,0,1|2,0,0]=4 3886 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Br)Br 1458a_100011215257_200012351560 [0,1,0,0,0,1|2,0,0]=4 3887 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Br)Cl 1458a_100011215257_100000755608 [0,1,0,0,0,1|2,0,0]=4 3888 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Br)F 1458a_100011215257_100000243222 [0,1,0,0,0,1|2,0,0]=4 3889 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Br)I 1458a_100011215257_100010146610 [0,1,0,0,0,1|2,0,0]=4 3890 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Cl)Br 1458a_100011215257_100011740631 [0,1,0,0,0,1|2,0,0]=4 3891 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100011215257_100000188473 [0,1,0,0,0,1|2,0,0]=4 3892 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1Cl)F 1458a_100011215257_100011216360 [0,1,0,0,0,1|2,0,0]=4 3893 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1F)Br 1458a_100011215257_100000211606 [0,1,0,0,0,1|2,0,0]=4 3894 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1F)Cl 1458a_100011215257_100000709361 [0,1,0,0,0,1|2,0,0]=4 3895 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1F)F 1458a_100011215257_100000748237 [0,1,0,0,0,1|2,0,0]=4 3896 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1F)I 1458a_100011215257_100010244991 [0,1,0,0,0,1|2,0,0]=4 3897 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1I)Br 1458a_100011215257_100010146615 [0,1,0,0,0,1|2,0,0]=4 3898 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1I)Cl 1458a_100011215257_100010254388 [0,1,0,0,0,1|2,0,0]=4 3899 B16R1.11390 NC(=O)CCC(=O)Cc1ccc(cc1I)F 1458a_100011215257_100012354799 [0,1,0,0,0,1|2,0,0]=4 3900 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100011215257 [0,1,0,0,0,1|2,0,0]=4 3901 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100011215257 [0,1,0,0,0,1|2,0,0]=4 3902 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100011215257 [0,1,0,0,0,1|2,0,0]=4 3903 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100011215257 [0,1,0,0,0,1|2,0,0]=4 3904 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100011215257 [0,1,0,0,0,1|2,0,0]=4 3905 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100011215257 [0,1,0,0,0,1|2,0,0]=4 3906 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100011215257 [0,1,0,0,0,1|2,0,0]=4 3907 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100011215257 [0,1,0,0,0,1|2,0,0]=4 3908 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100011215257 [0,1,0,0,0,1|2,0,0]=4 3909 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1F)F 22a_100000210720_100011215257 [0,1,0,0,0,1|2,0,0]=4 3910 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1F)I 22a_100011215594_100011215257 [0,1,0,0,0,1|2,0,0]=4 3911 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1F)O 22a_100000759473_100011215257 [0,1,0,0,0,1|2,0,0]=4 3912 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1F)O 527a_100000759473_100011215257 [0,1,0,0,0,1|2,0,0]=4 3913 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1I)F 22a_100000760547_100011215257 [0,1,0,0,0,1|2,0,0]=4 3914 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1I)O 22a_100010084370_100011215257 [0,1,0,0,0,1|2,0,0]=4 3915 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1I)O 527a_100010084370_100011215257 [0,1,0,0,0,1|2,0,0]=4 3916 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100011215257 [0,1,0,0,0,1|1,0,0]=3 3917 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100011215257 [0,1,0,0,0,1|1,0,0]=3 3918 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100011215257 [0,1,0,0,0,1|1,0,0]=3 3919 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100011215257 [0,1,0,0,0,1|1,0,0]=3 3920 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100011215257 [0,1,0,0,0,1|1,0,0]=3 3921 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100011215257 [0,1,0,0,0,1|1,0,0]=3 3922 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100011215257 [0,1,0,0,0,1|1,0,0]=3 3923 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100011215257 [0,1,0,0,0,1|1,0,0]=3 3924 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100011215257 [0,1,0,0,0,1|1,0,0]=3 3925 B16R1.11390 NC(=O)CCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100011215257 [0,1,0,0,0,1|1,0,0]=3 3926 B16R1.11390 NC(=O)CNC(=O)Cc1ccc(cc1O)Br 240690a_100000711301_100000707504 [0,1,0,0,0,1|2,0,0]=4 3927 B16R1.11390 NC(=O)CNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100000711301 [0,1,0,0,0,1|2,0,0]=4 3928 B16R1.11390 NC(=O)CNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100000711301 [0,1,0,0,0,1|2,0,0]=4 3929 B16R1.11390 NC(=O)CNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100000711301 [0,1,0,0,0,1|2,0,0]=4 3930 B16R1.11390 NC(=O)CNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100000711301 [0,1,0,0,0,1|2,0,0]=4 3931 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000184981 [0,1,0,0,0,1|2,0,0]=4 3932 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000184981 [0,1,0,0,0,1|2,0,0]=4 3933 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000184981 [0,1,0,0,0,1|2,0,0]=4 3934 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000184981 [0,1,0,0,0,1|2,0,0]=4 3935 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000184981 [0,1,0,0,0,1|2,0,0]=4 3936 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000184981 [0,1,0,0,0,1|2,0,0]=4 3937 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000184981 [0,1,0,0,0,1|2,0,0]=4 3938 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000184981 [0,1,0,0,0,1|2,0,0]=4 3939 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000184981 [0,1,0,0,0,1|2,0,0]=4 3940 B16R1.11390 NC(=O)NCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000184981 [0,1,0,0,0,1|2,0,0]=4 3941 B16R1.11390 [13CH3]C(=O)CCC(=O)Nc1ccc(cc1F)Cl 1458a_200000181003_200025704644 [0,1,0,0,0,1|2,0,0]=4 3942 B16R1.7397 CC(C)(O)CSCC(=O)c1ccccc1O 62a_100000188908_100000764493 [0,1,0,0,0,1|1,0,1]=4 3943 B16R1.7397 CC(C)(O)CSCC(=O)c1ccccc1O 62a_100000764493_100000188908 [0,1,0,0,0,1|1,0,1]=4 3944 B16R1.7397 CS(=O)(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100000754308 [0,1,0,0,0,1|1,0,1]=4 3945 B16R1.7397 CS(=O)(=O)CCNC(=O)c1ccccc1O 240690a_100000740961_100015234032 [0,1,0,0,0,1|1,0,1]=4 3946 B16R1.7397 CS(=O)(=O)NCCC(=O)c1ccccc1O 1458a_100015234032_100000754112 [0,1,0,0,0,1|1,0,1]=4 3947 B16R1.7397 CS(=O)(=O)OCCC(=O)c1ccccc1O 1458a_100015234032_200000036756 [0,1,0,0,0,1|1,0,1]=4 3948 B16R1.7397 NS(=O)(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100000750626 [0,1,0,0,0,1|1,0,1]=4 3949 B16R1.7397 NS(=O)(=O)CCNC(=O)c1ccccc1O 240690a_100000738205_100015234032 [0,1,0,0,0,1|1,0,1]=4 3950 B16R1.7397 NS(=O)(=O)CSCC(=O)c1ccccc1O 62a_100000188908_100000741382 [0,1,0,0,0,1|1,0,1]=4 3951 B16R1.7397 NS(=O)(=O)CSCC(=O)c1ccccc1O 62a_100000741382_100000188908 [0,1,0,0,0,1|1,0,1]=4 3952 B16R1.7397 O=C(CCCS(=O)(=O)[O-])c1ccccc1O 1458a_100015234032_100009813499 [0,1,0,0,0,1|1,0,1]=4 3953 B16R1.7397 O=C(CSCS(=O)(=O)[O-])c1ccccc1O 62a_100000188908_100009817235 [0,1,0,0,0,1|1,0,1]=4 3954 B16R1.7397 O=C(CSCS(=O)(=O)[O-])c1ccccc1O 62a_100009817235_100000188908 [0,1,0,0,0,1|1,0,1]=4 3955 B16R1.7437 C=C(C)CN(C)CC(=O)c1ccccc1O 269982a_100000225649_100000188908 [0,1,0,0,0,1|2,0,0]=4 3956 B16R1.7437 CC(=O)NC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183797 [0,1,0,0,0,1|1,0,1]=4 3957 B16R1.7437 CC(O)CN(C)CC(=O)c1ccccc1O 269982a_100000227577_100000188908 [0,1,0,0,0,1|1,0,1]=4 3958 B16R1.7437 CN(CC(=O)O)CC(=O)c1ccccc1Br 269956a_100000746989_100000199116 [0,1,0,0,0,1|1,0,0]=3 3959 B16R1.7437 CN(CC(=O)O)CC(=O)c1ccccc1Cl 269956a_100000746989_100000211432 [0,1,0,0,0,1|1,0,0]=3 3960 B16R1.7437 CN(CC(=O)O)CC(=O)c1ccccc1F 269956a_100000746989_100000204681 [0,1,0,0,0,1|1,0,0]=3 3961 B16R1.7437 CN(CC(=O)O)CC(=O)c1ccccc1O 269956a_100000746989_100000188908 [0,1,0,0,0,1|0,0,0]=2 3962 B16R1.7437 C[C@@H](O)CC(=O)CC(=O)c1ccccc1O 1458a_100011933948_100000188908 [0,1,0,0,0,1|1,0,1]=4 3963 B16R1.7437 Cc1ccccc1C(=O)CC(=O)CC(=O)N 1458a_100134613110_100000741374 [0,1,0,0,0,1|2,0,0]=4 3964 B16R1.7437 Cc1ccccc1C(=O)CN(C)CC(=O)N 2230a_100000739694_100000741374 [0,1,0,0,0,1|2,0,0]=4 3965 B16R1.7437 Cc1ccccc1C(=O)CN(C)CC(=O)O 269956a_100000746989_100000741374 [0,1,0,0,0,1|1,0,0]=3 3966 B16R1.7437 NC(=O)CC(=O)CC(=O)c1ccccc1Br 1458a_100134613110_100000199116 [0,1,0,0,0,1|2,0,0]=4 3967 B16R1.7437 NC(=O)CC(=O)CC(=O)c1ccccc1Cl 1458a_100134613110_100000211432 [0,1,0,0,0,1|2,0,0]=4 3968 B16R1.7437 NC(=O)CC(=O)CC(=O)c1ccccc1F 1458a_100134613110_100000204681 [0,1,0,0,0,1|2,0,0]=4 3969 B16R1.7437 NC(=O)CC(=O)CC(=O)c1ccccc1O 1458a_100134613110_100000188908 [0,1,0,0,0,1|1,0,0]=3 3970 B16R1.7437 NC(=O)NC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000182717 [0,1,0,0,0,1|1,0,1]=4 3971 B16R1.7492 C=C(C)COCC(=O)c1cc(ccc1O)Br 34a_100000210245_200009828000 [0,1,0,0,0,1|2,0,0]=4 3972 B16R1.7492 C=C(C)COCC(=O)c1cc(ccc1O)F 34a_100000210245_100009814381 [0,1,0,0,0,1|2,0,0]=4 3973 B16R1.7492 C=C(C)COCC(=O)c1cc(ccc1O)O 34a_100000210245_100009814097 [0,1,0,0,0,1|2,0,0]=4 3974 B16R1.7492 C=C(C)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000211660 [0,1,0,0,0,1|2,0,0]=4 3975 B16R1.7492 C=C(C)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000211660 [0,1,0,0,0,1|2,0,0]=4 3976 B16R1.7492 C=C(C)CSCC(=O)c1cc(ccc1O)F 62a_100000748629_100009814381 [0,1,0,0,0,1|2,0,0]=4 3977 B16R1.7492 C=C(C)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000211660 [0,1,0,0,0,1|2,0,0]=4 3978 B16R1.7492 C=C(C)CSCC(=O)c1cc(ccc1O)O 62a_100000748629_100009814097 [0,1,0,0,0,1|2,0,0]=4 3979 B16R1.7492 C=C(C)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000211660 [0,1,0,0,0,1|2,0,0]=4 3980 B16R1.7492 C=C(F)COCC(=O)c1cc(ccc1O)Br 34a_200010262243_200009828000 [0,1,0,0,0,1|2,0,0]=4 3981 B16R1.7492 C=C(F)COCC(=O)c1cc(ccc1O)F 34a_200010262243_100009814381 [0,1,0,0,0,1|2,0,0]=4 3982 B16R1.7492 C=C(F)COCC(=O)c1cc(ccc1O)O 34a_200010262243_100009814097 [0,1,0,0,0,1|2,0,0]=4 3983 B16R1.7492 C=C(F)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000042424 [0,1,0,0,0,1|2,0,0]=4 3984 B16R1.7492 C=C(F)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000042424 [0,1,0,0,0,1|2,0,0]=4 3985 B16R1.7492 C=C(F)CSCC(=O)c1cc(ccc1O)F 62a_100000042424_100009814381 [0,1,0,0,0,1|2,0,0]=4 3986 B16R1.7492 C=C(F)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000042424 [0,1,0,0,0,1|2,0,0]=4 3987 B16R1.7492 C=C(F)CSCC(=O)c1cc(ccc1O)O 62a_100000042424_100009814097 [0,1,0,0,0,1|2,0,0]=4 3988 B16R1.7492 C=C(F)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000042424 [0,1,0,0,0,1|2,0,0]=4 3989 B16R1.7492 CC(=CCCC(=O)c1cc(ccc1O)Br)C 1458a_100000212140_100011217483 [0,1,0,0,0,1|2,0,0]=4 3990 B16R1.7492 CC(=CCCC(=O)c1cc(ccc1O)C)C 1458a_100000229998_100011217483 [0,1,0,0,0,1|2,0,0]=4 3991 B16R1.7492 CC(=CCCC(=O)c1cc(ccc1O)Cl)C 1458a_100000212143_100011217483 [0,1,0,0,0,1|2,0,0]=4 3992 B16R1.7492 CC(=CCCC(=O)c1cc(ccc1O)F)C 1458a_100000742286_100011217483 [0,1,0,0,0,1|2,0,0]=4 3993 B16R1.7492 CC(=CCCC(=O)c1cc(ccc1O)I)C 1458a_100000212111_100011217483 [0,1,0,0,0,1|2,0,0]=4 3994 B16R1.7492 CC(=CCCC(=O)c1cc(ccc1O)O)C 1458a_100000758025_100011217483 [0,1,0,0,0,1|2,0,0]=4 3995 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011215641 [0,1,0,0,0,1|2,0,0]=4 3996 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100011215641 [0,1,0,0,0,1|2,0,0]=4 3997 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011215641 [0,1,0,0,0,1|2,0,0]=4 3998 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011215641 [0,1,0,0,0,1|2,0,0]=4 3999 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011215641 [0,1,0,0,0,1|2,0,0]=4 4000 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011215641 [0,1,0,0,0,1|2,0,0]=4 4001 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100011215641 [0,1,0,0,0,1|2,0,0]=4 4002 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100011215641 [0,1,0,0,0,1|2,0,0]=4 4003 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100011215641 [0,1,0,0,0,1|2,0,0]=4 4004 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100011215641 [0,1,0,0,0,1|2,0,0]=4 4005 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100011215641 [0,1,0,0,0,1|2,0,0]=4 4006 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100011215641 [0,1,0,0,0,1|2,0,0]=4 4007 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011215641 [0,1,0,0,0,1|2,0,0]=4 4008 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100011215641 [0,1,0,0,0,1|2,0,0]=4 4009 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011215641 [0,1,0,0,0,1|2,0,0]=4 4010 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011215641 [0,1,0,0,0,1|2,0,0]=4 4011 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011215641 [0,1,0,0,0,1|2,0,0]=4 4012 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011215641 [0,1,0,0,0,1|2,0,0]=4 4013 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011215641 [0,1,0,0,0,1|2,0,0]=4 4014 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100011215641 [0,1,0,0,0,1|2,0,0]=4 4015 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011215641 [0,1,0,0,0,1|2,0,0]=4 4016 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100011215641 [0,1,0,0,0,1|2,0,0]=4 4017 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100011215641 [0,1,0,0,0,1|2,0,0]=4 4018 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100011215641 [0,1,0,0,0,1|2,0,0]=4 4019 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011215641 [0,1,0,0,0,1|2,0,0]=4 4020 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100011215641 [0,1,0,0,0,1|2,0,0]=4 4021 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011215641 [0,1,0,0,0,1|2,0,0]=4 4022 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100011215641 [0,1,0,0,0,1|2,0,0]=4 4023 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100011215641 [0,1,0,0,0,1|2,0,0]=4 4024 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100011215641 [0,1,0,0,0,1|2,0,0]=4 4025 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215641 [0,1,0,0,0,1|1,0,0]=3 4026 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100011215641 [0,1,0,0,0,1|1,0,0]=3 4027 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215641 [0,1,0,0,0,1|1,0,0]=3 4028 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215641 [0,1,0,0,0,1|1,0,0]=3 4029 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215641 [0,1,0,0,0,1|1,0,0]=3 4030 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215641 [0,1,0,0,0,1|1,0,0]=3 4031 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1Br)Cl 34a_100000211253_100012361344 [0,1,0,0,0,1|2,0,0]=4 4032 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1C)C 34a_100000211253_100000183774 [0,1,0,0,0,1|2,0,0]=4 4033 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1Cl)F 34a_100000211253_200010187420 [0,1,0,0,0,1|2,0,0]=4 4034 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1F)F 34a_100000211253_100000211571 [0,1,0,0,0,1|2,0,0]=4 4035 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1O)Br 34a_100000211253_200009828000 [0,1,0,0,0,1|1,0,0]=3 4036 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1O)F 34a_100000211253_100009814381 [0,1,0,0,0,1|1,0,0]=3 4037 B16R1.7492 CC(=O)COCC(=O)c1cc(ccc1O)O 34a_100000211253_100009814097 [0,1,0,0,0,1|1,0,0]=3 4038 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000189650 [0,1,0,0,0,1|2,0,0]=4 4039 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000189650 [0,1,0,0,0,1|2,0,0]=4 4040 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000189650 [0,1,0,0,0,1|2,0,0]=4 4041 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000189650 [0,1,0,0,0,1|2,0,0]=4 4042 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000189650 [0,1,0,0,0,1|2,0,0]=4 4043 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000189650 [0,1,0,0,0,1|2,0,0]=4 4044 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000189650 [0,1,0,0,0,1|2,0,0]=4 4045 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000189650 [0,1,0,0,0,1|2,0,0]=4 4046 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000189650 [0,1,0,0,0,1|2,0,0]=4 4047 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000189650 [0,1,0,0,0,1|2,0,0]=4 4048 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000189650 [0,1,0,0,0,1|2,0,0]=4 4049 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000189650 [0,1,0,0,0,1|2,0,0]=4 4050 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000189650 [0,1,0,0,0,1|2,0,0]=4 4051 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000189650 [0,1,0,0,0,1|2,0,0]=4 4052 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000189650 [0,1,0,0,0,1|2,0,0]=4 4053 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000189650 [0,1,0,0,0,1|2,0,0]=4 4054 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000189650 [0,1,0,0,0,1|2,0,0]=4 4055 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000189650 [0,1,0,0,0,1|2,0,0]=4 4056 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000189650 [0,1,0,0,0,1|2,0,0]=4 4057 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000189650 [0,1,0,0,0,1|2,0,0]=4 4058 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000189650 [0,1,0,0,0,1|2,0,0]=4 4059 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000189650 [0,1,0,0,0,1|2,0,0]=4 4060 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000189650 [0,1,0,0,0,1|2,0,0]=4 4061 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000189650 [0,1,0,0,0,1|2,0,0]=4 4062 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000189650 [0,1,0,0,0,1|2,0,0]=4 4063 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000189650 [0,1,0,0,0,1|2,0,0]=4 4064 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000189650 [0,1,0,0,0,1|2,0,0]=4 4065 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000189650 [0,1,0,0,0,1|2,0,0]=4 4066 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000189650 [0,1,0,0,0,1|2,0,0]=4 4067 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000189650 [0,1,0,0,0,1|2,0,0]=4 4068 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000189650 [0,1,0,0,0,1|1,0,0]=3 4069 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000189650 [0,1,0,0,0,1|1,0,0]=3 4070 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000189650 [0,1,0,0,0,1|1,0,0]=3 4071 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000189650 [0,1,0,0,0,1|1,0,0]=3 4072 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000189650 [0,1,0,0,0,1|1,0,0]=3 4073 B16R1.7492 CC(=O)NCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000189650 [0,1,0,0,0,1|1,0,0]=3 4074 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100009814007 [0,1,0,0,0,1|2,0,0]=4 4075 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100009814007 [0,1,0,0,0,1|2,0,0]=4 4076 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100009814007 [0,1,0,0,0,1|2,0,0]=4 4077 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100009814007 [0,1,0,0,0,1|2,0,0]=4 4078 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100009814007 [0,1,0,0,0,1|2,0,0]=4 4079 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100009814007 [0,1,0,0,0,1|2,0,0]=4 4080 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100009814007 [0,1,0,0,0,1|2,0,0]=4 4081 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100009814007 [0,1,0,0,0,1|2,0,0]=4 4082 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100009814007 [0,1,0,0,0,1|2,0,0]=4 4083 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100009814007 [0,1,0,0,0,1|2,0,0]=4 4084 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100009814007 [0,1,0,0,0,1|2,0,0]=4 4085 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100009814007 [0,1,0,0,0,1|2,0,0]=4 4086 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100009814007 [0,1,0,0,0,1|2,0,0]=4 4087 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100009814007 [0,1,0,0,0,1|2,0,0]=4 4088 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100009814007 [0,1,0,0,0,1|2,0,0]=4 4089 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100009814007 [0,1,0,0,0,1|2,0,0]=4 4090 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100009814007 [0,1,0,0,0,1|2,0,0]=4 4091 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100009814007 [0,1,0,0,0,1|2,0,0]=4 4092 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100009814007 [0,1,0,0,0,1|2,0,0]=4 4093 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100009814007 [0,1,0,0,0,1|2,0,0]=4 4094 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100009814007 [0,1,0,0,0,1|2,0,0]=4 4095 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100009814007 [0,1,0,0,0,1|2,0,0]=4 4096 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100009814007 [0,1,0,0,0,1|2,0,0]=4 4097 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100009814007 [0,1,0,0,0,1|2,0,0]=4 4098 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100009814007 [0,1,0,0,0,1|2,0,0]=4 4099 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100009814007 [0,1,0,0,0,1|2,0,0]=4 4100 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100009814007 [0,1,0,0,0,1|2,0,0]=4 4101 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100009814007 [0,1,0,0,0,1|2,0,0]=4 4102 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100009814007 [0,1,0,0,0,1|2,0,0]=4 4103 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100009814007 [0,1,0,0,0,1|2,0,0]=4 4104 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100009814007 [0,1,0,0,0,1|1,0,0]=3 4105 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100009814007 [0,1,0,0,0,1|1,0,0]=3 4106 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100009814007 [0,1,0,0,0,1|1,0,0]=3 4107 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100009814007 [0,1,0,0,0,1|1,0,0]=3 4108 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100009814007 [0,1,0,0,0,1|1,0,0]=3 4109 B16R1.7492 CC(=O)OCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100009814007 [0,1,0,0,0,1|1,0,0]=3 4110 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000718107 [0,1,0,0,0,1|1,0,1]=4 4111 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000718107 [0,1,0,0,0,1|1,0,1]=4 4112 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_200000718107 [0,1,0,0,0,1|1,0,1]=4 4113 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_200000718107 [0,1,0,0,0,1|1,0,1]=4 4114 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_200000718107 [0,1,0,0,0,1|1,0,1]=4 4115 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Br 240690a_200000755665_100000212140 [0,1,0,0,0,1|1,0,1]=4 4116 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Br 527a_200000755665_100000212140 [0,1,0,0,0,1|1,0,1]=4 4117 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Cl 240690a_200000755665_100000212143 [0,1,0,0,0,1|1,0,1]=4 4118 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Cl 527a_200000755665_100000212143 [0,1,0,0,0,1|1,0,1]=4 4119 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)F 240690a_200000755665_100000742286 [0,1,0,0,0,1|1,0,1]=4 4120 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)F 527a_200000755665_100000742286 [0,1,0,0,0,1|1,0,1]=4 4121 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)I 240690a_200000755665_100000212111 [0,1,0,0,0,1|1,0,1]=4 4122 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)I 527a_200000755665_100000212111 [0,1,0,0,0,1|1,0,1]=4 4123 B16R1.7492 CC(O)CNCC(=O)c1cc(ccc1O)Br 34a_100000210904_200009828000 [0,1,0,0,0,1|1,0,1]=4 4124 B16R1.7492 CC(O)CNCC(=O)c1cc(ccc1O)F 34a_100000210904_100009814381 [0,1,0,0,0,1|1,0,1]=4 4125 B16R1.7492 CC(O)CNCC(=O)c1cc(ccc1O)O 34a_100000210904_100009814097 [0,1,0,0,0,1|1,0,1]=4 4126 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100011218427 [0,1,0,0,0,1|1,0,1]=4 4127 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100011218427 [0,1,0,0,0,1|1,0,1]=4 4128 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100011218427 [0,1,0,0,0,1|1,0,1]=4 4129 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)F 62a_100011218427_100009814381 [0,1,0,0,0,1|1,0,1]=4 4130 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100011218427 [0,1,0,0,0,1|1,0,1]=4 4131 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)O 62a_100011218427_100009814097 [0,1,0,0,0,1|1,0,1]=4 4132 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100009817552 [0,1,0,0,0,1|1,0,1]=4 4133 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100009817552 [0,1,0,0,0,1|1,0,1]=4 4134 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100009817552 [0,1,0,0,0,1|1,0,1]=4 4135 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)F 62a_100009817552_100009814381 [0,1,0,0,0,1|1,0,1]=4 4136 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100009817552 [0,1,0,0,0,1|1,0,1]=4 4137 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)O 62a_100009817552_100009814097 [0,1,0,0,0,1|1,0,1]=4 4138 B16R1.7492 Cc1ccc(c(c1)C(=O)CCC=C(F)F)O 1458a_100000229998_200009816681 [0,1,0,0,0,1|2,0,0]=4 4139 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(=O)N)Br 1458a_100000689033_100102525003 [0,1,0,0,0,1|2,0,0]=4 4140 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(=O)N)C 1458a_100000195421_100102525003 [0,1,0,0,0,1|2,0,0]=4 4141 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(=O)N)Cl 1458a_100011290873_100102525003 [0,1,0,0,0,1|2,0,0]=4 4142 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(=O)N)F 1458a_100000749327_100102525003 [0,1,0,0,0,1|2,0,0]=4 4143 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(=O)N)I 1458a_100000057929_100102525003 [0,1,0,0,0,1|2,0,0]=4 4144 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(=O)N)O 1458a_100000229998_100102525003 [0,1,0,0,0,1|1,0,0]=3 4145 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)O 1458a_100000229998_200000718107 [0,1,0,0,0,1|1,0,1]=4 4146 B16R1.7492 Cc1ccc(c(c1)C(=O)CCNC(=O)N)Br 1458a_100000689033_200000034859 [0,1,0,0,0,1|2,0,0]=4 4147 B16R1.7492 Cc1ccc(c(c1)C(=O)CCNC(=O)N)C 1458a_100000195421_200000034859 [0,1,0,0,0,1|2,0,0]=4 4148 B16R1.7492 Cc1ccc(c(c1)C(=O)CCNC(=O)N)Cl 1458a_100011290873_200000034859 [0,1,0,0,0,1|2,0,0]=4 4149 B16R1.7492 Cc1ccc(c(c1)C(=O)CCNC(=O)N)F 1458a_100000749327_200000034859 [0,1,0,0,0,1|2,0,0]=4 4150 B16R1.7492 Cc1ccc(c(c1)C(=O)CCNC(=O)N)I 1458a_100000057929_200000034859 [0,1,0,0,0,1|2,0,0]=4 4151 B16R1.7492 Cc1ccc(c(c1)C(=O)CCNC(=O)N)O 1458a_100000229998_200000034859 [0,1,0,0,0,1|1,0,0]=3 4152 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(=O)N)Br 1458a_100000689033_200011214921 [0,1,0,0,0,1|2,0,0]=4 4153 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(=O)N)C 1458a_100000195421_200011214921 [0,1,0,0,0,1|2,0,0]=4 4154 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(=O)N)Cl 1458a_100011290873_200011214921 [0,1,0,0,0,1|2,0,0]=4 4155 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(=O)N)F 1458a_100000749327_200011214921 [0,1,0,0,0,1|2,0,0]=4 4156 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(=O)N)I 1458a_100000057929_200011214921 [0,1,0,0,0,1|2,0,0]=4 4157 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(=O)N)O 1458a_100000229998_200011214921 [0,1,0,0,0,1|1,0,0]=3 4158 B16R1.7492 Cc1ccc(c(c1)C(=O)CNCC(=O)N)C 2230a_100000711301_100000183774 [0,1,0,0,0,1|2,0,0]=4 4159 B16R1.7492 Cc1ccc(c(c1)C(=O)CNCC(=O)O)C 269956a_100016091260_100000183774 [0,1,0,0,0,1|1,0,0]=3 4160 B16R1.7492 Cc1ccc(c(c1)C(=O)CSCC(=O)N)C 62a_100000183774_100000747473 [0,1,0,0,0,1|2,0,0]=4 4161 B16R1.7492 Cc1ccc(c(c1)C(=O)CSCC(=O)N)C 62a_100000747473_100000183774 [0,1,0,0,0,1|2,0,0]=4 4162 B16R1.7492 Cc1ccc(c(c1)C(=O)CSCC(=O)[O-])C 62a_100000183774_100020667443 [0,1,0,0,0,1|1,0,1]=4 4163 B16R1.7492 Cc1ccc(c(c1)C(=O)CSCC(=O)[O-])C 62a_100020667443_100000183774 [0,1,0,0,0,1|1,0,1]=4 4164 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)Br 11a_100000740010_100000689033 [0,1,0,0,0,1|2,0,0]=4 4165 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)Br 240690a_100000740010_100000689033 [0,1,0,0,0,1|2,0,0]=4 4166 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)Br 527a_100000740010_100000689033 [0,1,0,0,0,1|2,0,0]=4 4167 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)C 11a_100000740010_100000195421 [0,1,0,0,0,1|2,0,0]=4 4168 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)C 240690a_100000740010_100000195421 [0,1,0,0,0,1|2,0,0]=4 4169 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)C 527a_100000740010_100000195421 [0,1,0,0,0,1|2,0,0]=4 4170 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)Cl 11a_100000740010_100011290873 [0,1,0,0,0,1|2,0,0]=4 4171 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)Cl 240690a_100000740010_100011290873 [0,1,0,0,0,1|2,0,0]=4 4172 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)Cl 527a_100000740010_100011290873 [0,1,0,0,0,1|2,0,0]=4 4173 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)F 11a_100000740010_100000749327 [0,1,0,0,0,1|2,0,0]=4 4174 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)F 240690a_100000740010_100000749327 [0,1,0,0,0,1|2,0,0]=4 4175 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)F 527a_100000740010_100000749327 [0,1,0,0,0,1|2,0,0]=4 4176 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)I 11a_100000740010_100000057929 [0,1,0,0,0,1|2,0,0]=4 4177 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)I 240690a_100000740010_100000057929 [0,1,0,0,0,1|2,0,0]=4 4178 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)I 527a_100000740010_100000057929 [0,1,0,0,0,1|2,0,0]=4 4179 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)O 240690a_100000740010_100000229998 [0,1,0,0,0,1|1,0,0]=3 4180 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(=O)N)O 527a_100000740010_100000229998 [0,1,0,0,0,1|1,0,0]=3 4181 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)O 240690a_200000755665_100000229998 [0,1,0,0,0,1|1,0,1]=4 4182 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)O 527a_200000755665_100000229998 [0,1,0,0,0,1|1,0,1]=4 4183 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(=O)N)Br 1458a_100000759961_100102525003 [0,1,0,0,0,1|2,0,0]=4 4184 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(=O)N)Cl 1458a_100000692595_100102525003 [0,1,0,0,0,1|2,0,0]=4 4185 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(=O)N)F 1458a_100000240043_100102525003 [0,1,0,0,0,1|2,0,0]=4 4186 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(=O)N)I 1458a_100000688012_100102525003 [0,1,0,0,0,1|2,0,0]=4 4187 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(=O)N)O 1458a_100000687834_100102525003 [0,1,0,0,0,1|2,0,0]=4 4188 B16R1.7492 Cc1ccc(cc1C(=O)CCNC(=O)N)Br 1458a_100000759961_200000034859 [0,1,0,0,0,1|2,0,0]=4 4189 B16R1.7492 Cc1ccc(cc1C(=O)CCNC(=O)N)Cl 1458a_100000692595_200000034859 [0,1,0,0,0,1|2,0,0]=4 4190 B16R1.7492 Cc1ccc(cc1C(=O)CCNC(=O)N)F 1458a_100000240043_200000034859 [0,1,0,0,0,1|2,0,0]=4 4191 B16R1.7492 Cc1ccc(cc1C(=O)CCNC(=O)N)I 1458a_100000688012_200000034859 [0,1,0,0,0,1|2,0,0]=4 4192 B16R1.7492 Cc1ccc(cc1C(=O)CCNC(=O)N)O 1458a_100000687834_200000034859 [0,1,0,0,0,1|2,0,0]=4 4193 B16R1.7492 Cc1ccc(cc1C(=O)CCOC(=O)N)Br 1458a_100000759961_200011214921 [0,1,0,0,0,1|2,0,0]=4 4194 B16R1.7492 Cc1ccc(cc1C(=O)CCOC(=O)N)Cl 1458a_100000692595_200011214921 [0,1,0,0,0,1|2,0,0]=4 4195 B16R1.7492 Cc1ccc(cc1C(=O)CCOC(=O)N)F 1458a_100000240043_200011214921 [0,1,0,0,0,1|2,0,0]=4 4196 B16R1.7492 Cc1ccc(cc1C(=O)CCOC(=O)N)I 1458a_100000688012_200011214921 [0,1,0,0,0,1|2,0,0]=4 4197 B16R1.7492 Cc1ccc(cc1C(=O)CCOC(=O)N)O 1458a_100000687834_200011214921 [0,1,0,0,0,1|2,0,0]=4 4198 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)Br 11a_100000740010_100000759961 [0,1,0,0,0,1|2,0,0]=4 4199 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)Br 240690a_100000740010_100000759961 [0,1,0,0,0,1|2,0,0]=4 4200 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)Br 527a_100000740010_100000759961 [0,1,0,0,0,1|2,0,0]=4 4201 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)Cl 11a_100000740010_100000692595 [0,1,0,0,0,1|2,0,0]=4 4202 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)Cl 240690a_100000740010_100000692595 [0,1,0,0,0,1|2,0,0]=4 4203 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)Cl 527a_100000740010_100000692595 [0,1,0,0,0,1|2,0,0]=4 4204 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)F 11a_100000740010_100000240043 [0,1,0,0,0,1|2,0,0]=4 4205 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)F 240690a_100000740010_100000240043 [0,1,0,0,0,1|2,0,0]=4 4206 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)F 527a_100000740010_100000240043 [0,1,0,0,0,1|2,0,0]=4 4207 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)I 11a_100000740010_100000688012 [0,1,0,0,0,1|2,0,0]=4 4208 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)I 240690a_100000740010_100000688012 [0,1,0,0,0,1|2,0,0]=4 4209 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)I 527a_100000740010_100000688012 [0,1,0,0,0,1|2,0,0]=4 4210 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(=O)N)O 240690a_100000740010_100000687834 [0,1,0,0,0,1|2,0,0]=4 4211 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100102525003 [0,1,0,0,0,1|2,0,0]=4 4212 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100102525003 [0,1,0,0,0,1|2,0,0]=4 4213 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100102525003 [0,1,0,0,0,1|2,0,0]=4 4214 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100102525003 [0,1,0,0,0,1|2,0,0]=4 4215 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100102525003 [0,1,0,0,0,1|2,0,0]=4 4216 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100102525003 [0,1,0,0,0,1|2,0,0]=4 4217 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100102525003 [0,1,0,0,0,1|2,0,0]=4 4218 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100102525003 [0,1,0,0,0,1|2,0,0]=4 4219 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100102525003 [0,1,0,0,0,1|2,0,0]=4 4220 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100102525003 [0,1,0,0,0,1|2,0,0]=4 4221 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100102525003 [0,1,0,0,0,1|2,0,0]=4 4222 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100102525003 [0,1,0,0,0,1|2,0,0]=4 4223 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100102525003 [0,1,0,0,0,1|2,0,0]=4 4224 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100102525003 [0,1,0,0,0,1|2,0,0]=4 4225 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100102525003 [0,1,0,0,0,1|2,0,0]=4 4226 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100102525003 [0,1,0,0,0,1|2,0,0]=4 4227 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100102525003 [0,1,0,0,0,1|2,0,0]=4 4228 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100102525003 [0,1,0,0,0,1|2,0,0]=4 4229 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100102525003 [0,1,0,0,0,1|2,0,0]=4 4230 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100102525003 [0,1,0,0,0,1|2,0,0]=4 4231 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100102525003 [0,1,0,0,0,1|1,0,0]=3 4232 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100102525003 [0,1,0,0,0,1|1,0,0]=3 4233 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100102525003 [0,1,0,0,0,1|1,0,0]=3 4234 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100102525003 [0,1,0,0,0,1|1,0,0]=3 4235 B16R1.7492 NC(=O)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100102525003 [0,1,0,0,0,1|1,0,0]=3 4236 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)Br 11a_100000740010_100000690610 [0,1,0,0,0,1|2,0,0]=4 4237 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)Br 240690a_100000740010_100000690610 [0,1,0,0,0,1|2,0,0]=4 4238 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)Br 527a_100000740010_100000690610 [0,1,0,0,0,1|2,0,0]=4 4239 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)Cl 11a_100000740010_100000736951 [0,1,0,0,0,1|2,0,0]=4 4240 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)Cl 240690a_100000740010_100000736951 [0,1,0,0,0,1|2,0,0]=4 4241 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)Cl 527a_100000740010_100000736951 [0,1,0,0,0,1|2,0,0]=4 4242 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)F 11a_100000740010_100000212315 [0,1,0,0,0,1|2,0,0]=4 4243 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)F 240690a_100000740010_100000212315 [0,1,0,0,0,1|2,0,0]=4 4244 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)F 527a_100000740010_100000212315 [0,1,0,0,0,1|2,0,0]=4 4245 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)I 11a_100000740010_100000698340 [0,1,0,0,0,1|2,0,0]=4 4246 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)I 240690a_100000740010_100000698340 [0,1,0,0,0,1|2,0,0]=4 4247 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)I 527a_100000740010_100000698340 [0,1,0,0,0,1|2,0,0]=4 4248 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)O 240690a_100000740010_100012352043 [0,1,0,0,0,1|2,0,0]=4 4249 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Br)O 527a_100000740010_100012352043 [0,1,0,0,0,1|2,0,0]=4 4250 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)Br 11a_100000740010_100000211212 [0,1,0,0,0,1|2,0,0]=4 4251 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)Br 240690a_100000740010_100000211212 [0,1,0,0,0,1|2,0,0]=4 4252 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)Br 527a_100000740010_100000211212 [0,1,0,0,0,1|2,0,0]=4 4253 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)Cl 11a_100000740010_100000210642 [0,1,0,0,0,1|2,0,0]=4 4254 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000740010_100000210642 [0,1,0,0,0,1|2,0,0]=4 4255 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)Cl 527a_100000740010_100000210642 [0,1,0,0,0,1|2,0,0]=4 4256 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)F 11a_100000740010_100011219680 [0,1,0,0,0,1|2,0,0]=4 4257 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)F 240690a_100000740010_100011219680 [0,1,0,0,0,1|2,0,0]=4 4258 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)F 527a_100000740010_100011219680 [0,1,0,0,0,1|2,0,0]=4 4259 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)I 11a_100000740010_100000688013 [0,1,0,0,0,1|2,0,0]=4 4260 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)I 240690a_100000740010_100000688013 [0,1,0,0,0,1|2,0,0]=4 4261 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)I 527a_100000740010_100000688013 [0,1,0,0,0,1|2,0,0]=4 4262 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)O 240690a_100000740010_100000719527 [0,1,0,0,0,1|2,0,0]=4 4263 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1Cl)O 527a_100000740010_100000719527 [0,1,0,0,0,1|2,0,0]=4 4264 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)Br 11a_100000740010_100000212322 [0,1,0,0,0,1|2,0,0]=4 4265 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)Br 240690a_100000740010_100000212322 [0,1,0,0,0,1|2,0,0]=4 4266 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)Br 527a_100000740010_100000212322 [0,1,0,0,0,1|2,0,0]=4 4267 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)Cl 11a_100000740010_100000214954 [0,1,0,0,0,1|2,0,0]=4 4268 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)Cl 240690a_100000740010_100000214954 [0,1,0,0,0,1|2,0,0]=4 4269 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)Cl 527a_100000740010_100000214954 [0,1,0,0,0,1|2,0,0]=4 4270 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)F 11a_100000740010_100000198512 [0,1,0,0,0,1|2,0,0]=4 4271 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)F 240690a_100000740010_100000198512 [0,1,0,0,0,1|2,0,0]=4 4272 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)F 527a_100000740010_100000198512 [0,1,0,0,0,1|2,0,0]=4 4273 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)I 11a_100000740010_100000688014 [0,1,0,0,0,1|2,0,0]=4 4274 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)I 240690a_100000740010_100000688014 [0,1,0,0,0,1|2,0,0]=4 4275 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)I 527a_100000740010_100000688014 [0,1,0,0,0,1|2,0,0]=4 4276 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)O 240690a_100000740010_100000037260 [0,1,0,0,0,1|2,0,0]=4 4277 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1F)O 527a_100000740010_100000037260 [0,1,0,0,0,1|2,0,0]=4 4278 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)Br 11a_100000740010_100000183945 [0,1,0,0,0,1|2,0,0]=4 4279 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)Br 240690a_100000740010_100000183945 [0,1,0,0,0,1|2,0,0]=4 4280 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)Cl 11a_100000740010_100000739379 [0,1,0,0,0,1|2,0,0]=4 4281 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)Cl 240690a_100000740010_100000739379 [0,1,0,0,0,1|2,0,0]=4 4282 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)Cl 527a_100000740010_100000739379 [0,1,0,0,0,1|2,0,0]=4 4283 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)F 11a_100000740010_100000748905 [0,1,0,0,0,1|2,0,0]=4 4284 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)F 240690a_100000740010_100000748905 [0,1,0,0,0,1|2,0,0]=4 4285 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)F 527a_100000740010_100000748905 [0,1,0,0,0,1|2,0,0]=4 4286 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)I 11a_100000740010_100000750460 [0,1,0,0,0,1|2,0,0]=4 4287 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)I 240690a_100000740010_100000750460 [0,1,0,0,0,1|2,0,0]=4 4288 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)I 527a_100000740010_100000750460 [0,1,0,0,0,1|2,0,0]=4 4289 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)O 240690a_100000740010_200009995701 [0,1,0,0,0,1|2,0,0]=4 4290 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1I)O 527a_100000740010_200009995701 [0,1,0,0,0,1|2,0,0]=4 4291 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)Br 240690a_100000740010_100000212140 [0,1,0,0,0,1|1,0,0]=3 4292 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)Br 527a_100000740010_100000212140 [0,1,0,0,0,1|1,0,0]=3 4293 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)Cl 11a_100000740010_100000212143 [0,1,0,0,0,1|1,0,0]=3 4294 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)Cl 240690a_100000740010_100000212143 [0,1,0,0,0,1|1,0,0]=3 4295 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)Cl 527a_100000740010_100000212143 [0,1,0,0,0,1|1,0,0]=3 4296 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)F 240690a_100000740010_100000742286 [0,1,0,0,0,1|1,0,0]=3 4297 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)F 527a_100000740010_100000742286 [0,1,0,0,0,1|1,0,0]=3 4298 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)I 240690a_100000740010_100000212111 [0,1,0,0,0,1|1,0,0]=3 4299 B16R1.7492 NC(=O)CCNC(=O)c1cc(ccc1O)I 527a_100000740010_100000212111 [0,1,0,0,0,1|1,0,0]=3 4300 B16R1.7492 NC(=O)CNCC(=O)c1cc(ccc1Br)Cl 2230a_100000711301_100012361344 [0,1,0,0,0,1|2,0,0]=4 4301 B16R1.7492 NC(=O)CNCC(=O)c1cc(ccc1Cl)Cl 2230a_100000711301_100000183120 [0,1,0,0,0,1|2,0,0]=4 4302 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100000747473 [0,1,0,0,0,1|2,0,0]=4 4303 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100000747473 [0,1,0,0,0,1|2,0,0]=4 4304 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1Cl)F 62a_100000747473_200010187420 [0,1,0,0,0,1|2,0,0]=4 4305 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100000747473 [0,1,0,0,0,1|2,0,0]=4 4306 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1F)F 62a_100000211571_100000747473 [0,1,0,0,0,1|2,0,0]=4 4307 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1F)F 62a_100000747473_100000211571 [0,1,0,0,0,1|2,0,0]=4 4308 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000747473 [0,1,0,0,0,1|1,0,0]=3 4309 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000747473 [0,1,0,0,0,1|1,0,0]=3 4310 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1O)F 62a_100000747473_100009814381 [0,1,0,0,0,1|1,0,0]=3 4311 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000747473 [0,1,0,0,0,1|1,0,0]=3 4312 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1O)O 62a_100000747473_100009814097 [0,1,0,0,0,1|1,0,0]=3 4313 B16R1.7492 NC(=O)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000747473 [0,1,0,0,0,1|1,0,0]=3 4314 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000034859 [0,1,0,0,0,1|2,0,0]=4 4315 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000034859 [0,1,0,0,0,1|2,0,0]=4 4316 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000034859 [0,1,0,0,0,1|2,0,0]=4 4317 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000034859 [0,1,0,0,0,1|2,0,0]=4 4318 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000034859 [0,1,0,0,0,1|2,0,0]=4 4319 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000034859 [0,1,0,0,0,1|2,0,0]=4 4320 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000034859 [0,1,0,0,0,1|2,0,0]=4 4321 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000034859 [0,1,0,0,0,1|2,0,0]=4 4322 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000034859 [0,1,0,0,0,1|2,0,0]=4 4323 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000034859 [0,1,0,0,0,1|2,0,0]=4 4324 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000034859 [0,1,0,0,0,1|2,0,0]=4 4325 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000034859 [0,1,0,0,0,1|2,0,0]=4 4326 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1F)F 1458a_100000198512_200000034859 [0,1,0,0,0,1|2,0,0]=4 4327 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1F)I 1458a_100000688014_200000034859 [0,1,0,0,0,1|2,0,0]=4 4328 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1F)O 1458a_100000037260_200000034859 [0,1,0,0,0,1|2,0,0]=4 4329 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000034859 [0,1,0,0,0,1|2,0,0]=4 4330 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000034859 [0,1,0,0,0,1|2,0,0]=4 4331 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1I)F 1458a_100000748905_200000034859 [0,1,0,0,0,1|2,0,0]=4 4332 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1I)I 1458a_100000750460_200000034859 [0,1,0,0,0,1|2,0,0]=4 4333 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1I)O 1458a_200009995701_200000034859 [0,1,0,0,0,1|2,0,0]=4 4334 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000034859 [0,1,0,0,0,1|1,0,0]=3 4335 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000034859 [0,1,0,0,0,1|1,0,0]=3 4336 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1O)F 1458a_100000742286_200000034859 [0,1,0,0,0,1|1,0,0]=3 4337 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1O)I 1458a_100000212111_200000034859 [0,1,0,0,0,1|1,0,0]=3 4338 B16R1.7492 NC(=O)NCCC(=O)c1cc(ccc1O)O 1458a_100000758025_200000034859 [0,1,0,0,0,1|1,0,0]=3 4339 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200011214921 [0,1,0,0,0,1|2,0,0]=4 4340 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200011214921 [0,1,0,0,0,1|2,0,0]=4 4341 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_200011214921 [0,1,0,0,0,1|2,0,0]=4 4342 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_200011214921 [0,1,0,0,0,1|2,0,0]=4 4343 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_200011214921 [0,1,0,0,0,1|2,0,0]=4 4344 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200011214921 [0,1,0,0,0,1|2,0,0]=4 4345 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200011214921 [0,1,0,0,0,1|2,0,0]=4 4346 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200011214921 [0,1,0,0,0,1|2,0,0]=4 4347 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200011214921 [0,1,0,0,0,1|2,0,0]=4 4348 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200011214921 [0,1,0,0,0,1|2,0,0]=4 4349 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_200011214921 [0,1,0,0,0,1|2,0,0]=4 4350 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200011214921 [0,1,0,0,0,1|2,0,0]=4 4351 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1F)F 1458a_100000198512_200011214921 [0,1,0,0,0,1|2,0,0]=4 4352 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1F)I 1458a_100000688014_200011214921 [0,1,0,0,0,1|2,0,0]=4 4353 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1F)O 1458a_100000037260_200011214921 [0,1,0,0,0,1|2,0,0]=4 4354 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_200011214921 [0,1,0,0,0,1|2,0,0]=4 4355 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200011214921 [0,1,0,0,0,1|2,0,0]=4 4356 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1I)F 1458a_100000748905_200011214921 [0,1,0,0,0,1|2,0,0]=4 4357 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1I)I 1458a_100000750460_200011214921 [0,1,0,0,0,1|2,0,0]=4 4358 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1I)O 1458a_200009995701_200011214921 [0,1,0,0,0,1|2,0,0]=4 4359 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_200011214921 [0,1,0,0,0,1|1,0,0]=3 4360 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200011214921 [0,1,0,0,0,1|1,0,0]=3 4361 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1O)F 1458a_100000742286_200011214921 [0,1,0,0,0,1|1,0,0]=3 4362 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1O)I 1458a_100000212111_200011214921 [0,1,0,0,0,1|1,0,0]=3 4363 B16R1.7492 NC(=O)OCCC(=O)c1cc(ccc1O)O 1458a_100000758025_200011214921 [0,1,0,0,0,1|1,0,0]=3 4364 B16R1.7492 O=C(CCC=C(F)F)c1cc(ccc1O)Br 1458a_100000212140_200009816681 [0,1,0,0,0,1|2,0,0]=4 4365 B16R1.7492 O=C(CCC=C(F)F)c1cc(ccc1O)Cl 1458a_100000212143_200009816681 [0,1,0,0,0,1|2,0,0]=4 4366 B16R1.7492 O=C(CCC=C(F)F)c1cc(ccc1O)F 1458a_100000742286_200009816681 [0,1,0,0,0,1|2,0,0]=4 4367 B16R1.7492 O=C(CCC=C(F)F)c1cc(ccc1O)I 1458a_100000212111_200009816681 [0,1,0,0,0,1|2,0,0]=4 4368 B16R1.7492 O=C(CCC=C(F)F)c1cc(ccc1O)O 1458a_100000758025_200009816681 [0,1,0,0,0,1|2,0,0]=4 4369 B16R1.7492 O=C(CSC[N+](=O)[O-])c1cc(ccc1O)Br 62a_200009828000_100000761209 [0,1,0,0,0,1|1,0,1]=4 4370 B16R1.7492 O=C(CSC[N+](=O)[O-])c1cc(ccc1O)Cl 62a_200009816716_100000761209 [0,1,0,0,0,1|1,0,1]=4 4371 B16R1.7492 O=C(CSC[N+](=O)[O-])c1cc(ccc1O)F 62a_100009814381_100000761209 [0,1,0,0,0,1|1,0,1]=4 4372 B16R1.7492 O=C(CSC[N+](=O)[O-])c1cc(ccc1O)O 62a_100009814097_100000761209 [0,1,0,0,0,1|1,0,1]=4 4373 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1Br)Cl 269956a_100016091260_100012361344 [0,1,0,0,0,1|1,0,0]=3 4374 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1Cl)Cl 269956a_100016091260_100000183120 [0,1,0,0,0,1|1,0,0]=3 4375 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1Cl)F 269956a_100016091260_200010187420 [0,1,0,0,0,1|1,0,0]=3 4376 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1F)F 269956a_100016091260_100000211571 [0,1,0,0,0,1|1,0,0]=3 4377 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1O)Br 269956a_100016091260_200009828000 [0,1,0,0,0,1|0,0,0]=2 4378 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1O)Cl 269956a_100016091260_200009816716 [0,1,0,0,0,1|0,0,0]=2 4379 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1O)F 269956a_100016091260_100009814381 [0,1,0,0,0,1|0,0,0]=2 4380 B16R1.7492 O=C(O)CNCC(=O)c1cc(ccc1O)O 269956a_100016091260_100009814097 [0,1,0,0,0,1|0,0,0]=2 4381 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100020667443 [0,1,0,0,0,1|1,0,1]=4 4382 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100020667443 [0,1,0,0,0,1|1,0,1]=4 4383 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1Cl)F 62a_100020667443_200010187420 [0,1,0,0,0,1|1,0,1]=4 4384 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100020667443 [0,1,0,0,0,1|1,0,1]=4 4385 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1F)F 62a_100000211571_100020667443 [0,1,0,0,0,1|1,0,1]=4 4386 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1F)F 62a_100020667443_100000211571 [0,1,0,0,0,1|1,0,1]=4 4387 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100020667443 [0,1,0,0,0,1|0,0,1]=3 4388 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100020667443 [0,1,0,0,0,1|0,0,1]=3 4389 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100020667443 [0,1,0,0,0,1|0,0,1]=3 4390 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1O)F 62a_100020667443_100009814381 [0,1,0,0,0,1|0,0,1]=3 4391 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100020667443 [0,1,0,0,0,1|0,0,1]=3 4392 B16R1.7492 O=C([O-])CSCC(=O)c1cc(ccc1O)O 62a_100020667443_100009814097 [0,1,0,0,0,1|0,0,1]=3 4393 B16R1.10819 CC(=O)C(C)OCC(=O)c1ccccc1Br 34a_100000212229_100000199116 [0,1,0,0,0,1|2,0,0]=4 4394 B16R1.10819 CC(=O)C(C)OCC(=O)c1ccccc1C 34a_100000212229_100000741374 [0,1,0,0,0,1|2,0,0]=4 4395 B16R1.10819 CC(=O)C(C)OCC(=O)c1ccccc1Cl 34a_100000212229_100000211432 [0,1,0,0,0,1|2,0,0]=4 4396 B16R1.10819 CC(=O)C(C)OCC(=O)c1ccccc1F 34a_100000212229_100000204681 [0,1,0,0,0,1|2,0,0]=4 4397 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1Br 62a_100000199116_100009814033 [0,1,0,0,0,1|2,0,0]=4 4398 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1C 62a_100000741374_100009814033 [0,1,0,0,0,1|2,0,0]=4 4399 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1C 62a_100009814033_100000741374 [0,1,0,0,0,1|2,0,0]=4 4400 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100009814033 [0,1,0,0,0,1|2,0,0]=4 4401 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1Cl 62a_100009814033_100000211432 [0,1,0,0,0,1|2,0,0]=4 4402 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1F 62a_100000204681_100009814033 [0,1,0,0,0,1|2,0,0]=4 4403 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1F 62a_100009814033_100000204681 [0,1,0,0,0,1|2,0,0]=4 4404 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1O 62a_100000188908_100009814033 [0,1,0,0,0,1|1,0,0]=3 4405 B16R1.10819 CC(=O)C(C)SCC(=O)c1ccccc1O 62a_100009814033_100000188908 [0,1,0,0,0,1|1,0,0]=3 4406 B16R1.10819 CC(SCC(=O)c1ccccc1Br)C(=O)N 62a_100000199116_100000702099 [0,1,0,0,0,1|2,0,0]=4 4407 B16R1.10819 CC(SCC(=O)c1ccccc1Cl)C(=O)N 62a_100000211432_100000702099 [0,1,0,0,0,1|2,0,0]=4 4408 B16R1.10819 CC(SCC(=O)c1ccccc1Cl)C(=O)N 62a_100000702099_100000211432 [0,1,0,0,0,1|2,0,0]=4 4409 B16R1.10819 CC(SCC(=O)c1ccccc1F)C(=O)N 62a_100000204681_100000702099 [0,1,0,0,0,1|2,0,0]=4 4410 B16R1.10819 CC(SCC(=O)c1ccccc1F)C(=O)N 62a_100000702099_100000204681 [0,1,0,0,0,1|2,0,0]=4 4411 B16R1.10819 CC(SCC(=O)c1ccccc1O)C(=O)N 62a_100000188908_100000702099 [0,1,0,0,0,1|1,0,0]=3 4412 B16R1.10819 CC(SCC(=O)c1ccccc1O)C(=O)N 62a_100000702099_100000188908 [0,1,0,0,0,1|1,0,0]=3 4413 B16R1.10819 C[C@@H](NCC(=O)c1ccccc1Br)C(=O)N 34a_100000119354_100000199116 [0,1,0,0,0,1|2,0,0]=4 4414 B16R1.10819 C[C@@H](NCC(=O)c1ccccc1Cl)C(=O)N 34a_100000119354_100000211432 [0,1,0,0,0,1|2,0,0]=4 4415 B16R1.10819 C[C@@H](NCC(=O)c1ccccc1F)C(=O)N 34a_100000119354_100000204681 [0,1,0,0,0,1|2,0,0]=4 4416 B16R1.10819 C[C@@H](OCC(=O)c1ccccc1Br)C(=O)N 34a_100000731257_100000199116 [0,1,0,0,0,1|2,0,0]=4 4417 B16R1.10819 C[C@@H](OCC(=O)c1ccccc1Cl)C(=O)N 34a_100000731257_100000211432 [0,1,0,0,0,1|2,0,0]=4 4418 B16R1.10819 C[C@@H](OCC(=O)c1ccccc1F)C(=O)N 34a_100000731257_100000204681 [0,1,0,0,0,1|2,0,0]=4 4419 B16R1.10819 C[C@@H](OCC(=O)c1ccccc1F)C(=O)N 7a_100000731257_100000204681 [0,1,0,0,0,1|2,0,0]=4 4420 B16R1.10819 C[C@@H](OCC(=O)c1ccccc1O)C(=O)N 7a_100000731257_100000188908 [0,1,0,0,0,1|1,0,0]=3 4421 B16R1.10819 C[C@H](NCC(=O)c1ccccc1Br)C(=O)O 269956a_100000743915_100000199116 [0,1,0,0,0,1|1,0,0]=3 4422 B16R1.10819 C[C@H](NCC(=O)c1ccccc1Cl)C(=O)O 269956a_100000743915_100000211432 [0,1,0,0,0,1|1,0,0]=3 4423 B16R1.10819 C[C@H](NCC(=O)c1ccccc1F)C(=O)O 269956a_100000743915_100000204681 [0,1,0,0,0,1|1,0,0]=3 4424 B16R1.10819 C[C@H](NCC(=O)c1ccccc1O)C(=O)O 269956a_100000743915_100000188908 [0,1,0,0,0,1|0,0,0]=2 4425 B16R1.10819 C[C@H](OCC(=O)c1ccccc1F)C(=O)[O-] 7a_217856618621_100000204681 [0,1,0,0,0,1|1,0,1]=4 4426 B16R1.10819 C[C@H](OCC(=O)c1ccccc1O)C(=O)[O-] 7a_217856618621_100000188908 [0,1,0,0,0,1|0,0,1]=3 4427 B16R1.10819 Cc1ccccc1C(=O)CN[C@@H](C)C(=O)O 269956a_100000743915_100000741374 [0,1,0,0,0,1|1,0,0]=3 4428 B16R1.10819 Cc1ccccc1C(=O)CN[C@H](C)C(=O)N 2230a_100000119354_100000741374 [0,1,0,0,0,1|2,0,0]=4 4429 B16R1.10819 Cc1ccccc1C(=O)CN[C@H](C)C(=O)N 34a_100000119354_100000741374 [0,1,0,0,0,1|2,0,0]=4 4430 B16R1.10819 Cc1ccccc1C(=O)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000741374 [0,1,0,0,0,1|1,0,1]=4 4431 B16R1.10819 Cc1ccccc1C(=O)CO[C@H](C)C(=O)N 34a_100000731257_100000741374 [0,1,0,0,0,1|2,0,0]=4 4432 B16R1.10819 Cc1ccccc1C(=O)CO[C@H](C)C(=O)N 7a_100000731257_100000741374 [0,1,0,0,0,1|2,0,0]=4 4433 B16R1.10819 Cc1ccccc1C(=O)CSC(C)C(=O)N 62a_100000702099_100000741374 [0,1,0,0,0,1|2,0,0]=4 4434 B16R1.10819 Cc1ccccc1C(=O)CSC(C)C(=O)N 62a_100000741374_100000702099 [0,1,0,0,0,1|2,0,0]=4 4435 B16R1.10819 Cc1ccccc1C(=O)CSC(F)C(=O)N 62a_100000741374_100009813875 [0,1,0,0,0,1|2,0,0]=4 4436 B16R1.10819 Cc1ccccc1C(=O)CSC(F)C(=O)N 62a_100009813875_100000741374 [0,1,0,0,0,1|2,0,0]=4 4437 B16R1.10819 Cc1ccccc1C(=O)CSC(F)C(=O)[O-] 62a_100000741374_100020610796 [0,1,0,0,0,1|1,0,1]=4 4438 B16R1.10819 Cc1ccccc1C(=O)CSC(F)C(=O)[O-] 62a_100020610796_100000741374 [0,1,0,0,0,1|1,0,1]=4 4439 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1Br 62a_100000199116_100009813875 [0,1,0,0,0,1|2,0,0]=4 4440 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1Cl 62a_100000211432_100009813875 [0,1,0,0,0,1|2,0,0]=4 4441 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1Cl 62a_100009813875_100000211432 [0,1,0,0,0,1|2,0,0]=4 4442 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1F 62a_100000204681_100009813875 [0,1,0,0,0,1|2,0,0]=4 4443 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1F 62a_100009813875_100000204681 [0,1,0,0,0,1|2,0,0]=4 4444 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1O 62a_100000188908_100009813875 [0,1,0,0,0,1|1,0,0]=3 4445 B16R1.10819 NC(=O)C(F)SCC(=O)c1ccccc1O 62a_100009813875_100000188908 [0,1,0,0,0,1|1,0,0]=3 4446 B16R1.10819 O=C(CCC(=C(F)F)F)c1ccccc1O 1458a_100015234032_100009813398 [0,1,0,0,0,1|2,0,0]=4 4447 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1Br 62a_100000199116_100020610796 [0,1,0,0,0,1|1,0,1]=4 4448 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1Cl 62a_100000211432_100020610796 [0,1,0,0,0,1|1,0,1]=4 4449 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1Cl 62a_100020610796_100000211432 [0,1,0,0,0,1|1,0,1]=4 4450 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1F 62a_100000204681_100020610796 [0,1,0,0,0,1|1,0,1]=4 4451 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1F 62a_100020610796_100000204681 [0,1,0,0,0,1|1,0,1]=4 4452 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1O 62a_100000188908_100020610796 [0,1,0,0,0,1|0,0,1]=3 4453 B16R1.10819 O=C(CSC(F)C(=O)[O-])c1ccccc1O 62a_100020610796_100000188908 [0,1,0,0,0,1|0,0,1]=3 4454 B16R1.11264 CC(=CCCC(=O)c1cccc(c1O)Br)C 1458a_100000752940_100011217483 [0,1,0,0,0,1|2,0,0]=4 4455 B16R1.11264 CC(=CCCC(=O)c1cccc(c1O)C)C 1458a_100000183896_100011217483 [0,1,0,0,0,1|2,0,0]=4 4456 B16R1.11264 CC(=CCCC(=O)c1cccc(c1O)Cl)C 1458a_100000742801_100011217483 [0,1,0,0,0,1|2,0,0]=4 4457 B16R1.11264 CC(=CCCC(=O)c1cccc(c1O)F)C 1458a_100011217230_100011217483 [0,1,0,0,0,1|2,0,0]=4 4458 B16R1.11264 CC(=CCCC(=O)c1cccc(c1O)O)C 1458a_100000690420_100011217483 [0,1,0,0,0,1|2,0,0]=4 4459 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011215641 [0,1,0,0,0,1|2,0,0]=4 4460 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100011215641 [0,1,0,0,0,1|2,0,0]=4 4461 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011215641 [0,1,0,0,0,1|2,0,0]=4 4462 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100011215641 [0,1,0,0,0,1|2,0,0]=4 4463 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100011215641 [0,1,0,0,0,1|2,0,0]=4 4464 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100011215641 [0,1,0,0,0,1|2,0,0]=4 4465 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100011215641 [0,1,0,0,0,1|2,0,0]=4 4466 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1C)C 1458a_100000183679_100011215641 [0,1,0,0,0,1|2,0,0]=4 4467 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100011215641 [0,1,0,0,0,1|2,0,0]=4 4468 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1C)F 1458a_100011218272_100011215641 [0,1,0,0,0,1|2,0,0]=4 4469 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1C)I 1458a_100000751865_100011215641 [0,1,0,0,0,1|2,0,0]=4 4470 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1C)O 1458a_100000766327_100011215641 [0,1,0,0,0,1|2,0,0]=4 4471 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011215641 [0,1,0,0,0,1|2,0,0]=4 4472 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100011215641 [0,1,0,0,0,1|2,0,0]=4 4473 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011215641 [0,1,0,0,0,1|2,0,0]=4 4474 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011215641 [0,1,0,0,0,1|2,0,0]=4 4475 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011215641 [0,1,0,0,0,1|2,0,0]=4 4476 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011215641 [0,1,0,0,0,1|2,0,0]=4 4477 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100011215641 [0,1,0,0,0,1|2,0,0]=4 4478 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1F)C 1458a_100000766181_100011215641 [0,1,0,0,0,1|2,0,0]=4 4479 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011215641 [0,1,0,0,0,1|2,0,0]=4 4480 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1F)F 1458a_100000748134_100011215641 [0,1,0,0,0,1|2,0,0]=4 4481 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1F)I 1458a_100010185205_100011215641 [0,1,0,0,0,1|2,0,0]=4 4482 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100011215641 [0,1,0,0,0,1|2,0,0]=4 4483 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100011215641 [0,1,0,0,0,1|2,0,0]=4 4484 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1I)C 1458a_100000739377_100011215641 [0,1,0,0,0,1|2,0,0]=4 4485 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011215641 [0,1,0,0,0,1|2,0,0]=4 4486 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1I)F 1458a_100000690930_100011215641 [0,1,0,0,0,1|2,0,0]=4 4487 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100011215641 [0,1,0,0,0,1|2,0,0]=4 4488 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215641 [0,1,0,0,0,1|1,0,0]=3 4489 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100011215641 [0,1,0,0,0,1|1,0,0]=3 4490 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215641 [0,1,0,0,0,1|1,0,0]=3 4491 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215641 [0,1,0,0,0,1|1,0,0]=3 4492 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215641 [0,1,0,0,0,1|1,0,0]=3 4493 B16R1.11264 CC(=O)COCC(=O)c1cccc(c1C)I 34a_100000211253_100160470822 [0,1,0,0,0,1|2,0,0]=4 4494 B16R1.11264 CC(=O)COCC(=O)c1cccc(c1F)Br 34a_100000211253_100012356374 [0,1,0,0,0,1|2,0,0]=4 4495 B16R1.11264 CC(=O)COCC(=O)c1cccc(c1F)Cl 34a_100000211253_200012351890 [0,1,0,0,0,1|2,0,0]=4 4496 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000189650 [0,1,0,0,0,1|2,0,0]=4 4497 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000189650 [0,1,0,0,0,1|2,0,0]=4 4498 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000189650 [0,1,0,0,0,1|2,0,0]=4 4499 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000189650 [0,1,0,0,0,1|2,0,0]=4 4500 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000189650 [0,1,0,0,0,1|2,0,0]=4 4501 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000189650 [0,1,0,0,0,1|2,0,0]=4 4502 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000189650 [0,1,0,0,0,1|2,0,0]=4 4503 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000189650 [0,1,0,0,0,1|2,0,0]=4 4504 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000189650 [0,1,0,0,0,1|2,0,0]=4 4505 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000189650 [0,1,0,0,0,1|2,0,0]=4 4506 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000189650 [0,1,0,0,0,1|2,0,0]=4 4507 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000189650 [0,1,0,0,0,1|2,0,0]=4 4508 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000189650 [0,1,0,0,0,1|2,0,0]=4 4509 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000189650 [0,1,0,0,0,1|2,0,0]=4 4510 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000189650 [0,1,0,0,0,1|2,0,0]=4 4511 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000189650 [0,1,0,0,0,1|2,0,0]=4 4512 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000189650 [0,1,0,0,0,1|2,0,0]=4 4513 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000189650 [0,1,0,0,0,1|2,0,0]=4 4514 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000189650 [0,1,0,0,0,1|2,0,0]=4 4515 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000189650 [0,1,0,0,0,1|2,0,0]=4 4516 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000189650 [0,1,0,0,0,1|2,0,0]=4 4517 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000189650 [0,1,0,0,0,1|2,0,0]=4 4518 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000189650 [0,1,0,0,0,1|2,0,0]=4 4519 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000189650 [0,1,0,0,0,1|2,0,0]=4 4520 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000189650 [0,1,0,0,0,1|2,0,0]=4 4521 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000189650 [0,1,0,0,0,1|2,0,0]=4 4522 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000189650 [0,1,0,0,0,1|2,0,0]=4 4523 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000189650 [0,1,0,0,0,1|2,0,0]=4 4524 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000189650 [0,1,0,0,0,1|2,0,0]=4 4525 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000189650 [0,1,0,0,0,1|1,0,0]=3 4526 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000189650 [0,1,0,0,0,1|1,0,0]=3 4527 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000189650 [0,1,0,0,0,1|1,0,0]=3 4528 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000189650 [0,1,0,0,0,1|1,0,0]=3 4529 B16R1.11264 CC(=O)NCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000189650 [0,1,0,0,0,1|1,0,0]=3 4530 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100009814007 [0,1,0,0,0,1|2,0,0]=4 4531 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100009814007 [0,1,0,0,0,1|2,0,0]=4 4532 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100009814007 [0,1,0,0,0,1|2,0,0]=4 4533 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100009814007 [0,1,0,0,0,1|2,0,0]=4 4534 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100009814007 [0,1,0,0,0,1|2,0,0]=4 4535 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100009814007 [0,1,0,0,0,1|2,0,0]=4 4536 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100009814007 [0,1,0,0,0,1|2,0,0]=4 4537 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1C)C 1458a_100000183679_100009814007 [0,1,0,0,0,1|2,0,0]=4 4538 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100009814007 [0,1,0,0,0,1|2,0,0]=4 4539 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1C)F 1458a_100011218272_100009814007 [0,1,0,0,0,1|2,0,0]=4 4540 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1C)I 1458a_100000751865_100009814007 [0,1,0,0,0,1|2,0,0]=4 4541 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1C)O 1458a_100000766327_100009814007 [0,1,0,0,0,1|2,0,0]=4 4542 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100009814007 [0,1,0,0,0,1|2,0,0]=4 4543 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100009814007 [0,1,0,0,0,1|2,0,0]=4 4544 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100009814007 [0,1,0,0,0,1|2,0,0]=4 4545 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100009814007 [0,1,0,0,0,1|2,0,0]=4 4546 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100009814007 [0,1,0,0,0,1|2,0,0]=4 4547 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100009814007 [0,1,0,0,0,1|2,0,0]=4 4548 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100009814007 [0,1,0,0,0,1|2,0,0]=4 4549 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1F)C 1458a_100000766181_100009814007 [0,1,0,0,0,1|2,0,0]=4 4550 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100009814007 [0,1,0,0,0,1|2,0,0]=4 4551 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1F)F 1458a_100000748134_100009814007 [0,1,0,0,0,1|2,0,0]=4 4552 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1F)I 1458a_100010185205_100009814007 [0,1,0,0,0,1|2,0,0]=4 4553 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1F)O 1458a_100000037433_100009814007 [0,1,0,0,0,1|2,0,0]=4 4554 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100009814007 [0,1,0,0,0,1|2,0,0]=4 4555 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1I)C 1458a_100000739377_100009814007 [0,1,0,0,0,1|2,0,0]=4 4556 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100009814007 [0,1,0,0,0,1|2,0,0]=4 4557 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1I)F 1458a_100000690930_100009814007 [0,1,0,0,0,1|2,0,0]=4 4558 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1I)O 1458a_100010084636_100009814007 [0,1,0,0,0,1|2,0,0]=4 4559 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100009814007 [0,1,0,0,0,1|1,0,0]=3 4560 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1O)C 1458a_100000183896_100009814007 [0,1,0,0,0,1|1,0,0]=3 4561 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100009814007 [0,1,0,0,0,1|1,0,0]=3 4562 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1O)F 1458a_100011217230_100009814007 [0,1,0,0,0,1|1,0,0]=3 4563 B16R1.11264 CC(=O)OCCC(=O)c1cccc(c1O)O 1458a_100000690420_100009814007 [0,1,0,0,0,1|1,0,0]=3 4564 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_200000718107 [0,1,0,0,0,1|1,0,1]=4 4565 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000718107 [0,1,0,0,0,1|1,0,1]=4 4566 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_200000718107 [0,1,0,0,0,1|1,0,1]=4 4567 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_200000718107 [0,1,0,0,0,1|1,0,1]=4 4568 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Br 240690a_200000755665_100000752940 [0,1,0,0,0,1|1,0,1]=4 4569 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Br 527a_200000755665_100000752940 [0,1,0,0,0,1|1,0,1]=4 4570 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Cl 240690a_200000755665_100000742801 [0,1,0,0,0,1|1,0,1]=4 4571 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Cl 527a_200000755665_100000742801 [0,1,0,0,0,1|1,0,1]=4 4572 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)F 240690a_200000755665_100011217230 [0,1,0,0,0,1|1,0,1]=4 4573 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)F 527a_200000755665_100011217230 [0,1,0,0,0,1|1,0,1]=4 4574 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)O 527a_200000755665_100000690420 [0,1,0,0,0,1|1,0,1]=4 4575 B16R1.11264 Cc1c(cccc1C(=O)CCCC(=O)N)Br 1458a_100000760464_100102525003 [0,1,0,0,0,1|2,0,0]=4 4576 B16R1.11264 Cc1c(cccc1C(=O)CCCC(=O)N)Cl 1458a_100000690184_100102525003 [0,1,0,0,0,1|2,0,0]=4 4577 B16R1.11264 Cc1c(cccc1C(=O)CCCC(=O)N)F 1458a_100011218272_100102525003 [0,1,0,0,0,1|2,0,0]=4 4578 B16R1.11264 Cc1c(cccc1C(=O)CCCC(=O)N)I 1458a_100000751865_100102525003 [0,1,0,0,0,1|2,0,0]=4 4579 B16R1.11264 Cc1c(cccc1C(=O)CCCC(=O)N)O 1458a_100000766327_100102525003 [0,1,0,0,0,1|2,0,0]=4 4580 B16R1.11264 Cc1c(cccc1C(=O)CCNC(=O)N)Br 1458a_100000760464_200000034859 [0,1,0,0,0,1|2,0,0]=4 4581 B16R1.11264 Cc1c(cccc1C(=O)CCNC(=O)N)Cl 1458a_100000690184_200000034859 [0,1,0,0,0,1|2,0,0]=4 4582 B16R1.11264 Cc1c(cccc1C(=O)CCNC(=O)N)F 1458a_100011218272_200000034859 [0,1,0,0,0,1|2,0,0]=4 4583 B16R1.11264 Cc1c(cccc1C(=O)CCNC(=O)N)I 1458a_100000751865_200000034859 [0,1,0,0,0,1|2,0,0]=4 4584 B16R1.11264 Cc1c(cccc1C(=O)CCNC(=O)N)O 1458a_100000766327_200000034859 [0,1,0,0,0,1|2,0,0]=4 4585 B16R1.11264 Cc1c(cccc1C(=O)CCOC(=O)N)Br 1458a_100000760464_200011214921 [0,1,0,0,0,1|2,0,0]=4 4586 B16R1.11264 Cc1c(cccc1C(=O)CCOC(=O)N)Cl 1458a_100000690184_200011214921 [0,1,0,0,0,1|2,0,0]=4 4587 B16R1.11264 Cc1c(cccc1C(=O)CCOC(=O)N)F 1458a_100011218272_200011214921 [0,1,0,0,0,1|2,0,0]=4 4588 B16R1.11264 Cc1c(cccc1C(=O)CCOC(=O)N)I 1458a_100000751865_200011214921 [0,1,0,0,0,1|2,0,0]=4 4589 B16R1.11264 Cc1c(cccc1C(=O)CCOC(=O)N)O 1458a_100000766327_200011214921 [0,1,0,0,0,1|2,0,0]=4 4590 B16R1.11264 Cc1c(cccc1C(=O)CNCC(=O)O)I 269956a_100016091260_100160470822 [0,1,0,0,0,1|1,0,0]=3 4591 B16R1.11264 Cc1c(cccc1C(=O)CSCC(=O)N)I 62a_100000747473_100160470822 [0,1,0,0,0,1|2,0,0]=4 4592 B16R1.11264 Cc1c(cccc1C(=O)CSCC(=O)N)I 62a_100160470822_100000747473 [0,1,0,0,0,1|2,0,0]=4 4593 B16R1.11264 Cc1c(cccc1C(=O)CSCC(=O)[O-])I 62a_100020667443_100160470822 [0,1,0,0,0,1|1,0,1]=4 4594 B16R1.11264 Cc1c(cccc1C(=O)CSCC(=O)[O-])I 62a_100160470822_100020667443 [0,1,0,0,0,1|1,0,1]=4 4595 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)Br 11a_100000740010_100000760464 [0,1,0,0,0,1|2,0,0]=4 4596 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)Br 240690a_100000740010_100000760464 [0,1,0,0,0,1|2,0,0]=4 4597 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)Br 527a_100000740010_100000760464 [0,1,0,0,0,1|2,0,0]=4 4598 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)Cl 11a_100000740010_100000690184 [0,1,0,0,0,1|2,0,0]=4 4599 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)Cl 240690a_100000740010_100000690184 [0,1,0,0,0,1|2,0,0]=4 4600 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)Cl 527a_100000740010_100000690184 [0,1,0,0,0,1|2,0,0]=4 4601 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)F 11a_100000740010_100011218272 [0,1,0,0,0,1|2,0,0]=4 4602 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)F 240690a_100000740010_100011218272 [0,1,0,0,0,1|2,0,0]=4 4603 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)F 527a_100000740010_100011218272 [0,1,0,0,0,1|2,0,0]=4 4604 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)I 11a_100000740010_100000751865 [0,1,0,0,0,1|2,0,0]=4 4605 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)I 240690a_100000740010_100000751865 [0,1,0,0,0,1|2,0,0]=4 4606 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)I 527a_100000740010_100000751865 [0,1,0,0,0,1|2,0,0]=4 4607 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)O 240690a_100000740010_100000766327 [0,1,0,0,0,1|2,0,0]=4 4608 B16R1.11264 Cc1c(cccc1C(=O)NCCC(=O)N)O 527a_100000740010_100000766327 [0,1,0,0,0,1|2,0,0]=4 4609 B16R1.11264 Cc1cccc(c1Br)C(=O)CCCC(=O)N 1458a_100000692419_100102525003 [0,1,0,0,0,1|2,0,0]=4 4610 B16R1.11264 Cc1cccc(c1Br)C(=O)CCNC(=O)N 1458a_100000692419_200000034859 [0,1,0,0,0,1|2,0,0]=4 4611 B16R1.11264 Cc1cccc(c1Br)C(=O)CCOC(=O)N 1458a_100000692419_200011214921 [0,1,0,0,0,1|2,0,0]=4 4612 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(=O)N 11a_100000740010_100000692419 [0,1,0,0,0,1|2,0,0]=4 4613 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(=O)N 240690a_100000740010_100000692419 [0,1,0,0,0,1|2,0,0]=4 4614 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(=O)N 527a_100000740010_100000692419 [0,1,0,0,0,1|2,0,0]=4 4615 B16R1.11264 Cc1cccc(c1C)C(=O)CCCC(=O)N 1458a_100000183679_100102525003 [0,1,0,0,0,1|2,0,0]=4 4616 B16R1.11264 Cc1cccc(c1C)C(=O)CCNC(=O)N 1458a_100000183679_200000034859 [0,1,0,0,0,1|2,0,0]=4 4617 B16R1.11264 Cc1cccc(c1C)C(=O)CCOC(=O)N 1458a_100000183679_200011214921 [0,1,0,0,0,1|2,0,0]=4 4618 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(=O)N 11a_100000740010_100000183679 [0,1,0,0,0,1|2,0,0]=4 4619 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(=O)N 240690a_100000740010_100000183679 [0,1,0,0,0,1|2,0,0]=4 4620 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(=O)N 527a_100000740010_100000183679 [0,1,0,0,0,1|2,0,0]=4 4621 B16R1.11264 Cc1cccc(c1Cl)C(=O)CCCC(=O)N 1458a_100000693142_100102525003 [0,1,0,0,0,1|2,0,0]=4 4622 B16R1.11264 Cc1cccc(c1Cl)C(=O)CCNC(=O)N 1458a_100000693142_200000034859 [0,1,0,0,0,1|2,0,0]=4 4623 B16R1.11264 Cc1cccc(c1Cl)C(=O)CCOC(=O)N 1458a_100000693142_200011214921 [0,1,0,0,0,1|2,0,0]=4 4624 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(=O)N 11a_100000740010_100000693142 [0,1,0,0,0,1|2,0,0]=4 4625 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(=O)N 240690a_100000740010_100000693142 [0,1,0,0,0,1|2,0,0]=4 4626 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(=O)N 527a_100000740010_100000693142 [0,1,0,0,0,1|2,0,0]=4 4627 B16R1.11264 Cc1cccc(c1F)C(=O)CCCC(=O)N 1458a_100000766181_100102525003 [0,1,0,0,0,1|2,0,0]=4 4628 B16R1.11264 Cc1cccc(c1F)C(=O)CCNC(=O)N 1458a_100000766181_200000034859 [0,1,0,0,0,1|2,0,0]=4 4629 B16R1.11264 Cc1cccc(c1F)C(=O)CCOC(=O)N 1458a_100000766181_200011214921 [0,1,0,0,0,1|2,0,0]=4 4630 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(=O)N 11a_100000740010_100000766181 [0,1,0,0,0,1|2,0,0]=4 4631 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(=O)N 240690a_100000740010_100000766181 [0,1,0,0,0,1|2,0,0]=4 4632 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(=O)N 527a_100000740010_100000766181 [0,1,0,0,0,1|2,0,0]=4 4633 B16R1.11264 Cc1cccc(c1I)C(=O)CCCC(=O)N 1458a_100000739377_100102525003 [0,1,0,0,0,1|2,0,0]=4 4634 B16R1.11264 Cc1cccc(c1I)C(=O)CCNC(=O)N 1458a_100000739377_200000034859 [0,1,0,0,0,1|2,0,0]=4 4635 B16R1.11264 Cc1cccc(c1I)C(=O)CCOC(=O)N 1458a_100000739377_200011214921 [0,1,0,0,0,1|2,0,0]=4 4636 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(=O)N 11a_100000740010_100000739377 [0,1,0,0,0,1|2,0,0]=4 4637 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(=O)N 240690a_100000740010_100000739377 [0,1,0,0,0,1|2,0,0]=4 4638 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(=O)N 527a_100000740010_100000739377 [0,1,0,0,0,1|2,0,0]=4 4639 B16R1.11264 Cc1cccc(c1O)C(=O)CCC=C(F)F 1458a_100000183896_200009816681 [0,1,0,0,0,1|2,0,0]=4 4640 B16R1.11264 Cc1cccc(c1O)C(=O)CCCC(=O)N 1458a_100000183896_100102525003 [0,1,0,0,0,1|1,0,0]=3 4641 B16R1.11264 Cc1cccc(c1O)C(=O)CCCC(C)O 1458a_100000183896_200000718107 [0,1,0,0,0,1|1,0,1]=4 4642 B16R1.11264 Cc1cccc(c1O)C(=O)CCNC(=O)N 1458a_100000183896_200000034859 [0,1,0,0,0,1|1,0,0]=3 4643 B16R1.11264 Cc1cccc(c1O)C(=O)CCOC(=O)N 1458a_100000183896_200011214921 [0,1,0,0,0,1|1,0,0]=3 4644 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(=O)N 240690a_100000740010_100000183896 [0,1,0,0,0,1|1,0,0]=3 4645 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(=O)N 527a_100000740010_100000183896 [0,1,0,0,0,1|1,0,0]=3 4646 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(C)O 240690a_200000755665_100000183896 [0,1,0,0,0,1|1,0,1]=4 4647 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(C)O 527a_200000755665_100000183896 [0,1,0,0,0,1|1,0,1]=4 4648 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100102525003 [0,1,0,0,0,1|2,0,0]=4 4649 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100102525003 [0,1,0,0,0,1|2,0,0]=4 4650 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100102525003 [0,1,0,0,0,1|2,0,0]=4 4651 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100102525003 [0,1,0,0,0,1|2,0,0]=4 4652 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100102525003 [0,1,0,0,0,1|2,0,0]=4 4653 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100102525003 [0,1,0,0,0,1|2,0,0]=4 4654 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100102525003 [0,1,0,0,0,1|2,0,0]=4 4655 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100102525003 [0,1,0,0,0,1|2,0,0]=4 4656 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100102525003 [0,1,0,0,0,1|2,0,0]=4 4657 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100102525003 [0,1,0,0,0,1|2,0,0]=4 4658 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100102525003 [0,1,0,0,0,1|2,0,0]=4 4659 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100102525003 [0,1,0,0,0,1|2,0,0]=4 4660 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1F)F 1458a_100000748134_100102525003 [0,1,0,0,0,1|2,0,0]=4 4661 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1F)I 1458a_100010185205_100102525003 [0,1,0,0,0,1|2,0,0]=4 4662 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100102525003 [0,1,0,0,0,1|2,0,0]=4 4663 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100102525003 [0,1,0,0,0,1|2,0,0]=4 4664 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100102525003 [0,1,0,0,0,1|2,0,0]=4 4665 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1I)F 1458a_100000690930_100102525003 [0,1,0,0,0,1|2,0,0]=4 4666 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100102525003 [0,1,0,0,0,1|2,0,0]=4 4667 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100102525003 [0,1,0,0,0,1|1,0,0]=3 4668 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100102525003 [0,1,0,0,0,1|1,0,0]=3 4669 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100102525003 [0,1,0,0,0,1|1,0,0]=3 4670 B16R1.11264 NC(=O)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100102525003 [0,1,0,0,0,1|1,0,0]=3 4671 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)Br 11a_100000740010_100012360534 [0,1,0,0,0,1|2,0,0]=4 4672 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)Br 240690a_100000740010_100012360534 [0,1,0,0,0,1|2,0,0]=4 4673 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)Br 527a_100000740010_100012360534 [0,1,0,0,0,1|2,0,0]=4 4674 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)Cl 11a_100000740010_100012339722 [0,1,0,0,0,1|2,0,0]=4 4675 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)Cl 240690a_100000740010_100012339722 [0,1,0,0,0,1|2,0,0]=4 4676 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)Cl 527a_100000740010_100012339722 [0,1,0,0,0,1|2,0,0]=4 4677 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)F 11a_100000740010_100011217547 [0,1,0,0,0,1|2,0,0]=4 4678 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)F 240690a_100000740010_100011217547 [0,1,0,0,0,1|2,0,0]=4 4679 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)F 527a_100000740010_100011217547 [0,1,0,0,0,1|2,0,0]=4 4680 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)I 11a_100000740010_100010232522 [0,1,0,0,0,1|2,0,0]=4 4681 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)I 240690a_100000740010_100010232522 [0,1,0,0,0,1|2,0,0]=4 4682 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)I 527a_100000740010_100010232522 [0,1,0,0,0,1|2,0,0]=4 4683 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)O 240690a_100000740010_100010230362 [0,1,0,0,0,1|2,0,0]=4 4684 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Br)O 527a_100000740010_100010230362 [0,1,0,0,0,1|2,0,0]=4 4685 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)Br 11a_100000740010_100000760540 [0,1,0,0,0,1|2,0,0]=4 4686 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)Br 240690a_100000740010_100000760540 [0,1,0,0,0,1|2,0,0]=4 4687 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)Br 527a_100000740010_100000760540 [0,1,0,0,0,1|2,0,0]=4 4688 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)Cl 11a_100000740010_100000183631 [0,1,0,0,0,1|2,0,0]=4 4689 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)Cl 240690a_100000740010_100000183631 [0,1,0,0,0,1|2,0,0]=4 4690 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)Cl 527a_100000740010_100000183631 [0,1,0,0,0,1|2,0,0]=4 4691 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)F 11a_100000740010_100000759904 [0,1,0,0,0,1|2,0,0]=4 4692 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)F 240690a_100000740010_100000759904 [0,1,0,0,0,1|2,0,0]=4 4693 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)F 527a_100000740010_100000759904 [0,1,0,0,0,1|2,0,0]=4 4694 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)I 11a_100000740010_100010176783 [0,1,0,0,0,1|2,0,0]=4 4695 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)I 240690a_100000740010_100010176783 [0,1,0,0,0,1|2,0,0]=4 4696 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)I 527a_100000740010_100010176783 [0,1,0,0,0,1|2,0,0]=4 4697 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)O 240690a_100000740010_100000092362 [0,1,0,0,0,1|2,0,0]=4 4698 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1Cl)O 527a_100000740010_100000092362 [0,1,0,0,0,1|2,0,0]=4 4699 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)Br 11a_100000740010_100000756403 [0,1,0,0,0,1|2,0,0]=4 4700 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)Br 240690a_100000740010_100000756403 [0,1,0,0,0,1|2,0,0]=4 4701 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)Br 527a_100000740010_100000756403 [0,1,0,0,0,1|2,0,0]=4 4702 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)Cl 11a_100000740010_100000688816 [0,1,0,0,0,1|2,0,0]=4 4703 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)Cl 240690a_100000740010_100000688816 [0,1,0,0,0,1|2,0,0]=4 4704 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)Cl 527a_100000740010_100000688816 [0,1,0,0,0,1|2,0,0]=4 4705 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)F 11a_100000740010_100000748134 [0,1,0,0,0,1|2,0,0]=4 4706 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)F 240690a_100000740010_100000748134 [0,1,0,0,0,1|2,0,0]=4 4707 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)F 527a_100000740010_100000748134 [0,1,0,0,0,1|2,0,0]=4 4708 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)I 11a_100000740010_100010185205 [0,1,0,0,0,1|2,0,0]=4 4709 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)I 240690a_100000740010_100010185205 [0,1,0,0,0,1|2,0,0]=4 4710 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)I 527a_100000740010_100010185205 [0,1,0,0,0,1|2,0,0]=4 4711 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)O 240690a_100000740010_100000037433 [0,1,0,0,0,1|2,0,0]=4 4712 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1F)O 527a_100000740010_100000037433 [0,1,0,0,0,1|2,0,0]=4 4713 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)Br 11a_100000740010_100000688019 [0,1,0,0,0,1|2,0,0]=4 4714 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)Br 240690a_100000740010_100000688019 [0,1,0,0,0,1|2,0,0]=4 4715 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)Br 527a_100000740010_100000688019 [0,1,0,0,0,1|2,0,0]=4 4716 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)Cl 11a_100000740010_100010176784 [0,1,0,0,0,1|2,0,0]=4 4717 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)Cl 240690a_100000740010_100010176784 [0,1,0,0,0,1|2,0,0]=4 4718 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)Cl 527a_100000740010_100010176784 [0,1,0,0,0,1|2,0,0]=4 4719 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)F 11a_100000740010_100000690930 [0,1,0,0,0,1|2,0,0]=4 4720 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)F 240690a_100000740010_100000690930 [0,1,0,0,0,1|2,0,0]=4 4721 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)F 527a_100000740010_100000690930 [0,1,0,0,0,1|2,0,0]=4 4722 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1I)O 527a_100000740010_100010084636 [0,1,0,0,0,1|2,0,0]=4 4723 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)Br 240690a_100000740010_100000752940 [0,1,0,0,0,1|1,0,0]=3 4724 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)Br 527a_100000740010_100000752940 [0,1,0,0,0,1|1,0,0]=3 4725 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)Cl 240690a_100000740010_100000742801 [0,1,0,0,0,1|1,0,0]=3 4726 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)Cl 527a_100000740010_100000742801 [0,1,0,0,0,1|1,0,0]=3 4727 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)F 240690a_100000740010_100011217230 [0,1,0,0,0,1|1,0,0]=3 4728 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)F 527a_100000740010_100011217230 [0,1,0,0,0,1|1,0,0]=3 4729 B16R1.11264 NC(=O)CCNC(=O)c1cccc(c1O)O 527a_100000740010_100000690420 [0,1,0,0,0,1|1,0,0]=3 4730 B16R1.11264 NC(=O)CNCC(=O)c1cccc(c1F)Br 2230a_100000711301_100012356374 [0,1,0,0,0,1|2,0,0]=4 4731 B16R1.11264 NC(=O)CNCC(=O)c1cccc(c1F)Cl 2230a_100000711301_200012351890 [0,1,0,0,0,1|2,0,0]=4 4732 B16R1.11264 NC(=O)CSCC(=O)c1cccc(c1F)Br 62a_100000747473_100012356374 [0,1,0,0,0,1|2,0,0]=4 4733 B16R1.11264 NC(=O)CSCC(=O)c1cccc(c1F)Br 62a_100012356374_100000747473 [0,1,0,0,0,1|2,0,0]=4 4734 B16R1.11264 NC(=O)CSCC(=O)c1cccc(c1F)Cl 62a_100000747473_200012351890 [0,1,0,0,0,1|2,0,0]=4 4735 B16R1.11264 NC(=O)CSCC(=O)c1cccc(c1F)Cl 62a_200012351890_100000747473 [0,1,0,0,0,1|2,0,0]=4 4736 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000034859 [0,1,0,0,0,1|2,0,0]=4 4737 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000034859 [0,1,0,0,0,1|2,0,0]=4 4738 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Br)F 1458a_100011217547_200000034859 [0,1,0,0,0,1|2,0,0]=4 4739 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Br)I 1458a_100010232522_200000034859 [0,1,0,0,0,1|2,0,0]=4 4740 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Br)O 1458a_100010230362_200000034859 [0,1,0,0,0,1|2,0,0]=4 4741 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000034859 [0,1,0,0,0,1|2,0,0]=4 4742 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000034859 [0,1,0,0,0,1|2,0,0]=4 4743 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000034859 [0,1,0,0,0,1|2,0,0]=4 4744 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000034859 [0,1,0,0,0,1|2,0,0]=4 4745 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000034859 [0,1,0,0,0,1|2,0,0]=4 4746 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1F)Br 1458a_100000756403_200000034859 [0,1,0,0,0,1|2,0,0]=4 4747 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000034859 [0,1,0,0,0,1|2,0,0]=4 4748 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1F)F 1458a_100000748134_200000034859 [0,1,0,0,0,1|2,0,0]=4 4749 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1F)I 1458a_100010185205_200000034859 [0,1,0,0,0,1|2,0,0]=4 4750 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1F)O 1458a_100000037433_200000034859 [0,1,0,0,0,1|2,0,0]=4 4751 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1I)Br 1458a_100000688019_200000034859 [0,1,0,0,0,1|2,0,0]=4 4752 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000034859 [0,1,0,0,0,1|2,0,0]=4 4753 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1I)F 1458a_100000690930_200000034859 [0,1,0,0,0,1|2,0,0]=4 4754 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1I)O 1458a_100010084636_200000034859 [0,1,0,0,0,1|2,0,0]=4 4755 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1O)Br 1458a_100000752940_200000034859 [0,1,0,0,0,1|1,0,0]=3 4756 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000034859 [0,1,0,0,0,1|1,0,0]=3 4757 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1O)F 1458a_100011217230_200000034859 [0,1,0,0,0,1|1,0,0]=3 4758 B16R1.11264 NC(=O)NCCC(=O)c1cccc(c1O)O 1458a_100000690420_200000034859 [0,1,0,0,0,1|1,0,0]=3 4759 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_200011214921 [0,1,0,0,0,1|2,0,0]=4 4760 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200011214921 [0,1,0,0,0,1|2,0,0]=4 4761 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Br)F 1458a_100011217547_200011214921 [0,1,0,0,0,1|2,0,0]=4 4762 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Br)I 1458a_100010232522_200011214921 [0,1,0,0,0,1|2,0,0]=4 4763 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Br)O 1458a_100010230362_200011214921 [0,1,0,0,0,1|2,0,0]=4 4764 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200011214921 [0,1,0,0,0,1|2,0,0]=4 4765 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200011214921 [0,1,0,0,0,1|2,0,0]=4 4766 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_200011214921 [0,1,0,0,0,1|2,0,0]=4 4767 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_200011214921 [0,1,0,0,0,1|2,0,0]=4 4768 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_200011214921 [0,1,0,0,0,1|2,0,0]=4 4769 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1F)Br 1458a_100000756403_200011214921 [0,1,0,0,0,1|2,0,0]=4 4770 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_200011214921 [0,1,0,0,0,1|2,0,0]=4 4771 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1F)F 1458a_100000748134_200011214921 [0,1,0,0,0,1|2,0,0]=4 4772 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1F)I 1458a_100010185205_200011214921 [0,1,0,0,0,1|2,0,0]=4 4773 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1F)O 1458a_100000037433_200011214921 [0,1,0,0,0,1|2,0,0]=4 4774 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1I)Br 1458a_100000688019_200011214921 [0,1,0,0,0,1|2,0,0]=4 4775 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_200011214921 [0,1,0,0,0,1|2,0,0]=4 4776 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1I)F 1458a_100000690930_200011214921 [0,1,0,0,0,1|2,0,0]=4 4777 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1I)O 1458a_100010084636_200011214921 [0,1,0,0,0,1|2,0,0]=4 4778 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1O)Br 1458a_100000752940_200011214921 [0,1,0,0,0,1|1,0,0]=3 4779 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_200011214921 [0,1,0,0,0,1|1,0,0]=3 4780 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1O)F 1458a_100011217230_200011214921 [0,1,0,0,0,1|1,0,0]=3 4781 B16R1.11264 NC(=O)OCCC(=O)c1cccc(c1O)O 1458a_100000690420_200011214921 [0,1,0,0,0,1|1,0,0]=3 4782 B16R1.11264 O=C(CCC=C(F)F)c1cccc(c1O)Br 1458a_100000752940_200009816681 [0,1,0,0,0,1|2,0,0]=4 4783 B16R1.11264 O=C(CCC=C(F)F)c1cccc(c1O)Cl 1458a_100000742801_200009816681 [0,1,0,0,0,1|2,0,0]=4 4784 B16R1.11264 O=C(CCC=C(F)F)c1cccc(c1O)F 1458a_100011217230_200009816681 [0,1,0,0,0,1|2,0,0]=4 4785 B16R1.11264 O=C(CCC=C(F)F)c1cccc(c1O)O 1458a_100000690420_200009816681 [0,1,0,0,0,1|2,0,0]=4 4786 B16R1.11264 O=C(O)CNCC(=O)c1cccc(c1F)Br 269956a_100016091260_100012356374 [0,1,0,0,0,1|1,0,0]=3 4787 B16R1.11264 O=C(O)CNCC(=O)c1cccc(c1F)Cl 269956a_100016091260_200012351890 [0,1,0,0,0,1|1,0,0]=3 4788 B16R1.11264 O=C([O-])CSCC(=O)c1cccc(c1F)Br 62a_100012356374_100020667443 [0,1,0,0,0,1|1,0,1]=4 4789 B16R1.11264 O=C([O-])CSCC(=O)c1cccc(c1F)Br 62a_100020667443_100012356374 [0,1,0,0,0,1|1,0,1]=4 4790 B16R1.11264 O=C([O-])CSCC(=O)c1cccc(c1F)Cl 62a_100020667443_200012351890 [0,1,0,0,0,1|1,0,1]=4 4791 B16R1.11264 O=C([O-])CSCC(=O)c1cccc(c1F)Cl 62a_200012351890_100020667443 [0,1,0,0,0,1|1,0,1]=4 4792 B16R1.11442 C=C(C)COCC(=O)c1ccc(cc1O)F 34a_100000210245_100009817053 [0,1,0,0,0,1|2,0,0]=4 4793 B16R1.11442 C=C(C)COCC(=O)c1ccc(cc1O)O 34a_100000210245_100009814262 [0,1,0,0,0,1|2,0,0]=4 4794 B16R1.11442 C=C(C)CSCC(=O)c1ccc(cc1O)F 62a_100000748629_100009817053 [0,1,0,0,0,1|2,0,0]=4 4795 B16R1.11442 C=C(C)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000211660 [0,1,0,0,0,1|2,0,0]=4 4796 B16R1.11442 C=C(C)CSCC(=O)c1ccc(cc1O)O 62a_100000748629_100009814262 [0,1,0,0,0,1|2,0,0]=4 4797 B16R1.11442 C=C(C)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000211660 [0,1,0,0,0,1|2,0,0]=4 4798 B16R1.11442 C=C(F)COCC(=O)c1ccc(cc1O)F 34a_200010262243_100009817053 [0,1,0,0,0,1|2,0,0]=4 4799 B16R1.11442 C=C(F)COCC(=O)c1ccc(cc1O)O 34a_200010262243_100009814262 [0,1,0,0,0,1|2,0,0]=4 4800 B16R1.11442 C=C(F)CSCC(=O)c1ccc(cc1O)F 62a_100000042424_100009817053 [0,1,0,0,0,1|2,0,0]=4 4801 B16R1.11442 C=C(F)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000042424 [0,1,0,0,0,1|2,0,0]=4 4802 B16R1.11442 C=C(F)CSCC(=O)c1ccc(cc1O)O 62a_100000042424_100009814262 [0,1,0,0,0,1|2,0,0]=4 4803 B16R1.11442 C=C(F)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000042424 [0,1,0,0,0,1|2,0,0]=4 4804 B16R1.11442 CC(=CCCC(=O)c1ccc(cc1O)Br)C 1458a_100000744433_100011217483 [0,1,0,0,0,1|2,0,0]=4 4805 B16R1.11442 CC(=CCCC(=O)c1ccc(cc1O)C)C 1458a_100000212137_100011217483 [0,1,0,0,0,1|2,0,0]=4 4806 B16R1.11442 CC(=CCCC(=O)c1ccc(cc1O)Cl)C 1458a_100000188622_100011217483 [0,1,0,0,0,1|2,0,0]=4 4807 B16R1.11442 CC(=CCCC(=O)c1ccc(cc1O)F)C 1458a_100000746061_100011217483 [0,1,0,0,0,1|2,0,0]=4 4808 B16R1.11442 CC(=CCCC(=O)c1ccc(cc1O)I)C 1458a_100000091984_100011217483 [0,1,0,0,0,1|2,0,0]=4 4809 B16R1.11442 CC(=CCCC(=O)c1ccc(cc1O)O)C 1458a_100000212172_100011217483 [0,1,0,0,0,1|2,0,0]=4 4810 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011215641 [0,1,0,0,0,1|2,0,0]=4 4811 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100011215641 [0,1,0,0,0,1|2,0,0]=4 4812 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011215641 [0,1,0,0,0,1|2,0,0]=4 4813 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011215641 [0,1,0,0,0,1|2,0,0]=4 4814 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011215641 [0,1,0,0,0,1|2,0,0]=4 4815 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011215641 [0,1,0,0,0,1|2,0,0]=4 4816 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100011215641 [0,1,0,0,0,1|2,0,0]=4 4817 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100011215641 [0,1,0,0,0,1|2,0,0]=4 4818 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011215641 [0,1,0,0,0,1|2,0,0]=4 4819 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100011215641 [0,1,0,0,0,1|2,0,0]=4 4820 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100011215641 [0,1,0,0,0,1|2,0,0]=4 4821 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100011215641 [0,1,0,0,0,1|2,0,0]=4 4822 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011215641 [0,1,0,0,0,1|2,0,0]=4 4823 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100011215641 [0,1,0,0,0,1|2,0,0]=4 4824 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215641 [0,1,0,0,0,1|2,0,0]=4 4825 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011215641 [0,1,0,0,0,1|2,0,0]=4 4826 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011215641 [0,1,0,0,0,1|2,0,0]=4 4827 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011215641 [0,1,0,0,0,1|2,0,0]=4 4828 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011215641 [0,1,0,0,0,1|2,0,0]=4 4829 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100011215641 [0,1,0,0,0,1|2,0,0]=4 4830 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011215641 [0,1,0,0,0,1|2,0,0]=4 4831 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)F 1458a_100000070787_100012405562 [0,1,0,0,0,1|2,0,0]=4 4832 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100011215641 [0,1,0,0,0,1|2,0,0]=4 4833 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100011215641 [0,1,0,0,0,1|2,0,0]=4 4834 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100011215641 [0,1,0,0,0,1|2,0,0]=4 4835 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011215641 [0,1,0,0,0,1|2,0,0]=4 4836 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100011215641 [0,1,0,0,0,1|2,0,0]=4 4837 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011215641 [0,1,0,0,0,1|2,0,0]=4 4838 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100011215641 [0,1,0,0,0,1|2,0,0]=4 4839 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215641 [0,1,0,0,0,1|1,0,0]=3 4840 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100011215641 [0,1,0,0,0,1|1,0,0]=3 4841 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215641 [0,1,0,0,0,1|1,0,0]=3 4842 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215641 [0,1,0,0,0,1|1,0,0]=3 4843 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215641 [0,1,0,0,0,1|1,0,0]=3 4844 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215641 [0,1,0,0,0,1|1,0,0]=3 4845 B16R1.11442 CC(=O)CCNC(=O)c1ccc(cc1Cl)F 1458a_100000195331_200000210301 [0,1,0,0,0,1|2,0,0]=4 4846 B16R1.11442 CC(=O)CCNC(=O)c1ccc(cc1F)F 1458a_100000195307_200000210301 [0,1,0,0,0,1|2,0,0]=4 4847 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1Br)F 34a_100000211253_100012361341 [0,1,0,0,0,1|2,0,0]=4 4848 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1C)C 34a_100000211253_100000229959 [0,1,0,0,0,1|2,0,0]=4 4849 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1Cl)F 34a_100000211253_100012056422 [0,1,0,0,0,1|2,0,0]=4 4850 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1F)Br 34a_100000211253_200012361339 [0,1,0,0,0,1|2,0,0]=4 4851 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1F)Cl 34a_100000211253_100012351891 [0,1,0,0,0,1|2,0,0]=4 4852 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1F)F 34a_100000211253_100000229962 [0,1,0,0,0,1|2,0,0]=4 4853 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1O)F 34a_100000211253_100009817053 [0,1,0,0,0,1|1,0,0]=3 4854 B16R1.11442 CC(=O)COCC(=O)c1ccc(cc1O)O 34a_100000211253_100009814262 [0,1,0,0,0,1|1,0,0]=3 4855 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000189650 [0,1,0,0,0,1|2,0,0]=4 4856 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000189650 [0,1,0,0,0,1|2,0,0]=4 4857 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000189650 [0,1,0,0,0,1|2,0,0]=4 4858 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000189650 [0,1,0,0,0,1|2,0,0]=4 4859 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000189650 [0,1,0,0,0,1|2,0,0]=4 4860 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000189650 [0,1,0,0,0,1|2,0,0]=4 4861 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000189650 [0,1,0,0,0,1|2,0,0]=4 4862 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000189650 [0,1,0,0,0,1|2,0,0]=4 4863 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000189650 [0,1,0,0,0,1|2,0,0]=4 4864 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000189650 [0,1,0,0,0,1|2,0,0]=4 4865 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000189650 [0,1,0,0,0,1|2,0,0]=4 4866 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000189650 [0,1,0,0,0,1|2,0,0]=4 4867 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000189650 [0,1,0,0,0,1|2,0,0]=4 4868 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000189650 [0,1,0,0,0,1|2,0,0]=4 4869 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000189650 [0,1,0,0,0,1|2,0,0]=4 4870 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000189650 [0,1,0,0,0,1|2,0,0]=4 4871 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000189650 [0,1,0,0,0,1|2,0,0]=4 4872 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000189650 [0,1,0,0,0,1|2,0,0]=4 4873 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000189650 [0,1,0,0,0,1|2,0,0]=4 4874 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000189650 [0,1,0,0,0,1|2,0,0]=4 4875 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000189650 [0,1,0,0,0,1|2,0,0]=4 4876 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000189650 [0,1,0,0,0,1|2,0,0]=4 4877 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000189650 [0,1,0,0,0,1|2,0,0]=4 4878 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000189650 [0,1,0,0,0,1|2,0,0]=4 4879 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000189650 [0,1,0,0,0,1|2,0,0]=4 4880 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000189650 [0,1,0,0,0,1|2,0,0]=4 4881 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000189650 [0,1,0,0,0,1|2,0,0]=4 4882 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000189650 [0,1,0,0,0,1|2,0,0]=4 4883 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000189650 [0,1,0,0,0,1|1,0,0]=3 4884 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000189650 [0,1,0,0,0,1|1,0,0]=3 4885 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000189650 [0,1,0,0,0,1|1,0,0]=3 4886 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000189650 [0,1,0,0,0,1|1,0,0]=3 4887 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000189650 [0,1,0,0,0,1|1,0,0]=3 4888 B16R1.11442 CC(=O)NCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000189650 [0,1,0,0,0,1|1,0,0]=3 4889 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100009814007 [0,1,0,0,0,1|2,0,0]=4 4890 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100009814007 [0,1,0,0,0,1|2,0,0]=4 4891 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100009814007 [0,1,0,0,0,1|2,0,0]=4 4892 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100009814007 [0,1,0,0,0,1|2,0,0]=4 4893 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100009814007 [0,1,0,0,0,1|2,0,0]=4 4894 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100009814007 [0,1,0,0,0,1|2,0,0]=4 4895 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100009814007 [0,1,0,0,0,1|2,0,0]=4 4896 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100009814007 [0,1,0,0,0,1|2,0,0]=4 4897 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100009814007 [0,1,0,0,0,1|2,0,0]=4 4898 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100009814007 [0,1,0,0,0,1|2,0,0]=4 4899 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100009814007 [0,1,0,0,0,1|2,0,0]=4 4900 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100009814007 [0,1,0,0,0,1|2,0,0]=4 4901 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100009814007 [0,1,0,0,0,1|2,0,0]=4 4902 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100009814007 [0,1,0,0,0,1|2,0,0]=4 4903 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100009814007 [0,1,0,0,0,1|2,0,0]=4 4904 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100009814007 [0,1,0,0,0,1|2,0,0]=4 4905 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100009814007 [0,1,0,0,0,1|2,0,0]=4 4906 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100009814007 [0,1,0,0,0,1|2,0,0]=4 4907 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100009814007 [0,1,0,0,0,1|2,0,0]=4 4908 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100009814007 [0,1,0,0,0,1|2,0,0]=4 4909 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100009814007 [0,1,0,0,0,1|2,0,0]=4 4910 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100009814007 [0,1,0,0,0,1|2,0,0]=4 4911 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100009814007 [0,1,0,0,0,1|2,0,0]=4 4912 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100009814007 [0,1,0,0,0,1|2,0,0]=4 4913 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100009814007 [0,1,0,0,0,1|2,0,0]=4 4914 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100009814007 [0,1,0,0,0,1|2,0,0]=4 4915 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100009814007 [0,1,0,0,0,1|2,0,0]=4 4916 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100009814007 [0,1,0,0,0,1|2,0,0]=4 4917 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100009814007 [0,1,0,0,0,1|1,0,0]=3 4918 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100009814007 [0,1,0,0,0,1|1,0,0]=3 4919 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100009814007 [0,1,0,0,0,1|1,0,0]=3 4920 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100009814007 [0,1,0,0,0,1|1,0,0]=3 4921 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100009814007 [0,1,0,0,0,1|1,0,0]=3 4922 B16R1.11442 CC(=O)OCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100009814007 [0,1,0,0,0,1|1,0,0]=3 4923 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000718107 [0,1,0,0,0,1|1,0,1]=4 4924 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000718107 [0,1,0,0,0,1|1,0,1]=4 4925 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_200000718107 [0,1,0,0,0,1|1,0,1]=4 4926 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_200000718107 [0,1,0,0,0,1|1,0,1]=4 4927 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_200000718107 [0,1,0,0,0,1|1,0,1]=4 4928 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Br 240690a_200000755665_100000744433 [0,1,0,0,0,1|1,0,1]=4 4929 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Br 527a_200000755665_100000744433 [0,1,0,0,0,1|1,0,1]=4 4930 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Cl 240690a_200000755665_100000188622 [0,1,0,0,0,1|1,0,1]=4 4931 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Cl 527a_200000755665_100000188622 [0,1,0,0,0,1|1,0,1]=4 4932 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)F 240690a_200000755665_100000746061 [0,1,0,0,0,1|1,0,1]=4 4933 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)F 527a_200000755665_100000746061 [0,1,0,0,0,1|1,0,1]=4 4934 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)I 240690a_200000755665_100000091984 [0,1,0,0,0,1|1,0,1]=4 4935 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)I 527a_200000755665_100000091984 [0,1,0,0,0,1|1,0,1]=4 4936 B16R1.11442 CC(O)CNCC(=O)c1ccc(cc1O)F 34a_100000210904_100009817053 [0,1,0,0,0,1|1,0,1]=4 4937 B16R1.11442 CC(O)CNCC(=O)c1ccc(cc1O)O 34a_100000210904_100009814262 [0,1,0,0,0,1|1,0,1]=4 4938 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100011218427 [0,1,0,0,0,1|1,0,1]=4 4939 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)F 62a_100011218427_100009817053 [0,1,0,0,0,1|1,0,1]=4 4940 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100011218427 [0,1,0,0,0,1|1,0,1]=4 4941 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)O 62a_100011218427_100009814262 [0,1,0,0,0,1|1,0,1]=4 4942 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100009817552 [0,1,0,0,0,1|1,0,1]=4 4943 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)F 62a_100009817552_100009817053 [0,1,0,0,0,1|1,0,1]=4 4944 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100009817552 [0,1,0,0,0,1|1,0,1]=4 4945 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)O 62a_100009817552_100009814262 [0,1,0,0,0,1|1,0,1]=4 4946 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(=O)N)Br 1458a_100000741311_100102525003 [0,1,0,0,0,1|2,0,0]=4 4947 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(=O)N)Cl 1458a_100000688705_100102525003 [0,1,0,0,0,1|2,0,0]=4 4948 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(=O)N)F 1458a_100000686989_100102525003 [0,1,0,0,0,1|2,0,0]=4 4949 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(=O)N)I 1458a_100010189873_100102525003 [0,1,0,0,0,1|2,0,0]=4 4950 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(=O)N)O 1458a_100000692822_100102525003 [0,1,0,0,0,1|2,0,0]=4 4951 B16R1.11442 Cc1cc(ccc1C(=O)CCNC(=O)N)Br 1458a_100000741311_200000034859 [0,1,0,0,0,1|2,0,0]=4 4952 B16R1.11442 Cc1cc(ccc1C(=O)CCNC(=O)N)Cl 1458a_100000688705_200000034859 [0,1,0,0,0,1|2,0,0]=4 4953 B16R1.11442 Cc1cc(ccc1C(=O)CCNC(=O)N)F 1458a_100000686989_200000034859 [0,1,0,0,0,1|2,0,0]=4 4954 B16R1.11442 Cc1cc(ccc1C(=O)CCNC(=O)N)I 1458a_100010189873_200000034859 [0,1,0,0,0,1|2,0,0]=4 4955 B16R1.11442 Cc1cc(ccc1C(=O)CCNC(=O)N)O 1458a_100000692822_200000034859 [0,1,0,0,0,1|2,0,0]=4 4956 B16R1.11442 Cc1cc(ccc1C(=O)CCOC(=O)N)Br 1458a_100000741311_200011214921 [0,1,0,0,0,1|2,0,0]=4 4957 B16R1.11442 Cc1cc(ccc1C(=O)CCOC(=O)N)Cl 1458a_100000688705_200011214921 [0,1,0,0,0,1|2,0,0]=4 4958 B16R1.11442 Cc1cc(ccc1C(=O)CCOC(=O)N)F 1458a_100000686989_200011214921 [0,1,0,0,0,1|2,0,0]=4 4959 B16R1.11442 Cc1cc(ccc1C(=O)CCOC(=O)N)I 1458a_100010189873_200011214921 [0,1,0,0,0,1|2,0,0]=4 4960 B16R1.11442 Cc1cc(ccc1C(=O)CCOC(=O)N)O 1458a_100000692822_200011214921 [0,1,0,0,0,1|2,0,0]=4 4961 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)Br 11a_100000740010_100000741311 [0,1,0,0,0,1|2,0,0]=4 4962 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)Br 240690a_100000740010_100000741311 [0,1,0,0,0,1|2,0,0]=4 4963 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)Br 527a_100000740010_100000741311 [0,1,0,0,0,1|2,0,0]=4 4964 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)Cl 11a_100000740010_100000688705 [0,1,0,0,0,1|2,0,0]=4 4965 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)Cl 240690a_100000740010_100000688705 [0,1,0,0,0,1|2,0,0]=4 4966 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)Cl 527a_100000740010_100000688705 [0,1,0,0,0,1|2,0,0]=4 4967 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)F 11a_100000740010_100000686989 [0,1,0,0,0,1|2,0,0]=4 4968 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)F 240690a_100000740010_100000686989 [0,1,0,0,0,1|2,0,0]=4 4969 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)F 527a_100000740010_100000686989 [0,1,0,0,0,1|2,0,0]=4 4970 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)I 11a_100000740010_100010189873 [0,1,0,0,0,1|2,0,0]=4 4971 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)I 240690a_100000740010_100010189873 [0,1,0,0,0,1|2,0,0]=4 4972 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)I 527a_100000740010_100010189873 [0,1,0,0,0,1|2,0,0]=4 4973 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)O 240690a_100000740010_100000692822 [0,1,0,0,0,1|2,0,0]=4 4974 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(=O)N)O 527a_100000740010_100000692822 [0,1,0,0,0,1|2,0,0]=4 4975 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)CCCC(=O)N 1458a_100000685072_100102525003 [0,1,0,0,0,1|2,0,0]=4 4976 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)CCNC(=O)N 1458a_100000685072_200000034859 [0,1,0,0,0,1|2,0,0]=4 4977 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)CCOC(=O)N 1458a_100000685072_200011214921 [0,1,0,0,0,1|2,0,0]=4 4978 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(=O)N 11a_100000740010_100000685072 [0,1,0,0,0,1|2,0,0]=4 4979 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(=O)N 240690a_100000740010_100000685072 [0,1,0,0,0,1|2,0,0]=4 4980 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(=O)N 527a_100000740010_100000685072 [0,1,0,0,0,1|2,0,0]=4 4981 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CCCC(=O)N 1458a_100000211164_100102525003 [0,1,0,0,0,1|2,0,0]=4 4982 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CCNC(=O)N 1458a_100000211164_200000034859 [0,1,0,0,0,1|2,0,0]=4 4983 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CCOC(=O)N 1458a_100000211164_200011214921 [0,1,0,0,0,1|2,0,0]=4 4984 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CNCC(=O)N 2230a_100000711301_100000229959 [0,1,0,0,0,1|2,0,0]=4 4985 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CNCC(=O)O 269956a_100016091260_100000229959 [0,1,0,0,0,1|1,0,0]=3 4986 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CSCC(=O)N 62a_100000229959_100000747473 [0,1,0,0,0,1|2,0,0]=4 4987 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CSCC(=O)N 62a_100000747473_100000229959 [0,1,0,0,0,1|2,0,0]=4 4988 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CSCC(=O)[O-] 62a_100000229959_100020667443 [0,1,0,0,0,1|1,0,1]=4 4989 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CSCC(=O)[O-] 62a_100020667443_100000229959 [0,1,0,0,0,1|1,0,1]=4 4990 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(=O)N 11a_100000740010_100000211164 [0,1,0,0,0,1|2,0,0]=4 4991 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(=O)N 240690a_100000740010_100000211164 [0,1,0,0,0,1|2,0,0]=4 4992 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(=O)N 527a_100000740010_100000211164 [0,1,0,0,0,1|2,0,0]=4 4993 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)CCCC(=O)N 1458a_100000766932_100102525003 [0,1,0,0,0,1|2,0,0]=4 4994 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)CCNC(=O)N 1458a_100000766932_200000034859 [0,1,0,0,0,1|2,0,0]=4 4995 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)CCOC(=O)N 1458a_100000766932_200011214921 [0,1,0,0,0,1|2,0,0]=4 4996 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(=O)N 11a_100000740010_100000766932 [0,1,0,0,0,1|2,0,0]=4 4997 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(=O)N 240690a_100000740010_100000766932 [0,1,0,0,0,1|2,0,0]=4 4998 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(=O)N 527a_100000740010_100000766932 [0,1,0,0,0,1|2,0,0]=4 4999 B16R1.11442 Cc1ccc(c(c1)F)C(=O)CCCC(=O)N 1458a_100000766033_100102525003 [0,1,0,0,0,1|2,0,0]=4 5000 B16R1.11442 Cc1ccc(c(c1)F)C(=O)CCNC(=O)N 1458a_100000766033_200000034859 [0,1,0,0,0,1|2,0,0]=4 5001 B16R1.11442 Cc1ccc(c(c1)F)C(=O)CCOC(=O)N 1458a_100000766033_200011214921 [0,1,0,0,0,1|2,0,0]=4 5002 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(=O)N 11a_100000740010_100000766033 [0,1,0,0,0,1|2,0,0]=4 5003 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(=O)N 240690a_100000740010_100000766033 [0,1,0,0,0,1|2,0,0]=4 5004 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(=O)N 527a_100000740010_100000766033 [0,1,0,0,0,1|2,0,0]=4 5005 B16R1.11442 Cc1ccc(c(c1)I)C(=O)CCCC(=O)N 1458a_100009999607_100102525003 [0,1,0,0,0,1|2,0,0]=4 5006 B16R1.11442 Cc1ccc(c(c1)I)C(=O)CCNC(=O)N 1458a_100009999607_200000034859 [0,1,0,0,0,1|2,0,0]=4 5007 B16R1.11442 Cc1ccc(c(c1)I)C(=O)CCOC(=O)N 1458a_100009999607_200011214921 [0,1,0,0,0,1|2,0,0]=4 5008 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(=O)N 11a_100000740010_100009999607 [0,1,0,0,0,1|2,0,0]=4 5009 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(=O)N 240690a_100000740010_100009999607 [0,1,0,0,0,1|2,0,0]=4 5010 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(=O)N 527a_100000740010_100009999607 [0,1,0,0,0,1|2,0,0]=4 5011 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCC=C(F)F 1458a_100000212137_200009816681 [0,1,0,0,0,1|2,0,0]=4 5012 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCCC(=O)N 1458a_100000212137_100102525003 [0,1,0,0,0,1|1,0,0]=3 5013 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCCC(C)O 1458a_100000212137_200000718107 [0,1,0,0,0,1|1,0,1]=4 5014 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCNC(=O)N 1458a_100000212137_200000034859 [0,1,0,0,0,1|1,0,0]=3 5015 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCOC(=O)N 1458a_100000212137_200011214921 [0,1,0,0,0,1|1,0,0]=3 5016 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(=O)N 240690a_100000740010_100000212137 [0,1,0,0,0,1|1,0,0]=3 5017 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(=O)N 527a_100000740010_100000212137 [0,1,0,0,0,1|1,0,0]=3 5018 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)O 240690a_200000755665_100000212137 [0,1,0,0,0,1|1,0,1]=4 5019 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)O 527a_200000755665_100000212137 [0,1,0,0,0,1|1,0,1]=4 5020 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100102525003 [0,1,0,0,0,1|2,0,0]=4 5021 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100102525003 [0,1,0,0,0,1|2,0,0]=4 5022 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100102525003 [0,1,0,0,0,1|2,0,0]=4 5023 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100102525003 [0,1,0,0,0,1|2,0,0]=4 5024 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100102525003 [0,1,0,0,0,1|2,0,0]=4 5025 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100102525003 [0,1,0,0,0,1|2,0,0]=4 5026 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100102525003 [0,1,0,0,0,1|2,0,0]=4 5027 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100102525003 [0,1,0,0,0,1|2,0,0]=4 5028 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100102525003 [0,1,0,0,0,1|2,0,0]=4 5029 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100102525003 [0,1,0,0,0,1|2,0,0]=4 5030 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100102525003 [0,1,0,0,0,1|2,0,0]=4 5031 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100102525003 [0,1,0,0,0,1|2,0,0]=4 5032 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100102525003 [0,1,0,0,0,1|2,0,0]=4 5033 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100102525003 [0,1,0,0,0,1|2,0,0]=4 5034 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100102525003 [0,1,0,0,0,1|2,0,0]=4 5035 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100102525003 [0,1,0,0,0,1|2,0,0]=4 5036 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100102525003 [0,1,0,0,0,1|2,0,0]=4 5037 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100102525003 [0,1,0,0,0,1|2,0,0]=4 5038 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100102525003 [0,1,0,0,0,1|1,0,0]=3 5039 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100102525003 [0,1,0,0,0,1|1,0,0]=3 5040 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100102525003 [0,1,0,0,0,1|1,0,0]=3 5041 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100102525003 [0,1,0,0,0,1|1,0,0]=3 5042 B16R1.11442 NC(=O)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100102525003 [0,1,0,0,0,1|1,0,0]=3 5043 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)Br 11a_100000740010_100000762965 [0,1,0,0,0,1|2,0,0]=4 5044 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)Br 240690a_100000740010_100000762965 [0,1,0,0,0,1|2,0,0]=4 5045 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)Br 527a_100000740010_100000762965 [0,1,0,0,0,1|2,0,0]=4 5046 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)Cl 11a_100000740010_100000766353 [0,1,0,0,0,1|2,0,0]=4 5047 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)Cl 240690a_100000740010_100000766353 [0,1,0,0,0,1|2,0,0]=4 5048 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)Cl 527a_100000740010_100000766353 [0,1,0,0,0,1|2,0,0]=4 5049 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)F 11a_100000740010_100000212304 [0,1,0,0,0,1|2,0,0]=4 5050 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)F 240690a_100000740010_100000212304 [0,1,0,0,0,1|2,0,0]=4 5051 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)F 527a_100000740010_100000212304 [0,1,0,0,0,1|2,0,0]=4 5052 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)I 11a_100000740010_100012360512 [0,1,0,0,0,1|2,0,0]=4 5053 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)I 240690a_100000740010_100012360512 [0,1,0,0,0,1|2,0,0]=4 5054 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)I 527a_100000740010_100012360512 [0,1,0,0,0,1|2,0,0]=4 5055 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)O 240690a_100000740010_100012344906 [0,1,0,0,0,1|2,0,0]=4 5056 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Br)O 527a_100000740010_100012344906 [0,1,0,0,0,1|2,0,0]=4 5057 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)Br 11a_100000740010_100000741628 [0,1,0,0,0,1|2,0,0]=4 5058 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)Br 240690a_100000740010_100000741628 [0,1,0,0,0,1|2,0,0]=4 5059 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)Br 527a_100000740010_100000741628 [0,1,0,0,0,1|2,0,0]=4 5060 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)Cl 11a_100000740010_100000185840 [0,1,0,0,0,1|2,0,0]=4 5061 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000740010_100000185840 [0,1,0,0,0,1|2,0,0]=4 5062 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)Cl 527a_100000740010_100000185840 [0,1,0,0,0,1|2,0,0]=4 5063 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)F 11a_100000740010_100000211397 [0,1,0,0,0,1|2,0,0]=4 5064 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)F 240690a_100000740010_100000211397 [0,1,0,0,0,1|2,0,0]=4 5065 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)F 527a_100000740010_100000211397 [0,1,0,0,0,1|2,0,0]=4 5066 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)I 11a_100000740010_100000751301 [0,1,0,0,0,1|2,0,0]=4 5067 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)I 240690a_100000740010_100000751301 [0,1,0,0,0,1|2,0,0]=4 5068 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)I 527a_100000740010_100000751301 [0,1,0,0,0,1|2,0,0]=4 5069 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)O 240690a_100000740010_100000702456 [0,1,0,0,0,1|2,0,0]=4 5070 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1Cl)O 527a_100000740010_100000702456 [0,1,0,0,0,1|2,0,0]=4 5071 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)Br 11a_100000740010_100000214689 [0,1,0,0,0,1|2,0,0]=4 5072 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)Br 240690a_100000740010_100000214689 [0,1,0,0,0,1|2,0,0]=4 5073 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)Br 527a_100000740010_100000214689 [0,1,0,0,0,1|2,0,0]=4 5074 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)Cl 11a_100000740010_100000212326 [0,1,0,0,0,1|2,0,0]=4 5075 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)Cl 240690a_100000740010_100000212326 [0,1,0,0,0,1|2,0,0]=4 5076 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)Cl 527a_100000740010_100000212326 [0,1,0,0,0,1|2,0,0]=4 5077 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)F 11a_100000740010_100000211022 [0,1,0,0,0,1|2,0,0]=4 5078 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)F 240690a_100000740010_100000211022 [0,1,0,0,0,1|2,0,0]=4 5079 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)F 527a_100000740010_100000211022 [0,1,0,0,0,1|2,0,0]=4 5080 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)I 11a_100000740010_100000037189 [0,1,0,0,0,1|2,0,0]=4 5081 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)I 240690a_100000740010_100000037189 [0,1,0,0,0,1|2,0,0]=4 5082 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)I 527a_100000740010_100000037189 [0,1,0,0,0,1|2,0,0]=4 5083 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)O 240690a_100000740010_100000689029 [0,1,0,0,0,1|2,0,0]=4 5084 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1F)O 527a_100000740010_100000689029 [0,1,0,0,0,1|2,0,0]=4 5085 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)Br 11a_100000740010_100000751167 [0,1,0,0,0,1|2,0,0]=4 5086 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)Br 240690a_100000740010_100000751167 [0,1,0,0,0,1|2,0,0]=4 5087 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)Br 527a_100000740010_100000751167 [0,1,0,0,0,1|2,0,0]=4 5088 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)Cl 11a_100000740010_100000739380 [0,1,0,0,0,1|2,0,0]=4 5089 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)Cl 240690a_100000740010_100000739380 [0,1,0,0,0,1|2,0,0]=4 5090 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)Cl 527a_100000740010_100000739380 [0,1,0,0,0,1|2,0,0]=4 5091 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)F 11a_100000740010_100000739341 [0,1,0,0,0,1|2,0,0]=4 5092 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)F 240690a_100000740010_100000739341 [0,1,0,0,0,1|2,0,0]=4 5093 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1I)F 527a_100000740010_100000739341 [0,1,0,0,0,1|2,0,0]=4 5094 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)Br 240690a_100000740010_100000744433 [0,1,0,0,0,1|1,0,0]=3 5095 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)Br 527a_100000740010_100000744433 [0,1,0,0,0,1|1,0,0]=3 5096 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)Cl 11a_100000740010_100000188622 [0,1,0,0,0,1|1,0,0]=3 5097 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)Cl 240690a_100000740010_100000188622 [0,1,0,0,0,1|1,0,0]=3 5098 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)Cl 527a_100000740010_100000188622 [0,1,0,0,0,1|1,0,0]=3 5099 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)F 240690a_100000740010_100000746061 [0,1,0,0,0,1|1,0,0]=3 5100 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)F 527a_100000740010_100000746061 [0,1,0,0,0,1|1,0,0]=3 5101 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)I 240690a_100000740010_100000091984 [0,1,0,0,0,1|1,0,0]=3 5102 B16R1.11442 NC(=O)CCNC(=O)c1ccc(cc1O)I 527a_100000740010_100000091984 [0,1,0,0,0,1|1,0,0]=3 5103 B16R1.11442 NC(=O)CNCC(=O)c1ccc(cc1Cl)Cl 2230a_100000711301_100011218845 [0,1,0,0,0,1|2,0,0]=4 5104 B16R1.11442 NC(=O)CNCC(=O)c1ccc(cc1Cl)F 2230a_100000711301_100012056422 [0,1,0,0,0,1|2,0,0]=4 5105 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1Br)F 62a_100012361341_100000747473 [0,1,0,0,0,1|2,0,0]=4 5106 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000747473 [0,1,0,0,0,1|2,0,0]=4 5107 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1Cl)F 62a_100000747473_100012056422 [0,1,0,0,0,1|2,0,0]=4 5108 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100000747473 [0,1,0,0,0,1|2,0,0]=4 5109 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1F)Br 62a_200012361339_100000747473 [0,1,0,0,0,1|2,0,0]=4 5110 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1F)Cl 62a_100000747473_100012351891 [0,1,0,0,0,1|2,0,0]=4 5111 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000747473 [0,1,0,0,0,1|2,0,0]=4 5112 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1F)F 62a_100000229962_100000747473 [0,1,0,0,0,1|2,0,0]=4 5113 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1F)F 62a_100000747473_100000229962 [0,1,0,0,0,1|2,0,0]=4 5114 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1O)F 62a_100000747473_100009817053 [0,1,0,0,0,1|1,0,0]=3 5115 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000747473 [0,1,0,0,0,1|1,0,0]=3 5116 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1O)O 62a_100000747473_100009814262 [0,1,0,0,0,1|1,0,0]=3 5117 B16R1.11442 NC(=O)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000747473 [0,1,0,0,0,1|1,0,0]=3 5118 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000034859 [0,1,0,0,0,1|2,0,0]=4 5119 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000034859 [0,1,0,0,0,1|2,0,0]=4 5120 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000034859 [0,1,0,0,0,1|2,0,0]=4 5121 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000034859 [0,1,0,0,0,1|2,0,0]=4 5122 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000034859 [0,1,0,0,0,1|2,0,0]=4 5123 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000034859 [0,1,0,0,0,1|2,0,0]=4 5124 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000034859 [0,1,0,0,0,1|2,0,0]=4 5125 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000034859 [0,1,0,0,0,1|2,0,0]=4 5126 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000034859 [0,1,0,0,0,1|2,0,0]=4 5127 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000034859 [0,1,0,0,0,1|2,0,0]=4 5128 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000034859 [0,1,0,0,0,1|2,0,0]=4 5129 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000034859 [0,1,0,0,0,1|2,0,0]=4 5130 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1F)F 1458a_100000211022_200000034859 [0,1,0,0,0,1|2,0,0]=4 5131 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1F)I 1458a_100000037189_200000034859 [0,1,0,0,0,1|2,0,0]=4 5132 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1F)O 1458a_100000689029_200000034859 [0,1,0,0,0,1|2,0,0]=4 5133 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000034859 [0,1,0,0,0,1|2,0,0]=4 5134 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000034859 [0,1,0,0,0,1|2,0,0]=4 5135 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1I)F 1458a_100000739341_200000034859 [0,1,0,0,0,1|2,0,0]=4 5136 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000034859 [0,1,0,0,0,1|1,0,0]=3 5137 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000034859 [0,1,0,0,0,1|1,0,0]=3 5138 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1O)F 1458a_100000746061_200000034859 [0,1,0,0,0,1|1,0,0]=3 5139 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1O)I 1458a_100000091984_200000034859 [0,1,0,0,0,1|1,0,0]=3 5140 B16R1.11442 NC(=O)NCCC(=O)c1ccc(cc1O)O 1458a_100000212172_200000034859 [0,1,0,0,0,1|1,0,0]=3 5141 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200011214921 [0,1,0,0,0,1|2,0,0]=4 5142 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200011214921 [0,1,0,0,0,1|2,0,0]=4 5143 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_200011214921 [0,1,0,0,0,1|2,0,0]=4 5144 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_200011214921 [0,1,0,0,0,1|2,0,0]=4 5145 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_200011214921 [0,1,0,0,0,1|2,0,0]=4 5146 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200011214921 [0,1,0,0,0,1|2,0,0]=4 5147 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200011214921 [0,1,0,0,0,1|2,0,0]=4 5148 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200011214921 [0,1,0,0,0,1|2,0,0]=4 5149 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200011214921 [0,1,0,0,0,1|2,0,0]=4 5150 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200011214921 [0,1,0,0,0,1|2,0,0]=4 5151 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_200011214921 [0,1,0,0,0,1|2,0,0]=4 5152 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200011214921 [0,1,0,0,0,1|2,0,0]=4 5153 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1F)F 1458a_100000211022_200011214921 [0,1,0,0,0,1|2,0,0]=4 5154 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1F)I 1458a_100000037189_200011214921 [0,1,0,0,0,1|2,0,0]=4 5155 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1F)O 1458a_100000689029_200011214921 [0,1,0,0,0,1|2,0,0]=4 5156 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_200011214921 [0,1,0,0,0,1|2,0,0]=4 5157 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200011214921 [0,1,0,0,0,1|2,0,0]=4 5158 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1I)F 1458a_100000739341_200011214921 [0,1,0,0,0,1|2,0,0]=4 5159 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_200011214921 [0,1,0,0,0,1|1,0,0]=3 5160 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200011214921 [0,1,0,0,0,1|1,0,0]=3 5161 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1O)F 1458a_100000746061_200011214921 [0,1,0,0,0,1|1,0,0]=3 5162 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1O)I 1458a_100000091984_200011214921 [0,1,0,0,0,1|1,0,0]=3 5163 B16R1.11442 NC(=O)OCCC(=O)c1ccc(cc1O)O 1458a_100000212172_200011214921 [0,1,0,0,0,1|1,0,0]=3 5164 B16R1.11442 O=C(CCC=C(F)F)c1ccc(cc1O)Br 1458a_100000744433_200009816681 [0,1,0,0,0,1|2,0,0]=4 5165 B16R1.11442 O=C(CCC=C(F)F)c1ccc(cc1O)Cl 1458a_100000188622_200009816681 [0,1,0,0,0,1|2,0,0]=4 5166 B16R1.11442 O=C(CCC=C(F)F)c1ccc(cc1O)F 1458a_100000746061_200009816681 [0,1,0,0,0,1|2,0,0]=4 5167 B16R1.11442 O=C(CCC=C(F)F)c1ccc(cc1O)I 1458a_100000091984_200009816681 [0,1,0,0,0,1|2,0,0]=4 5168 B16R1.11442 O=C(CCC=C(F)F)c1ccc(cc1O)O 1458a_100000212172_200009816681 [0,1,0,0,0,1|2,0,0]=4 5169 B16R1.11442 O=C(CSC[N+](=O)[O-])c1ccc(cc1O)F 62a_100009817053_100000761209 [0,1,0,0,0,1|1,0,1]=4 5170 B16R1.11442 O=C(CSC[N+](=O)[O-])c1ccc(cc1O)O 62a_100009814262_100000761209 [0,1,0,0,0,1|1,0,1]=4 5171 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1Br)F 269956a_100016091260_100012361341 [0,1,0,0,0,1|1,0,0]=3 5172 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1Cl)Cl 269956a_100016091260_100011218845 [0,1,0,0,0,1|1,0,0]=3 5173 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1Cl)F 269956a_100016091260_100012056422 [0,1,0,0,0,1|1,0,0]=3 5174 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1F)Br 269956a_100016091260_200012361339 [0,1,0,0,0,1|1,0,0]=3 5175 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1F)Cl 269956a_100016091260_100012351891 [0,1,0,0,0,1|1,0,0]=3 5176 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1F)F 269956a_100016091260_100000229962 [0,1,0,0,0,1|1,0,0]=3 5177 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1O)F 269956a_100016091260_100009817053 [0,1,0,0,0,1|0,0,0]=2 5178 B16R1.11442 O=C(O)CNCC(=O)c1ccc(cc1O)O 269956a_100016091260_100009814262 [0,1,0,0,0,1|0,0,0]=2 5179 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1Br)F 62a_100012361341_100020667443 [0,1,0,0,0,1|1,0,1]=4 5180 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100020667443 [0,1,0,0,0,1|1,0,1]=4 5181 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100020667443 [0,1,0,0,0,1|1,0,1]=4 5182 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1Cl)F 62a_100020667443_100012056422 [0,1,0,0,0,1|1,0,1]=4 5183 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1F)Br 62a_200012361339_100020667443 [0,1,0,0,0,1|1,0,1]=4 5184 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100020667443 [0,1,0,0,0,1|1,0,1]=4 5185 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1F)Cl 62a_100020667443_100012351891 [0,1,0,0,0,1|1,0,1]=4 5186 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1F)F 62a_100000229962_100020667443 [0,1,0,0,0,1|1,0,1]=4 5187 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1F)F 62a_100020667443_100000229962 [0,1,0,0,0,1|1,0,1]=4 5188 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100020667443 [0,1,0,0,0,1|0,0,1]=3 5189 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1O)F 62a_100020667443_100009817053 [0,1,0,0,0,1|0,0,1]=3 5190 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100020667443 [0,1,0,0,0,1|0,0,1]=3 5191 B16R1.11442 O=C([O-])CSCC(=O)c1ccc(cc1O)O 62a_100020667443_100009814262 [0,1,0,0,0,1|0,0,1]=3 5192 B16R1.11442 [13CH3]C(=O)CCNC(=O)c1ccc(cc1Cl)F 1458a_100000195331_200025704644 [0,1,0,0,0,1|2,0,0]=4 5193 B16R1.11442 [13CH3]C(=O)CCNC(=O)c1ccc(cc1F)F 1458a_100000195307_200025704644 [0,1,0,0,0,1|2,0,0]=4 5194 B16R1.16971 C=C(C#N)CSCC(=O)c1ccccc1O 62a_100000188908_100000694840 [0,1,0,0,0,1|2,0,0]=4 5195 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1Br 1458a_100000188424_100009813456 [0,1,0,0,0,1|2,0,0]=4 5196 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1C 1458a_100000212026_100009813456 [0,1,0,0,0,1|2,0,0]=4 5197 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1Cl 1458a_100000185844_100009813456 [0,1,0,0,0,1|2,0,0]=4 5198 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1F 1458a_100000188656_100009813456 [0,1,0,0,0,1|2,0,0]=4 5199 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1I 1458a_100000187884_100009813456 [0,1,0,0,0,1|2,0,0]=4 5200 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1O 1458a_100015234032_100009813456 [0,1,0,0,0,1|1,0,0]=3 5201 B16R1.16971 C=CC(=O)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_100009813456 [0,1,0,0,0,1|1,0,1]=4 5202 B16R1.16971 C=CC(O)CSCC(=O)c1ccccc1O 62a_100000188908_100000730141 [0,1,0,0,0,1|1,0,1]=4 5203 B16R1.16971 C=CC(O)CSCC(=O)c1ccccc1O 62a_100000730141_100000188908 [0,1,0,0,0,1|1,0,1]=4 5204 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1O 240690a_106354213184_100015234032 [0,1,0,0,0,1|1,0,1]=4 5205 B16R1.16971 CC(CO)SCCC(=O)c1ccccc1O 62a_100012180447_100009873196 [0,1,0,0,0,1|1,0,1]=4 5206 B16R1.16971 CCC(=O)CCNC(=O)c1ccccc1C 1458a_100000195313_100000210202 [0,1,0,0,0,1|2,0,0]=4 5207 B16R1.16971 CCC(=O)CCNC(=O)c1ccccc1Cl 1458a_100000182440_100000210202 [0,1,0,0,0,1|2,0,0]=4 5208 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1Br 34a_100000725409_100000199116 [0,1,0,0,0,1|2,0,0]=4 5209 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1C 34a_100000725409_100000741374 [0,1,0,0,0,1|2,0,0]=4 5210 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1Cl 34a_100000725409_100000211432 [0,1,0,0,0,1|2,0,0]=4 5211 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1F 34a_100000725409_100000204681 [0,1,0,0,0,1|2,0,0]=4 5212 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1Br 62a_100000199116_100000747405 [0,1,0,0,0,1|2,0,0]=4 5213 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1C 62a_100000741374_100000747405 [0,1,0,0,0,1|2,0,0]=4 5214 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1C 62a_100000747405_100000741374 [0,1,0,0,0,1|2,0,0]=4 5215 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000747405 [0,1,0,0,0,1|2,0,0]=4 5216 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1Cl 62a_100000747405_100000211432 [0,1,0,0,0,1|2,0,0]=4 5217 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1F 62a_100000204681_100000747405 [0,1,0,0,0,1|2,0,0]=4 5218 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1F 62a_100000747405_100000204681 [0,1,0,0,0,1|2,0,0]=4 5219 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1O 62a_100000188908_100000747405 [0,1,0,0,0,1|1,0,0]=3 5220 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1O 62a_100000747405_100000188908 [0,1,0,0,0,1|1,0,0]=3 5221 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1O 62a_100000188908_100011218378 [0,1,0,0,0,1|1,0,1]=4 5222 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1O 62a_100011218378_100000188908 [0,1,0,0,0,1|1,0,1]=4 5223 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100000741757 [0,1,0,0,0,1|2,0,0]=4 5224 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1C 1458a_100000212026_100000741757 [0,1,0,0,0,1|2,0,0]=4 5225 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000741757 [0,1,0,0,0,1|2,0,0]=4 5226 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100000741757 [0,1,0,0,0,1|2,0,0]=4 5227 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100000741757 [0,1,0,0,0,1|2,0,0]=4 5228 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100000741757 [0,1,0,0,0,1|1,0,0]=3 5229 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000741757 [0,1,0,0,0,1|1,0,1]=4 5230 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Br 11a_100000738227_100000188424 [0,1,0,0,0,1|2,0,0]=4 5231 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Br 240690a_100000738227_100000188424 [0,1,0,0,0,1|2,0,0]=4 5232 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Br 527a_100000738227_100000188424 [0,1,0,0,0,1|2,0,0]=4 5233 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 11a_100000738227_100000212026 [0,1,0,0,0,1|2,0,0]=4 5234 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 11a_106832991635_100000195313 [0,1,0,0,0,1|2,0,0]=4 5235 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 1626a_100102657272_100000195313 [0,1,0,0,0,1|2,0,0]=4 5236 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 240690a_100000738227_100000212026 [0,1,0,0,0,1|2,0,0]=4 5237 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 240690a_100102657272_100000195313 [0,1,0,0,0,1|2,0,0]=4 5238 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 527a_100000738227_100000212026 [0,1,0,0,0,1|2,0,0]=4 5239 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1C 527a_100102657272_100000195313 [0,1,0,0,0,1|2,0,0]=4 5240 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 11a_100000738227_100000185844 [0,1,0,0,0,1|2,0,0]=4 5241 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 11a_106832991635_100000182440 [0,1,0,0,0,1|2,0,0]=4 5242 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 1626a_100102657272_100000182440 [0,1,0,0,0,1|2,0,0]=4 5243 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 240690a_100000738227_100000185844 [0,1,0,0,0,1|2,0,0]=4 5244 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 240690a_100102657272_100000182440 [0,1,0,0,0,1|2,0,0]=4 5245 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 527a_100000738227_100000185844 [0,1,0,0,0,1|2,0,0]=4 5246 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1Cl 527a_100102657272_100000182440 [0,1,0,0,0,1|2,0,0]=4 5247 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1F 11a_100000738227_100000188656 [0,1,0,0,0,1|2,0,0]=4 5248 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1F 240690a_100000738227_100000188656 [0,1,0,0,0,1|2,0,0]=4 5249 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1F 527a_100000738227_100000188656 [0,1,0,0,0,1|2,0,0]=4 5250 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1I 11a_100000738227_100000187884 [0,1,0,0,0,1|2,0,0]=4 5251 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1I 240690a_100000738227_100000187884 [0,1,0,0,0,1|2,0,0]=4 5252 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1I 527a_100000738227_100000187884 [0,1,0,0,0,1|2,0,0]=4 5253 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1O 240690a_100000738227_100015234032 [0,1,0,0,0,1|1,0,0]=3 5254 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1[O-] 240690a_100000738227_100009911694 [0,1,0,0,0,1|1,0,1]=4 5255 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1[O-] 527a_100000738227_100009911694 [0,1,0,0,0,1|1,0,1]=4 5256 B16R1.16971 CNC(=O)CNCC(=O)c1ccccc1C 2230a_100000693194_100000741374 [0,1,0,0,0,1|2,0,0]=4 5257 B16R1.16971 CNC(=O)COCC(=O)c1ccccc1Br 34a_100000750040_100000199116 [0,1,0,0,0,1|2,0,0]=4 5258 B16R1.16971 CNC(=O)COCC(=O)c1ccccc1C 34a_100000750040_100000741374 [0,1,0,0,0,1|2,0,0]=4 5259 B16R1.16971 CNC(=O)COCC(=O)c1ccccc1Cl 34a_100000750040_100000211432 [0,1,0,0,0,1|2,0,0]=4 5260 B16R1.16971 CNC(=O)COCC(=O)c1ccccc1F 34a_100000750040_100000204681 [0,1,0,0,0,1|2,0,0]=4 5261 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1Br 62a_100000199116_100000183359 [0,1,0,0,0,1|2,0,0]=4 5262 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1C 62a_100000183359_100000741374 [0,1,0,0,0,1|2,0,0]=4 5263 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1C 62a_100000741374_100000183359 [0,1,0,0,0,1|2,0,0]=4 5264 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1Cl 62a_100000183359_100000211432 [0,1,0,0,0,1|2,0,0]=4 5265 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000183359 [0,1,0,0,0,1|2,0,0]=4 5266 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1F 62a_100000183359_100000204681 [0,1,0,0,0,1|2,0,0]=4 5267 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1F 62a_100000204681_100000183359 [0,1,0,0,0,1|2,0,0]=4 5268 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1O 62a_100000183359_100000188908 [0,1,0,0,0,1|1,0,0]=3 5269 B16R1.16971 CNC(=O)CSCC(=O)c1ccccc1O 62a_100000188908_100000183359 [0,1,0,0,0,1|1,0,0]=3 5270 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1Br 1458a_100000188424_200011997002 [0,1,0,0,0,1|2,0,0]=4 5271 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1C 1458a_100000212026_200011997002 [0,1,0,0,0,1|2,0,0]=4 5272 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1Cl 1458a_100000185844_200011997002 [0,1,0,0,0,1|2,0,0]=4 5273 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1F 1458a_100000188656_200011997002 [0,1,0,0,0,1|2,0,0]=4 5274 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1I 1458a_100000187884_200011997002 [0,1,0,0,0,1|2,0,0]=4 5275 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1O 1458a_100015234032_200011997002 [0,1,0,0,0,1|1,0,0]=3 5276 B16R1.16971 CNC(=O)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_200011997002 [0,1,0,0,0,1|1,0,1]=4 5277 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011218270 [0,1,0,0,0,1|1,0,0]=3 5278 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1C 1458a_100000212026_100011218270 [0,1,0,0,0,1|1,0,0]=3 5279 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011218270 [0,1,0,0,0,1|1,0,0]=3 5280 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100011218270 [0,1,0,0,0,1|1,0,0]=3 5281 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100011218270 [0,1,0,0,0,1|1,0,0]=3 5282 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100011218270 [0,1,0,0,0,1|0,0,0]=2 5283 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011218270 [0,1,0,0,0,1|0,0,1]=3 5284 B16R1.16971 COC(=O)CCCN(C)c1ccccc1O 269982a_100000033821_100011218270 [0,1,0,0,0,1|2,0,0]=4 5285 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1Br 188690a_100000683876_100000188424 [0,1,0,0,0,1|1,0,0]=3 5286 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1C 188690a_100000683876_100000212026 [0,1,0,0,0,1|1,0,0]=3 5287 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1Cl 188690a_100000683876_100000185844 [0,1,0,0,0,1|1,0,0]=3 5288 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1I 188690a_100000683876_100000187884 [0,1,0,0,0,1|1,0,0]=3 5289 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1O 188690a_100000683876_100015234032 [0,1,0,0,0,1|0,0,0]=2 5290 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1[O-] 188690a_100000683876_100009911694 [0,1,0,0,0,1|0,0,1]=3 5291 B16R1.16971 COC(=O)CCN[C@H](C)c1ccccc1O 2230a_100025703389_100000204255 [0,1,0,0,0,1|1,0,1]=4 5292 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1Br 62a_100000199116_100000747449 [0,1,0,0,0,1|1,0,0]=3 5293 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1C 62a_100000741374_100000747449 [0,1,0,0,0,1|1,0,0]=3 5294 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1C 62a_100000747449_100000741374 [0,1,0,0,0,1|1,0,0]=3 5295 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000747449 [0,1,0,0,0,1|1,0,0]=3 5296 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1Cl 62a_100000747449_100000211432 [0,1,0,0,0,1|1,0,0]=3 5297 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1F 62a_100000204681_100000747449 [0,1,0,0,0,1|1,0,0]=3 5298 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1F 62a_100000747449_100000204681 [0,1,0,0,0,1|1,0,0]=3 5299 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1O 62a_100000188908_100000747449 [0,1,0,0,0,1|0,0,0]=2 5300 B16R1.16971 COC(=O)CSCC(=O)c1ccccc1O 62a_100000747449_100000188908 [0,1,0,0,0,1|0,0,0]=2 5301 B16R1.16971 COC(C)SCCC(=O)c1ccccc1O 62a_100009879195_100009873196 [0,1,0,0,0,1|1,0,1]=4 5302 B16R1.16971 C[C@@H](CO)CSCC(=O)c1ccccc1O 62a_100000059175_100000188908 [0,1,0,0,0,1|1,0,1]=4 5303 B16R1.16971 C[C@@H](CO)CSCC(=O)c1ccccc1O 62a_100000188908_100000059175 [0,1,0,0,0,1|1,0,1]=4 5304 B16R1.16971 C[C@H](CO)SCCC(=O)c1ccccc1O 62a_100016084084_100009873196 [0,1,0,0,0,1|1,0,1]=4 5305 B16R1.16971 Cc1ccccc1C(=O)NCCC(=O)CF 1458a_100000195313_100015361967 [0,1,0,0,0,1|2,0,0]=4 5306 B16R1.16971 O=C(CF)CCNC(=O)c1ccccc1Cl 1458a_100000182440_100015361967 [0,1,0,0,0,1|2,0,0]=4 5307 B16R1.16971 O=C(CSCC(O)CO)c1ccccc1O 62a_100000188908_100011219619 [0,1,0,0,0,1|0,0,2]=4 5308 B16R1.16971 O=C(CSCC(O)CO)c1ccccc1O 62a_100011219619_100000188908 [0,1,0,0,0,1|0,0,2]=4 5309 B16R1.16971 O=C(CSC[C@@H](O)CF)c1ccccc1O 62a_100000188908_100015614560 [0,1,0,0,0,1|1,0,1]=4 5310 B16R1.16971 O=C(CSC[C@@H](O)CF)c1ccccc1O 62a_100015614560_100000188908 [0,1,0,0,0,1|1,0,1]=4 5311 B16R1.16971 O=C(CSC[C@@H](O)CO)c1ccccc1O 62a_100000188908_100009815848 [0,1,0,0,0,1|0,0,2]=4 5312 B16R1.16971 O=C(CSC[C@@H](O)CO)c1ccccc1O 62a_100009815848_100000188908 [0,1,0,0,0,1|0,0,2]=4 5313 B16R1.18704 C#Cc1ccccc1C(=O)CCCC(=O)C 1458a_100011243808_100011215641 [0,1,0,0,0,1|2,0,0]=4 5314 B16R1.18704 C#Cc1ccccc1C(=O)CCCC(=O)N 1458a_100011243808_100102525003 [0,1,0,0,0,1|2,0,0]=4 5315 B16R1.18704 C#Cc1ccccc1C(=O)CCNC(=O)C 1458a_100011243808_100000189650 [0,1,0,0,0,1|2,0,0]=4 5316 B16R1.18704 C#Cc1ccccc1C(=O)CCNC(=O)N 1458a_100011243808_200000034859 [0,1,0,0,0,1|2,0,0]=4 5317 B16R1.18704 C#Cc1ccccc1C(=O)CCOC(=O)C 1458a_100011243808_100009814007 [0,1,0,0,0,1|2,0,0]=4 5318 B16R1.18704 C#Cc1ccccc1C(=O)CCOC(=O)N 1458a_100011243808_200011214921 [0,1,0,0,0,1|2,0,0]=4 5319 B16R1.18704 C#Cc1ccccc1C(=O)NCCC(=O)N 527a_100000740010_100011243808 [0,1,0,0,0,1|2,0,0]=4 5320 B16R1.18704 C=C(C)COCC(=O)c1ccccc1OC 34a_100000210245_100000195505 [0,1,0,0,0,1|2,0,0]=4 5321 B16R1.18704 C=C(C)CSCC(=O)c1ccccc1OC 62a_100000195505_100000211660 [0,1,0,0,0,1|2,0,0]=4 5322 B16R1.18704 C=C(F)COCC(=O)c1ccccc1OC 34a_200010262243_100000195505 [0,1,0,0,0,1|2,0,0]=4 5323 B16R1.18704 C=C(F)CSCC(=O)c1ccccc1OC 62a_100000195505_100000042424 [0,1,0,0,0,1|2,0,0]=4 5324 B16R1.18704 C=Cc1ccccc1C(=O)CCCC(=O)C 1458a_100011830265_100011215641 [0,1,0,0,0,1|2,0,0]=4 5325 B16R1.18704 C=Cc1ccccc1C(=O)CCCC(=O)N 1458a_100011830265_100102525003 [0,1,0,0,0,1|2,0,0]=4 5326 B16R1.18704 C=Cc1ccccc1C(=O)CCNC(=O)C 1458a_100011830265_100000189650 [0,1,0,0,0,1|2,0,0]=4 5327 B16R1.18704 C=Cc1ccccc1C(=O)CCNC(=O)N 1458a_100011830265_200000034859 [0,1,0,0,0,1|2,0,0]=4 5328 B16R1.18704 C=Cc1ccccc1C(=O)CCOC(=O)C 1458a_100011830265_100009814007 [0,1,0,0,0,1|2,0,0]=4 5329 B16R1.18704 C=Cc1ccccc1C(=O)CCOC(=O)N 1458a_100011830265_200011214921 [0,1,0,0,0,1|2,0,0]=4 5330 B16R1.18704 CC(=CCCC(=O)c1ccccc1CO)C 1458a_100011301526_100011217483 [0,1,0,0,0,1|2,0,0]=4 5331 B16R1.18704 CC(=O)CCCC(=O)c1ccccc1C#N 1458a_100000742908_100011215641 [0,1,0,0,0,1|2,0,0]=4 5332 B16R1.18704 CC(=O)CCCC(=O)c1ccccc1CO 1458a_100011301526_100011215641 [0,1,0,0,0,1|1,0,0]=3 5333 B16R1.18704 CC(=O)CCCC(=O)c1ccccc1I=O 1458a_100000032414_100011215641 [0,1,0,0,0,1|1,0,1]=4 5334 B16R1.18704 CC(=O)NCCC(=O)c1ccccc1C#N 1458a_100000742908_100000189650 [0,1,0,0,0,1|2,0,0]=4 5335 B16R1.18704 CC(=O)NCCC(=O)c1ccccc1CO 1458a_100011301526_100000189650 [0,1,0,0,0,1|1,0,0]=3 5336 B16R1.18704 CC(=O)NCCC(=O)c1ccccc1I=O 1458a_100000032414_100000189650 [0,1,0,0,0,1|1,0,1]=4 5337 B16R1.18704 CC(=O)OCCC(=O)c1ccccc1C#N 1458a_100000742908_100009814007 [0,1,0,0,0,1|2,0,0]=4 5338 B16R1.18704 CC(=O)OCCC(=O)c1ccccc1CO 1458a_100011301526_100009814007 [0,1,0,0,0,1|1,0,0]=3 5339 B16R1.18704 CC(=O)OCCC(=O)c1ccccc1I=O 1458a_100000032414_100009814007 [0,1,0,0,0,1|1,0,1]=4 5340 B16R1.18704 CC(O)CCCC(=O)c1ccccc1CO 1458a_100011301526_200000718107 [0,1,0,0,0,1|1,0,1]=4 5341 B16R1.18704 CCc1ccccc1C(=O)CCCC(=O)C 1458a_100000689120_100011215641 [0,1,0,0,0,1|2,0,0]=4 5342 B16R1.18704 CCc1ccccc1C(=O)CCCC(=O)N 1458a_100000689120_100102525003 [0,1,0,0,0,1|2,0,0]=4 5343 B16R1.18704 CCc1ccccc1C(=O)CCNC(=O)C 1458a_100000689120_100000189650 [0,1,0,0,0,1|2,0,0]=4 5344 B16R1.18704 CCc1ccccc1C(=O)CCNC(=O)N 1458a_100000689120_200000034859 [0,1,0,0,0,1|2,0,0]=4 5345 B16R1.18704 CCc1ccccc1C(=O)CCOC(=O)C 1458a_100000689120_100009814007 [0,1,0,0,0,1|2,0,0]=4 5346 B16R1.18704 CCc1ccccc1C(=O)CCOC(=O)N 1458a_100000689120_200011214921 [0,1,0,0,0,1|2,0,0]=4 5347 B16R1.18704 CCc1ccccc1C(=O)NCCC(=O)N 11a_100000740010_100000689120 [0,1,0,0,0,1|2,0,0]=4 5348 B16R1.18704 CCc1ccccc1C(=O)NCCC(=O)N 240690a_100000740010_100000689120 [0,1,0,0,0,1|2,0,0]=4 5349 B16R1.18704 CCc1ccccc1C(=O)NCCC(=O)N 527a_100000740010_100000689120 [0,1,0,0,0,1|2,0,0]=4 5350 B16R1.18704 COc1ccccc1C(=O)CCC=C(C)C 1458a_100000185835_100011217483 [0,1,0,0,0,1|2,0,0]=4 5351 B16R1.18704 COc1ccccc1C(=O)CCC=C(F)F 1458a_100000185835_200009816681 [0,1,0,0,0,1|2,0,0]=4 5352 B16R1.18704 COc1ccccc1C(=O)CCCC(=O)C 1458a_100000185835_100011215641 [0,1,0,0,0,1|1,0,0]=3 5353 B16R1.18704 COc1ccccc1C(=O)CCCC(=O)N 1458a_100000185835_100102525003 [0,1,0,0,0,1|1,0,0]=3 5354 B16R1.18704 COc1ccccc1C(=O)CCCC(C)O 1458a_100000185835_200000718107 [0,1,0,0,0,1|1,0,1]=4 5355 B16R1.18704 COc1ccccc1C(=O)CCNC(=O)C 1458a_100000185835_100000189650 [0,1,0,0,0,1|1,0,0]=3 5356 B16R1.18704 COc1ccccc1C(=O)CCNC(=O)N 1458a_100000185835_200000034859 [0,1,0,0,0,1|1,0,0]=3 5357 B16R1.18704 COc1ccccc1C(=O)CCOC(=O)C 1458a_100000185835_100009814007 [0,1,0,0,0,1|1,0,0]=3 5358 B16R1.18704 COc1ccccc1C(=O)CCOC(=O)N 1458a_100000185835_200011214921 [0,1,0,0,0,1|1,0,0]=3 5359 B16R1.18704 COc1ccccc1C(=O)CNCC(=O)O 269956a_100016091260_100000195505 [0,1,0,0,0,1|0,0,0]=2 5360 B16R1.18704 COc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000195505 [0,1,0,0,0,1|1,0,1]=4 5361 B16R1.18704 COc1ccccc1C(=O)COCC(=O)C 34a_100000211253_100000195505 [0,1,0,0,0,1|1,0,0]=3 5362 B16R1.18704 COc1ccccc1C(=O)CSCC(=O)N 62a_100000195505_100000747473 [0,1,0,0,0,1|1,0,0]=3 5363 B16R1.18704 COc1ccccc1C(=O)CSCC(=O)[O-] 62a_100000195505_100020667443 [0,1,0,0,0,1|0,0,1]=3 5364 B16R1.18704 COc1ccccc1C(=O)CSCC(C)O 62a_100000195505_100011218427 [0,1,0,0,0,1|1,0,1]=4 5365 B16R1.18704 COc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000195505_100009817552 [0,1,0,0,0,1|1,0,1]=4 5366 B16R1.18704 COc1ccccc1C(=O)CSC[N+](=O)[O-] 62a_100000195505_100000761209 [0,1,0,0,0,1|1,0,1]=4 5367 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)C 1458a_100000184143_200000210301 [0,1,0,0,0,1|1,0,0]=3 5368 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)N 11a_100000740010_100000185835 [0,1,0,0,0,1|1,0,0]=3 5369 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)N 240690a_100000740010_100000185835 [0,1,0,0,0,1|1,0,0]=3 5370 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)N 527a_100000740010_100000185835 [0,1,0,0,0,1|1,0,0]=3 5371 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)[13CH3] 1458a_100000184143_200025704644 [0,1,0,0,0,1|1,0,0]=3 5372 B16R1.18704 COc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000185835 [0,1,0,0,0,1|1,0,1]=4 5373 B16R1.18704 COc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000185835 [0,1,0,0,0,1|1,0,1]=4 5374 B16R1.18704 CSc1ccccc1C(=O)CCCC(=O)C 1458a_100000183967_100011215641 [0,1,0,0,0,1|1,1,0]=4 5375 B16R1.18704 CSc1ccccc1C(=O)CCCC(=O)N 1458a_100000183967_100102525003 [0,1,0,0,0,1|1,1,0]=4 5376 B16R1.18704 CSc1ccccc1C(=O)CCNC(=O)C 1458a_100000183967_100000189650 [0,1,0,0,0,1|1,1,0]=4 5377 B16R1.18704 CSc1ccccc1C(=O)CCNC(=O)N 1458a_100000183967_200000034859 [0,1,0,0,0,1|1,1,0]=4 5378 B16R1.18704 CSc1ccccc1C(=O)CCOC(=O)C 1458a_100000183967_100009814007 [0,1,0,0,0,1|1,1,0]=4 5379 B16R1.18704 CSc1ccccc1C(=O)CCOC(=O)N 1458a_100000183967_200011214921 [0,1,0,0,0,1|1,1,0]=4 5380 B16R1.18704 CSc1ccccc1C(=O)NCCC(=O)N 11a_100000740010_100000183967 [0,1,0,0,0,1|1,1,0]=4 5381 B16R1.18704 CSc1ccccc1C(=O)NCCC(=O)N 240690a_100000740010_100000183967 [0,1,0,0,0,1|1,1,0]=4 5382 B16R1.18704 CSc1ccccc1C(=O)NCCC(=O)N 527a_100000740010_100000183967 [0,1,0,0,0,1|1,1,0]=4 5383 B16R1.18704 N#Cc1ccccc1C(=O)CCCC(=O)N 1458a_100000742908_100102525003 [0,1,0,0,0,1|2,0,0]=4 5384 B16R1.18704 N#Cc1ccccc1C(=O)CCNC(=O)N 1458a_100000742908_200000034859 [0,1,0,0,0,1|2,0,0]=4 5385 B16R1.18704 N#Cc1ccccc1C(=O)CCOC(=O)N 1458a_100000742908_200011214921 [0,1,0,0,0,1|2,0,0]=4 5386 B16R1.18704 N#Cc1ccccc1C(=O)NCCC(=O)N 11a_100000740010_100000742908 [0,1,0,0,0,1|2,0,0]=4 5387 B16R1.18704 N#Cc1ccccc1C(=O)NCCC(=O)N 527a_100000740010_100000742908 [0,1,0,0,0,1|2,0,0]=4 5388 B16R1.18704 NC(=O)CCCC(=O)c1ccccc1CO 1458a_100011301526_100102525003 [0,1,0,0,0,1|1,0,0]=3 5389 B16R1.18704 NC(=O)CCCC(=O)c1ccccc1I=O 1458a_100000032414_100102525003 [0,1,0,0,0,1|1,0,1]=4 5390 B16R1.18704 NC(=O)CCNC(=O)c1ccccc1I=O 240690a_100000740010_100000032414 [0,1,0,0,0,1|1,0,1]=4 5391 B16R1.18704 NC(=O)CCNC(=O)c1ccccc1I=O 527a_100000740010_100000032414 [0,1,0,0,0,1|1,0,1]=4 5392 B16R1.18704 NC(=O)NCCC(=O)c1ccccc1CO 1458a_100011301526_200000034859 [0,1,0,0,0,1|1,0,0]=3 5393 B16R1.18704 NC(=O)NCCC(=O)c1ccccc1I=O 1458a_100000032414_200000034859 [0,1,0,0,0,1|1,0,1]=4 5394 B16R1.18704 NC(=O)OCCC(=O)c1ccccc1CO 1458a_100011301526_200011214921 [0,1,0,0,0,1|1,0,0]=3 5395 B16R1.18704 NC(=O)OCCC(=O)c1ccccc1I=O 1458a_100000032414_200011214921 [0,1,0,0,0,1|1,0,1]=4 5396 B16R1.18704 O=C(CCC=C(F)F)c1ccccc1CO 1458a_100011301526_200009816681 [0,1,0,0,0,1|2,0,0]=4 5397 B16R1.44936 CC(=CCCC(=O)c1c(cccc1Br)O)C 1458a_100011935254_100011217483 [0,1,0,0,0,1|2,0,0]=4 5398 B16R1.44936 CC(=CCCC(=O)c1c(cccc1Cl)O)C 1458a_100000745519_100011217483 [0,1,0,0,0,1|2,0,0]=4 5399 B16R1.44936 CC(=CCCC(=O)c1c(cccc1F)O)C 1458a_100000763259_100011217483 [0,1,0,0,0,1|2,0,0]=4 5400 B16R1.44936 CC(=CCCC(=O)c1c(cccc1O)C)C 1458a_100011934116_100011217483 [0,1,0,0,0,1|2,0,0]=4 5401 B16R1.44936 CC(=CCCC(=O)c1c(cccc1O)O)C 1458a_100000755285_100011217483 [0,1,0,0,0,1|2,0,0]=4 5402 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011215641 [0,1,0,0,0,1|2,0,0]=4 5403 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100011215641 [0,1,0,0,0,1|2,0,0]=4 5404 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011215641 [0,1,0,0,0,1|2,0,0]=4 5405 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100011215641 [0,1,0,0,0,1|2,0,0]=4 5406 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215641 [0,1,0,0,0,1|1,0,0]=3 5407 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1C)C 1458a_100000758298_100011215641 [0,1,0,0,0,1|2,0,0]=4 5408 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100011215641 [0,1,0,0,0,1|2,0,0]=4 5409 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011215641 [0,1,0,0,0,1|2,0,0]=4 5410 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011215641 [0,1,0,0,0,1|2,0,0]=4 5411 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215641 [0,1,0,0,0,1|1,0,0]=3 5412 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1F)C 1458a_100000762013_100011215641 [0,1,0,0,0,1|2,0,0]=4 5413 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1F)F 1458a_100000210804_100011215641 [0,1,0,0,0,1|2,0,0]=4 5414 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215641 [0,1,0,0,0,1|1,0,0]=3 5415 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100011215641 [0,1,0,0,0,1|2,0,0]=4 5416 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1I)C 1458a_100000688020_100011215641 [0,1,0,0,0,1|2,0,0]=4 5417 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011215641 [0,1,0,0,0,1|2,0,0]=4 5418 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1I)F 1458a_100000023732_100011215641 [0,1,0,0,0,1|2,0,0]=4 5419 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100011215641 [0,1,0,0,0,1|1,0,0]=3 5420 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215641 [0,1,0,0,0,1|1,0,0]=3 5421 B16R1.44936 CC(=O)COCC(=O)c1c(cccc1Cl)Cl 34a_100000211253_100012340516 [0,1,0,0,0,1|2,0,0]=4 5422 B16R1.44936 CC(=O)COCC(=O)c1c(cccc1Cl)F 34a_100000211253_100011219195 [0,1,0,0,0,1|2,0,0]=4 5423 B16R1.44936 CC(=O)COCC(=O)c1c(cccc1F)F 34a_100000211253_100000199083 [0,1,0,0,0,1|2,0,0]=4 5424 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000189650 [0,1,0,0,0,1|2,0,0]=4 5425 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000189650 [0,1,0,0,0,1|2,0,0]=4 5426 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000189650 [0,1,0,0,0,1|2,0,0]=4 5427 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000189650 [0,1,0,0,0,1|2,0,0]=4 5428 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000189650 [0,1,0,0,0,1|1,0,0]=3 5429 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000189650 [0,1,0,0,0,1|2,0,0]=4 5430 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000189650 [0,1,0,0,0,1|2,0,0]=4 5431 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000189650 [0,1,0,0,0,1|2,0,0]=4 5432 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000189650 [0,1,0,0,0,1|2,0,0]=4 5433 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000189650 [0,1,0,0,0,1|1,0,0]=3 5434 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000189650 [0,1,0,0,0,1|2,0,0]=4 5435 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000189650 [0,1,0,0,0,1|2,0,0]=4 5436 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000189650 [0,1,0,0,0,1|1,0,0]=3 5437 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000189650 [0,1,0,0,0,1|2,0,0]=4 5438 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000189650 [0,1,0,0,0,1|2,0,0]=4 5439 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000189650 [0,1,0,0,0,1|2,0,0]=4 5440 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000189650 [0,1,0,0,0,1|2,0,0]=4 5441 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000189650 [0,1,0,0,0,1|1,0,0]=3 5442 B16R1.44936 CC(=O)NCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000189650 [0,1,0,0,0,1|1,0,0]=3 5443 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100009814007 [0,1,0,0,0,1|2,0,0]=4 5444 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100009814007 [0,1,0,0,0,1|2,0,0]=4 5445 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100009814007 [0,1,0,0,0,1|2,0,0]=4 5446 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100009814007 [0,1,0,0,0,1|2,0,0]=4 5447 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100009814007 [0,1,0,0,0,1|1,0,0]=3 5448 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1C)C 1458a_100000758298_100009814007 [0,1,0,0,0,1|2,0,0]=4 5449 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100009814007 [0,1,0,0,0,1|2,0,0]=4 5450 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100009814007 [0,1,0,0,0,1|2,0,0]=4 5451 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100009814007 [0,1,0,0,0,1|2,0,0]=4 5452 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100009814007 [0,1,0,0,0,1|1,0,0]=3 5453 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1F)C 1458a_100000762013_100009814007 [0,1,0,0,0,1|2,0,0]=4 5454 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1F)F 1458a_100000210804_100009814007 [0,1,0,0,0,1|2,0,0]=4 5455 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1F)O 1458a_100000763259_100009814007 [0,1,0,0,0,1|1,0,0]=3 5456 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100009814007 [0,1,0,0,0,1|2,0,0]=4 5457 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1I)C 1458a_100000688020_100009814007 [0,1,0,0,0,1|2,0,0]=4 5458 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100009814007 [0,1,0,0,0,1|2,0,0]=4 5459 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1I)F 1458a_100000023732_100009814007 [0,1,0,0,0,1|2,0,0]=4 5460 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1O)C 1458a_100011934116_100009814007 [0,1,0,0,0,1|1,0,0]=3 5461 B16R1.44936 CC(=O)OCCC(=O)c1c(cccc1O)O 1458a_100000755285_100009814007 [0,1,0,0,0,1|1,0,0]=3 5462 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_200000718107 [0,1,0,0,0,1|1,0,1]=4 5463 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000718107 [0,1,0,0,0,1|1,0,1]=4 5464 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_200000718107 [0,1,0,0,0,1|1,0,1]=4 5465 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_200000718107 [0,1,0,0,0,1|1,0,1]=4 5466 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)O 240690a_200000755665_100011935254 [0,1,0,0,0,1|1,0,1]=4 5467 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)O 527a_200000755665_100011935254 [0,1,0,0,0,1|1,0,1]=4 5468 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)O 240690a_200000755665_100000745519 [0,1,0,0,0,1|1,0,1]=4 5469 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)O 527a_200000755665_100000745519 [0,1,0,0,0,1|1,0,1]=4 5470 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1F)O 527a_200000755665_100000763259 [0,1,0,0,0,1|1,0,1]=4 5471 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1O)O 527a_200000755665_100000755285 [0,1,0,0,0,1|1,0,1]=4 5472 B16R1.44936 Cc1cccc(c1C(=O)CCC=C(F)F)O 1458a_100011934116_200009816681 [0,1,0,0,0,1|2,0,0]=4 5473 B16R1.44936 Cc1cccc(c1C(=O)CCCC(=O)N)Br 1458a_100000701904_100102525003 [0,1,0,0,0,1|2,0,0]=4 5474 B16R1.44936 Cc1cccc(c1C(=O)CCCC(=O)N)C 1458a_100000758298_100102525003 [0,1,0,0,0,1|2,0,0]=4 5475 B16R1.44936 Cc1cccc(c1C(=O)CCCC(=O)N)Cl 1458a_100000692601_100102525003 [0,1,0,0,0,1|2,0,0]=4 5476 B16R1.44936 Cc1cccc(c1C(=O)CCCC(=O)N)F 1458a_100000762013_100102525003 [0,1,0,0,0,1|2,0,0]=4 5477 B16R1.44936 Cc1cccc(c1C(=O)CCCC(=O)N)I 1458a_100000688020_100102525003 [0,1,0,0,0,1|2,0,0]=4 5478 B16R1.44936 Cc1cccc(c1C(=O)CCCC(=O)N)O 1458a_100011934116_100102525003 [0,1,0,0,0,1|1,0,0]=3 5479 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)O 1458a_100011934116_200000718107 [0,1,0,0,0,1|1,0,1]=4 5480 B16R1.44936 Cc1cccc(c1C(=O)CCNC(=O)N)Br 1458a_100000701904_200000034859 [0,1,0,0,0,1|2,0,0]=4 5481 B16R1.44936 Cc1cccc(c1C(=O)CCNC(=O)N)C 1458a_100000758298_200000034859 [0,1,0,0,0,1|2,0,0]=4 5482 B16R1.44936 Cc1cccc(c1C(=O)CCNC(=O)N)Cl 1458a_100000692601_200000034859 [0,1,0,0,0,1|2,0,0]=4 5483 B16R1.44936 Cc1cccc(c1C(=O)CCNC(=O)N)F 1458a_100000762013_200000034859 [0,1,0,0,0,1|2,0,0]=4 5484 B16R1.44936 Cc1cccc(c1C(=O)CCNC(=O)N)I 1458a_100000688020_200000034859 [0,1,0,0,0,1|2,0,0]=4 5485 B16R1.44936 Cc1cccc(c1C(=O)CCNC(=O)N)O 1458a_100011934116_200000034859 [0,1,0,0,0,1|1,0,0]=3 5486 B16R1.44936 Cc1cccc(c1C(=O)CCOC(=O)N)Br 1458a_100000701904_200011214921 [0,1,0,0,0,1|2,0,0]=4 5487 B16R1.44936 Cc1cccc(c1C(=O)CCOC(=O)N)C 1458a_100000758298_200011214921 [0,1,0,0,0,1|2,0,0]=4 5488 B16R1.44936 Cc1cccc(c1C(=O)CCOC(=O)N)Cl 1458a_100000692601_200011214921 [0,1,0,0,0,1|2,0,0]=4 5489 B16R1.44936 Cc1cccc(c1C(=O)CCOC(=O)N)F 1458a_100000762013_200011214921 [0,1,0,0,0,1|2,0,0]=4 5490 B16R1.44936 Cc1cccc(c1C(=O)CCOC(=O)N)I 1458a_100000688020_200011214921 [0,1,0,0,0,1|2,0,0]=4 5491 B16R1.44936 Cc1cccc(c1C(=O)CCOC(=O)N)O 1458a_100011934116_200011214921 [0,1,0,0,0,1|1,0,0]=3 5492 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)Br 11a_100000740010_100000701904 [0,1,0,0,0,1|2,0,0]=4 5493 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)Br 240690a_100000740010_100000701904 [0,1,0,0,0,1|2,0,0]=4 5494 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)Br 527a_100000740010_100000701904 [0,1,0,0,0,1|2,0,0]=4 5495 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)C 11a_100000740010_100000758298 [0,1,0,0,0,1|2,0,0]=4 5496 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)C 240690a_100000740010_100000758298 [0,1,0,0,0,1|2,0,0]=4 5497 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)Cl 11a_100000740010_100000692601 [0,1,0,0,0,1|2,0,0]=4 5498 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)Cl 240690a_100000740010_100000692601 [0,1,0,0,0,1|2,0,0]=4 5499 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)F 11a_100000740010_100000762013 [0,1,0,0,0,1|2,0,0]=4 5500 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)F 240690a_100000740010_100000762013 [0,1,0,0,0,1|2,0,0]=4 5501 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)F 527a_100000740010_100000762013 [0,1,0,0,0,1|2,0,0]=4 5502 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)I 11a_100000740010_100000688020 [0,1,0,0,0,1|2,0,0]=4 5503 B16R1.44936 Cc1cccc(c1C(=O)NCCC(=O)N)I 240690a_100000740010_100000688020 [0,1,0,0,0,1|2,0,0]=4 5504 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100102525003 [0,1,0,0,0,1|2,0,0]=4 5505 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100102525003 [0,1,0,0,0,1|2,0,0]=4 5506 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100102525003 [0,1,0,0,0,1|2,0,0]=4 5507 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100102525003 [0,1,0,0,0,1|1,0,0]=3 5508 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100102525003 [0,1,0,0,0,1|2,0,0]=4 5509 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100102525003 [0,1,0,0,0,1|2,0,0]=4 5510 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100102525003 [0,1,0,0,0,1|1,0,0]=3 5511 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1F)F 1458a_100000210804_100102525003 [0,1,0,0,0,1|2,0,0]=4 5512 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100102525003 [0,1,0,0,0,1|1,0,0]=3 5513 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100102525003 [0,1,0,0,0,1|2,0,0]=4 5514 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100102525003 [0,1,0,0,0,1|2,0,0]=4 5515 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1I)F 1458a_100000023732_100102525003 [0,1,0,0,0,1|2,0,0]=4 5516 B16R1.44936 NC(=O)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100102525003 [0,1,0,0,0,1|1,0,0]=3 5517 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)Br 11a_100000740010_100000690891 [0,1,0,0,0,1|2,0,0]=4 5518 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)Br 240690a_100000740010_100000690891 [0,1,0,0,0,1|2,0,0]=4 5519 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)Br 527a_100000740010_100000690891 [0,1,0,0,0,1|2,0,0]=4 5520 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)Cl 11a_100000740010_100011253703 [0,1,0,0,0,1|2,0,0]=4 5521 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)Cl 240690a_100000740010_100011253703 [0,1,0,0,0,1|2,0,0]=4 5522 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)Cl 527a_100000740010_100011253703 [0,1,0,0,0,1|2,0,0]=4 5523 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)F 11a_100000740010_100000752694 [0,1,0,0,0,1|2,0,0]=4 5524 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)F 240690a_100000740010_100000752694 [0,1,0,0,0,1|2,0,0]=4 5525 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)F 527a_100000740010_100000752694 [0,1,0,0,0,1|2,0,0]=4 5526 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)O 240690a_100000740010_100011935254 [0,1,0,0,0,1|1,0,0]=3 5527 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Br)O 527a_100000740010_100011935254 [0,1,0,0,0,1|1,0,0]=3 5528 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)Cl 11a_100000740010_100000210656 [0,1,0,0,0,1|2,0,0]=4 5529 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)Cl 240690a_100000740010_100000210656 [0,1,0,0,0,1|2,0,0]=4 5530 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)F 11a_100000740010_100000210369 [0,1,0,0,0,1|2,0,0]=4 5531 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)F 240690a_100000740010_100000210369 [0,1,0,0,0,1|2,0,0]=4 5532 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)F 527a_100000740010_100000210369 [0,1,0,0,0,1|2,0,0]=4 5533 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)O 240690a_100000740010_100000745519 [0,1,0,0,0,1|1,0,0]=3 5534 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1Cl)O 527a_100000740010_100000745519 [0,1,0,0,0,1|1,0,0]=3 5535 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1F)F 11a_100000740010_100000210804 [0,1,0,0,0,1|2,0,0]=4 5536 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1F)F 240690a_100000740010_100000210804 [0,1,0,0,0,1|2,0,0]=4 5537 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1F)F 527a_100000740010_100000210804 [0,1,0,0,0,1|2,0,0]=4 5538 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1F)O 527a_100000740010_100000763259 [0,1,0,0,0,1|1,0,0]=3 5539 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)Br 11a_100000740010_100010232521 [0,1,0,0,0,1|2,0,0]=4 5540 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)Br 240690a_100000740010_100010232521 [0,1,0,0,0,1|2,0,0]=4 5541 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)Br 527a_100000740010_100010232521 [0,1,0,0,0,1|2,0,0]=4 5542 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)Cl 11a_100000740010_100000702859 [0,1,0,0,0,1|2,0,0]=4 5543 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)Cl 240690a_100000740010_100000702859 [0,1,0,0,0,1|2,0,0]=4 5544 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)Cl 527a_100000740010_100000702859 [0,1,0,0,0,1|2,0,0]=4 5545 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)F 11a_100000740010_100000023732 [0,1,0,0,0,1|2,0,0]=4 5546 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1I)F 240690a_100000740010_100000023732 [0,1,0,0,0,1|2,0,0]=4 5547 B16R1.44936 NC(=O)CCNC(=O)c1c(cccc1O)O 527a_100000740010_100000755285 [0,1,0,0,0,1|1,0,0]=3 5548 B16R1.44936 NC(=O)CNCC(=O)c1c(cccc1Cl)Cl 2230a_100000711301_100012340516 [0,1,0,0,0,1|2,0,0]=4 5549 B16R1.44936 NC(=O)CNCC(=O)c1c(cccc1Cl)F 2230a_100000711301_100011219195 [0,1,0,0,0,1|2,0,0]=4 5550 B16R1.44936 NC(=O)CSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100000747473 [0,1,0,0,0,1|2,0,0]=4 5551 B16R1.44936 NC(=O)CSCC(=O)c1c(cccc1Cl)F 62a_100000747473_100011219195 [0,1,0,0,0,1|2,0,0]=4 5552 B16R1.44936 NC(=O)CSCC(=O)c1c(cccc1Cl)F 62a_100011219195_100000747473 [0,1,0,0,0,1|2,0,0]=4 5553 B16R1.44936 NC(=O)CSCC(=O)c1c(cccc1F)F 62a_100000199083_100000747473 [0,1,0,0,0,1|2,0,0]=4 5554 B16R1.44936 NC(=O)CSCC(=O)c1c(cccc1F)F 62a_100000747473_100000199083 [0,1,0,0,0,1|2,0,0]=4 5555 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000034859 [0,1,0,0,0,1|2,0,0]=4 5556 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000034859 [0,1,0,0,0,1|2,0,0]=4 5557 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Br)F 1458a_100000752694_200000034859 [0,1,0,0,0,1|2,0,0]=4 5558 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Br)O 1458a_100011935254_200000034859 [0,1,0,0,0,1|1,0,0]=3 5559 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000034859 [0,1,0,0,0,1|2,0,0]=4 5560 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000034859 [0,1,0,0,0,1|2,0,0]=4 5561 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000034859 [0,1,0,0,0,1|1,0,0]=3 5562 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1F)F 1458a_100000210804_200000034859 [0,1,0,0,0,1|2,0,0]=4 5563 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1F)O 1458a_100000763259_200000034859 [0,1,0,0,0,1|1,0,0]=3 5564 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1I)Br 1458a_100010232521_200000034859 [0,1,0,0,0,1|2,0,0]=4 5565 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000034859 [0,1,0,0,0,1|2,0,0]=4 5566 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1I)F 1458a_100000023732_200000034859 [0,1,0,0,0,1|2,0,0]=4 5567 B16R1.44936 NC(=O)NCCC(=O)c1c(cccc1O)O 1458a_100000755285_200000034859 [0,1,0,0,0,1|1,0,0]=3 5568 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_200011214921 [0,1,0,0,0,1|2,0,0]=4 5569 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200011214921 [0,1,0,0,0,1|2,0,0]=4 5570 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Br)F 1458a_100000752694_200011214921 [0,1,0,0,0,1|2,0,0]=4 5571 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Br)O 1458a_100011935254_200011214921 [0,1,0,0,0,1|1,0,0]=3 5572 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200011214921 [0,1,0,0,0,1|2,0,0]=4 5573 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_200011214921 [0,1,0,0,0,1|2,0,0]=4 5574 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_200011214921 [0,1,0,0,0,1|1,0,0]=3 5575 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1F)F 1458a_100000210804_200011214921 [0,1,0,0,0,1|2,0,0]=4 5576 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1F)O 1458a_100000763259_200011214921 [0,1,0,0,0,1|1,0,0]=3 5577 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1I)Br 1458a_100010232521_200011214921 [0,1,0,0,0,1|2,0,0]=4 5578 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_200011214921 [0,1,0,0,0,1|2,0,0]=4 5579 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1I)F 1458a_100000023732_200011214921 [0,1,0,0,0,1|2,0,0]=4 5580 B16R1.44936 NC(=O)OCCC(=O)c1c(cccc1O)O 1458a_100000755285_200011214921 [0,1,0,0,0,1|1,0,0]=3 5581 B16R1.44936 O=C(CCC=C(F)F)c1c(cccc1Br)O 1458a_100011935254_200009816681 [0,1,0,0,0,1|2,0,0]=4 5582 B16R1.44936 O=C(CCC=C(F)F)c1c(cccc1Cl)O 1458a_100000745519_200009816681 [0,1,0,0,0,1|2,0,0]=4 5583 B16R1.44936 O=C(CCC=C(F)F)c1c(cccc1F)O 1458a_100000763259_200009816681 [0,1,0,0,0,1|2,0,0]=4 5584 B16R1.44936 O=C(CCC=C(F)F)c1c(cccc1O)O 1458a_100000755285_200009816681 [0,1,0,0,0,1|2,0,0]=4 5585 B16R1.44936 O=C(O)CNCC(=O)c1c(cccc1Cl)Cl 269956a_100016091260_100012340516 [0,1,0,0,0,1|1,0,0]=3 5586 B16R1.44936 O=C(O)CNCC(=O)c1c(cccc1Cl)F 269956a_100016091260_100011219195 [0,1,0,0,0,1|1,0,0]=3 5587 B16R1.44936 O=C(O)CNCC(=O)c1c(cccc1F)F 269956a_100016091260_100000199083 [0,1,0,0,0,1|1,0,0]=3 5588 B16R1.44936 O=C([O-])CSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100020667443 [0,1,0,0,0,1|1,0,1]=4 5589 B16R1.44936 O=C([O-])CSCC(=O)c1c(cccc1Cl)F 62a_100011219195_100020667443 [0,1,0,0,0,1|1,0,1]=4 5590 B16R1.44936 O=C([O-])CSCC(=O)c1c(cccc1Cl)F 62a_100020667443_100011219195 [0,1,0,0,0,1|1,0,1]=4 5591 B16R1.44936 O=C([O-])CSCC(=O)c1c(cccc1F)F 62a_100000199083_100020667443 [0,1,0,0,0,1|1,0,1]=4 5592 B16R1.44936 O=C([O-])CSCC(=O)c1c(cccc1F)F 62a_100020667443_100000199083 [0,1,0,0,0,1|1,0,1]=4 5593 B16R1.697 C=C(C)CCC(=O)c1ccccc1COC 1458a_100000737999_100000730704 [0,2,0,0,0,0|2,0,0]=4 5594 B16R1.697 C=C(C)CCC(=O)c1ccccc1OCC 1458a_100000211144_100000730704 [0,2,0,0,0,0|2,0,0]=4 5595 B16R1.697 CCOc1ccccc1C(=O)CCC(C)O 1458a_100000211144_100012276601 [0,2,0,0,0,0|1,0,1]=4 5596 B16R1.697 CCOc1ccccc1C(=O)NCC(=O)C 1458a_100000183251_200000210301 [0,2,0,0,0,0|2,0,0]=4 5597 B16R1.697 CCOc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000211144 [0,2,0,0,0,0|2,0,0]=4 5598 B16R1.697 CCOc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000211144 [0,2,0,0,0,0|2,0,0]=4 5599 B16R1.697 CCOc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000211144 [0,2,0,0,0,0|2,0,0]=4 5600 B16R1.697 CCOc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000183251_200025704644 [0,2,0,0,0,0|2,0,0]=4 5601 B16R1.697 COCc1ccccc1C(=O)CCC(C)O 1458a_100000737999_100012276601 [0,2,0,0,0,0|1,0,1]=4 5602 B16R1.697 COCc1ccccc1C(=O)NCC(=O)N 11a_100000711301_100000737999 [0,2,0,0,0,0|2,0,0]=4 5603 B16R1.697 COCc1ccccc1C(=O)NCC(=O)N 240690a_100000711301_100000737999 [0,2,0,0,0,0|2,0,0]=4 5604 B16R1.697 COCc1ccccc1C(=O)NCC(=O)N 527a_100000711301_100000737999 [0,2,0,0,0,0|2,0,0]=4 5605 B16R1.4361 C=C(C)CCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000730704 [0,2,0,0,0,0|2,0,0]=4 5606 B16R1.4361 C=C(C)CCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000730704 [0,2,0,0,0,0|2,0,0]=4 5607 B16R1.4361 C=C(C)CCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000730704 [0,2,0,0,0,0|2,0,0]=4 5608 B16R1.4361 C=C(C)CCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000730704 [0,2,0,0,0,0|2,0,0]=4 5609 B16R1.4361 C=C(C)CCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000730704 [0,2,0,0,0,0|2,0,0]=4 5610 B16R1.4361 C=C(C)CCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000730704 [0,2,0,0,0,0|2,0,0]=4 5611 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)Br 1458a_100000188853_100012276601 [0,2,0,0,0,0|1,0,1]=4 5612 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)C 1458a_100000204667_100012276601 [0,2,0,0,0,0|1,0,1]=4 5613 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)Cl 1458a_100000211409_100012276601 [0,2,0,0,0,0|1,0,1]=4 5614 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)F 1458a_100000735445_100012276601 [0,2,0,0,0,0|1,0,1]=4 5615 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)I 1458a_100000230898_100012276601 [0,2,0,0,0,0|1,0,1]=4 5616 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)O 1458a_200000100057_100012276601 [0,2,0,0,0,0|1,0,1]=4 5617 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)Br 11a_100000711301_100000188853 [0,2,0,0,0,0|2,0,0]=4 5618 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)Br 240690a_100000711301_100000188853 [0,2,0,0,0,0|2,0,0]=4 5619 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)Br 527a_100000711301_100000188853 [0,2,0,0,0,0|2,0,0]=4 5620 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)C 11a_100000711301_100000204667 [0,2,0,0,0,0|2,0,0]=4 5621 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)C 240690a_100000711301_100000204667 [0,2,0,0,0,0|2,0,0]=4 5622 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)C 527a_100000711301_100000204667 [0,2,0,0,0,0|2,0,0]=4 5623 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)Cl 11a_100000711301_100000211409 [0,2,0,0,0,0|2,0,0]=4 5624 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000211409 [0,2,0,0,0,0|2,0,0]=4 5625 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)Cl 527a_100000711301_100000211409 [0,2,0,0,0,0|2,0,0]=4 5626 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)F 11a_100000711301_100000735445 [0,2,0,0,0,0|2,0,0]=4 5627 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)F 240690a_100000711301_100000735445 [0,2,0,0,0,0|2,0,0]=4 5628 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)F 527a_100000711301_100000735445 [0,2,0,0,0,0|2,0,0]=4 5629 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)I 11a_100000711301_100000230898 [0,2,0,0,0,0|2,0,0]=4 5630 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)I 240690a_100000711301_100000230898 [0,2,0,0,0,0|2,0,0]=4 5631 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)I 527a_100000711301_100000230898 [0,2,0,0,0,0|2,0,0]=4 5632 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)O 240690a_100000711301_200000100057 [0,2,0,0,0,0|2,0,0]=4 5633 B16R1.4361 COc1ccc(cc1C(=O)NCC(=O)N)O 527a_100000711301_200000100057 [0,2,0,0,0,0|2,0,0]=4 5634 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000730704 [0,2,0,0,0,0|2,0,0]=4 5635 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000730704 [0,2,0,0,0,0|2,0,0]=4 5636 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000730704 [0,2,0,0,0,0|2,0,0]=4 5637 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000730704 [0,2,0,0,0,0|2,0,0]=4 5638 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000730704 [0,2,0,0,0,0|2,0,0]=4 5639 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000730704 [0,2,0,0,0,0|2,0,0]=4 5640 B16R1.4719 C=C(C)CCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000730704 [0,2,0,0,0,0|2,0,0]=4 5641 B16R1.4719 CC(O)CCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100012276601 [0,2,0,0,0,0|1,0,1]=4 5642 B16R1.4719 CC(O)CCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100012276601 [0,2,0,0,0,0|1,0,1]=4 5643 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)Br 1458a_100000748230_100012276601 [0,2,0,0,0,0|1,0,1]=4 5644 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)C 1458a_100000217210_100012276601 [0,2,0,0,0,0|1,0,1]=4 5645 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)Cl 1458a_100000217211_100012276601 [0,2,0,0,0,0|1,0,1]=4 5646 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)F 1458a_100000239970_100012276601 [0,2,0,0,0,0|1,0,1]=4 5647 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)I 1458a_100012353712_100012276601 [0,2,0,0,0,0|1,0,1]=4 5648 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)Br 11a_100000711301_100000748230 [0,2,0,0,0,0|2,0,0]=4 5649 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)Br 240690a_100000711301_100000748230 [0,2,0,0,0,0|2,0,0]=4 5650 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)Br 527a_100000711301_100000748230 [0,2,0,0,0,0|2,0,0]=4 5651 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)C 11a_100000711301_100000217210 [0,2,0,0,0,0|2,0,0]=4 5652 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)C 240690a_100000711301_100000217210 [0,2,0,0,0,0|2,0,0]=4 5653 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)C 527a_100000711301_100000217210 [0,2,0,0,0,0|2,0,0]=4 5654 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)Cl 11a_100000711301_100000217211 [0,2,0,0,0,0|2,0,0]=4 5655 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000217211 [0,2,0,0,0,0|2,0,0]=4 5656 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)Cl 527a_100000711301_100000217211 [0,2,0,0,0,0|2,0,0]=4 5657 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)F 11a_100000711301_100000239970 [0,2,0,0,0,0|2,0,0]=4 5658 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)F 240690a_100000711301_100000239970 [0,2,0,0,0,0|2,0,0]=4 5659 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)F 527a_100000711301_100000239970 [0,2,0,0,0,0|2,0,0]=4 5660 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)I 11a_100000711301_100012353712 [0,2,0,0,0,0|2,0,0]=4 5661 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)I 240690a_100000711301_100012353712 [0,2,0,0,0,0|2,0,0]=4 5662 B16R1.4719 COc1cc(ccc1C(=O)NCC(=O)N)I 527a_100000711301_100012353712 [0,2,0,0,0,0|2,0,0]=4 5663 B16R1.4719 NC(=O)CNC(=O)c1ccc(cc1CO)F 240690a_100000711301_100013035055 [0,2,0,0,0,0|2,0,0]=4 5664 B16R1.5565 CC(=O)OC(C)C(=O)c1ccccc1CO 1458a_100011301526_100009818208 [0,2,0,0,0,0|2,0,0]=4 5665 B16R1.5565 COc1ccccc1C(=O)C(C)OC(=O)C 1458a_100000185835_100009818208 [0,2,0,0,0,0|2,0,0]=4 5666 B16R1.5565 COc1ccccc1C(=O)N(C)CC(=O)N 11a_100000739694_100000185835 [0,2,0,0,0,0|2,0,0]=4 5667 B16R1.5565 COc1ccccc1C(=O)N(C)CC(=O)N 527a_100000739694_100000185835 [0,2,0,0,0,0|2,0,0]=4 5668 B16R1.5566 CC(=O)C(=O)CC(=O)c1ccccc1CO 1458a_100011301526_100011261029 [0,2,0,0,0,0|1,0,1]=4 5669 B16R1.5566 COc1ccccc1C(=O)CC(=O)C(=O)C 1458a_100000185835_100011261029 [0,2,0,0,0,0|1,0,1]=4 5670 B16R1.5566 COc1ccccc1C(=O)N[C@H](C)C(=O)N 11a_100000119354_100000185835 [0,2,0,0,0,0|2,0,0]=4 5671 B16R1.5566 COc1ccccc1C(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000185835 [0,2,0,0,0,0|2,0,0]=4 5672 B16R1.5566 COc1ccccc1C(=O)N[C@H](C)C(=O)N 527a_100000119354_100000185835 [0,2,0,0,0,0|2,0,0]=4 5673 B16R1.5567 C=Cc1ccccc1C(=O)NCC(=O)OC 188690a_100000185156_100011830265 [0,2,0,0,0,0|2,0,0]=4 5674 B16R1.5567 CCC(=O)CNC(=O)c1ccccc1OC 1458a_100000183908_100000210202 [0,2,0,0,0,0|2,0,0]=4 5675 B16R1.5567 CCc1ccccc1C(=O)NCC(=O)OC 188690a_100000185156_100000689120 [0,2,0,0,0,0|2,0,0]=4 5676 B16R1.5567 CNC(=O)CNC(=O)c1ccccc1OC 11a_100000693194_100000185835 [0,2,0,0,0,0|2,0,0]=4 5677 B16R1.5567 CNC(=O)CNC(=O)c1ccccc1OC 11a_106832991635_100000183908 [0,2,0,0,0,0|2,0,0]=4 5678 B16R1.5567 CNC(=O)CNC(=O)c1ccccc1OC 240690a_100000693194_100000185835 [0,2,0,0,0,0|2,0,0]=4 5679 B16R1.5567 CNC(=O)CNC(=O)c1ccccc1OC 240690a_100102657272_100000183908 [0,2,0,0,0,0|2,0,0]=4 5680 B16R1.5567 CNC(=O)CNC(=O)c1ccccc1OC 527a_100000693194_100000185835 [0,2,0,0,0,0|2,0,0]=4 5681 B16R1.5567 CNC(=O)CNC(=O)c1ccccc1OC 527a_100102657272_100000183908 [0,2,0,0,0,0|2,0,0]=4 5682 B16R1.5567 COC(=O)CCN(C)c1ccccc1OC 2230a_100000219746_100000204255 [0,2,0,0,0,0|2,0,0]=4 5683 B16R1.5567 COC(=O)CCN(C)c1ccccc1OC 269982a_100000219746_100000204255 [0,2,0,0,0,0|2,0,0]=4 5684 B16R1.5567 COC(=O)CCN(C)c1ccccc1OC 34a_100000219746_100000742370 [0,2,0,0,0,0|2,0,0]=4 5685 B16R1.5567 COC(=O)CNC(=O)c1ccccc1CO 188690a_100000185156_100011301526 [0,2,0,0,0,0|1,0,0]=3 5686 B16R1.5567 COC(=O)CNC(=O)c1ccccc1I=O 188690a_100000185156_100000032414 [0,2,0,0,0,0|1,0,1]=4 5687 B16R1.5567 COC(=O)CNC(=O)c1ccccc1OC 188690a_100000185156_100000185835 [0,2,0,0,0,0|1,0,0]=3 5688 B16R1.5567 COC(=O)CNC(=O)c1ccccc1SC 188690a_100000185156_100000183967 [0,2,0,0,0,0|1,1,0]=4 5689 B16R1.5567 COc1ccccc1C(=O)NCC(=O)CF 1458a_100000183908_100015361967 [0,2,0,0,0,0|2,0,0]=4 5690 B16R1.5567 COc1ccccc1C(=O)NNC(=O)CO 22a_100000189102_100000210174 [0,2,0,0,0,0|2,0,0]=4 5691 B16R1.5950 C=C(C)CCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000730704 [0,2,0,0,0,0|2,0,0]=4 5692 B16R1.5950 C=C(C)CCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000730704 [0,2,0,0,0,0|2,0,0]=4 5693 B16R1.5950 C=C(C)CCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000730704 [0,2,0,0,0,0|2,0,0]=4 5694 B16R1.5950 C=C(C)CCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000730704 [0,2,0,0,0,0|2,0,0]=4 5695 B16R1.5950 C=C(C)CCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000730704 [0,2,0,0,0,0|2,0,0]=4 5696 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)Br 1458a_100000689802_100012276601 [0,2,0,0,0,0|1,0,1]=4 5697 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)C 1458a_100000187929_100012276601 [0,2,0,0,0,0|1,0,1]=4 5698 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)Cl 1458a_100011934004_100012276601 [0,2,0,0,0,0|1,0,1]=4 5699 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)F 1458a_100011218433_100012276601 [0,2,0,0,0,0|1,0,1]=4 5700 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)O 1458a_100000080799_100012276601 [0,2,0,0,0,0|1,0,1]=4 5701 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)Br 11a_100000711301_100000689802 [0,2,0,0,0,0|2,0,0]=4 5702 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)Br 240690a_100000711301_100000689802 [0,2,0,0,0,0|2,0,0]=4 5703 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)Br 527a_100000711301_100000689802 [0,2,0,0,0,0|2,0,0]=4 5704 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)C 11a_100000711301_100000187929 [0,2,0,0,0,0|2,0,0]=4 5705 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)C 240690a_100000711301_100000187929 [0,2,0,0,0,0|2,0,0]=4 5706 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)C 527a_100000711301_100000187929 [0,2,0,0,0,0|2,0,0]=4 5707 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)Cl 11a_100000711301_100011934004 [0,2,0,0,0,0|2,0,0]=4 5708 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100011934004 [0,2,0,0,0,0|2,0,0]=4 5709 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)Cl 527a_100000711301_100011934004 [0,2,0,0,0,0|2,0,0]=4 5710 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)F 11a_100000711301_100011218433 [0,2,0,0,0,0|2,0,0]=4 5711 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)F 240690a_100000711301_100011218433 [0,2,0,0,0,0|2,0,0]=4 5712 B16R1.5950 COc1c(cccc1C(=O)NCC(=O)N)F 527a_100000711301_100011218433 [0,2,0,0,0,0|2,0,0]=4 5713 B16R1.18701 COc1ccccc1C(=O)CCS(=O)(=O)C 1458a_100000185835_100000731031 [0,2,0,0,0,0|1,0,1]=4 5714 B16R1.18701 COc1ccccc1C(=O)CCS(=O)(=O)[O-] 1458a_100000185835_100000762736 [0,2,0,0,0,0|1,0,1]=4 5715 B16R1.18701 CS(=O)(=O)CCC(=O)c1ccccc1CO 1458a_100011301526_100000731031 [0,2,0,0,0,0|1,0,1]=4 5716 B16R1.18701 O=C(CCS(=O)(=O)[O-])c1ccccc1CO 1458a_100011301526_100000762736 [0,2,0,0,0,0|1,0,1]=4 5717 B16R1.19821 C=C(C)CCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000730704 [0,2,0,0,0,0|2,0,0]=4 5718 B16R1.19821 C=C(C)CCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000730704 [0,2,0,0,0,0|2,0,0]=4 5719 B16R1.19821 C=C(C)CCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000730704 [0,2,0,0,0,0|2,0,0]=4 5720 B16R1.19821 C=C(C)CCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000730704 [0,2,0,0,0,0|2,0,0]=4 5721 B16R1.19821 C=C(C)CCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000730704 [0,2,0,0,0,0|2,0,0]=4 5722 B16R1.19821 C=C(C)CCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000730704 [0,2,0,0,0,0|2,0,0]=4 5723 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)Br 1458a_100011593405_100012276601 [0,2,0,0,0,0|1,0,1]=4 5724 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)C 1458a_100000066212_100012276601 [0,2,0,0,0,0|1,0,1]=4 5725 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)Cl 1458a_100000743539_100012276601 [0,2,0,0,0,0|1,0,1]=4 5726 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)F 1458a_100000759380_100012276601 [0,2,0,0,0,0|1,0,1]=4 5727 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)I 1458a_100010179659_100012276601 [0,2,0,0,0,0|1,0,1]=4 5728 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)O 1458a_100000043310_100012276601 [0,2,0,0,0,0|1,0,1]=4 5729 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)Br 11a_100000711301_100011593405 [0,2,0,0,0,0|2,0,0]=4 5730 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)Br 240690a_100000711301_100011593405 [0,2,0,0,0,0|2,0,0]=4 5731 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)Br 527a_100000711301_100011593405 [0,2,0,0,0,0|2,0,0]=4 5732 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)C 11a_100000711301_100000066212 [0,2,0,0,0,0|2,0,0]=4 5733 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)C 240690a_100000711301_100000066212 [0,2,0,0,0,0|2,0,0]=4 5734 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)Cl 11a_100000711301_100000743539 [0,2,0,0,0,0|2,0,0]=4 5735 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000743539 [0,2,0,0,0,0|2,0,0]=4 5736 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)Cl 527a_100000711301_100000743539 [0,2,0,0,0,0|2,0,0]=4 5737 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)F 11a_100000711301_100000759380 [0,2,0,0,0,0|2,0,0]=4 5738 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)F 240690a_100000711301_100000759380 [0,2,0,0,0,0|2,0,0]=4 5739 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)F 527a_100000711301_100000759380 [0,2,0,0,0,0|2,0,0]=4 5740 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)I 11a_100000711301_100010179659 [0,2,0,0,0,0|2,0,0]=4 5741 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)I 240690a_100000711301_100010179659 [0,2,0,0,0,0|2,0,0]=4 5742 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)I 527a_100000711301_100010179659 [0,2,0,0,0,0|2,0,0]=4 5743 B16R1.19821 COc1cccc(c1C(=O)NCC(=O)N)O 240690a_100000711301_100000043310 [0,2,0,0,0,0|2,0,0]=4 5744 B16R1.47 C=C(C)CCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100000730704 [0,2,0,0,0,0|2,0,0]=4 5745 B16R1.47 C=C(C)CCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000730704 [0,2,0,0,0,0|2,0,0]=4 5746 B16R1.47 CC(O)CCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100012276601 [0,2,0,0,0,0|1,0,1]=4 5747 B16R1.47 COc1cccc(c1O)C(=O)CCC(C)O 1458a_100000212136_100012276601 [0,2,0,0,0,0|1,0,1]=4 5748 B16R1.47 COc1cccc(c1O)C(=O)NCC(=O)N 240690a_100000711301_100000212136 [0,2,0,0,0,0|2,0,0]=4 5749 B16R1.47 COc1cccc(c1O)C(=O)NCC(=O)N 527a_100000711301_100000212136 [0,2,0,0,0,0|2,0,0]=4 5750 B16R1.47 N#Cc1cccc(c1O)C(=O)NCC(=O)N 527a_100000711301_100009886288 [0,2,0,0,0,0|2,0,0]=4 5751 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)Br 240690a_100000693194_100000752940 [0,2,0,0,0,0|2,0,0]=4 5752 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)Br 527a_100000693194_100000752940 [0,2,0,0,0,0|2,0,0]=4 5753 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)C 240690a_100000693194_100000183896 [0,2,0,0,0,0|2,0,0]=4 5754 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)C 527a_100000693194_100000183896 [0,2,0,0,0,0|2,0,0]=4 5755 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)Cl 240690a_100000693194_100000742801 [0,2,0,0,0,0|2,0,0]=4 5756 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)Cl 527a_100000693194_100000742801 [0,2,0,0,0,0|2,0,0]=4 5757 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)F 240690a_100000693194_100011217230 [0,2,0,0,0,0|2,0,0]=4 5758 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)F 527a_100000693194_100011217230 [0,2,0,0,0,0|2,0,0]=4 5759 B16R1.89 CNC(=O)CNC(=O)c1cccc(c1O)O 527a_100000693194_100000690420 [0,2,0,0,0,0|2,0,0]=4 5760 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Br)Br 188690a_100000185156_100012360534 [0,2,0,0,0,0|2,0,0]=4 5761 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Br)C 188690a_100000185156_100000692419 [0,2,0,0,0,0|2,0,0]=4 5762 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Br)Cl 188690a_100000185156_100012339722 [0,2,0,0,0,0|2,0,0]=4 5763 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Br)F 188690a_100000185156_100011217547 [0,2,0,0,0,0|2,0,0]=4 5764 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Br)I 188690a_100000185156_100010232522 [0,2,0,0,0,0|2,0,0]=4 5765 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Br)O 188690a_100000185156_100010230362 [0,2,0,0,0,0|2,0,0]=4 5766 B16R1.89 COC(=O)CNC(=O)c1cccc(c1C)Br 188690a_100000185156_100000760464 [0,2,0,0,0,0|2,0,0]=4 5767 B16R1.89 COC(=O)CNC(=O)c1cccc(c1C)C 188690a_100000185156_100000183679 [0,2,0,0,0,0|2,0,0]=4 5768 B16R1.89 COC(=O)CNC(=O)c1cccc(c1C)Cl 188690a_100000185156_100000690184 [0,2,0,0,0,0|2,0,0]=4 5769 B16R1.89 COC(=O)CNC(=O)c1cccc(c1C)F 188690a_100000185156_100011218272 [0,2,0,0,0,0|2,0,0]=4 5770 B16R1.89 COC(=O)CNC(=O)c1cccc(c1C)I 188690a_100000185156_100000751865 [0,2,0,0,0,0|2,0,0]=4 5771 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Cl)Br 188690a_100000185156_100000760540 [0,2,0,0,0,0|2,0,0]=4 5772 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Cl)C 188690a_100000185156_100000693142 [0,2,0,0,0,0|2,0,0]=4 5773 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Cl)Cl 188690a_100000185156_100000183631 [0,2,0,0,0,0|2,0,0]=4 5774 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Cl)F 188690a_100000185156_100000759904 [0,2,0,0,0,0|2,0,0]=4 5775 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Cl)I 188690a_100000185156_100010176783 [0,2,0,0,0,0|2,0,0]=4 5776 B16R1.89 COC(=O)CNC(=O)c1cccc(c1Cl)O 188690a_100000185156_100000092362 [0,2,0,0,0,0|2,0,0]=4 5777 B16R1.89 COC(=O)CNC(=O)c1cccc(c1F)C 188690a_100000185156_100000766181 [0,2,0,0,0,0|2,0,0]=4 5778 B16R1.89 COC(=O)CNC(=O)c1cccc(c1F)I 188690a_100000185156_100010185205 [0,2,0,0,0,0|2,0,0]=4 5779 B16R1.89 COC(=O)CNC(=O)c1cccc(c1I)Br 188690a_100000185156_100000688019 [0,2,0,0,0,0|2,0,0]=4 5780 B16R1.89 COC(=O)CNC(=O)c1cccc(c1I)C 188690a_100000185156_100000739377 [0,2,0,0,0,0|2,0,0]=4 5781 B16R1.89 COC(=O)CNC(=O)c1cccc(c1I)Cl 188690a_100000185156_100010176784 [0,2,0,0,0,0|2,0,0]=4 5782 B16R1.89 COC(=O)CNC(=O)c1cccc(c1I)F 188690a_100000185156_100000690930 [0,2,0,0,0,0|2,0,0]=4 5783 B16R1.89 COC(=O)CNC(=O)c1cccc(c1I)O 188690a_100000185156_100010084636 [0,2,0,0,0,0|2,0,0]=4 5784 B16R1.89 COC(=O)CNC(=O)c1cccc(c1O)Br 188690a_100000185156_100000752940 [0,2,0,0,0,0|1,0,0]=3 5785 B16R1.89 COC(=O)CNC(=O)c1cccc(c1O)C 188690a_100000185156_100000183896 [0,2,0,0,0,0|1,0,0]=3 5786 B16R1.89 COC(=O)CNC(=O)c1cccc(c1O)Cl 188690a_100000185156_100000742801 [0,2,0,0,0,0|1,0,0]=3 5787 B16R1.89 COC(=O)CNC(=O)c1cccc(c1O)F 188690a_100000185156_100011217230 [0,2,0,0,0,0|1,0,0]=3 5788 B16R1.7305 CS(=O)(=O)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000731031 [0,2,0,0,0,0|1,0,1]=4 5789 B16R1.7305 CS(=O)(=O)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000731031 [0,2,0,0,0,0|1,0,1]=4 5790 B16R1.7305 CS(=O)(=O)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000731031 [0,2,0,0,0,0|1,0,1]=4 5791 B16R1.7305 CS(=O)(=O)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000731031 [0,2,0,0,0,0|1,0,1]=4 5792 B16R1.7305 Cc1cccc(c1O)C(=O)CCS(=O)(=O)C 1458a_100000183896_100000731031 [0,2,0,0,0,0|1,0,1]=4 5793 B16R1.7305 Cc1cccc(c1O)C(=O)CCS(=O)(=O)[O-] 1458a_100000183896_100000762736 [0,2,0,0,0,0|1,0,1]=4 5794 B16R1.7305 O=C(CCS(=O)(=O)[O-])c1cccc(c1O)Br 1458a_100000752940_100000762736 [0,2,0,0,0,0|1,0,1]=4 5795 B16R1.7305 O=C(CCS(=O)(=O)[O-])c1cccc(c1O)Cl 1458a_100000742801_100000762736 [0,2,0,0,0,0|1,0,1]=4 5796 B16R1.7305 O=C(CCS(=O)(=O)[O-])c1cccc(c1O)F 1458a_100011217230_100000762736 [0,2,0,0,0,0|1,0,1]=4 5797 B16R1.7305 O=C(CCS(=O)(=O)[O-])c1cccc(c1O)O 1458a_100000690420_100000762736 [0,2,0,0,0,0|1,0,1]=4 5798 B16R1.11262 CC(=O)OC(C)C(=O)c1cccc(c1O)Br 1458a_100000752940_100009818208 [0,2,0,0,0,0|2,0,0]=4 5799 B16R1.11262 CC(=O)OC(C)C(=O)c1cccc(c1O)C 1458a_100000183896_100009818208 [0,2,0,0,0,0|2,0,0]=4 5800 B16R1.11262 CC(=O)OC(C)C(=O)c1cccc(c1O)Cl 1458a_100000742801_100009818208 [0,2,0,0,0,0|2,0,0]=4 5801 B16R1.11262 CC(=O)OC(C)C(=O)c1cccc(c1O)F 1458a_100011217230_100009818208 [0,2,0,0,0,0|2,0,0]=4 5802 B16R1.11262 CC(=O)OC(C)C(=O)c1cccc(c1O)O 1458a_100000690420_100009818208 [0,2,0,0,0,0|2,0,0]=4 5803 B16R1.11262 CN(CC(=O)N)C(=O)c1cccc(c1O)Br 527a_100000739694_100000752940 [0,2,0,0,0,0|2,0,0]=4 5804 B16R1.11262 CN(CC(=O)N)C(=O)c1cccc(c1O)Cl 527a_100000739694_100000742801 [0,2,0,0,0,0|2,0,0]=4 5805 B16R1.11262 CN(CC(=O)N)C(=O)c1cccc(c1O)F 527a_100000739694_100011217230 [0,2,0,0,0,0|2,0,0]=4 5806 B16R1.11262 CN(CC(=O)N)C(=O)c1cccc(c1O)O 527a_100000739694_100000690420 [0,2,0,0,0,0|2,0,0]=4 5807 B16R1.11262 Cc1cccc(c1O)C(=O)N(C)CC(=O)N 527a_100000739694_100000183896 [0,2,0,0,0,0|2,0,0]=4 5808 B16R1.11263 CC(=O)C(=O)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100011261029 [0,2,0,0,0,0|1,0,1]=4 5809 B16R1.11263 CC(=O)C(=O)CC(=O)c1cccc(c1O)C 1458a_100000183896_100011261029 [0,2,0,0,0,0|1,0,1]=4 5810 B16R1.11263 CC(=O)C(=O)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011261029 [0,2,0,0,0,0|1,0,1]=4 5811 B16R1.11263 CC(=O)C(=O)CC(=O)c1cccc(c1O)F 1458a_100011217230_100011261029 [0,2,0,0,0,0|1,0,1]=4 5812 B16R1.11263 CC(=O)C(=O)CC(=O)c1cccc(c1O)O 1458a_100000690420_100011261029 [0,2,0,0,0,0|1,0,1]=4 5813 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)Br)C(=O)N 240690a_100000119354_100000752940 [0,2,0,0,0,0|2,0,0]=4 5814 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)Br)C(=O)N 527a_100000119354_100000752940 [0,2,0,0,0,0|2,0,0]=4 5815 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)Cl)C(=O)N 240690a_100000119354_100000742801 [0,2,0,0,0,0|2,0,0]=4 5816 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)Cl)C(=O)N 527a_100000119354_100000742801 [0,2,0,0,0,0|2,0,0]=4 5817 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)F)C(=O)N 240690a_100000119354_100011217230 [0,2,0,0,0,0|2,0,0]=4 5818 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)F)C(=O)N 527a_100000119354_100011217230 [0,2,0,0,0,0|2,0,0]=4 5819 B16R1.11263 C[C@@H](NC(=O)c1cccc(c1O)O)C(=O)N 527a_100000119354_100000690420 [0,2,0,0,0,0|2,0,0]=4 5820 B16R1.11263 Cc1cccc(c1O)C(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000183896 [0,2,0,0,0,0|2,0,0]=4 5821 B16R1.11263 Cc1cccc(c1O)C(=O)N[C@H](C)C(=O)N 527a_100000119354_100000183896 [0,2,0,0,0,0|2,0,0]=4 5822 B16R1.11387 C=C(C)CCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000730704 [0,2,0,0,0,0|2,0,0]=4 5823 B16R1.11387 C=C(C)CCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000730704 [0,2,0,0,0,0|2,0,0]=4 5824 B16R1.11387 C=C(C)CCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000730704 [0,2,0,0,0,0|2,0,0]=4 5825 B16R1.11387 C=C(C)CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000730704 [0,2,0,0,0,0|2,0,0]=4 5826 B16R1.11387 CC(O)CCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100012276601 [0,2,0,0,0,0|1,0,1]=4 5827 B16R1.11387 CC(O)CCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100012276601 [0,2,0,0,0,0|1,0,1]=4 5828 B16R1.11387 CC(O)CCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100012276601 [0,2,0,0,0,0|1,0,1]=4 5829 B16R1.11387 Cc1ccc(c(c1C)O)C(=O)CCC(C)O 1458a_100000742916_100012276601 [0,2,0,0,0,0|1,0,1]=4 5830 B16R1.11387 Cc1ccc(c(c1C)O)C(=O)NCC(=O)N 240690a_100000711301_100000742916 [0,2,0,0,0,0|2,0,0]=4 5831 B16R1.11387 Cc1ccc(c(c1C)O)C(=O)NCC(=O)N 527a_100000711301_100000742916 [0,2,0,0,0,0|2,0,0]=4 5832 B16R1.11387 NC(=O)CNC(=O)c1ccc(c(c1O)F)Br 240690a_100000711301_100010761495 [0,2,0,0,0,0|2,0,0]=4 5833 B16R1.11387 NC(=O)CNC(=O)c1ccc(c(c1O)F)Br 527a_100000711301_100010761495 [0,2,0,0,0,0|2,0,0]=4 5834 B16R1.11387 NC(=O)CNC(=O)c1ccc(c(c1O)F)F 240690a_100000711301_100011799213 [0,2,0,0,0,0|2,0,0]=4 5835 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000730704 [0,2,0,0,0,0|2,0,0]=4 5836 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000730704 [0,2,0,0,0,0|2,0,0]=4 5837 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000730704 [0,2,0,0,0,0|2,0,0]=4 5838 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000730704 [0,2,0,0,0,0|2,0,0]=4 5839 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000730704 [0,2,0,0,0,0|2,0,0]=4 5840 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000730704 [0,2,0,0,0,0|2,0,0]=4 5841 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000730704 [0,2,0,0,0,0|2,0,0]=4 5842 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000730704 [0,2,0,0,0,0|2,0,0]=4 5843 B16R1.23757 C=C(C)CCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000730704 [0,2,0,0,0,0|2,0,0]=4 5844 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100012276601 [0,2,0,0,0,0|1,0,1]=4 5845 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100012276601 [0,2,0,0,0,0|1,0,1]=4 5846 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100012276601 [0,2,0,0,0,0|1,0,1]=4 5847 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100012276601 [0,2,0,0,0,0|1,0,1]=4 5848 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100012276601 [0,2,0,0,0,0|1,0,1]=4 5849 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100012276601 [0,2,0,0,0,0|1,0,1]=4 5850 B16R1.23757 CC(O)CCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100012276601 [0,2,0,0,0,0|1,0,1]=4 5851 B16R1.23757 Cc1cc(cc(c1O)C(=O)CCC(C)O)Br 1458a_100011825902_100012276601 [0,2,0,0,0,0|1,0,1]=4 5852 B16R1.23757 Cc1cc(cc(c1O)C(=O)CCC(C)O)Cl 1458a_100011255218_100012276601 [0,2,0,0,0,0|1,0,1]=4 5853 B16R1.23757 Cc1cc(cc(c1O)C(=O)NCC(=O)N)Br 240690a_100000711301_100011825902 [0,2,0,0,0,0|2,0,0]=4 5854 B16R1.23757 Cc1cc(cc(c1O)C(=O)NCC(=O)N)Cl 240690a_100000711301_100011255218 [0,2,0,0,0,0|2,0,0]=4 5855 B16R1.23757 Cc1cc(cc(c1O)C(=O)NCC(=O)N)Cl 527a_100000711301_100011255218 [0,2,0,0,0,0|2,0,0]=4 5856 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)Br)Br 240690a_100000711301_100000212120 [0,2,0,0,0,0|2,0,0]=4 5857 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)Br)Br 527a_100000711301_100000212120 [0,2,0,0,0,0|2,0,0]=4 5858 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100000711301_100000765379 [0,2,0,0,0,0|2,0,0]=4 5859 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)Br)Cl 527a_100000711301_100000765379 [0,2,0,0,0,0|2,0,0]=4 5860 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100000711301_100000215963 [0,2,0,0,0,0|2,0,0]=4 5861 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100000711301_100000215963 [0,2,0,0,0,0|2,0,0]=4 5862 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)F)Br 240690a_100000711301_100011255233 [0,2,0,0,0,0|2,0,0]=4 5863 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)F)Br 527a_100000711301_100011255233 [0,2,0,0,0,0|2,0,0]=4 5864 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)F)F 240690a_100000711301_100011255242 [0,2,0,0,0,0|2,0,0]=4 5865 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)F)F 527a_100000711301_100011255242 [0,2,0,0,0,0|2,0,0]=4 5866 B16R1.23757 NC(=O)CNC(=O)c1cc(cc(c1O)I)I 240690a_100000711301_100000748652 [0,2,0,0,0,0|2,0,0]=4 5867 B16R1.39643 C=C(C)CCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000730704 [0,2,0,0,0,0|2,0,0]=4 5868 B16R1.39643 C=C(C)CCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000730704 [0,2,0,0,0,0|2,0,0]=4 5869 B16R1.39643 C=C(C)CCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000730704 [0,2,0,0,0,0|2,0,0]=4 5870 B16R1.39643 C=C(C)CCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000730704 [0,2,0,0,0,0|2,0,0]=4 5871 B16R1.39643 C=C(C)CCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000730704 [0,2,0,0,0,0|2,0,0]=4 5872 B16R1.39643 C=C(C)CCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000730704 [0,2,0,0,0,0|2,0,0]=4 5873 B16R1.39643 CC(O)CCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100012276601 [0,2,0,0,0,0|1,0,1]=4 5874 B16R1.39643 CC(O)CCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100012276601 [0,2,0,0,0,0|1,0,1]=4 5875 B16R1.39643 CC(O)CCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100012276601 [0,2,0,0,0,0|1,0,1]=4 5876 B16R1.39643 CC(O)CCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100012276601 [0,2,0,0,0,0|1,0,1]=4 5877 B16R1.39643 CC(O)CCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100012276601 [0,2,0,0,0,0|1,0,1]=4 5878 B16R1.39643 Cc1ccc(c(c1O)C(=O)CCC(C)O)C 1458a_100011255215_100012276601 [0,2,0,0,0,0|1,0,1]=4 5879 B16R1.39643 Cc1ccc(c(c1O)C(=O)NCC(=O)N)C 240690a_100000711301_100011255215 [0,2,0,0,0,0|2,0,0]=4 5880 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1F)F)O 240690a_100000711301_100000062415 [0,2,0,0,0,0|2,0,0]=4 5881 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1F)F)O 527a_100000711301_100000062415 [0,2,0,0,0,0|2,0,0]=4 5882 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)Br)O 240690a_100000711301_100010008628 [0,2,0,0,0,0|2,0,0]=4 5883 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)Br)O 527a_100000711301_100010008628 [0,2,0,0,0,0|2,0,0]=4 5884 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100000711301_100011255222 [0,2,0,0,0,0|2,0,0]=4 5885 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100000711301_100011255222 [0,2,0,0,0,0|2,0,0]=4 5886 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)Cl)O 240690a_100000711301_100000080727 [0,2,0,0,0,0|2,0,0]=4 5887 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)Cl)O 527a_100000711301_100000080727 [0,2,0,0,0,0|2,0,0]=4 5888 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)F)F 240690a_100000711301_100011830443 [0,2,0,0,0,0|2,0,0]=4 5889 B16R1.39643 NC(=O)CNC(=O)c1c(ccc(c1O)F)F 527a_100000711301_100011830443 [0,2,0,0,0,0|2,0,0]=4 5890 B16R1.11216 CC(=O)OC(C)C(=O)c1c(cccc1Br)O 1458a_100011935254_100009818208 [0,2,0,0,0,0|2,0,0]=4 5891 B16R1.11216 CC(=O)OC(C)C(=O)c1c(cccc1Cl)O 1458a_100000745519_100009818208 [0,2,0,0,0,0|2,0,0]=4 5892 B16R1.11216 CC(=O)OC(C)C(=O)c1c(cccc1F)O 1458a_100000763259_100009818208 [0,2,0,0,0,0|2,0,0]=4 5893 B16R1.11216 CC(=O)OC(C)C(=O)c1c(cccc1O)C 1458a_100011934116_100009818208 [0,2,0,0,0,0|2,0,0]=4 5894 B16R1.11216 CC(=O)OC(C)C(=O)c1c(cccc1O)O 1458a_100000755285_100009818208 [0,2,0,0,0,0|2,0,0]=4 5895 B16R1.11216 CN(CC(=O)N)C(=O)c1c(cccc1Br)O 527a_100000739694_100011935254 [0,2,0,0,0,0|2,0,0]=4 5896 B16R1.11216 CN(CC(=O)N)C(=O)c1c(cccc1Cl)O 527a_100000739694_100000745519 [0,2,0,0,0,0|2,0,0]=4 5897 B16R1.11216 CN(CC(=O)N)C(=O)c1c(cccc1F)O 527a_100000739694_100000763259 [0,2,0,0,0,0|2,0,0]=4 5898 B16R1.11216 CN(CC(=O)N)C(=O)c1c(cccc1O)O 527a_100000739694_100000755285 [0,2,0,0,0,0|2,0,0]=4 5899 B16R1.11399 CC(=O)OC(C)C(=O)c1cc(ccc1O)Br 1458a_100000212140_100009818208 [0,2,0,0,0,0|2,0,0]=4 5900 B16R1.11399 CC(=O)OC(C)C(=O)c1cc(ccc1O)C 1458a_100000229998_100009818208 [0,2,0,0,0,0|2,0,0]=4 5901 B16R1.11399 CC(=O)OC(C)C(=O)c1cc(ccc1O)Cl 1458a_100000212143_100009818208 [0,2,0,0,0,0|2,0,0]=4 5902 B16R1.11399 CC(=O)OC(C)C(=O)c1cc(ccc1O)F 1458a_100000742286_100009818208 [0,2,0,0,0,0|2,0,0]=4 5903 B16R1.11399 CC(=O)OC(C)C(=O)c1cc(ccc1O)I 1458a_100000212111_100009818208 [0,2,0,0,0,0|2,0,0]=4 5904 B16R1.11399 CC(=O)OC(C)C(=O)c1cc(ccc1O)O 1458a_100000758025_100009818208 [0,2,0,0,0,0|2,0,0]=4 5905 B16R1.11399 CN(CC(=O)N)C(=O)c1cc(ccc1O)Br 527a_100000739694_100000212140 [0,2,0,0,0,0|2,0,0]=4 5906 B16R1.11399 CN(CC(=O)N)C(=O)c1cc(ccc1O)Cl 11a_100000739694_100000212143 [0,2,0,0,0,0|2,0,0]=4 5907 B16R1.11399 CN(CC(=O)N)C(=O)c1cc(ccc1O)Cl 527a_100000739694_100000212143 [0,2,0,0,0,0|2,0,0]=4 5908 B16R1.11399 CN(CC(=O)N)C(=O)c1cc(ccc1O)F 527a_100000739694_100000742286 [0,2,0,0,0,0|2,0,0]=4 5909 B16R1.11399 CN(CC(=O)N)C(=O)c1cc(ccc1O)I 527a_100000739694_100000212111 [0,2,0,0,0,0|2,0,0]=4 5910 B16R1.11399 Cc1ccc(c(c1)C(=O)N(C)CC(=O)N)O 527a_100000739694_100000229998 [0,2,0,0,0,0|2,0,0]=4 5911 B16R1.11440 CC(=O)OC(C)C(=O)c1ccc(cc1O)Br 1458a_100000744433_100009818208 [0,2,0,0,0,0|2,0,0]=4 5912 B16R1.11440 CC(=O)OC(C)C(=O)c1ccc(cc1O)C 1458a_100000212137_100009818208 [0,2,0,0,0,0|2,0,0]=4 5913 B16R1.11440 CC(=O)OC(C)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_100009818208 [0,2,0,0,0,0|2,0,0]=4 5914 B16R1.11440 CC(=O)OC(C)C(=O)c1ccc(cc1O)F 1458a_100000746061_100009818208 [0,2,0,0,0,0|2,0,0]=4 5915 B16R1.11440 CC(=O)OC(C)C(=O)c1ccc(cc1O)I 1458a_100000091984_100009818208 [0,2,0,0,0,0|2,0,0]=4 5916 B16R1.11440 CC(=O)OC(C)C(=O)c1ccc(cc1O)O 1458a_100000212172_100009818208 [0,2,0,0,0,0|2,0,0]=4 5917 B16R1.11440 CN(CC(=O)N)C(=O)c1ccc(cc1O)Br 527a_100000739694_100000744433 [0,2,0,0,0,0|2,0,0]=4 5918 B16R1.11440 CN(CC(=O)N)C(=O)c1ccc(cc1O)Cl 11a_100000739694_100000188622 [0,2,0,0,0,0|2,0,0]=4 5919 B16R1.11440 CN(CC(=O)N)C(=O)c1ccc(cc1O)Cl 527a_100000739694_100000188622 [0,2,0,0,0,0|2,0,0]=4 5920 B16R1.11440 CN(CC(=O)N)C(=O)c1ccc(cc1O)F 527a_100000739694_100000746061 [0,2,0,0,0,0|2,0,0]=4 5921 B16R1.11440 CN(CC(=O)N)C(=O)c1ccc(cc1O)I 527a_100000739694_100000091984 [0,2,0,0,0,0|2,0,0]=4 5922 B16R1.11440 Cc1ccc(c(c1)O)C(=O)N(C)CC(=O)N 527a_100000739694_100000212137 [0,2,0,0,0,0|2,0,0]=4 5923 B16R1.16913 CNC(=O)CN(C)C(=O)c1ccccc1O 240690a_100000189611_100015234032 [0,2,0,0,0,0|2,0,0]=4 5924 B16R1.16913 COC(=O)CC(C)N(C)c1ccccc1O 269982a_100000033821_100009817358 [0,2,0,0,0,0|2,0,0]=4 5925 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Br 11a_100000198492_100000188424 [0,2,0,0,0,0|2,0,0]=4 5926 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Br 1626a_100000198492_100000188424 [0,2,0,0,0,0|2,0,0]=4 5927 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Br 240690a_100000198492_100000188424 [0,2,0,0,0,0|2,0,0]=4 5928 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Br 527a_100000198492_100000188424 [0,2,0,0,0,0|2,0,0]=4 5929 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1C 11a_100000198492_100000212026 [0,2,0,0,0,0|2,0,0]=4 5930 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1C 1626a_100000198492_100000212026 [0,2,0,0,0,0|2,0,0]=4 5931 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1C 240690a_100000198492_100000212026 [0,2,0,0,0,0|2,0,0]=4 5932 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1C 527a_100000198492_100000212026 [0,2,0,0,0,0|2,0,0]=4 5933 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Cl 11a_100000198492_100000185844 [0,2,0,0,0,0|2,0,0]=4 5934 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Cl 1626a_100000198492_100000185844 [0,2,0,0,0,0|2,0,0]=4 5935 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Cl 240690a_100000198492_100000185844 [0,2,0,0,0,0|2,0,0]=4 5936 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1Cl 527a_100000198492_100000185844 [0,2,0,0,0,0|2,0,0]=4 5937 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1F 11a_100000198492_100000188656 [0,2,0,0,0,0|2,0,0]=4 5938 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1F 1626a_100000198492_100000188656 [0,2,0,0,0,0|2,0,0]=4 5939 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1F 240690a_100000198492_100000188656 [0,2,0,0,0,0|2,0,0]=4 5940 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1F 527a_100000198492_100000188656 [0,2,0,0,0,0|2,0,0]=4 5941 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1I 11a_100000198492_100000187884 [0,2,0,0,0,0|2,0,0]=4 5942 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1I 1626a_100000198492_100000187884 [0,2,0,0,0,0|2,0,0]=4 5943 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1I 240690a_100000198492_100000187884 [0,2,0,0,0,0|2,0,0]=4 5944 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1I 527a_100000198492_100000187884 [0,2,0,0,0,0|2,0,0]=4 5945 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1O 240690a_100000198492_100015234032 [0,2,0,0,0,0|1,0,0]=3 5946 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1[O-] 1626a_100000198492_100009911694 [0,2,0,0,0,0|1,0,1]=4 5947 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1[O-] 240690a_100000198492_100009911694 [0,2,0,0,0,0|1,0,1]=4 5948 B16R1.16913 COC(=O)CN(C)C(=O)c1ccccc1[O-] 527a_100000198492_100009911694 [0,2,0,0,0,0|1,0,1]=4 5949 B16R1.636 CCC(NC(=O)c1ccccc1O)C(=O)N 240690a_100000733705_100015234032 [0,2,0,0,0,0|2,0,0]=4 5950 B16R1.636 NC(=O)[C@H](CO)NC(=O)c1ccccc1O 240690a_100000729942_100015234032 [0,2,0,0,0,0|2,0,0]=4 5951 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011261029 [0,2,0,0,0,0|1,0,1]=4 5952 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)C 1458a_100000212137_100011261029 [0,2,0,0,0,0|1,0,1]=4 5953 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011261029 [0,2,0,0,0,0|1,0,1]=4 5954 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100011261029 [0,2,0,0,0,0|1,0,1]=4 5955 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100011261029 [0,2,0,0,0,0|1,0,1]=4 5956 B16R1.11441 CC(=O)C(=O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100011261029 [0,2,0,0,0,0|1,0,1]=4 5957 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)Br)C(=O)N 240690a_100000119354_100000744433 [0,2,0,0,0,0|2,0,0]=4 5958 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)Br)C(=O)N 527a_100000119354_100000744433 [0,2,0,0,0,0|2,0,0]=4 5959 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)Cl)C(=O)N 11a_100000119354_100000188622 [0,2,0,0,0,0|2,0,0]=4 5960 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)Cl)C(=O)N 240690a_100000119354_100000188622 [0,2,0,0,0,0|2,0,0]=4 5961 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)Cl)C(=O)N 527a_100000119354_100000188622 [0,2,0,0,0,0|2,0,0]=4 5962 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)F)C(=O)N 240690a_100000119354_100000746061 [0,2,0,0,0,0|2,0,0]=4 5963 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)F)C(=O)N 527a_100000119354_100000746061 [0,2,0,0,0,0|2,0,0]=4 5964 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)I)C(=O)N 240690a_100000119354_100000091984 [0,2,0,0,0,0|2,0,0]=4 5965 B16R1.11441 C[C@@H](NC(=O)c1ccc(cc1O)I)C(=O)N 527a_100000119354_100000091984 [0,2,0,0,0,0|2,0,0]=4 5966 B16R1.11441 Cc1ccc(c(c1)O)C(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000212137 [0,2,0,0,0,0|2,0,0]=4 5967 B16R1.11441 Cc1ccc(c(c1)O)C(=O)N[C@H](C)C(=O)N 527a_100000119354_100000212137 [0,2,0,0,0,0|2,0,0]=4 5968 B16R1.11443 CC(=O)C(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011261029 [0,2,0,0,0,0|1,0,1]=4 5969 B16R1.11443 CC(=O)C(=O)CC(=O)c1cc(ccc1O)C 1458a_100000229998_100011261029 [0,2,0,0,0,0|1,0,1]=4 5970 B16R1.11443 CC(=O)C(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011261029 [0,2,0,0,0,0|1,0,1]=4 5971 B16R1.11443 CC(=O)C(=O)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100011261029 [0,2,0,0,0,0|1,0,1]=4 5972 B16R1.11443 CC(=O)C(=O)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100011261029 [0,2,0,0,0,0|1,0,1]=4 5973 B16R1.11443 CC(=O)C(=O)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100011261029 [0,2,0,0,0,0|1,0,1]=4 5974 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)Br)C(=O)N 240690a_100000119354_100000212140 [0,2,0,0,0,0|2,0,0]=4 5975 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)Br)C(=O)N 527a_100000119354_100000212140 [0,2,0,0,0,0|2,0,0]=4 5976 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)Cl)C(=O)N 11a_100000119354_100000212143 [0,2,0,0,0,0|2,0,0]=4 5977 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)Cl)C(=O)N 240690a_100000119354_100000212143 [0,2,0,0,0,0|2,0,0]=4 5978 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)Cl)C(=O)N 527a_100000119354_100000212143 [0,2,0,0,0,0|2,0,0]=4 5979 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)F)C(=O)N 240690a_100000119354_100000742286 [0,2,0,0,0,0|2,0,0]=4 5980 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)F)C(=O)N 527a_100000119354_100000742286 [0,2,0,0,0,0|2,0,0]=4 5981 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)I)C(=O)N 240690a_100000119354_100000212111 [0,2,0,0,0,0|2,0,0]=4 5982 B16R1.11443 C[C@@H](NC(=O)c1cc(ccc1O)I)C(=O)N 527a_100000119354_100000212111 [0,2,0,0,0,0|2,0,0]=4 5983 B16R1.11443 Cc1ccc(c(c1)C(=O)N[C@H](C)C(=O)N)O 240690a_100000119354_100000229998 [0,2,0,0,0,0|2,0,0]=4 5984 B16R1.11443 Cc1ccc(c(c1)C(=O)N[C@H](C)C(=O)N)O 527a_100000119354_100000229998 [0,2,0,0,0,0|2,0,0]=4 5985 B16R1.16904 CNC(=O)C(=O)CC(=O)c1ccccc1O 1458a_100011218921_100000188908 [0,2,0,0,0,0|1,0,1]=4 5986 B16R1.16904 CNC(=O)[C@@H](C)NC(=O)c1ccccc1O 240690a_100000684985_100015234032 [0,2,0,0,0,0|2,0,0]=4 5987 B16R1.16904 COC(=O)C(=O)CC(=O)c1ccccc1O 271570a_203496583355_100000743152 [0,2,0,0,0,0|0,0,1]=3 5988 B16R1.16904 COC(=O)C(C)CN(C)c1ccccc1O 269982a_100000033821_100000698445 [0,2,0,0,0,0|2,0,0]=4 5989 B16R1.16904 COC(=O)[C@@H](C)NC(=O)c1ccccc1Br 188690a_100000687819_100000188424 [0,2,0,0,0,0|2,0,0]=4 5990 B16R1.16904 COC(=O)[C@@H](C)NC(=O)c1ccccc1C 188690a_100000687819_100000212026 [0,2,0,0,0,0|2,0,0]=4 5991 B16R1.16904 COC(=O)[C@@H](C)NC(=O)c1ccccc1Cl 188690a_100000687819_100000185844 [0,2,0,0,0,0|2,0,0]=4 5992 B16R1.16904 COC(=O)[C@@H](C)NC(=O)c1ccccc1I 188690a_100000687819_100000187884 [0,2,0,0,0,0|2,0,0]=4 5993 B16R1.16904 COC(=O)[C@@H](C)NC(=O)c1ccccc1O 188690a_100000687819_100015234032 [0,2,0,0,0,0|1,0,0]=3 5994 B16R1.16904 COC(=O)[C@@H](C)NC(=O)c1ccccc1[O-] 188690a_100000687819_100009911694 [0,2,0,0,0,0|1,0,1]=4 5995 B16R1.40086 CC(C)(NC(=O)c1ccccc1O)C(=O)N 240690a_100000743658_100015234032 [0,2,0,0,0,0|2,0,0]=4 5996 B16R1.54270 CC(=O)C(=O)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100011261029 [0,2,0,0,0,0|1,0,1]=4 5997 B16R1.54270 CC(=O)C(=O)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011261029 [0,2,0,0,0,0|1,0,1]=4 5998 B16R1.54270 CC(=O)C(=O)CC(=O)c1c(cccc1F)O 1458a_100000763259_100011261029 [0,2,0,0,0,0|1,0,1]=4 5999 B16R1.54270 CC(=O)C(=O)CC(=O)c1c(cccc1O)C 1458a_100011934116_100011261029 [0,2,0,0,0,0|1,0,1]=4 6000 B16R1.54270 CC(=O)C(=O)CC(=O)c1c(cccc1O)O 1458a_100000755285_100011261029 [0,2,0,0,0,0|1,0,1]=4 6001 B16R1.54270 C[C@@H](NC(=O)c1c(cccc1Br)O)C(=O)N 240690a_100000119354_100011935254 [0,2,0,0,0,0|2,0,0]=4 6002 B16R1.54270 C[C@@H](NC(=O)c1c(cccc1Br)O)C(=O)N 527a_100000119354_100011935254 [0,2,0,0,0,0|2,0,0]=4 6003 B16R1.54270 C[C@@H](NC(=O)c1c(cccc1Cl)O)C(=O)N 240690a_100000119354_100000745519 [0,2,0,0,0,0|2,0,0]=4 6004 B16R1.54270 C[C@@H](NC(=O)c1c(cccc1Cl)O)C(=O)N 527a_100000119354_100000745519 [0,2,0,0,0,0|2,0,0]=4 6005 B16R1.54270 C[C@@H](NC(=O)c1c(cccc1F)O)C(=O)N 527a_100000119354_100000763259 [0,2,0,0,0,0|2,0,0]=4 6006 B16R1.54270 C[C@@H](NC(=O)c1c(cccc1O)O)C(=O)N 527a_100000119354_100000755285 [0,2,0,0,0,0|2,0,0]=4 6007 B16R1.5624 C#CCC(=O)CCC(=O)c1ccccc1F 1458a_100011220946_100000086012 [0,2,0,0,0,0|2,0,0]=4 6008 B16R1.5624 C#CCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000184674 [0,2,0,0,0,0|2,0,0]=4 6009 B16R1.5624 C=CCC(=O)CCC(=O)c1ccccc1F 1458a_100000210193_100000086012 [0,2,0,0,0,0|2,0,0]=4 6010 B16R1.5624 C=CCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000210623 [0,2,0,0,0,0|2,0,0]=4 6011 B16R1.5624 CC#CC(=O)CCC(=O)c1ccccc1F 1458a_100000763181_100000086012 [0,2,0,0,0,0|2,0,0]=4 6012 B16R1.5624 CC=CC(=O)CCC(=O)c1ccccc1F 1458a_100000210699_100000086012 [0,2,0,0,0,0|2,0,0]=4 6013 B16R1.5624 CCCC(=O)CCC(=O)c1ccccc1F 1458a_100000211992_100000086012 [0,2,0,0,0,0|2,0,0]=4 6014 B16R1.5624 CCCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000210303 [0,2,0,0,0,0|2,0,0]=4 6015 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1O 1458a_100015234032_100000034017 [0,2,0,0,0,0|2,0,0]=4 6016 B16R1.5624 CCNC(=O)CNC(=O)c1ccccc1O 240690a_100015525214_100011193979 [0,2,0,0,0,0|2,0,0]=4 6017 B16R1.5624 CCNC(=O)CNC(=O)c1ccccc1O 240690a_100016988866_100015234032 [0,2,0,0,0,0|2,0,0]=4 6018 B16R1.5624 CCNC(=O)CNC(=O)c1ccccc1O 527a_100015525214_100011193979 [0,2,0,0,0,0|2,0,0]=4 6019 B16R1.5624 CCOC(=O)CCN(C)c1ccccc1O 269982a_100000033821_100011206558 [0,2,0,0,0,0|2,0,0]=4 6020 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1Br 188690a_100000741813_100000188424 [0,2,0,0,0,0|2,0,0]=4 6021 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1C 188690a_100000741813_100000212026 [0,2,0,0,0,0|2,0,0]=4 6022 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1Cl 188690a_100000741813_100000185844 [0,2,0,0,0,0|2,0,0]=4 6023 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1I 188690a_100000741813_100000187884 [0,2,0,0,0,0|2,0,0]=4 6024 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1O 188690a_100000741813_100015234032 [0,2,0,0,0,0|1,0,0]=3 6025 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1[O-] 188690a_100000741813_100009911694 [0,2,0,0,0,0|1,0,1]=4 6026 B16R1.5624 CN(CCO)CCC(=O)c1ccccc1O 269982a_100000210263_100009873196 [0,2,0,0,0,0|2,0,0]=4 6027 B16R1.5624 CNNC(=O)CNC(=O)c1ccccc1O 22a_100016993582_100011193979 [0,2,0,0,0,0|2,0,0]=4 6028 B16R1.5624 COCC(=O)CCC(=O)c1ccccc1F 1458a_100000210968_100000086012 [0,2,0,0,0,0|1,0,0]=3 6029 B16R1.5624 COCC(=O)NNC(=O)c1ccccc1O 22a_100000216845_100015234032 [0,2,0,0,0,0|2,0,0]=4 6030 B16R1.5624 CSCC(=O)CCC(=O)c1ccccc1F 1458a_100000184570_100000086012 [0,2,0,0,0,0|1,1,0]=4 6031 B16R1.5624 Cc1ccccc1C(=O)NCC(=O)CCO 1458a_100000184812_100000211926 [0,2,0,0,0,0|2,0,0]=4 6032 B16R1.5624 N#CCC(=O)CCC(=O)c1ccccc1F 1458a_100051588842_100000086012 [0,2,0,0,0,0|2,0,0]=4 6033 B16R1.5624 N#CCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100011214920 [0,2,0,0,0,0|2,0,0]=4 6034 B16R1.5624 O=C(C=CBr)CCC(=O)c1ccccc1F 1458a_100016273825_100000086012 [0,2,0,0,0,0|2,0,0]=4 6035 B16R1.5624 O=C(C=CCl)CCC(=O)c1ccccc1F 1458a_200016279998_100000086012 [0,2,0,0,0,0|2,0,0]=4 6036 B16R1.5624 O=C(C=CI)CCC(=O)c1ccccc1F 1458a_100016256311_100000086012 [0,2,0,0,0,0|2,0,0]=4 6037 B16R1.5624 O=C(CCF)CNC(=O)c1ccccc1O 1458a_100011193979_100011217306 [0,2,0,0,0,0|2,0,0]=4 6038 B16R1.5624 O=C(CCO)CCC(=O)c1ccccc1F 1458a_100011216618_100000086012 [0,2,0,0,0,0|1,0,0]=3 6039 B16R1.5624 O=C(CCO)CNC(=O)c1ccccc1Cl 1458a_100000182550_100000211926 [0,2,0,0,0,0|2,0,0]=4 6040 B16R1.5624 O=C(CCO)CNC(=O)c1ccccc1F 1458a_100000182453_100000211926 [0,2,0,0,0,0|2,0,0]=4 6041 B16R1.5624 O=C(CCO)CNC(=O)c1ccccc1I 1458a_100000194700_100000211926 [0,2,0,0,0,0|2,0,0]=4 6042 B16R1.5624 O=C(CCO)CNC(=O)c1ccccc1O 1458a_100011193979_100000211926 [0,2,0,0,0,0|1,0,0]=3 6043 B16R1.7441 CCC(=O)CNC(=O)c1cc(ccc1O)O 1458a_100011219787_100000210202 [0,2,0,0,0,0|2,0,0]=4 6044 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)Br 240690a_100000693194_100000212140 [0,2,0,0,0,0|2,0,0]=4 6045 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)Br 527a_100000693194_100000212140 [0,2,0,0,0,0|2,0,0]=4 6046 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)C 240690a_100000693194_100000229998 [0,2,0,0,0,0|2,0,0]=4 6047 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)C 527a_100000693194_100000229998 [0,2,0,0,0,0|2,0,0]=4 6048 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)Cl 11a_100000693194_100000212143 [0,2,0,0,0,0|2,0,0]=4 6049 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)Cl 240690a_100000693194_100000212143 [0,2,0,0,0,0|2,0,0]=4 6050 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)Cl 527a_100000693194_100000212143 [0,2,0,0,0,0|2,0,0]=4 6051 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)F 240690a_100000693194_100000742286 [0,2,0,0,0,0|2,0,0]=4 6052 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)F 527a_100000693194_100000742286 [0,2,0,0,0,0|2,0,0]=4 6053 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)I 240690a_100000693194_100000212111 [0,2,0,0,0,0|2,0,0]=4 6054 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)I 527a_100000693194_100000212111 [0,2,0,0,0,0|2,0,0]=4 6055 B16R1.7441 CNC(=O)CNC(=O)c1cc(ccc1O)O 240690a_100102657272_100011219787 [0,2,0,0,0,0|2,0,0]=4 6056 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Br)Br 188690a_100000185156_100000690610 [0,2,0,0,0,0|2,0,0]=4 6057 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Br)C 188690a_100000185156_100000689033 [0,2,0,0,0,0|2,0,0]=4 6058 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Br)Cl 188690a_100000185156_100000736951 [0,2,0,0,0,0|2,0,0]=4 6059 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Br)F 188690a_100000185156_100000212315 [0,2,0,0,0,0|2,0,0]=4 6060 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Br)I 188690a_100000185156_100000698340 [0,2,0,0,0,0|2,0,0]=4 6061 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Br)O 188690a_100000185156_100012352043 [0,2,0,0,0,0|2,0,0]=4 6062 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1C)Br 188690a_100000185156_100000759961 [0,2,0,0,0,0|2,0,0]=4 6063 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1C)C 188690a_100000185156_100000195421 [0,2,0,0,0,0|2,0,0]=4 6064 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1C)Cl 188690a_100000185156_100000692595 [0,2,0,0,0,0|2,0,0]=4 6065 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1C)F 188690a_100000185156_100000240043 [0,2,0,0,0,0|2,0,0]=4 6066 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1C)I 188690a_100000185156_100000688012 [0,2,0,0,0,0|2,0,0]=4 6067 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1C)O 188690a_100000185156_100000687834 [0,2,0,0,0,0|2,0,0]=4 6068 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Cl)Br 188690a_100000185156_100000211212 [0,2,0,0,0,0|2,0,0]=4 6069 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Cl)C 188690a_100000185156_100011290873 [0,2,0,0,0,0|2,0,0]=4 6070 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Cl)Cl 188690a_100000185156_100000210642 [0,2,0,0,0,0|2,0,0]=4 6071 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Cl)F 188690a_100000185156_100011219680 [0,2,0,0,0,0|2,0,0]=4 6072 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Cl)I 188690a_100000185156_100000688013 [0,2,0,0,0,0|2,0,0]=4 6073 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1Cl)O 188690a_100000185156_100000719527 [0,2,0,0,0,0|2,0,0]=4 6074 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1F)C 188690a_100000185156_100000749327 [0,2,0,0,0,0|2,0,0]=4 6075 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1F)Cl 188690a_100000185156_100000214954 [0,2,0,0,0,0|2,0,0]=4 6076 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1F)F 188690a_100000185156_100000198512 [0,2,0,0,0,0|2,0,0]=4 6077 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1F)I 188690a_100000185156_100000688014 [0,2,0,0,0,0|2,0,0]=4 6078 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1I)Br 188690a_100000185156_100000183945 [0,2,0,0,0,0|2,0,0]=4 6079 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1I)C 188690a_100000185156_100000057929 [0,2,0,0,0,0|2,0,0]=4 6080 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1I)Cl 188690a_100000185156_100000739379 [0,2,0,0,0,0|2,0,0]=4 6081 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1I)F 188690a_100000185156_100000748905 [0,2,0,0,0,0|2,0,0]=4 6082 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1I)I 188690a_100000185156_100000750460 [0,2,0,0,0,0|2,0,0]=4 6083 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1I)O 188690a_100000185156_200009995701 [0,2,0,0,0,0|2,0,0]=4 6084 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1O)Br 188690a_100000185156_100000212140 [0,2,0,0,0,0|1,0,0]=3 6085 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1O)C 188690a_100000185156_100000229998 [0,2,0,0,0,0|1,0,0]=3 6086 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1O)Cl 188690a_100000185156_100000212143 [0,2,0,0,0,0|1,0,0]=3 6087 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1O)F 188690a_100000185156_100000742286 [0,2,0,0,0,0|1,0,0]=3 6088 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1O)I 188690a_100000185156_100000212111 [0,2,0,0,0,0|1,0,0]=3 6089 B16R1.7441 COC(=O)CNC(=O)c1cc(ccc1O)O 188690a_100000185156_100000758025 [0,2,0,0,0,0|1,0,0]=3 6090 B16R1.7441 O=C(CF)CNC(=O)c1cc(ccc1O)O 1458a_100011219787_100015361967 [0,2,0,0,0,0|2,0,0]=4 6091 B16R1.7441 O=C(CO)CCS(=O)c1cc(ccc1Cl)Cl 1458a_100000210174_100000047736 [0,2,0,0,0,0|2,0,0]=4 6092 B16R1.10467 CCS(=O)(=O)CCC(=O)c1ccccc1O 1458a_100015234032_100000756660 [0,2,0,0,0,0|1,0,1]=4 6093 B16R1.14189 COC(CCC(=O)c1ccccc1O)OC 1458a_100015234032_100000139399 [0,2,0,0,0,0|0,0,2]=4 6094 B16R1.18293 CCN(CCC(=O)OC)c1ccccc1O 269982a_103624766699_100000204255 [0,2,0,0,0,0|2,0,0]=4 6095 B16R1.40160 C#CC(=O)CCC(=O)c1ccc(cc1F)Br 1458a_100000211873_100010339771 [0,2,0,0,0,0|2,0,0]=4 6096 B16R1.40160 C=CC(=O)CCC(=O)c1ccc(cc1F)Br 1458a_100000185746_100010339771 [0,2,0,0,0,0|2,0,0]=4 6097 B16R1.40160 CCC(=O)CCC(=O)c1ccc(cc1F)Br 1458a_100000210414_100010339771 [0,2,0,0,0,0|2,0,0]=4 6098 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)Br 240690a_100000693194_100000744433 [0,2,0,0,0,0|2,0,0]=4 6099 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)Br 527a_100000693194_100000744433 [0,2,0,0,0,0|2,0,0]=4 6100 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)C 240690a_100000693194_100000212137 [0,2,0,0,0,0|2,0,0]=4 6101 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)C 527a_100000693194_100000212137 [0,2,0,0,0,0|2,0,0]=4 6102 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)Cl 11a_100000693194_100000188622 [0,2,0,0,0,0|2,0,0]=4 6103 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)Cl 240690a_100000693194_100000188622 [0,2,0,0,0,0|2,0,0]=4 6104 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)Cl 527a_100000693194_100000188622 [0,2,0,0,0,0|2,0,0]=4 6105 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)F 240690a_100000693194_100000746061 [0,2,0,0,0,0|2,0,0]=4 6106 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)F 527a_100000693194_100000746061 [0,2,0,0,0,0|2,0,0]=4 6107 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)I 240690a_100000693194_100000091984 [0,2,0,0,0,0|2,0,0]=4 6108 B16R1.40160 CNC(=O)CNC(=O)c1ccc(cc1O)I 527a_100000693194_100000091984 [0,2,0,0,0,0|2,0,0]=4 6109 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Br)Br 188690a_100000185156_100000762965 [0,2,0,0,0,0|2,0,0]=4 6110 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Br)C 188690a_100000185156_100000685072 [0,2,0,0,0,0|2,0,0]=4 6111 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Br)Cl 188690a_100000185156_100000766353 [0,2,0,0,0,0|2,0,0]=4 6112 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Br)F 188690a_100000185156_100000212304 [0,2,0,0,0,0|2,0,0]=4 6113 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Br)I 188690a_100000185156_100012360512 [0,2,0,0,0,0|2,0,0]=4 6114 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Br)O 188690a_100000185156_100012344906 [0,2,0,0,0,0|2,0,0]=4 6115 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1C)Br 188690a_100000185156_100000741311 [0,2,0,0,0,0|2,0,0]=4 6116 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1C)C 188690a_100000185156_100000211164 [0,2,0,0,0,0|2,0,0]=4 6117 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1C)Cl 188690a_100000185156_100000688705 [0,2,0,0,0,0|2,0,0]=4 6118 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1C)F 188690a_100000185156_100000686989 [0,2,0,0,0,0|2,0,0]=4 6119 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1C)I 188690a_100000185156_100010189873 [0,2,0,0,0,0|2,0,0]=4 6120 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1C)O 188690a_100000185156_100000692822 [0,2,0,0,0,0|2,0,0]=4 6121 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Cl)Br 188690a_100000185156_100000741628 [0,2,0,0,0,0|2,0,0]=4 6122 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Cl)C 188690a_100000185156_100000766932 [0,2,0,0,0,0|2,0,0]=4 6123 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Cl)Cl 188690a_100000185156_100000185840 [0,2,0,0,0,0|2,0,0]=4 6124 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Cl)I 188690a_100000185156_100000751301 [0,2,0,0,0,0|2,0,0]=4 6125 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1Cl)O 188690a_100000185156_100000702456 [0,2,0,0,0,0|2,0,0]=4 6126 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1F)Cl 188690a_100000185156_100000212326 [0,2,0,0,0,0|2,0,0]=4 6127 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1F)I 188690a_100000185156_100000037189 [0,2,0,0,0,0|2,0,0]=4 6128 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1I)Br 188690a_100000185156_100000751167 [0,2,0,0,0,0|2,0,0]=4 6129 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1I)C 188690a_100000185156_100009999607 [0,2,0,0,0,0|2,0,0]=4 6130 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1I)Cl 188690a_100000185156_100000739380 [0,2,0,0,0,0|2,0,0]=4 6131 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1I)F 188690a_100000185156_100000739341 [0,2,0,0,0,0|2,0,0]=4 6132 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1O)Br 188690a_100000185156_100000744433 [0,2,0,0,0,0|1,0,0]=3 6133 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1O)C 188690a_100000185156_100000212137 [0,2,0,0,0,0|1,0,0]=3 6134 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1O)Cl 188690a_100000185156_100000188622 [0,2,0,0,0,0|1,0,0]=3 6135 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1O)I 188690a_100000185156_100000091984 [0,2,0,0,0,0|1,0,0]=3 6136 B16R1.40160 COC(=O)CNC(=O)c1ccc(cc1O)O 188690a_100000185156_100000212172 [0,2,0,0,0,0|1,0,0]=3 6137 B16R1.40160 O=C(CO)CCC(=O)c1ccc(cc1F)Br 1458a_100000210174_100010339771 [0,2,0,0,0,0|1,0,0]=3 6138 B16R1.40160 O=C(CO)COC(=O)c1ccc(cc1Cl)Cl 1458a_100000210174_100010978946 [0,2,0,0,0,0|2,0,0]=4 6139 B16R1.131047 CNC(=O)CNC(=O)c1c(cccc1Br)O 240690a_100000693194_100011935254 [0,2,0,0,0,0|2,0,0]=4 6140 B16R1.131047 CNC(=O)CNC(=O)c1c(cccc1Br)O 527a_100000693194_100011935254 [0,2,0,0,0,0|2,0,0]=4 6141 B16R1.131047 CNC(=O)CNC(=O)c1c(cccc1Cl)O 240690a_100000693194_100000745519 [0,2,0,0,0,0|2,0,0]=4 6142 B16R1.131047 CNC(=O)CNC(=O)c1c(cccc1Cl)O 527a_100000693194_100000745519 [0,2,0,0,0,0|2,0,0]=4 6143 B16R1.131047 CNC(=O)CNC(=O)c1c(cccc1F)O 527a_100000693194_100000763259 [0,2,0,0,0,0|2,0,0]=4 6144 B16R1.131047 CNC(=O)CNC(=O)c1c(cccc1O)O 527a_100000693194_100000755285 [0,2,0,0,0,0|2,0,0]=4 6145 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Br)Br 188690a_100000185156_100000690891 [0,2,0,0,0,0|2,0,0]=4 6146 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Br)C 188690a_100000185156_100000701904 [0,2,0,0,0,0|2,0,0]=4 6147 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Br)Cl 188690a_100000185156_100011253703 [0,2,0,0,0,0|2,0,0]=4 6148 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Br)F 188690a_100000185156_100000752694 [0,2,0,0,0,0|2,0,0]=4 6149 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Br)O 188690a_100000185156_100011935254 [0,2,0,0,0,0|1,0,0]=3 6150 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1C)C 188690a_100000185156_100000758298 [0,2,0,0,0,0|2,0,0]=4 6151 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Cl)C 188690a_100000185156_100000692601 [0,2,0,0,0,0|2,0,0]=4 6152 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Cl)Cl 188690a_100000185156_100000210656 [0,2,0,0,0,0|2,0,0]=4 6153 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Cl)F 188690a_100000185156_100000210369 [0,2,0,0,0,0|2,0,0]=4 6154 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1Cl)O 188690a_100000185156_100000745519 [0,2,0,0,0,0|1,0,0]=3 6155 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1F)C 188690a_100000185156_100000762013 [0,2,0,0,0,0|2,0,0]=4 6156 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1F)F 188690a_100000185156_100000210804 [0,2,0,0,0,0|2,0,0]=4 6157 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1F)O 188690a_100000185156_100000763259 [0,2,0,0,0,0|1,0,0]=3 6158 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1I)Br 188690a_100000185156_100010232521 [0,2,0,0,0,0|2,0,0]=4 6159 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1I)C 188690a_100000185156_100000688020 [0,2,0,0,0,0|2,0,0]=4 6160 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1I)Cl 188690a_100000185156_100000702859 [0,2,0,0,0,0|2,0,0]=4 6161 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1I)F 188690a_100000185156_100000023732 [0,2,0,0,0,0|2,0,0]=4 6162 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1O)C 188690a_100000185156_100011934116 [0,2,0,0,0,0|1,0,0]=3 6163 B16R1.131047 COC(=O)CNC(=O)c1c(cccc1O)O 188690a_100000185156_100000755285 [0,2,0,0,0,0|1,0,0]=3 6164 B16R1.5638 C=C(C)CCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000730704 [0,2,0,0,0,0|2,0,0]=4 6165 B16R1.5638 COc1ccc(c(c1)O)C(=O)CCC(C)O 1458a_100000212123_100012276601 [0,2,0,0,0,0|1,0,1]=4 6166 B16R1.5638 COc1ccc(c(c1)O)C(=O)NCC(=O)N 11a_100000711301_100000212123 [0,2,0,0,0,0|2,0,0]=4 6167 B16R1.5638 COc1ccc(c(c1)O)C(=O)NCC(=O)N 240690a_100000711301_100000212123 [0,2,0,0,0,0|2,0,0]=4 6168 B16R1.5638 COc1ccc(c(c1)O)C(=O)NCC(=O)N 527a_100000711301_100000212123 [0,2,0,0,0,0|2,0,0]=4 6169 B16R1.7463 CS(=O)(=O)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000731031 [0,2,0,0,0,0|1,0,1]=4 6170 B16R1.7463 CS(=O)(=O)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000731031 [0,2,0,0,0,0|1,0,1]=4 6171 B16R1.7463 CS(=O)(=O)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000731031 [0,2,0,0,0,0|1,0,1]=4 6172 B16R1.7463 CS(=O)(=O)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000731031 [0,2,0,0,0,0|1,0,1]=4 6173 B16R1.7463 CS(=O)(=O)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000731031 [0,2,0,0,0,0|1,0,1]=4 6174 B16R1.7463 Cc1ccc(c(c1)O)C(=O)CCS(=O)(=O)C 1458a_100000212137_100000731031 [0,2,0,0,0,0|1,0,1]=4 6175 B16R1.7463 Cc1ccc(c(c1)O)C(=O)CCS(=O)(=O)[O-] 1458a_100000212137_100000762736 [0,2,0,0,0,0|1,0,1]=4 6176 B16R1.7463 O=C(CCS(=O)(=O)[O-])c1ccc(cc1O)Br 1458a_100000744433_100000762736 [0,2,0,0,0,0|1,0,1]=4 6177 B16R1.7463 O=C(CCS(=O)(=O)[O-])c1ccc(cc1O)Cl 1458a_100000188622_100000762736 [0,2,0,0,0,0|1,0,1]=4 6178 B16R1.7463 O=C(CCS(=O)(=O)[O-])c1ccc(cc1O)F 1458a_100000746061_100000762736 [0,2,0,0,0,0|1,0,1]=4 6179 B16R1.7463 O=C(CCS(=O)(=O)[O-])c1ccc(cc1O)I 1458a_100000091984_100000762736 [0,2,0,0,0,0|1,0,1]=4 6180 B16R1.7463 O=C(CCS(=O)(=O)[O-])c1ccc(cc1O)O 1458a_100000212172_100000762736 [0,2,0,0,0,0|1,0,1]=4 6181 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000730704 [0,2,0,0,0,0|2,0,0]=4 6182 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000730704 [0,2,0,0,0,0|2,0,0]=4 6183 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000730704 [0,2,0,0,0,0|2,0,0]=4 6184 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000730704 [0,2,0,0,0,0|2,0,0]=4 6185 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000730704 [0,2,0,0,0,0|2,0,0]=4 6186 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000730704 [0,2,0,0,0,0|2,0,0]=4 6187 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000730704 [0,2,0,0,0,0|2,0,0]=4 6188 B16R1.11345 C=C(C)CCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000730704 [0,2,0,0,0,0|2,0,0]=4 6189 B16R1.11345 CC(O)CCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100012276601 [0,2,0,0,0,0|1,0,1]=4 6190 B16R1.11345 CC(O)CCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100012276601 [0,2,0,0,0,0|1,0,1]=4 6191 B16R1.11345 CC(O)CCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100012276601 [0,2,0,0,0,0|1,0,1]=4 6192 B16R1.11345 CC(O)CCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100012276601 [0,2,0,0,0,0|1,0,1]=4 6193 B16R1.11345 CC(O)CCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100012276601 [0,2,0,0,0,0|1,0,1]=4 6194 B16R1.11345 CC(O)CCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100012276601 [0,2,0,0,0,0|1,0,1]=4 6195 B16R1.11345 Cc1cc(c(cc1Br)C(=O)CCC(C)O)O 1458a_100010233826_100012276601 [0,2,0,0,0,0|1,0,1]=4 6196 B16R1.11345 Cc1cc(c(cc1Br)C(=O)NCC(=O)N)O 240690a_100000711301_100010233826 [0,2,0,0,0,0|2,0,0]=4 6197 B16R1.11345 Cc1cc(c(cc1Br)C(=O)NCC(=O)N)O 527a_100000711301_100010233826 [0,2,0,0,0,0|2,0,0]=4 6198 B16R1.11345 Cc1cc(c(cc1C)C(=O)CCC(C)O)O 1458a_100009831561_100012276601 [0,2,0,0,0,0|1,0,1]=4 6199 B16R1.11345 Cc1cc(c(cc1C)C(=O)NCC(=O)N)O 240690a_100000711301_100009831561 [0,2,0,0,0,0|2,0,0]=4 6200 B16R1.11345 Cc1cc(c(cc1C)C(=O)NCC(=O)N)O 527a_100000711301_100009831561 [0,2,0,0,0,0|2,0,0]=4 6201 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)Br)F 240690a_100000711301_100010827371 [0,2,0,0,0,0|2,0,0]=4 6202 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)Br)F 527a_100000711301_100010827371 [0,2,0,0,0,0|2,0,0]=4 6203 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100000711301_200009814723 [0,2,0,0,0,0|2,0,0]=4 6204 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)Cl)Br 527a_100000711301_200009814723 [0,2,0,0,0,0|2,0,0]=4 6205 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)F)Br 240690a_100000711301_100010188153 [0,2,0,0,0,0|2,0,0]=4 6206 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)F)Br 527a_100000711301_100010188153 [0,2,0,0,0,0|2,0,0]=4 6207 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)F)Cl 240690a_100000711301_100009910333 [0,2,0,0,0,0|2,0,0]=4 6208 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)F)Cl 527a_100000711301_100009910333 [0,2,0,0,0,0|2,0,0]=4 6209 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)F)F 240690a_100000711301_100012182723 [0,2,0,0,0,0|2,0,0]=4 6210 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)F)F 527a_100000711301_100012182723 [0,2,0,0,0,0|2,0,0]=4 6211 B16R1.11345 NC(=O)CNC(=O)c1cc(c(cc1O)O)Br 527a_100000711301_100009813906 [0,2,0,0,0,0|2,0,0]=4 6212 B16R1.44633 C=C(C)CCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000730704 [0,2,0,0,0,0|2,0,0]=4 6213 B16R1.44633 C=C(C)CCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000730704 [0,2,0,0,0,0|2,0,0]=4 6214 B16R1.44633 C=C(C)CCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000730704 [0,2,0,0,0,0|2,0,0]=4 6215 B16R1.44633 C=C(C)CCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000730704 [0,2,0,0,0,0|2,0,0]=4 6216 B16R1.44633 C=C(C)CCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000730704 [0,2,0,0,0,0|2,0,0]=4 6217 B16R1.44633 CC(O)CCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100012276601 [0,2,0,0,0,0|1,0,1]=4 6218 B16R1.44633 CC(O)CCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100012276601 [0,2,0,0,0,0|1,0,1]=4 6219 B16R1.44633 Cc1cc(c(c(c1)O)C(=O)CCC(C)O)C 1458a_100011255216_100012276601 [0,2,0,0,0,0|1,0,1]=4 6220 B16R1.44633 Cc1cc(c(c(c1)O)C(=O)CCC(C)O)O 1458a_100000036929_100012276601 [0,2,0,0,0,0|1,0,1]=4 6221 B16R1.44633 Cc1cc(c(c(c1)O)C(=O)NCC(=O)N)O 527a_100000711301_100000036929 [0,2,0,0,0,0|2,0,0]=4 6222 B16R1.44633 Cc1cc(cc(c1C(=O)CCC(C)O)O)O 1458a_200000061528_100012276601 [0,2,0,0,0,0|1,0,1]=4 6223 B16R1.44633 NC(=O)CNC(=O)c1c(cc(cc1F)Br)O 527a_100000711301_200015963038 [0,2,0,0,0,0|2,0,0]=4 6224 B16R1.44633 NC(=O)CNC(=O)c1c(cc(cc1F)F)O 240690a_100000711301_100000746385 [0,2,0,0,0,0|2,0,0]=4 6225 B16R1.44633 NC(=O)CNC(=O)c1c(cc(cc1F)F)O 527a_100000711301_100000746385 [0,2,0,0,0,0|2,0,0]=4 6226 B16R1.44633 NC(=O)CNC(=O)c1c(cc(cc1O)O)O 527a_100000711301_100000040092 [0,2,0,0,0,0|2,0,0]=4 6227 B16R1.7493 CS(=O)(=O)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000731031 [0,2,0,0,0,0|1,0,1]=4 6228 B16R1.7493 CS(=O)(=O)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000731031 [0,2,0,0,0,0|1,0,1]=4 6229 B16R1.7493 CS(=O)(=O)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000731031 [0,2,0,0,0,0|1,0,1]=4 6230 B16R1.7493 CS(=O)(=O)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000731031 [0,2,0,0,0,0|1,0,1]=4 6231 B16R1.7493 CS(=O)(=O)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000731031 [0,2,0,0,0,0|1,0,1]=4 6232 B16R1.7493 Cc1ccc(c(c1)C(=O)CCS(=O)(=O)C)O 1458a_100000229998_100000731031 [0,2,0,0,0,0|1,0,1]=4 6233 B16R1.7493 Cc1ccc(c(c1)C(=O)CCS(=O)(=O)[O-])O 1458a_100000229998_100000762736 [0,2,0,0,0,0|1,0,1]=4 6234 B16R1.7493 O=C(CCS(=O)(=O)[O-])c1cc(ccc1O)Br 1458a_100000212140_100000762736 [0,2,0,0,0,0|1,0,1]=4 6235 B16R1.7493 O=C(CCS(=O)(=O)[O-])c1cc(ccc1O)Cl 1458a_100000212143_100000762736 [0,2,0,0,0,0|1,0,1]=4 6236 B16R1.7493 O=C(CCS(=O)(=O)[O-])c1cc(ccc1O)F 1458a_100000742286_100000762736 [0,2,0,0,0,0|1,0,1]=4 6237 B16R1.7493 O=C(CCS(=O)(=O)[O-])c1cc(ccc1O)I 1458a_100000212111_100000762736 [0,2,0,0,0,0|1,0,1]=4 6238 B16R1.7493 O=C(CCS(=O)(=O)[O-])c1cc(ccc1O)O 1458a_100000758025_100000762736 [0,2,0,0,0,0|1,0,1]=4 6239 B16R1.44937 CS(=O)(=O)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000731031 [0,2,0,0,0,0|1,0,1]=4 6240 B16R1.44937 CS(=O)(=O)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000731031 [0,2,0,0,0,0|1,0,1]=4 6241 B16R1.44937 CS(=O)(=O)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000731031 [0,2,0,0,0,0|1,0,1]=4 6242 B16R1.44937 CS(=O)(=O)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000731031 [0,2,0,0,0,0|1,0,1]=4 6243 B16R1.44937 Cc1cccc(c1C(=O)CCS(=O)(=O)C)O 1458a_100011934116_100000731031 [0,2,0,0,0,0|1,0,1]=4 6244 B16R1.44937 Cc1cccc(c1C(=O)CCS(=O)(=O)[O-])O 1458a_100011934116_100000762736 [0,2,0,0,0,0|1,0,1]=4 6245 B16R1.44937 O=C(CCS(=O)(=O)[O-])c1c(cccc1Br)O 1458a_100011935254_100000762736 [0,2,0,0,0,0|1,0,1]=4 6246 B16R1.44937 O=C(CCS(=O)(=O)[O-])c1c(cccc1Cl)O 1458a_100000745519_100000762736 [0,2,0,0,0,0|1,0,1]=4 6247 B16R1.44937 O=C(CCS(=O)(=O)[O-])c1c(cccc1F)O 1458a_100000763259_100000762736 [0,2,0,0,0,0|1,0,1]=4 6248 B16R1.44937 O=C(CCS(=O)(=O)[O-])c1c(cccc1O)O 1458a_100000755285_100000762736 [0,2,0,0,0,0|1,0,1]=4 6249 B16R1.20153 C=C(C)CCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000730704 [0,2,0,0,0,0|2,0,0]=4 6250 B16R1.20153 C=C(C)CCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000730704 [0,2,0,0,0,0|2,0,0]=4 6251 B16R1.20153 C=C(C)CCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000730704 [0,2,0,0,0,0|2,0,0]=4 6252 B16R1.20153 C=C(C)CCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000730704 [0,2,0,0,0,0|2,0,0]=4 6253 B16R1.20153 CC(O)CCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100012276601 [0,2,0,0,0,0|1,0,1]=4 6254 B16R1.20153 CC(O)CCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100012276601 [0,2,0,0,0,0|1,0,1]=4 6255 B16R1.20153 CCc1ccc(c(c1)C(=O)CCC(C)O)O 1458a_200000748397_100012276601 [0,2,0,0,0,0|1,0,1]=4 6256 B16R1.20153 CCc1ccc(c(c1)C(=O)NCC(=O)N)O 240690a_100000711301_200000748397 [0,2,0,0,0,0|2,0,0]=4 6257 B16R1.20153 CCc1ccc(c(c1)C(=O)NCC(=O)N)O 527a_100000711301_200000748397 [0,2,0,0,0,0|2,0,0]=4 6258 B16R1.20153 COc1ccc(c(c1)C(=O)CCC(C)O)O 1458a_100000211986_100012276601 [0,2,0,0,0,0|1,0,1]=4 6259 B16R1.20153 COc1ccc(c(c1)C(=O)NCC(=O)N)O 240690a_100000711301_100000211986 [0,2,0,0,0,0|2,0,0]=4 6260 B16R1.20153 COc1ccc(c(c1)C(=O)NCC(=O)N)O 527a_100000711301_100000211986 [0,2,0,0,0,0|2,0,0]=4 6261 B16R1.20153 N#Cc1ccc(c(c1)C(=O)NCC(=O)N)O 240690a_100000711301_100000719980 [0,2,0,0,0,0|2,0,0]=4 6262 B16R1.20153 NC(=O)CNC(=O)c1cc(ccc1O)CO 240690a_100000711301_200000045694 [0,2,0,0,0,0|2,0,0]=4 6263 B14R1.4526 CC(=O)CNC(=O)C=Cc1ccco1 1458a_100015206730_200000210301 [0,0,1,1,0,0|2,0,0]=4 6264 B14R1.4526 O=C(O)CCC(=O)C=Cc1nccs1 6a_100000750902_100000210954 [0,0,1,1,0,0|1,1,0]=4 6265 B14R1.4526 [13CH3]C(=O)CNC(=O)C=Cc1ccco1 1458a_100015206730_200025704644 [0,0,1,1,0,0|2,0,0]=4 6266 B14R2.792 O=C(CCC1CO1)c2ccccc2 1458a_100000185807_100000732470 [1,0,0,1,0,0|1,0,1]=4 6267 B14R2.25733 CC(=O)C1CC(=O)c2c1cccc2 1458a_100000070787_100010208147 [1,0,0,1,0,0|1,0,0]=3 6268 B14R2.256 Cc1ccccc1C2=CC(=O)CC2 271570a_100010737933_100000210755 [1,0,0,1,0,0|2,0,0]=4 6269 B14R2.256 Nc1ccccc1C2=CC(=O)CC2 271570a_100010737933_100000210017 [1,0,0,1,0,0|2,0,0]=4 6270 B14R2.256 O=C1C=C(CC1)c2ccccc2Br 271570a_100010737933_100000695589 [1,0,0,1,0,0|2,0,0]=4 6271 B14R2.256 O=C1C=C(CC1)c2ccccc2Cl 271570a_100010737933_100000764095 [1,0,0,1,0,0|2,0,0]=4 6272 B14R2.256 O=C1C=C(CC1)c2ccccc2F 271570a_100010737933_100011215700 [1,0,0,1,0,0|2,0,0]=4 6273 B14R2.256 O=C1C=C(CC1)c2ccccc2O 271570a_100010737933_100000739446 [1,0,0,1,0,0|1,0,0]=3 6274 B14R2.256 O=C1C=C(CC1)c2ccncc2O 271570a_100010737933_100009817591 [1,0,0,1,0,0|2,0,0]=4 6275 B14R2.256 O=C1C=C(CC1)c2ncccc2O 271570a_100010737933_100000034122 [1,0,0,1,0,0|2,0,0]=4 6276 B14R2.663 O=C1CC(C1)Sc2ccccc2O 62a_100009894365_100000739446 [1,0,0,1,0,0|2,0,0]=4 6277 B14R2.768 CC(=O)Cc1cc2ccccc2o1 1458a_100000735538_200000210301 [1,0,0,1,0,0|1,0,1]=4 6278 B14R2.768 [13CH3]C(=O)Cc1cc2ccccc2o1 1458a_100000735538_200025704644 [1,0,0,1,0,0|1,0,1]=4 6279 B14R2.781 CC(=O)C1CCc2ccccc2O1 1458a_100000065239_200000210301 [1,0,0,1,0,0|1,0,1]=4 6280 B14R2.781 CC(=O)C1COc2ccccc2O1 1458a_100000182656_200000210301 [1,0,0,1,0,0|2,0,0]=4 6281 B14R2.781 [13CH3]C(=O)C1CCc2ccccc2O1 1458a_100000065239_200025704644 [1,0,0,1,0,0|1,0,1]=4 6282 B14R2.781 [13CH3]C(=O)C1COc2ccccc2O1 1458a_100000182656_200025704644 [1,0,0,1,0,0|2,0,0]=4 6283 B14R2.28454 O=C1CCCc2c(cccc2N1)O 271570a_203496583355_200000700058 [1,0,0,1,0,0|1,0,1]=4 6284 B14R2.3 O=CCSc1coc2c1cccc2 62a_200015260668_100009812202 [1,0,0,1,0,0|2,0,0]=4 6285 B14R2.3 O=CCSc1noc2c1cccc2 62a_200000703156_200015260668 [1,0,0,1,0,0|2,0,0]=4 6286 B14R2.3 O=CCSc1noc2c1cccc2 62a_200015260668_200000703156 [1,0,0,1,0,0|2,0,0]=4 6287 B14R2.24 Oc1ccccc1C2=COCCC2 271570a_100010175576_100000739446 [1,0,0,1,0,0|1,0,1]=4 6288 B14R2.4633 Cc1ccccc1C(=O)CC2CO2 1458a_100000212026_100011216344 [1,0,0,1,0,0|1,0,1]=4 6289 B14R2.4633 Cc1ccccc1C(=O)C[C@@H]2CO2 1458a_100000212026_100000745022 [1,0,0,1,0,0|1,0,1]=4 6290 B14R2.4633 O=C(CC1CC1)c2ccccc2O 1458a_100015234032_100000742324 [1,0,0,1,0,0|1,0,1]=4 6291 B14R2.4633 O=C(CC1CO1)c2ccccc2Br 1458a_100000188424_100011216344 [1,0,0,1,0,0|1,0,1]=4 6292 B14R2.4633 O=C(CC1CO1)c2ccccc2Cl 1458a_100000185844_100011216344 [1,0,0,1,0,0|1,0,1]=4 6293 B14R2.4633 O=C(CC1CO1)c2ccccc2F 1458a_100000188656_100011216344 [1,0,0,1,0,0|1,0,1]=4 6294 B14R2.4633 O=C(CC1CO1)c2ccccc2I 1458a_100000187884_100011216344 [1,0,0,1,0,0|1,0,1]=4 6295 B14R2.4633 O=C(CC1CO1)c2ccccc2O 1458a_100015234032_100011216344 [1,0,0,1,0,0|0,0,1]=3 6296 B14R2.4633 O=C(CC1CO1)c2ccccc2[O-] 1458a_100009911694_100011216344 [1,0,0,1,0,0|0,0,2]=4 6297 B14R2.4633 O=C(CC1CS1)c2ccccc2O 1458a_100015234032_100000031435 [1,0,0,1,0,0|0,1,1]=4 6298 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2Br 1458a_100000188424_100000745022 [1,0,0,1,0,0|1,0,1]=4 6299 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2Cl 1458a_100000185844_100000745022 [1,0,0,1,0,0|1,0,1]=4 6300 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2F 1458a_100000188656_100000745022 [1,0,0,1,0,0|1,0,1]=4 6301 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2I 1458a_100000187884_100000745022 [1,0,0,1,0,0|1,0,1]=4 6302 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2O 1458a_100015234032_100000745022 [1,0,0,1,0,0|0,0,1]=3 6303 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2[O-] 1458a_100009911694_100000745022 [1,0,0,1,0,0|0,0,2]=4 6304 B14R2.21545 O=C(c1ccccc1O)C2CCC2 1458a_100015234032_100000749161 [1,0,0,1,0,0|1,0,1]=4 6305 B14R2.21545 O=C(c1ccccc1O)C2COC2 1458a_100015234032_100000687716 [1,0,0,1,0,0|2,0,0]=4 6306 B14R2.2 CC(=O)Cc1coc2c1cccc2 1458a_100000217546_200000210301 [0,0,0,1,1,0|2,0,0]=4 6307 B14R2.2 CC(=O)Cc1noc2c1cccc2 1458a_100000070787_100009813815 [0,0,0,1,1,0|2,0,0]=4 6308 B14R2.2 CC(=O)Cc1noc2c1cccc2 1458a_100000205995_200000210301 [0,0,0,1,1,0|2,0,0]=4 6309 B14R2.2 [13CH3]C(=O)Cc1coc2c1cccc2 1458a_100000217546_200025704644 [0,0,0,1,1,0|2,0,0]=4 6310 B14R2.2 [13CH3]C(=O)Cc1noc2c1cccc2 1458a_100000205995_200025704644 [0,0,0,1,1,0|2,0,0]=4 6311 B14R2.450 CC(=O)C1Cc2ccccc2C1=O 1458a_100000070787_100011218503 [0,0,0,1,1,0|2,0,0]=4 6312 B14R2.28480 O=c1[nH]c2cccc(c2c(=O)o1)O 271570a_203496583355_100010201677 [0,0,0,1,1,0|2,0,0]=4 6313 B16R2.3989 CC(=O)CC1Oc2ccccc2NC1=O 1458a_100000016180_200000210301 [0,0,0,1,0,1|1,0,0]=3 6314 B16R2.3989 CC(=O)CC1Sc2ccccc2NC1=O 1458a_100000010723_200000210301 [0,0,0,1,0,1|1,1,0]=4 6315 B16R2.3989 [13CH3]C(=O)CC1Oc2ccccc2NC1=O 1458a_100000016180_200025704644 [0,0,0,1,0,1|1,0,0]=3 6316 B16R2.3989 [13CH3]C(=O)CC1Sc2ccccc2NC1=O 1458a_100000010723_200025704644 [0,0,0,1,0,1|1,1,0]=4 6317 B16R2.12426 C=C1CC(C1)C(=O)Nc2ccccc2O 22a_100000185747_100000065620 [0,0,0,1,0,1|2,0,0]=4 6318 B16R2.12426 C=C1CC(C1)C(=O)Nc2ccccc2O 527a_100000185747_100000065620 [0,0,0,1,0,1|2,0,0]=4 6319 B16R2.12426 Cc1ccccc1CC(=O)[C@@H]2CC(=O)N2 1458a_100016090685_100000211839 [0,0,0,1,0,1|2,0,0]=4 6320 B16R2.12426 Cc1ccccc1NC(=O)[C@@H]2CC(=O)N2 22a_100015192222_100016090685 [0,0,0,1,0,1|2,0,0]=4 6321 B16R2.12426 Cc1ccccc1NC(=O)[C@@H]2CC(=O)N2 527a_100015192222_100016090685 [0,0,0,1,0,1|2,0,0]=4 6322 B16R2.12426 O=C(Nc1ccccc1O)[C@H]2C[C@H](C2)O 22a_100000185747_100015266633 [0,0,0,1,0,1|1,0,1]=4 6323 B16R2.12426 O=C(Nc1ccccc1O)[C@H]2C[C@H](C2)O 527a_100000185747_100015266633 [0,0,0,1,0,1|1,0,1]=4 6324 B16R2.12426 O=C1C[C@H](N1)C(=O)Cc2ccccc2Br 1458a_100016090685_100000184730 [0,0,0,1,0,1|2,0,0]=4 6325 B16R2.12426 O=C1C[C@H](N1)C(=O)Cc2ccccc2Cl 1458a_100016090685_100000187162 [0,0,0,1,0,1|2,0,0]=4 6326 B16R2.12426 O=C1C[C@H](N1)C(=O)Cc2ccccc2F 1458a_100016090685_100000187165 [0,0,0,1,0,1|2,0,0]=4 6327 B16R2.12426 O=C1C[C@H](N1)C(=O)Cc2ccccc2I 1458a_100016090685_100011216222 [0,0,0,1,0,1|2,0,0]=4 6328 B16R2.12426 O=C1C[C@H](N1)C(=O)Cc2ncccc2O 1458a_100016090685_200020655725 [0,0,0,1,0,1|2,0,0]=4 6329 B16R2.12426 O=C1C[C@H](N1)C(=O)Nc2ccccc2Cl 22a_100000185783_100016090685 [0,0,0,1,0,1|2,0,0]=4 6330 B16R2.12426 O=C1C[C@H](N1)C(=O)Nc2ccccc2Cl 527a_100000185783_100016090685 [0,0,0,1,0,1|2,0,0]=4 6331 B16R2.12426 O=C1C[C@H](N1)C(=O)Nc2ccccc2F 22a_100000210422_100016090685 [0,0,0,1,0,1|2,0,0]=4 6332 B16R2.12426 O=C1C[C@H](N1)C(=O)Nc2ccccc2F 527a_100000210422_100016090685 [0,0,0,1,0,1|2,0,0]=4 6333 B16R2.12426 O=C1C[C@H](N1)C(=O)Nc2ccccc2O 22a_100000185747_100016090685 [0,0,0,1,0,1|1,0,0]=3 6334 B16R2.12426 O=C1C[C@H](N1)C(=O)Nc2ccccc2O 527a_100000185747_100016090685 [0,0,0,1,0,1|1,0,0]=3 6335 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2O 1458a_100000743006_100000732470 [0,0,0,1,0,1|1,0,1]=4 6336 B16R2.36 CC(=O)CCSc1coc2c1cccc2 62a_100000053229_100009812202 [0,0,0,1,0,1|2,0,0]=4 6337 B16R2.36 CC(=O)CCSc1noc2c1cccc2 62a_100000053229_200000703156 [0,0,0,1,0,1|2,0,0]=4 6338 B16R2.36 CC(=O)CCSc1noc2c1cccc2 62a_200000703156_100000053229 [0,0,0,1,0,1|2,0,0]=4 6339 B16R2.36 CC(=O)COCc1noc2c1cccc2 34a_100000211253_100009813815 [0,0,0,1,0,1|2,0,0]=4 6340 B16R2.36 CC(=O)NCCc1coc2c1cccc2 11a_100011934666_100015343762 [0,0,0,1,0,1|2,0,0]=4 6341 B16R2.36 CC(=O)NCCc1coc2c1cccc2 1626a_100011934666_100015343762 [0,0,0,1,0,1|2,0,0]=4 6342 B16R2.36 CC(=O)NCCc1coc2c1cccc2 240690a_100011934666_100015343762 [0,0,0,1,0,1|2,0,0]=4 6343 B16R2.36 CC(=O)NCCc1coc2c1cccc2 527a_100011934666_100103153847 [0,0,0,1,0,1|2,0,0]=4 6344 B16R2.36 NC(=O)CCSc1coc2c1cccc2 62a_100000744528_100009812202 [0,0,0,1,0,1|2,0,0]=4 6345 B16R2.36 NC(=O)CCSc1noc2c1cccc2 62a_100000744528_200000703156 [0,0,0,1,0,1|2,0,0]=4 6346 B16R2.36 NC(=O)CCSc1noc2c1cccc2 62a_200000703156_100000744528 [0,0,0,1,0,1|2,0,0]=4 6347 B16R2.36 NC(=O)CSCc1noc2c1cccc2 62a_100000747473_100009813815 [0,0,0,1,0,1|2,0,0]=4 6348 B16R2.36 NC(=O)CSCc1noc2c1cccc2 62a_100009813815_100000747473 [0,0,0,1,0,1|2,0,0]=4 6349 B16R2.36 O=C(O)CNCc1csc2c1cccc2 269956a_100016091260_200000742921 [0,0,0,1,0,1|1,1,0]=4 6350 B16R2.36 O=C(O)CNCc1noc2c1cccc2 269956a_100016091260_100009813815 [0,0,0,1,0,1|1,0,0]=3 6351 B16R2.36 O=C([O-])CSCc1noc2c1cccc2 62a_100009813815_100020667443 [0,0,0,1,0,1|1,0,1]=4 6352 B16R2.36 O=C([O-])CSCc1noc2c1cccc2 62a_100020667443_100009813815 [0,0,0,1,0,1|1,0,1]=4 6353 B16R2.3356 CC(=O)CCN1Cc2ccccc2C1=O 1458a_100000721835_200000210301 [0,0,0,1,0,1|2,0,0]=4 6354 B16R2.3356 CC(=O)CCn1sc2ccccc2c1=O 1458a_100000721913_200000210301 [0,0,0,1,0,1|1,1,0]=4 6355 B16R2.3356 NC(=O)CSC1Cc2ccccc2C1=O 62a_100000747473_100011218503 [0,0,0,1,0,1|2,0,0]=4 6356 B16R2.3356 NC(=O)CSC1Cc2ccccc2C1=O 62a_100011218503_100000747473 [0,0,0,1,0,1|2,0,0]=4 6357 B16R2.3356 O=C(O)CNC1Cc2ccccc2C1=O 269956a_100016091260_100011218503 [0,0,0,1,0,1|1,0,0]=3 6358 B16R2.3356 O=C([O-])CSC1Cc2ccccc2C1=O 62a_100011218503_100020667443 [0,0,0,1,0,1|1,0,1]=4 6359 B16R2.3356 O=C([O-])CSC1Cc2ccccc2C1=O 62a_100020667443_100011218503 [0,0,0,1,0,1|1,0,1]=4 6360 B16R2.3356 [13CH3]C(=O)CCN1Cc2ccccc2C1=O 1458a_100000721835_200025704644 [0,0,0,1,0,1|2,0,0]=4 6361 B16R2.3356 [13CH3]C(=O)CCn1sc2ccccc2c1=O 1458a_100000721913_200025704644 [0,0,0,1,0,1|1,1,0]=4 6362 B16R2.11440 O=C(c1ccccc1O)N2CCC(C2)O 240690a_100011215560_100015234032 [0,0,0,1,0,1|1,0,1]=4 6363 B16R2.11440 O=C1CN(CN1)C(=O)c2ccccc2O 240690a_200000708111_100015234032 [0,0,0,1,0,1|2,0,0]=4 6364 B16R2.12487 Cc1ccccc1C(=O)CC2CC(=O)C2 1458a_100000212026_100009874392 [0,0,0,1,0,1|2,0,0]=4 6365 B16R2.12487 O=C(CN1CC(C1)O)c2ccccc2O 269982a_100000749847_100000188908 [0,0,0,1,0,1|1,0,1]=4 6366 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2O 240690a_100020629032_100015234032 [0,0,0,1,0,1|1,0,1]=4 6367 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2Br 1458a_100000188424_100009874392 [0,0,0,1,0,1|2,0,0]=4 6368 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2Cl 1458a_100000185844_100009874392 [0,0,0,1,0,1|2,0,0]=4 6369 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2F 1458a_100000188656_100009874392 [0,0,0,1,0,1|2,0,0]=4 6370 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2I 1458a_100000187884_100009874392 [0,0,0,1,0,1|2,0,0]=4 6371 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2O 1458a_100015234032_100009874392 [0,0,0,1,0,1|1,0,0]=3 6372 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2[O-] 1458a_100009911694_100009874392 [0,0,0,1,0,1|1,0,1]=4 6373 B16R2.22604 O=C(CCCC1CO1)c2ccccc2O 1458a_100015234032_100000733510 [0,0,0,1,0,1|1,0,1]=4 6374 B16R2.22604 O=C(CSCC1CO1)c2ccccc2O 62a_100000188908_102125554688 [0,0,0,1,0,1|1,0,1]=4 6375 B16R2.22604 O=C(CSCC1CO1)c2ccccc2O 62a_102125554688_100000188908 [0,0,0,1,0,1|1,0,1]=4 6376 B16R2.22604 O=C(CSC[C@@H]1CO1)c2ccccc2O 62a_100000188908_100000745022 [0,0,0,1,0,1|1,0,1]=4 6377 B16R2.22604 O=C(CSC[C@@H]1CO1)c2ccccc2O 62a_100000745022_100000188908 [0,0,0,1,0,1|1,0,1]=4 6378 B16R2.36540 COc1ccccc1C(=O)CCC2CO2 1458a_100000185835_100000732470 [0,1,0,1,0,0|1,0,1]=4 6379 B16R2.36540 O=C(CCC1CO1)c2ccccc2CO 1458a_100011301526_100000732470 [0,1,0,1,0,0|1,0,1]=4 6380 B16R2.11967 Cc1cccc(c1O)C(=O)CCC2CO2 1458a_100000183896_100000732470 [0,1,0,1,0,0|1,0,1]=4 6381 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)Br 1458a_100000752940_100000732470 [0,1,0,1,0,0|1,0,1]=4 6382 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)Cl 1458a_100000742801_100000732470 [0,1,0,1,0,0|1,0,1]=4 6383 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)F 1458a_100011217230_100000732470 [0,1,0,1,0,0|1,0,1]=4 6384 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)O 1458a_100000690420_100000732470 [0,1,0,1,0,0|1,0,1]=4 6385 B16R2.14 COC(=O)CSc1coc2c1cccc2 62a_100000747449_100009812202 [0,1,0,1,0,0|2,0,0]=4 6386 B16R2.14 COC(=O)CSc1noc2c1cccc2 62a_100000747449_200000703156 [0,1,0,1,0,0|2,0,0]=4 6387 B16R2.14 COC(=O)CSc1noc2c1cccc2 62a_200000703156_100000747449 [0,1,0,1,0,0|2,0,0]=4 6388 B16R2.14 O=C(CO)CCc1c[nH]c2c1cccc2 1458a_100000210174_100011218569 [0,1,0,1,0,0|2,0,0]=4 6389 B16R2.138118 Cc1ccc(c(c1)O)C(=O)CCC2CO2 1458a_100000212137_100000732470 [0,1,0,1,0,0|1,0,1]=4 6390 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)Br 1458a_100000744433_100000732470 [0,1,0,1,0,0|1,0,1]=4 6391 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)Cl 1458a_100000188622_100000732470 [0,1,0,1,0,0|1,0,1]=4 6392 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)F 1458a_100000746061_100000732470 [0,1,0,1,0,0|1,0,1]=4 6393 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)I 1458a_100000091984_100000732470 [0,1,0,1,0,0|1,0,1]=4 6394 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)O 1458a_100000212172_100000732470 [0,1,0,1,0,0|1,0,1]=4 6395 B16R2.25683 Cc1cccc(c1C(=O)CCC2CO2)O 1458a_100011934116_100000732470 [0,1,0,1,0,0|1,0,1]=4 6396 B16R2.25683 O=C(CCC1CO1)c2c(cccc2Br)O 1458a_100011935254_100000732470 [0,1,0,1,0,0|1,0,1]=4 6397 B16R2.25683 O=C(CCC1CO1)c2c(cccc2Cl)O 1458a_100000745519_100000732470 [0,1,0,1,0,0|1,0,1]=4 6398 B16R2.25683 O=C(CCC1CO1)c2c(cccc2F)O 1458a_100000763259_100000732470 [0,1,0,1,0,0|1,0,1]=4 6399 B16R2.25683 O=C(CCC1CO1)c2c(cccc2O)O 1458a_100000755285_100000732470 [0,1,0,1,0,0|1,0,1]=4 6400 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CO2)O 1458a_100000229998_100000732470 [0,1,0,1,0,0|1,0,1]=4 6401 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)Br 1458a_100000212140_100000732470 [0,1,0,1,0,0|1,0,1]=4 6402 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)Cl 1458a_100000212143_100000732470 [0,1,0,1,0,0|1,0,1]=4 6403 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)F 1458a_100000742286_100000732470 [0,1,0,1,0,0|1,0,1]=4 6404 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)I 1458a_100000212111_100000732470 [0,1,0,1,0,0|1,0,1]=4 6405 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)O 1458a_100000758025_100000732470 [0,1,0,1,0,0|1,0,1]=4 6406 B16R2.4003 CC(=O)CCn1c(=O)oc2c1cccc2 1458a_100000188164_200000210301 [0,1,0,1,0,0|2,0,0]=4 6407 B16R2.4003 [13CH3]C(=O)CCn1c(=O)oc2c1cccc2 1458a_100000188164_200025704644 [0,1,0,1,0,0|2,0,0]=4 6408 B12R1.54 CC(=O)CCC(=O)c1cccs1 1458a_100000070787_100011290775 [1,0,0,0,1,0|2,0,0]=4 6409 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [1,0,0,0,1,0|2,0,0]=4 6410 B12R1.107 C=C(F)CC(=O)c1ccccc1 1458a_100000185807_100009893438 [1,0,0,0,1,0|2,0,0]=4 6411 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,0,0,0,1,0|1,0,0]=3 6412 B12R1.107 CC(=O)CC(=O)c1ccccn1 1458a_100000070787_100000027445 [1,0,0,0,1,0|2,0,0]=4 6413 B12R1.107 CC(=O)CC(=O)c1cccnc1 1458a_100000070787_100015188593 [1,0,0,0,1,0|2,0,0]=4 6414 B12R1.107 CC(=O)CC(=O)c1ccncc1 1458a_100000070787_100000027454 [1,0,0,0,1,0|2,0,0]=4 6415 B12R1.107 CC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218427 [1,0,0,0,1,0|1,0,1]=4 6416 B12R1.107 CN(CC(=O)O)c1ccccc1 269956a_100000212060_200000210301 [1,0,0,0,1,0|2,0,0]=4 6417 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [1,0,0,0,1,0|1,0,0]=3 6418 B12R1.107 O=C(C[N+](=O)[O-])c1ccccc1 1458a_100000185807_100000761209 [1,0,0,0,1,0|1,0,1]=4 6419 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [1,0,0,0,1,0|0,0,1]=3 6420 B12R1.107 [13CH3]N(CC(=O)O)c1ccccc1 269956a_100000212060_200025704644 [1,0,0,0,1,0|2,0,0]=4 6421 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [1,0,0,0,1,0|1,0,1]=4 6422 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000070787_100012161201 [1,0,0,0,1,0|2,0,0]=4 6423 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000740810_200000210301 [1,0,0,0,1,0|2,0,0]=4 6424 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000070787_100011713688 [1,0,0,0,1,0|2,0,0]=4 6425 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000748742_200000210301 [1,0,0,0,1,0|2,0,0]=4 6426 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000070787_100011713703 [1,0,0,0,1,0|2,0,0]=4 6427 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000184300_200000210301 [1,0,0,0,1,0|2,0,0]=4 6428 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000070787_100000720011 [1,0,0,0,1,0|2,0,0]=4 6429 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000189703_200000210301 [1,0,0,0,1,0|2,0,0]=4 6430 B12R1.125 CC(=O)CCc1ccccc1I 1458a_100000037306_200000210301 [1,0,0,0,1,0|2,0,0]=4 6431 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000070787_100000722297 [1,0,0,0,1,0|1,0,0]=3 6432 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000181328_200000210301 [1,0,0,0,1,0|1,0,0]=3 6433 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [1,0,0,0,1,0|2,0,0]=4 6434 B12R1.125 CC(=O)CSc1ccccc1O 1458a_100000695322_200000210301 [1,0,0,0,1,0|2,0,0]=4 6435 B12R1.125 CC(=O)NCc1ccccc1O 240690a_100000185550_100015343762 [1,0,0,0,1,0|2,0,0]=4 6436 B12R1.125 CC(=O)NCc1ccccc1O 271570a_203496583355_100011237613 [1,0,0,0,1,0|2,0,0]=4 6437 B12R1.125 CC(=O)NCc1ccccc1O 527a_100000185550_100103153847 [1,0,0,0,1,0|2,0,0]=4 6438 B12R1.125 Cc1ccccc1CCC(=O)[13CH3] 1458a_100000748742_200025704644 [1,0,0,0,1,0|2,0,0]=4 6439 B12R1.125 NC(=O)CCc1ccccc1O 271570a_203496583355_100009814947 [1,0,0,0,1,0|1,0,0]=3 6440 B12R1.125 NC(=O)CNc1ccccc1O 34a_100000185747_100000187820 [1,0,0,0,1,0|2,0,0]=4 6441 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [1,0,0,0,1,0|2,0,0]=4 6442 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000739446_100000747473 [1,0,0,0,1,0|2,0,0]=4 6443 B12R1.125 NC(=O)CSc1ccccc1O 62a_100000747473_100000739446 [1,0,0,0,1,0|2,0,0]=4 6444 B12R1.125 O=C([O-])CNc1ccccc1O 34a_100000185747_100020667443 [1,0,0,0,1,0|1,0,1]=4 6445 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100000739446_100020667443 [1,0,0,0,1,0|1,0,1]=4 6446 B12R1.125 O=C([O-])CSc1ccccc1O 62a_100020667443_100000739446 [1,0,0,0,1,0|1,0,1]=4 6447 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [1,0,0,0,1,0|1,0,1]=4 6448 B12R1.125 [13CH3]C(=O)CCc1ccccc1Br 1458a_100000740810_200025704644 [1,0,0,0,1,0|2,0,0]=4 6449 B12R1.125 [13CH3]C(=O)CCc1ccccc1Cl 1458a_100000184300_200025704644 [1,0,0,0,1,0|2,0,0]=4 6450 B12R1.125 [13CH3]C(=O)CCc1ccccc1F 1458a_100000189703_200025704644 [1,0,0,0,1,0|2,0,0]=4 6451 B12R1.125 [13CH3]C(=O)CCc1ccccc1I 1458a_100000037306_200025704644 [1,0,0,0,1,0|2,0,0]=4 6452 B12R1.125 [13CH3]C(=O)CCc1ccccc1O 1458a_100000181328_200025704644 [1,0,0,0,1,0|1,0,0]=3 6453 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [1,0,0,0,1,0|2,0,0]=4 6454 B12R1.125 [13CH3]C(=O)CSc1ccccc1O 1458a_100000695322_200025704644 [1,0,0,0,1,0|2,0,0]=4 6455 B14R1.420 C=C(C)CSCC(=O)c1ccccc1 62a_100000211460_100000211660 [1,0,0,0,0,1|2,0,0]=4 6456 B14R1.420 C=C(C)CSCC(=O)c1ccccc1 62a_100000748629_100000211460 [1,0,0,0,0,1|2,0,0]=4 6457 B14R1.420 C=C(CCCC(=O)C)c1ccccc1 1458a_200009911520_200000210301 [1,0,0,0,0,1|2,0,0]=4 6458 B14R1.420 C=C(CCCC(=O)[13CH3])c1ccccc1 1458a_200009911520_200025704644 [1,0,0,0,0,1|2,0,0]=4 6459 B14R1.420 C=C(F)CSCC(=O)c1ccccc1 62a_100000042424_100000211460 [1,0,0,0,0,1|2,0,0]=4 6460 B14R1.420 C=C(F)CSCC(=O)c1ccccc1 62a_100000211460_100000042424 [1,0,0,0,0,1|2,0,0]=4 6461 B14R1.420 CC(=CCCC(=O)c1ccccc1)C 1458a_100000185807_100011217483 [1,0,0,0,0,1|2,0,0]=4 6462 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000070787_100000211006 [1,0,0,0,0,1|1,0,0]=3 6463 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100011215641 [1,0,0,0,0,1|1,0,0]=3 6464 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000070787_200011215302 [1,0,0,0,0,1|1,0,0]=3 6465 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200000210301 [1,0,0,0,0,1|1,0,0]=3 6466 B14R1.420 CC(=O)CCOC(=O)c1ccccc1 1458a_100000070787_100000184176 [1,0,0,0,0,1|1,0,0]=3 6467 B14R1.420 CC(=O)COCC(=O)c1ccccn1 34a_100000211253_100000027445 [1,0,0,0,0,1|2,0,0]=4 6468 B14R1.420 CC(=O)NCCC(=O)c1ccccc1 1458a_100000185807_100000189650 [1,0,0,0,0,1|1,0,0]=3 6469 B14R1.420 CC(=O)OCCC(=O)c1ccccc1 1458a_100000185807_100009814007 [1,0,0,0,0,1|1,0,0]=3 6470 B14R1.420 CC(CNCC(=O)O)c1ccccc1 269956a_100016091260_100000756946 [1,0,0,0,0,1|1,0,1]=4 6471 B14R1.420 CC(O)CCCC(=O)c1ccccc1 1458a_100000185807_200000718107 [1,0,0,0,0,1|1,0,1]=4 6472 B14R1.420 CC(O)CCNC(=O)c1ccccc1 240690a_200000755665_100000185807 [1,0,0,0,0,1|1,0,1]=4 6473 B14R1.420 CC(O)CCNC(=O)c1ccccc1 527a_200000755665_100000185807 [1,0,0,0,0,1|1,0,1]=4 6474 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100000211460_100011218427 [1,0,0,0,0,1|1,0,1]=4 6475 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100011218427_100000211460 [1,0,0,0,0,1|1,0,1]=4 6476 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100000211460_100009817552 [1,0,0,0,0,1|1,0,1]=4 6477 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100009817552_100000211460 [1,0,0,0,0,1|1,0,1]=4 6478 B14R1.420 NC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100102525003 [1,0,0,0,0,1|1,0,0]=3 6479 B14R1.420 NC(=O)CCNC(=O)c1ccccc1 11a_100000740010_100000185807 [1,0,0,0,0,1|1,0,0]=3 6480 B14R1.420 NC(=O)CCNC(=O)c1ccccc1 240690a_100000740010_100000185807 [1,0,0,0,0,1|1,0,0]=3 6481 B14R1.420 NC(=O)CCNC(=O)c1ccccc1 527a_100000740010_100000185807 [1,0,0,0,0,1|1,0,0]=3 6482 B14R1.420 NC(=O)CSCC(=O)c1ccccc1 62a_100000211460_100000747473 [1,0,0,0,0,1|1,0,0]=3 6483 B14R1.420 NC(=O)CSCC(=O)c1ccccc1 62a_100000747473_100000211460 [1,0,0,0,0,1|1,0,0]=3 6484 B14R1.420 NC(=O)CSCC(=O)c1ccccn1 62a_100000027445_100000747473 [1,0,0,0,0,1|2,0,0]=4 6485 B14R1.420 NC(=O)CSCC(=O)c1ccccn1 62a_100000747473_100000027445 [1,0,0,0,0,1|2,0,0]=4 6486 B14R1.420 NC(=O)CSCC(=O)c1cccnc1 62a_100000747473_100000757877 [1,0,0,0,0,1|2,0,0]=4 6487 B14R1.420 NC(=O)CSCC(=O)c1cccnc1 62a_100000757877_100000747473 [1,0,0,0,0,1|2,0,0]=4 6488 B14R1.420 NC(=O)CSCC(=O)c1ccncc1 62a_100000027454_100000747473 [1,0,0,0,0,1|2,0,0]=4 6489 B14R1.420 NC(=O)CSCC(=O)c1ccncc1 62a_100000747473_100000027454 [1,0,0,0,0,1|2,0,0]=4 6490 B14R1.420 NC(=O)CSCS(=O)c1ccccc1 62a_100000747473_100000031784 [1,0,0,0,0,1|2,0,0]=4 6491 B14R1.420 NC(=O)NCCC(=O)c1ccccc1 1458a_100000185807_200000034859 [1,0,0,0,0,1|1,0,0]=3 6492 B14R1.420 NC(=O)OCCC(=O)c1ccccc1 1458a_100000185807_200011214921 [1,0,0,0,0,1|1,0,0]=3 6493 B14R1.420 O=C(CCC=C(F)F)c1ccccc1 1458a_100000185807_200009816681 [1,0,0,0,0,1|2,0,0]=4 6494 B14R1.420 O=C(CSC[N+](=O)[O-])c1ccccc1 62a_100000211460_100000761209 [1,0,0,0,0,1|1,0,1]=4 6495 B14R1.420 O=C(O)CNCC(=O)c1ccccc1 269956a_100016091260_100000211460 [1,0,0,0,0,1|0,0,0]=2 6496 B14R1.420 O=C(O)CNCC(=O)c1ccccn1 269956a_100016091260_100000027445 [1,0,0,0,0,1|1,0,0]=3 6497 B14R1.420 O=C(O)CNCC(=O)c1cccnc1 269956a_100016091260_100000757877 [1,0,0,0,0,1|1,0,0]=3 6498 B14R1.420 O=C(O)CNCC(=O)c1ccncc1 269956a_100016091260_100000027454 [1,0,0,0,0,1|1,0,0]=3 6499 B14R1.420 O=C(O)CNCC(=O)c1ncccn1 269956a_100016091260_100020636365 [1,0,0,0,0,1|2,0,0]=4 6500 B14R1.420 O=C(O)CNCC(O)c1ccccc1 269956a_100016091260_100000185958 [1,0,0,0,0,1|0,0,2]=4 6501 B14R1.420 O=C(O)CNCS(=O)c1ccccc1 269956a_100016091260_100000031784 [1,0,0,0,0,1|1,0,0]=3 6502 B14R1.420 O=C(O)CNC[C@@H](O)c1ccccc1 269956a_100016091260_100011933945 [1,0,0,0,0,1|0,0,2]=4 6503 B14R1.420 O=C([O-])CSCC(=O)c1ccccc1 62a_100000211460_100020667443 [1,0,0,0,0,1|0,0,1]=3 6504 B14R1.420 O=C([O-])CSCC(=O)c1ccccc1 62a_100020667443_100000211460 [1,0,0,0,0,1|0,0,1]=3 6505 B14R1.420 O=C([O-])CSCC(=O)c1ccccn1 62a_100000027445_100020667443 [1,0,0,0,0,1|1,0,1]=4 6506 B14R1.420 O=C([O-])CSCC(=O)c1ccccn1 62a_100020667443_100000027445 [1,0,0,0,0,1|1,0,1]=4 6507 B14R1.420 O=C([O-])CSCC(=O)c1cccnc1 62a_100000757877_100020667443 [1,0,0,0,0,1|1,0,1]=4 6508 B14R1.420 O=C([O-])CSCC(=O)c1cccnc1 62a_100020667443_100000757877 [1,0,0,0,0,1|1,0,1]=4 6509 B14R1.420 O=C([O-])CSCC(=O)c1ccncc1 62a_100000027454_100020667443 [1,0,0,0,0,1|1,0,1]=4 6510 B14R1.420 O=C([O-])CSCC(=O)c1ccncc1 62a_100020667443_100000027454 [1,0,0,0,0,1|1,0,1]=4 6511 B14R1.420 O=C([O-])CSCS(=O)c1ccccc1 62a_100020667443_100000031784 [1,0,0,0,0,1|1,0,1]=4 6512 B14R1.420 [13CH3]C(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200025704644 [1,0,0,0,0,1|1,0,0]=3 6513 B14R1.159 CC(=O)CCCNc1ccccc1O 34a_100000185747_100000685027 [1,0,0,0,0,1|1,0,1]=4 6514 B14R1.159 CC(=O)CCCSc1ccccc1O 62a_100000739446_100011215641 [1,0,0,0,0,1|1,0,1]=4 6515 B14R1.159 CC(=O)CCCSc1ccccc1O 62a_100011215641_100000739446 [1,0,0,0,0,1|1,0,1]=4 6516 B14R1.159 CC(=O)COCCc1ccccc1O 34a_100000211253_100000722297 [1,0,0,0,0,1|1,0,1]=4 6517 B14R1.159 CC(=O)NCCSc1ccccc1O 62a_100000189650_100000739446 [1,0,0,0,0,1|2,0,0]=4 6518 B14R1.159 CC(=O)NCCSc1ccccc1O 62a_100000739446_100000189650 [1,0,0,0,0,1|2,0,0]=4 6519 B14R1.159 CC(=O)OCC=Cc1ccccc1O 271570a_200000047263_100000739446 [1,0,0,0,0,1|1,0,1]=4 6520 B14R1.159 CC(=O)OCCNc1ccccc1O 34a_100000185747_100009814007 [1,0,0,0,0,1|2,0,0]=4 6521 B14R1.159 CC(=O)OCCSc1ccccc1O 62a_100000739446_100009814007 [1,0,0,0,0,1|2,0,0]=4 6522 B14R1.159 CC(=O)OCCSc1ccccc1O 62a_100009814007_100000739446 [1,0,0,0,0,1|2,0,0]=4 6523 B14R1.159 Cc1ccccc1CCNCC(=O)O 269956a_100016091260_100011713688 [1,0,0,0,0,1|1,0,1]=4 6524 B14R1.159 NC(=O)CCCNc1ccccc1O 34a_100000185747_100102525003 [1,0,0,0,0,1|1,0,1]=4 6525 B14R1.159 NC(=O)CCCSc1ccccc1O 62a_100000739446_100102525003 [1,0,0,0,0,1|1,0,1]=4 6526 B14R1.159 NC(=O)CCCSc1ccccc1O 62a_100102525003_100000739446 [1,0,0,0,0,1|1,0,1]=4 6527 B14R1.159 NC(=O)CCNCc1ccccc1O 34a_100000185550_100000731001 [1,0,0,0,0,1|1,0,1]=4 6528 B14R1.159 NC(=O)CNCCc1ccccc1O 34a_100011207237_100000187820 [1,0,0,0,0,1|1,0,1]=4 6529 B14R1.159 NC(=O)CSCCc1ccccc1O 62a_100000722297_100000747473 [1,0,0,0,0,1|1,0,1]=4 6530 B14R1.159 NC(=O)CSCCc1ccccc1O 62a_100000747473_100000722297 [1,0,0,0,0,1|1,0,1]=4 6531 B14R1.159 NC(=O)NCCSc1ccccc1O 62a_100000739446_200000034859 [1,0,0,0,0,1|2,0,0]=4 6532 B14R1.159 NC(=O)NCCSc1ccccc1O 62a_200000034859_100000739446 [1,0,0,0,0,1|2,0,0]=4 6533 B14R1.159 NC(=O)OCCNc1ccccc1O 34a_100000185747_200011214921 [1,0,0,0,0,1|2,0,0]=4 6534 B14R1.159 NC(=O)OCCSc1ccccc1O 62a_100000739446_200011214921 [1,0,0,0,0,1|2,0,0]=4 6535 B14R1.159 NC(=O)OCCSc1ccccc1O 62a_200011214921_100000739446 [1,0,0,0,0,1|2,0,0]=4 6536 B14R1.159 O=C(O)CNCCc1ccccc1Br 269956a_100016091260_100012161201 [1,0,0,0,0,1|1,0,1]=4 6537 B14R1.159 O=C(O)CNCCc1ccccc1Cl 269956a_100016091260_100011713703 [1,0,0,0,0,1|1,0,1]=4 6538 B14R1.159 O=C(O)CNCCc1ccccc1F 269956a_100016091260_100011713696 [1,0,0,0,0,1|1,0,1]=4 6539 B14R1.159 O=C(O)CNCCc1ccccc1O 269956a_100016091260_100000722297 [1,0,0,0,0,1|0,0,1]=3 6540 B14R1.159 O=C([O-])CNCCc1ccccc1O 34a_100011207237_100020667443 [1,0,0,0,0,1|0,0,2]=4 6541 B14R1.159 O=C([O-])CSCCc1ccccc1O 62a_100000722297_100020667443 [1,0,0,0,0,1|0,0,2]=4 6542 B14R1.159 O=C([O-])CSCCc1ccccc1O 62a_100020667443_100000722297 [1,0,0,0,0,1|0,0,2]=4 6543 B14R1.946 C#CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000753159 [1,0,0,0,0,1|1,0,1]=4 6544 B14R1.946 C#CCCC(=O)Nc1ccccc1O 22a_100000185747_100000692101 [1,0,0,0,0,1|1,0,1]=4 6545 B14R1.946 C#CCCC(=O)Nc1ccccc1O 527a_100000185747_100000692101 [1,0,0,0,0,1|1,0,1]=4 6546 B14R1.946 C/C=C/CC(=O)Cc1ccccc1O 1458a_100000743006_100102629194 [1,0,0,0,0,1|1,0,1]=4 6547 B14R1.946 C=CCCC(=O)Cc1ccccc1Br 1458a_100000749702_100000184730 [1,0,0,0,0,1|2,0,0]=4 6548 B14R1.946 C=CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000754431 [1,0,0,0,0,1|2,0,0]=4 6549 B14R1.946 C=CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000754431 [1,0,0,0,0,1|2,0,0]=4 6550 B14R1.946 C=CCCC(=O)Cc1ccccc1C 1458a_100000749702_100000211839 [1,0,0,0,0,1|2,0,0]=4 6551 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000754431 [1,0,0,0,0,1|2,0,0]=4 6552 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000749702_100000187162 [1,0,0,0,0,1|2,0,0]=4 6553 B14R1.946 C=CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000754431 [1,0,0,0,0,1|2,0,0]=4 6554 B14R1.946 C=CCCC(=O)Cc1ccccc1F 1458a_100000749702_100000187165 [1,0,0,0,0,1|2,0,0]=4 6555 B14R1.946 C=CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000754431 [1,0,0,0,0,1|2,0,0]=4 6556 B14R1.946 C=CCCC(=O)Cc1ccccc1I 1458a_100000749702_100011216222 [1,0,0,0,0,1|2,0,0]=4 6557 B14R1.946 C=CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000754431 [1,0,0,0,0,1|1,0,0]=3 6558 B14R1.946 C=CCCC(=O)Cc1ncccc1O 1458a_100000749702_200020655725 [1,0,0,0,0,1|2,0,0]=4 6559 B14R1.946 C=CCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749702 [1,0,0,0,0,1|2,0,0]=4 6560 B14R1.946 C=CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749702 [1,0,0,0,0,1|2,0,0]=4 6561 B14R1.946 C=CCCC(=O)Nc1ccccc1C 11a_100015192222_100000749702 [1,0,0,0,0,1|2,0,0]=4 6562 B14R1.946 C=CCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749702 [1,0,0,0,0,1|2,0,0]=4 6563 B14R1.946 C=CCCC(=O)Nc1ccccc1C 22a_100015192222_100000749702 [1,0,0,0,0,1|2,0,0]=4 6564 B14R1.946 C=CCCC(=O)Nc1ccccc1C 527a_100015192222_100000749702 [1,0,0,0,0,1|2,0,0]=4 6565 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749702 [1,0,0,0,0,1|2,0,0]=4 6566 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749702 [1,0,0,0,0,1|2,0,0]=4 6567 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749702 [1,0,0,0,0,1|2,0,0]=4 6568 B14R1.946 C=CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749702 [1,0,0,0,0,1|2,0,0]=4 6569 B14R1.946 C=CCCC(=O)Nc1ccccc1F 11a_100000210422_100000749702 [1,0,0,0,0,1|2,0,0]=4 6570 B14R1.946 C=CCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749702 [1,0,0,0,0,1|2,0,0]=4 6571 B14R1.946 C=CCCC(=O)Nc1ccccc1F 22a_100000210422_100000749702 [1,0,0,0,0,1|2,0,0]=4 6572 B14R1.946 C=CCCC(=O)Nc1ccccc1F 527a_100000210422_100000749702 [1,0,0,0,0,1|2,0,0]=4 6573 B14R1.946 C=CCCC(=O)Nc1ccccc1I 11a_100000210053_100000749702 [1,0,0,0,0,1|2,0,0]=4 6574 B14R1.946 C=CCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749702 [1,0,0,0,0,1|2,0,0]=4 6575 B14R1.946 C=CCCC(=O)Nc1ccccc1O 22a_100000185747_100000749702 [1,0,0,0,0,1|1,0,0]=3 6576 B14R1.946 C=CCCC(=O)Nc1ccccc1O 527a_100000185747_100000749702 [1,0,0,0,0,1|1,0,0]=3 6577 B14R1.946 C=CCNC(=O)Cc1ccccc1O 240690a_100020586998_100000743006 [1,0,0,0,0,1|2,0,0]=4 6578 B14R1.946 C=CCNC(=O)Cc1ccccc1O 527a_100020586998_100000743006 [1,0,0,0,0,1|2,0,0]=4 6579 B14R1.946 C=CCNC(=O)Nc1ccccc1O 2430a_100000185747_100020586998 [1,0,0,0,0,1|2,0,0]=4 6580 B14R1.946 CC=CCC(=O)Cc1ccccc1O 1458a_100000743006_100000070051 [1,0,0,0,0,1|1,0,1]=4 6581 B14R1.946 CC=CCC(=O)Nc1ccccc1O 22a_100000185747_100121576822 [1,0,0,0,0,1|1,0,1]=4 6582 B14R1.946 CC=CCC(=O)Nc1ccccc1O 527a_100000185747_100121576822 [1,0,0,0,0,1|1,0,1]=4 6583 B14R1.946 CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210211 [1,0,0,0,0,1|1,0,1]=4 6584 B14R1.946 CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000210183 [1,0,0,0,0,1|1,0,1]=4 6585 B14R1.946 CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000210183 [1,0,0,0,0,1|1,0,1]=4 6586 B14R1.946 COCCC(=O)Cc1ccccc1O 1458a_100000743006_100000233755 [1,0,0,0,0,1|2,0,0]=4 6587 B14R1.946 COCCC(=O)Nc1ccccc1O 22a_100000185747_100000749529 [1,0,0,0,0,1|2,0,0]=4 6588 B14R1.946 COCCC(=O)Nc1ccccc1O 527a_100000185747_100000749529 [1,0,0,0,0,1|2,0,0]=4 6589 B14R1.946 CSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000751147 [1,0,0,0,0,1|2,0,0]=4 6590 B14R1.946 CSCCC(=O)Nc1ccccc1O 22a_100000185747_100000174002 [1,0,0,0,0,1|2,0,0]=4 6591 B14R1.946 CSCCC(=O)Nc1ccccc1O 527a_100000185747_100000174002 [1,0,0,0,0,1|2,0,0]=4 6592 B14R1.946 Cc1ccccc1CC(=O)CCCO 1458a_100000212180_100011215043 [1,0,0,0,0,1|1,0,1]=4 6593 B14R1.946 N#CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215226 [1,0,0,0,0,1|1,0,1]=4 6594 B14R1.946 N#CCCC(=O)Nc1ccccc1O 22a_100000185747_100011934036 [1,0,0,0,0,1|1,0,1]=4 6595 B14R1.946 N#CCCC(=O)Nc1ccccc1O 527a_100000185747_100011934036 [1,0,0,0,0,1|1,0,1]=4 6596 B14R1.946 O=C(CCCF)Cc1ccccc1O 1458a_100000743006_100011934791 [1,0,0,0,0,1|1,0,1]=4 6597 B14R1.946 O=C(CCCO)Cc1ccccc1Br 1458a_100000751119_100011215043 [1,0,0,0,0,1|1,0,1]=4 6598 B14R1.946 O=C(CCCO)Cc1ccccc1Cl 1458a_100000183793_100011215043 [1,0,0,0,0,1|1,0,1]=4 6599 B14R1.946 O=C(CCCO)Cc1ccccc1F 1458a_100000212012_100011215043 [1,0,0,0,0,1|1,0,1]=4 6600 B14R1.946 O=C(CCCO)Cc1ccccc1I 1458a_100000036491_100011215043 [1,0,0,0,0,1|1,0,1]=4 6601 B14R1.946 O=C(CCCO)Cc1ccccc1O 1458a_100000743006_100011215043 [1,0,0,0,0,1|0,0,1]=3 6602 B14R1.946 O=C(Cc1ccccc1O)NCCO 240690a_100000210304_100000743006 [1,0,0,0,0,1|1,0,1]=4 6603 B14R1.946 O=C(Cc1ccccc1O)NCCO 527a_100000210304_100000743006 [1,0,0,0,0,1|1,0,1]=4 6604 B14R1.946 O=C(NCCO)Nc1ccccc1O 2430a_100000185747_100000210304 [1,0,0,0,0,1|1,0,1]=4 6605 B14R1.4488 Cn1cccc1C(=O)CNCC(=O)O 269956a_100016091260_200011262399 [0,0,0,0,1,1|2,0,0]=4 6606 B14R1.4488 O=C(O)CNCC(=O)c1sccc1Br 269956a_100016091260_100000740827 [0,0,0,0,1,1|2,0,0]=4 6607 B16R1.400 C=C(C)CCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000730704 [0,0,0,0,0,2|2,0,0]=4 6608 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1O 1458a_100000181328_100000730704 [0,0,0,0,0,2|2,0,0]=4 6609 B16R1.400 C=C(C)CCC(=O)CCc1ccccc1O 1458a_200000688413_100000722297 [0,0,0,0,0,2|2,0,0]=4 6610 B16R1.400 C=C(C)CCC(=O)COc1ccccc1O 1458a_100000183020_100000730704 [0,0,0,0,0,2|2,0,0]=4 6611 B16R1.400 C=C(C)CCC(=O)CSc1ccccc1O 1458a_100000695322_100000730704 [0,0,0,0,0,2|2,0,0]=4 6612 B16R1.400 C=C(C)CCC(=O)NCc1ccccc1O 240690a_100000185550_200000688413 [0,0,0,0,0,2|2,0,0]=4 6613 B16R1.400 C=C(C)CCC(=O)NCc1ccccc1O 527a_100000185550_200000688413 [0,0,0,0,0,2|2,0,0]=4 6614 B16R1.400 CC(=O)CCC(=O)NCc1ccccc1F 1458a_100000070787_200011194869 [0,0,0,0,0,2|2,0,0]=4 6615 B16R1.400 CC(=O)NCC(=O)CCc1ccccc1O 1458a_100000194580_100000722297 [0,0,0,0,0,2|2,0,0]=4 6616 B16R1.400 CC(=O)NCC(=O)NCc1ccccc1O 240690a_100000185550_100000194580 [0,0,0,0,0,2|2,0,0]=4 6617 B16R1.400 CC(=O)NCC(=O)NCc1ccccc1O 527a_100000185550_100000194580 [0,0,0,0,0,2|2,0,0]=4 6618 B16R1.400 CC(=O)OCC(=O)CCc1ccccc1O 1458a_100000183556_100000722297 [0,0,0,0,0,2|2,0,0]=4 6619 B16R1.400 CC(=O)OCC(=O)CNc1ccccc1O 34a_100000185747_100000036994 [0,0,0,0,0,2|2,0,0]=4 6620 B16R1.400 CC(=O)OCC(=O)CSc1ccccc1O 62a_100000036994_100000739446 [0,0,0,0,0,2|2,0,0]=4 6621 B16R1.400 CC(=O)OCC(=O)CSc1ccccc1O 62a_100000739446_100000036994 [0,0,0,0,0,2|2,0,0]=4 6622 B16R1.400 CC(=O)OCC(=O)NCc1ccccc1O 240690a_100000185550_100000183556 [0,0,0,0,0,2|2,0,0]=4 6623 B16R1.400 CC(=O)OCC(=O)NCc1ccccc1O 527a_100000185550_100000183556 [0,0,0,0,0,2|2,0,0]=4 6624 B16R1.400 CC(=O)SCC(=O)CCc1ccccc1O 1458a_100000049016_100000722297 [0,0,0,0,0,2|2,0,0]=4 6625 B16R1.400 CC(=O)SCC(=O)NCc1ccccc1O 240690a_100000185550_100000049016 [0,0,0,0,0,2|2,0,0]=4 6626 B16R1.400 CC(O)CCC(=O)C=Cc1ccccc1O 1458a_100016263591_100012276601 [0,0,0,0,0,2|1,0,1]=4 6627 B16R1.400 CC(O)CCC(=O)CCc1ccccc1O 1458a_100000181328_100012276601 [0,0,0,0,0,2|1,0,1]=4 6628 B16R1.400 CC(O)CCC(=O)COc1ccccc1O 1458a_100000183020_100012276601 [0,0,0,0,0,2|1,0,1]=4 6629 B16R1.400 CC(O)CCC(=O)CSc1ccccc1O 1458a_100000695322_100012276601 [0,0,0,0,0,2|1,0,1]=4 6630 B16R1.400 Cc1ccccc1CCC(=O)CCC(=O)N 1458a_100011215257_100011713688 [0,0,0,0,0,2|2,0,0]=4 6631 B16R1.400 Cc1ccccc1CNC(=O)CCC(=O)N 240690a_100000174972_100011215257 [0,0,0,0,0,2|2,0,0]=4 6632 B16R1.400 Cc1ccccc1CNC(=O)CCC(=O)N 527a_100000174972_100011215257 [0,0,0,0,0,2|2,0,0]=4 6633 B16R1.400 Cc1ccccc1NNC(=O)CCC(=O)N 22a_100000184220_100011215257 [0,0,0,0,0,2|2,0,0]=4 6634 B16R1.400 NC(=O)CCC(=O)CCc1ccccc1Br 1458a_100011215257_100012161201 [0,0,0,0,0,2|2,0,0]=4 6635 B16R1.400 NC(=O)CCC(=O)CCc1ccccc1Cl 1458a_100011215257_100011713703 [0,0,0,0,0,2|2,0,0]=4 6636 B16R1.400 NC(=O)CCC(=O)CCc1ccccc1F 1458a_100011215257_100000720011 [0,0,0,0,0,2|2,0,0]=4 6637 B16R1.400 NC(=O)CCC(=O)CCc1ccccc1O 1458a_100011215257_100000722297 [0,0,0,0,0,2|1,0,0]=3 6638 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1Br 240690a_100000689332_100011215257 [0,0,0,0,0,2|2,0,0]=4 6639 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1Br 527a_100000689332_100011215257 [0,0,0,0,0,2|2,0,0]=4 6640 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1Cl 240690a_100000174879_100011215257 [0,0,0,0,0,2|2,0,0]=4 6641 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1Cl 527a_100000174879_100011215257 [0,0,0,0,0,2|2,0,0]=4 6642 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1F 240690a_100000174869_100011215257 [0,0,0,0,0,2|2,0,0]=4 6643 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1F 527a_100000174869_100011215257 [0,0,0,0,0,2|2,0,0]=4 6644 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1I 240690a_100015347259_100011215257 [0,0,0,0,0,2|2,0,0]=4 6645 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1I 527a_100015347259_100011215257 [0,0,0,0,0,2|2,0,0]=4 6646 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1O 240690a_100000185550_100011215257 [0,0,0,0,0,2|1,0,0]=3 6647 B16R1.400 NC(=O)CCC(=O)NCc1ccccc1O 527a_100000185550_100011215257 [0,0,0,0,0,2|1,0,0]=3 6648 B16R1.400 NC(=O)CCC(=O)NNc1ccccc1Br 22a_100000241748_100011215257 [0,0,0,0,0,2|2,0,0]=4 6649 B16R1.400 NC(=O)CCC(=O)NNc1ccccc1Cl 22a_100000683529_100011215257 [0,0,0,0,0,2|2,0,0]=4 6650 B16R1.400 NC(=O)CCC(=O)NNc1ccccc1F 22a_100000239246_100011215257 [0,0,0,0,0,2|2,0,0]=4 6651 B16R1.400 NC(=O)CCC(=O)NNc1ccccc1I 22a_100011218156_100011215257 [0,0,0,0,0,2|2,0,0]=4 6652 B16R1.400 NC(=O)CNC(=O)CCc1ccccc1O 11a_100000711301_100000181328 [0,0,0,0,0,2|2,0,0]=4 6653 B16R1.400 NC(=O)CNC(=O)CCc1ccccc1O 240690a_100000711301_100000181328 [0,0,0,0,0,2|2,0,0]=4 6654 B16R1.400 NC(=O)CNC(=O)CCc1ccccc1O 527a_100000711301_100000181328 [0,0,0,0,0,2|2,0,0]=4 6655 B16R1.400 NC(=O)CNC(=O)COc1ccccc1O 240690a_100000711301_100000183020 [0,0,0,0,0,2|2,0,0]=4 6656 B16R1.400 NC(=O)CNC(=O)COc1ccccc1O 527a_100000711301_100000183020 [0,0,0,0,0,2|2,0,0]=4 6657 B16R1.400 NC(=O)CNC(=O)CSc1ccccc1O 240690a_100000711301_100000695322 [0,0,0,0,0,2|2,0,0]=4 6658 B16R1.400 NC(=O)CNC(=O)CSc1ccccc1O 527a_100000711301_100000695322 [0,0,0,0,0,2|2,0,0]=4 6659 B16R1.400 NC(=O)CNC(=O)NCc1ccccc1O 2708a_100000185550_100000711301 [0,0,0,0,0,2|2,0,0]=4 6660 B16R1.400 NC(=O)CNC(=O)NCc1ccccc1O 273464a_100000185550_100000711301 [0,0,0,0,0,2|2,0,0]=4 6661 B16R1.400 NC(=O)CNC(=O)NCc1ccccc1O 273464a_100000711301_100000185550 [0,0,0,0,0,2|2,0,0]=4 6662 B16R1.400 NC(=O)CNC(=O)NCc1ccccc1O 512a_100000185550_100000711301 [0,0,0,0,0,2|2,0,0]=4 6663 B16R1.400 NC(=O)NCC(=O)CCc1ccccc1O 1458a_100000184981_100000722297 [0,0,0,0,0,2|2,0,0]=4 6664 B16R1.400 NC(=O)NCC(=O)NCc1ccccc1O 240690a_100000185550_100000184981 [0,0,0,0,0,2|2,0,0]=4 6665 B16R1.400 NC(=O)NCC(=O)NCc1ccccc1O 527a_100000185550_100000184981 [0,0,0,0,0,2|2,0,0]=4 6666 B16R1.400 NC(=O)SCC(=O)NCc1ccccc1O 240690a_100000185550_200015941356 [0,0,0,0,0,2|2,0,0]=4 6667 B16R1.400 O=C(CC[N+](=O)[O-])NCc1ccccc1O 240690a_100000185550_200000064761 [0,0,0,0,0,2|1,0,1]=4 6668 B16R1.400 O=C(CCc1ccccc1O)CC[N+](=O)[O-] 1458a_200000064761_100000722297 [0,0,0,0,0,2|1,0,1]=4 6669 B16R1.7414 C=C(C)CSCC(=O)Nc1ccccc1O 62a_100000748629_100000014494 [0,0,0,0,0,2|2,0,0]=4 6670 B16R1.7414 C=C(F)CSCC(=O)Nc1ccccc1O 62a_100000042424_100000014494 [0,0,0,0,0,2|2,0,0]=4 6671 B16R1.7414 CC(=CCCC(=O)Cc1ccccc1O)C 1458a_100000743006_100011217483 [0,0,0,0,0,2|2,0,0]=4 6672 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215641 [0,0,0,0,0,2|2,0,0]=4 6673 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215641 [0,0,0,0,0,2|2,0,0]=4 6674 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215641 [0,0,0,0,0,2|2,0,0]=4 6675 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215641 [0,0,0,0,0,2|2,0,0]=4 6676 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215641 [0,0,0,0,0,2|2,0,0]=4 6677 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215641 [0,0,0,0,0,2|1,0,0]=3 6678 B16R1.7414 CC(=O)CCOC(=O)Nc1ccccc1Br 1458a_100000070787_100020589338 [0,0,0,0,0,2|2,0,0]=4 6679 B16R1.7414 CC(=O)CCOC(=O)Nc1ccccc1Cl 1458a_100000070787_200000178450 [0,0,0,0,0,2|2,0,0]=4 6680 B16R1.7414 CC(=O)COCC(=O)Cc1ccccc1Br 34a_100000211253_100000700504 [0,0,0,0,0,2|2,0,0]=4 6681 B16R1.7414 CC(=O)COCC(=O)Nc1ccccc1C 34a_100000211253_100000183529 [0,0,0,0,0,2|2,0,0]=4 6682 B16R1.7414 CC(=O)COCC(=O)Nc1ccccc1Cl 34a_100000211253_100000182448 [0,0,0,0,0,2|2,0,0]=4 6683 B16R1.7414 CC(=O)COCC(=O)Nc1ccccc1F 34a_100000211253_100000243840 [0,0,0,0,0,2|2,0,0]=4 6684 B16R1.7414 CC(=O)COCC(=O)Nc1ccccc1I 34a_100000211253_100000180142 [0,0,0,0,0,2|2,0,0]=4 6685 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1Br 1458a_100000183196_100000184730 [0,0,0,0,0,2|2,0,0]=4 6686 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000189650 [0,0,0,0,0,2|2,0,0]=4 6687 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1C 1458a_100000183196_100000211839 [0,0,0,0,0,2|2,0,0]=4 6688 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1C 1458a_100000212180_100000189650 [0,0,0,0,0,2|2,0,0]=4 6689 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1Cl 1458a_100000183196_100000187162 [0,0,0,0,0,2|2,0,0]=4 6690 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000189650 [0,0,0,0,0,2|2,0,0]=4 6691 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1F 1458a_100000183196_100000187165 [0,0,0,0,0,2|2,0,0]=4 6692 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1F 1458a_100000212012_100000189650 [0,0,0,0,0,2|2,0,0]=4 6693 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1I 1458a_100000036491_100000189650 [0,0,0,0,0,2|2,0,0]=4 6694 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1I 1458a_100000183196_100011216222 [0,0,0,0,0,2|2,0,0]=4 6695 B16R1.7414 CC(=O)NCCC(=O)Cc1ccccc1O 1458a_100000743006_100000189650 [0,0,0,0,0,2|1,0,0]=3 6696 B16R1.7414 CC(=O)NCCC(=O)Cc1ncccc1O 1458a_100000183196_200020655725 [0,0,0,0,0,2|2,0,0]=4 6697 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Br 11a_100000210017_100000183196 [0,0,0,0,0,2|2,0,0]=4 6698 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000183196 [0,0,0,0,0,2|2,0,0]=4 6699 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 11a_100015192222_100000183196 [0,0,0,0,0,2|2,0,0]=4 6700 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 11a_200015185780_100015343762 [0,0,0,0,0,2|2,0,0]=4 6701 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 1626a_100015192222_100000183196 [0,0,0,0,0,2|2,0,0]=4 6702 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 1626a_200015185780_100015343762 [0,0,0,0,0,2|2,0,0]=4 6703 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 22a_100015192222_100000183196 [0,0,0,0,0,2|2,0,0]=4 6704 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 240690a_200015185780_100015343762 [0,0,0,0,0,2|2,0,0]=4 6705 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 527a_100015192222_100000183196 [0,0,0,0,0,2|2,0,0]=4 6706 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1C 527a_200015185780_100103153847 [0,0,0,0,0,2|2,0,0]=4 6707 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000183196 [0,0,0,0,0,2|2,0,0]=4 6708 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000183196 [0,0,0,0,0,2|2,0,0]=4 6709 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000183196 [0,0,0,0,0,2|2,0,0]=4 6710 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000183196 [0,0,0,0,0,2|2,0,0]=4 6711 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 11a_100000210422_100000183196 [0,0,0,0,0,2|2,0,0]=4 6712 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 11a_100015185137_100015343762 [0,0,0,0,0,2|2,0,0]=4 6713 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 1626a_100000210422_100000183196 [0,0,0,0,0,2|2,0,0]=4 6714 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 1626a_100015185137_100015343762 [0,0,0,0,0,2|2,0,0]=4 6715 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 22a_100000210422_100000183196 [0,0,0,0,0,2|2,0,0]=4 6716 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 240690a_100015185137_100015343762 [0,0,0,0,0,2|2,0,0]=4 6717 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 527a_100000210422_100000183196 [0,0,0,0,0,2|2,0,0]=4 6718 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1F 527a_100015185137_100103153847 [0,0,0,0,0,2|2,0,0]=4 6719 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1I 11a_100000210053_100000183196 [0,0,0,0,0,2|2,0,0]=4 6720 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1I 1626a_100000210053_100000183196 [0,0,0,0,0,2|2,0,0]=4 6721 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1O 22a_100000185747_100000183196 [0,0,0,0,0,2|1,0,0]=3 6722 B16R1.7414 CC(=O)NCCC(=O)Nc1ccccc1O 527a_100000185747_100000183196 [0,0,0,0,0,2|1,0,0]=3 6723 B16R1.7414 CC(=O)OCCC(=O)Cc1ccccc1Br 1458a_100000751119_100009814007 [0,0,0,0,0,2|2,0,0]=4 6724 B16R1.7414 CC(=O)OCCC(=O)Cc1ccccc1C 1458a_100000212180_100009814007 [0,0,0,0,0,2|2,0,0]=4 6725 B16R1.7414 CC(=O)OCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100009814007 [0,0,0,0,0,2|2,0,0]=4 6726 B16R1.7414 CC(=O)OCCC(=O)Cc1ccccc1F 1458a_100000212012_100009814007 [0,0,0,0,0,2|2,0,0]=4 6727 B16R1.7414 CC(=O)OCCC(=O)Cc1ccccc1I 1458a_100000036491_100009814007 [0,0,0,0,0,2|2,0,0]=4 6728 B16R1.7414 CC(=O)OCCC(=O)Cc1ccccc1O 1458a_100000743006_100009814007 [0,0,0,0,0,2|1,0,0]=3 6729 B16R1.7414 CC(=O)SCCC(=O)Cc1ccccc1Br 1458a_100000048949_100000184730 [0,0,0,0,0,2|2,0,0]=4 6730 B16R1.7414 CC(=O)SCCC(=O)Cc1ccccc1C 1458a_100000048949_100000211839 [0,0,0,0,0,2|2,0,0]=4 6731 B16R1.7414 CC(=O)SCCC(=O)Cc1ccccc1Cl 1458a_100000048949_100000187162 [0,0,0,0,0,2|2,0,0]=4 6732 B16R1.7414 CC(=O)SCCC(=O)Cc1ccccc1F 1458a_100000048949_100000187165 [0,0,0,0,0,2|2,0,0]=4 6733 B16R1.7414 CC(=O)SCCC(=O)Cc1ccccc1I 1458a_100000048949_100011216222 [0,0,0,0,0,2|2,0,0]=4 6734 B16R1.7414 CC(=O)SCCC(=O)Cc1ncccc1O 1458a_100000048949_200020655725 [0,0,0,0,0,2|2,0,0]=4 6735 B16R1.7414 CC(=O)SCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000048949 [0,0,0,0,0,2|2,0,0]=4 6736 B16R1.7414 CC(=O)SCCC(=O)Nc1ccccc1C 1626a_100015192222_100000048949 [0,0,0,0,0,2|2,0,0]=4 6737 B16R1.7414 CC(=O)SCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000048949 [0,0,0,0,0,2|2,0,0]=4 6738 B16R1.7414 CC(=O)SCCC(=O)Nc1ccccc1F 1626a_100000210422_100000048949 [0,0,0,0,0,2|2,0,0]=4 6739 B16R1.7414 CC(=O)SCCC(=O)Nc1ccccc1I 1626a_100000210053_100000048949 [0,0,0,0,0,2|2,0,0]=4 6740 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_200000718107 [0,0,0,0,0,2|1,0,1]=4 6741 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1O 22a_100000185747_100000761597 [0,0,0,0,0,2|1,0,1]=4 6742 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1O 527a_100000185747_100000761597 [0,0,0,0,0,2|1,0,1]=4 6743 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1O 240690a_200000755665_100000743006 [0,0,0,0,0,2|1,0,1]=4 6744 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1O 527a_200000755665_100000743006 [0,0,0,0,0,2|1,0,1]=4 6745 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1O 2430a_100000185747_200000755665 [0,0,0,0,0,2|1,0,1]=4 6746 B16R1.7414 CC(O)CSCC(=O)Nc1ccccc1O 62a_100011218427_100000014494 [0,0,0,0,0,2|1,0,1]=4 6747 B16R1.7414 C[C@@H](O)CSCC(=O)Nc1ccccc1O 62a_100009817552_100000014494 [0,0,0,0,0,2|1,0,1]=4 6748 B16R1.7414 Cc1ccccc1CC(=O)CCCC(=O)N 1458a_100000212180_100102525003 [0,0,0,0,0,2|2,0,0]=4 6749 B16R1.7414 Cc1ccccc1CC(=O)CCNC(=O)N 1458a_100000181464_100000211839 [0,0,0,0,0,2|2,0,0]=4 6750 B16R1.7414 Cc1ccccc1CC(=O)CCNC(=O)N 1458a_100000212180_200000034859 [0,0,0,0,0,2|2,0,0]=4 6751 B16R1.7414 Cc1ccccc1CC(=O)CCOC(=O)N 1458a_100000212180_200011214921 [0,0,0,0,0,2|2,0,0]=4 6752 B16R1.7414 Cc1ccccc1CC(=O)CNCC(=O)N 2230a_100000711301_100011223134 [0,0,0,0,0,2|2,0,0]=4 6753 B16R1.7414 Cc1ccccc1CC(=O)CNCC(=O)O 269956a_100016091260_100011223134 [0,0,0,0,0,2|1,0,0]=3 6754 B16R1.7414 Cc1ccccc1CC(=O)COCC(=O)N 1458a_100011219004_100000211839 [0,0,0,0,0,2|2,0,0]=4 6755 B16R1.7414 Cc1ccccc1CC(=O)CSCC(=O)N 62a_100000747473_100011223134 [0,0,0,0,0,2|2,0,0]=4 6756 B16R1.7414 Cc1ccccc1CC(=O)CSCC(=O)N 62a_100011223134_100000747473 [0,0,0,0,0,2|2,0,0]=4 6757 B16R1.7414 Cc1ccccc1CC(=O)CSCC(=O)[O-] 62a_100011223134_100020667443 [0,0,0,0,0,2|1,0,1]=4 6758 B16R1.7414 Cc1ccccc1CC(=O)CSCC(=O)[O-] 62a_100020667443_100011223134 [0,0,0,0,0,2|1,0,1]=4 6759 B16R1.7414 Cc1ccccc1CC(=O)NCCC(=O)N 11a_100000740010_100000212180 [0,0,0,0,0,2|2,0,0]=4 6760 B16R1.7414 Cc1ccccc1CC(=O)NCCC(=O)N 240690a_100000740010_100000212180 [0,0,0,0,0,2|2,0,0]=4 6761 B16R1.7414 Cc1ccccc1CC(=O)NCCC(=O)N 527a_100000740010_100000212180 [0,0,0,0,0,2|2,0,0]=4 6762 B16R1.7414 Cc1ccccc1NC(=O)CCNC(=O)N 22a_100015192222_100000181464 [0,0,0,0,0,2|2,0,0]=4 6763 B16R1.7414 Cc1ccccc1NC(=O)CCNC(=O)N 527a_100015192222_100000181464 [0,0,0,0,0,2|2,0,0]=4 6764 B16R1.7414 Cc1ccccc1NC(=O)CNCC(=O)N 2230a_100000711301_100000183529 [0,0,0,0,0,2|2,0,0]=4 6765 B16R1.7414 Cc1ccccc1NC(=O)CNCC(=O)N 2230a_100015186652_100000747473 [0,0,0,0,0,2|2,0,0]=4 6766 B16R1.7414 Cc1ccccc1NC(=O)CNCC(=O)O 269956a_100016091260_100000183529 [0,0,0,0,0,2|1,0,0]=3 6767 B16R1.7414 Cc1ccccc1NC(=O)COCC(=O)N 1626a_100015192222_100011219004 [0,0,0,0,0,2|2,0,0]=4 6768 B16R1.7414 Cc1ccccc1NC(=O)COCC(=O)N 22a_100015192222_100011219004 [0,0,0,0,0,2|2,0,0]=4 6769 B16R1.7414 Cc1ccccc1NC(=O)COCC(=O)N 527a_100015192222_100011219004 [0,0,0,0,0,2|2,0,0]=4 6770 B16R1.7414 Cc1ccccc1NC(=O)CSCC(=O)N 11a_100015192222_100000150265 [0,0,0,0,0,2|2,0,0]=4 6771 B16R1.7414 Cc1ccccc1NC(=O)CSCC(=O)N 22a_100015192222_100000150265 [0,0,0,0,0,2|2,0,0]=4 6772 B16R1.7414 Cc1ccccc1NC(=O)CSCC(=O)N 527a_100015192222_100000150265 [0,0,0,0,0,2|2,0,0]=4 6773 B16R1.7414 Cc1ccccc1NC(=O)CSCC(=O)N 62a_100000747473_100000183529 [0,0,0,0,0,2|2,0,0]=4 6774 B16R1.7414 Cc1ccccc1NC(=O)CSCC(=O)[O-] 62a_100020667443_100000183529 [0,0,0,0,0,2|1,0,1]=4 6775 B16R1.7414 Cc1ccccc1NC(=O)NCCC(=O)N 2430a_100015192222_100000740010 [0,0,0,0,0,2|2,0,0]=4 6776 B16R1.7414 NC(=NCCC(=O)Nc1ccccc1O)N 22a_100000185747_100000033030 [0,0,0,0,0,2|2,0,0]=4 6777 B16R1.7414 NC(=O)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100102525003 [0,0,0,0,0,2|2,0,0]=4 6778 B16R1.7414 NC(=O)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100102525003 [0,0,0,0,0,2|2,0,0]=4 6779 B16R1.7414 NC(=O)CCCC(=O)Cc1ccccc1F 1458a_100000212012_100102525003 [0,0,0,0,0,2|2,0,0]=4 6780 B16R1.7414 NC(=O)CCCC(=O)Cc1ccccc1I 1458a_100000036491_100102525003 [0,0,0,0,0,2|2,0,0]=4 6781 B16R1.7414 NC(=O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100102525003 [0,0,0,0,0,2|1,0,0]=3 6782 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1Br 11a_100000740010_100000751119 [0,0,0,0,0,2|2,0,0]=4 6783 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1Br 240690a_100000740010_100000751119 [0,0,0,0,0,2|2,0,0]=4 6784 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1Br 527a_100000740010_100000751119 [0,0,0,0,0,2|2,0,0]=4 6785 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1Cl 11a_100000740010_100000183793 [0,0,0,0,0,2|2,0,0]=4 6786 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1Cl 240690a_100000740010_100000183793 [0,0,0,0,0,2|2,0,0]=4 6787 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1Cl 527a_100000740010_100000183793 [0,0,0,0,0,2|2,0,0]=4 6788 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1F 11a_100000740010_100000212012 [0,0,0,0,0,2|2,0,0]=4 6789 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1F 240690a_100000740010_100000212012 [0,0,0,0,0,2|2,0,0]=4 6790 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1F 527a_100000740010_100000212012 [0,0,0,0,0,2|2,0,0]=4 6791 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1I 11a_100000740010_100000036491 [0,0,0,0,0,2|2,0,0]=4 6792 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1I 240690a_100000740010_100000036491 [0,0,0,0,0,2|2,0,0]=4 6793 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1I 527a_100000740010_100000036491 [0,0,0,0,0,2|2,0,0]=4 6794 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1O 240690a_100000740010_100000743006 [0,0,0,0,0,2|1,0,0]=3 6795 B16R1.7414 NC(=O)CCNC(=O)Cc1ccccc1O 527a_100000740010_100000743006 [0,0,0,0,0,2|1,0,0]=3 6796 B16R1.7414 NC(=O)CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000740010 [0,0,0,0,0,2|2,0,0]=4 6797 B16R1.7414 NC(=O)CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000740010 [0,0,0,0,0,2|2,0,0]=4 6798 B16R1.7414 NC(=O)CCNC(=O)Nc1ccccc1F 2430a_100000210422_100000740010 [0,0,0,0,0,2|2,0,0]=4 6799 B16R1.7414 NC(=O)CCNC(=O)Nc1ccccc1I 2430a_100000210053_100000740010 [0,0,0,0,0,2|2,0,0]=4 6800 B16R1.7414 NC(=O)CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000740010 [0,0,0,0,0,2|1,0,0]=3 6801 B16R1.7414 NC(=O)CNCC(=O)Cc1ccccc1Br 2230a_100000711301_100000700504 [0,0,0,0,0,2|2,0,0]=4 6802 B16R1.7414 NC(=O)CNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000747473 [0,0,0,0,0,2|2,0,0]=4 6803 B16R1.7414 NC(=O)CNCC(=O)Nc1ccccc1Br 2230a_100000711301_100000182372 [0,0,0,0,0,2|2,0,0]=4 6804 B16R1.7414 NC(=O)CNCC(=O)Nc1ccccc1Cl 2230a_100000711301_100000182448 [0,0,0,0,0,2|2,0,0]=4 6805 B16R1.7414 NC(=O)CNCC(=O)Nc1ccccc1F 2230a_100000711301_100000182988 [0,0,0,0,0,2|2,0,0]=4 6806 B16R1.7414 NC(=O)CNCC(=O)Nc1ccccc1I 2230a_100000711301_100000180142 [0,0,0,0,0,2|2,0,0]=4 6807 B16R1.7414 NC(=O)COCC(=O)Cc1ccccc1Br 1458a_100011219004_100000184730 [0,0,0,0,0,2|2,0,0]=4 6808 B16R1.7414 NC(=O)COCC(=O)Cc1ccccc1Cl 1458a_100011219004_100000187162 [0,0,0,0,0,2|2,0,0]=4 6809 B16R1.7414 NC(=O)COCC(=O)Cc1ccccc1F 1458a_100011219004_100000187165 [0,0,0,0,0,2|2,0,0]=4 6810 B16R1.7414 NC(=O)COCC(=O)Cc1ccccc1I 1458a_100011219004_100011216222 [0,0,0,0,0,2|2,0,0]=4 6811 B16R1.7414 NC(=O)COCC(=O)Cc1ncccc1O 1458a_100011219004_200020655725 [0,0,0,0,0,2|2,0,0]=4 6812 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1Br 1626a_100000210017_100011219004 [0,0,0,0,0,2|2,0,0]=4 6813 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1Cl 1626a_100000185783_100011219004 [0,0,0,0,0,2|2,0,0]=4 6814 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1Cl 22a_100000185783_100011219004 [0,0,0,0,0,2|2,0,0]=4 6815 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1Cl 527a_100000185783_100011219004 [0,0,0,0,0,2|2,0,0]=4 6816 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1F 1626a_100000210422_100011219004 [0,0,0,0,0,2|2,0,0]=4 6817 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1F 22a_100000210422_100011219004 [0,0,0,0,0,2|2,0,0]=4 6818 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1F 527a_100000210422_100011219004 [0,0,0,0,0,2|2,0,0]=4 6819 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1I 1626a_100000210053_100011219004 [0,0,0,0,0,2|2,0,0]=4 6820 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1O 22a_100000185747_100011219004 [0,0,0,0,0,2|1,0,0]=3 6821 B16R1.7414 NC(=O)COCC(=O)Nc1ccccc1O 527a_100000185747_100011219004 [0,0,0,0,0,2|1,0,0]=3 6822 B16R1.7414 NC(=O)CSCC(=O)Cc1ccccc1Br 62a_100000700504_100000747473 [0,0,0,0,0,2|2,0,0]=4 6823 B16R1.7414 NC(=O)CSCC(=O)Cc1ccccc1Br 62a_100000747473_100000700504 [0,0,0,0,0,2|2,0,0]=4 6824 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Br 11a_100000210017_100000150265 [0,0,0,0,0,2|2,0,0]=4 6825 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Br 62a_100000182372_100000747473 [0,0,0,0,0,2|2,0,0]=4 6826 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Br 62a_100000747473_100000182372 [0,0,0,0,0,2|2,0,0]=4 6827 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000150265 [0,0,0,0,0,2|2,0,0]=4 6828 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000150265 [0,0,0,0,0,2|2,0,0]=4 6829 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000150265 [0,0,0,0,0,2|2,0,0]=4 6830 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Cl 62a_100000747473_100000182448 [0,0,0,0,0,2|2,0,0]=4 6831 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000747473 [0,0,0,0,0,2|2,0,0]=4 6832 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1F 11a_100000210422_100000150265 [0,0,0,0,0,2|2,0,0]=4 6833 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1F 22a_100000210422_100000150265 [0,0,0,0,0,2|2,0,0]=4 6834 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1F 527a_100000210422_100000150265 [0,0,0,0,0,2|2,0,0]=4 6835 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1F 62a_100000182988_100000747473 [0,0,0,0,0,2|2,0,0]=4 6836 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1F 62a_100000747473_100000182988 [0,0,0,0,0,2|2,0,0]=4 6837 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1I 11a_100000210053_100000150265 [0,0,0,0,0,2|2,0,0]=4 6838 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1I 62a_100000180142_100000747473 [0,0,0,0,0,2|2,0,0]=4 6839 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1I 62a_100000747473_100000180142 [0,0,0,0,0,2|2,0,0]=4 6840 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1O 22a_100000185747_100000150265 [0,0,0,0,0,2|1,0,0]=3 6841 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1O 527a_100000185747_100000150265 [0,0,0,0,0,2|1,0,0]=3 6842 B16R1.7414 NC(=O)CSCC(=O)Nc1ccccc1O 62a_100000747473_100000014494 [0,0,0,0,0,2|1,0,0]=3 6843 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1Br 1458a_100000181464_100000184730 [0,0,0,0,0,2|2,0,0]=4 6844 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1Br 1458a_100000751119_200000034859 [0,0,0,0,0,2|2,0,0]=4 6845 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1Cl 1458a_100000181464_100000187162 [0,0,0,0,0,2|2,0,0]=4 6846 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1Cl 1458a_100000183793_200000034859 [0,0,0,0,0,2|2,0,0]=4 6847 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1F 1458a_100000181464_100000187165 [0,0,0,0,0,2|2,0,0]=4 6848 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1F 1458a_100000212012_200000034859 [0,0,0,0,0,2|2,0,0]=4 6849 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1I 1458a_100000036491_200000034859 [0,0,0,0,0,2|2,0,0]=4 6850 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1I 1458a_100000181464_100011216222 [0,0,0,0,0,2|2,0,0]=4 6851 B16R1.7414 NC(=O)NCCC(=O)Cc1ccccc1O 1458a_100000743006_200000034859 [0,0,0,0,0,2|1,0,0]=3 6852 B16R1.7414 NC(=O)NCCC(=O)Cc1ncccc1O 1458a_100000181464_200020655725 [0,0,0,0,0,2|2,0,0]=4 6853 B16R1.7414 NC(=O)NCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000181464 [0,0,0,0,0,2|2,0,0]=4 6854 B16R1.7414 NC(=O)NCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000181464 [0,0,0,0,0,2|2,0,0]=4 6855 B16R1.7414 NC(=O)NCCC(=O)Nc1ccccc1F 22a_100000210422_100000181464 [0,0,0,0,0,2|2,0,0]=4 6856 B16R1.7414 NC(=O)NCCC(=O)Nc1ccccc1F 527a_100000210422_100000181464 [0,0,0,0,0,2|2,0,0]=4 6857 B16R1.7414 NC(=O)NCCC(=O)Nc1ccccc1O 22a_100000185747_100000181464 [0,0,0,0,0,2|1,0,0]=3 6858 B16R1.7414 NC(=O)NCCC(=O)Nc1ccccc1O 527a_100000185747_100000181464 [0,0,0,0,0,2|1,0,0]=3 6859 B16R1.7414 NC(=O)OCCC(=O)Cc1ccccc1Br 1458a_100000751119_200011214921 [0,0,0,0,0,2|2,0,0]=4 6860 B16R1.7414 NC(=O)OCCC(=O)Cc1ccccc1Cl 1458a_100000183793_200011214921 [0,0,0,0,0,2|2,0,0]=4 6861 B16R1.7414 NC(=O)OCCC(=O)Cc1ccccc1F 1458a_100000212012_200011214921 [0,0,0,0,0,2|2,0,0]=4 6862 B16R1.7414 NC(=O)OCCC(=O)Cc1ccccc1I 1458a_100000036491_200011214921 [0,0,0,0,0,2|2,0,0]=4 6863 B16R1.7414 NC(=O)OCCC(=O)Cc1ccccc1O 1458a_100000743006_200011214921 [0,0,0,0,0,2|1,0,0]=3 6864 B16R1.7414 O=C(CCC=C(F)F)Cc1ccccc1O 1458a_100000743006_200009816681 [0,0,0,0,0,2|2,0,0]=4 6865 B16R1.7414 O=C(CCC[N+](=O)[O-])Nc1ccccc1O 22a_100000185747_100016109205 [0,0,0,0,0,2|1,0,1]=4 6866 B16R1.7414 O=C(CCC[N+](=O)[O-])Nc1ccccc1O 527a_100000185747_100016109205 [0,0,0,0,0,2|1,0,1]=4 6867 B16R1.7414 O=C(O)CNCC(=O)Cc1ccccc1Br 269956a_100016091260_100000700504 [0,0,0,0,0,2|1,0,0]=3 6868 B16R1.7414 O=C(O)CNCC(=O)Nc1ccccc1Br 269956a_100016091260_100000182372 [0,0,0,0,0,2|1,0,0]=3 6869 B16R1.7414 O=C(O)CNCC(=O)Nc1ccccc1Cl 269956a_100016091260_100000182448 [0,0,0,0,0,2|1,0,0]=3 6870 B16R1.7414 O=C(O)CNCC(=O)Nc1ccccc1F 269956a_100016091260_100000182988 [0,0,0,0,0,2|1,0,0]=3 6871 B16R1.7414 O=C(O)CNCC(=O)Nc1ccccc1I 269956a_100016091260_100000180142 [0,0,0,0,0,2|1,0,0]=3 6872 B16R1.7414 O=C(O)CNCC(=O)Nc1ccccc1O 269956a_100016091260_100000014494 [0,0,0,0,0,2|0,0,0]=2 6873 B16R1.7414 O=C([O-])CSCC(=O)Cc1ccccc1Br 62a_100000700504_100020667443 [0,0,0,0,0,2|1,0,1]=4 6874 B16R1.7414 O=C([O-])CSCC(=O)Cc1ccccc1Br 62a_100020667443_100000700504 [0,0,0,0,0,2|1,0,1]=4 6875 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1Br 62a_100000182372_100020667443 [0,0,0,0,0,2|1,0,1]=4 6876 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1Br 62a_100020667443_100000182372 [0,0,0,0,0,2|1,0,1]=4 6877 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1Cl 62a_100020667443_100000182448 [0,0,0,0,0,2|1,0,1]=4 6878 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1Cl 62a_200011202291_100020667443 [0,0,0,0,0,2|1,0,1]=4 6879 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1F 62a_100000182988_100020667443 [0,0,0,0,0,2|1,0,1]=4 6880 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1F 62a_100020667443_100000182988 [0,0,0,0,0,2|1,0,1]=4 6881 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1I 62a_100000180142_100020667443 [0,0,0,0,0,2|1,0,1]=4 6882 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1I 62a_100020667443_100000180142 [0,0,0,0,0,2|1,0,1]=4 6883 B16R1.7414 O=C([O-])CSCC(=O)Nc1ccccc1O 62a_100020667443_100000014494 [0,0,0,0,0,2|0,0,1]=3 6884 B16R1.10817 C=C(C)CCSCC(=O)c1ccccc1O 62a_100000188908_100000730704 [0,0,0,0,0,2|2,0,0]=4 6885 B16R1.10817 C=C(C)CCSCC(=O)c1ccccc1O 62a_100000730704_100000188908 [0,0,0,0,0,2|2,0,0]=4 6886 B16R1.10817 C=C(C)CSCCC(=O)c1ccccc1O 62a_100000748629_100009873196 [0,0,0,0,0,2|2,0,0]=4 6887 B16R1.10817 C=C(F)CSCCC(=O)c1ccccc1O 62a_100000042424_100009873196 [0,0,0,0,0,2|2,0,0]=4 6888 B16R1.10817 CC(=CCSCC(=O)c1ccccc1O)C 62a_100000188908_100000761012 [0,0,0,0,0,2|2,0,0]=4 6889 B16R1.10817 CC(=CCSCC(=O)c1ccccc1O)C 62a_100000761012_100000188908 [0,0,0,0,0,2|2,0,0]=4 6890 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000735457 [0,0,0,0,0,2|2,0,0]=4 6891 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1C 1458a_100000212026_100000735457 [0,0,0,0,0,2|2,0,0]=4 6892 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000735457 [0,0,0,0,0,2|2,0,0]=4 6893 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1F 1458a_100000188656_100000735457 [0,0,0,0,0,2|2,0,0]=4 6894 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1I 1458a_100000187884_100000735457 [0,0,0,0,0,2|2,0,0]=4 6895 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1O 1458a_100015234032_100000735457 [0,0,0,0,0,2|1,0,0]=3 6896 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000735457 [0,0,0,0,0,2|1,0,1]=4 6897 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1Br 34a_100000759926_100000199116 [0,0,0,0,0,2|2,0,0]=4 6898 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1C 34a_100000759926_100000741374 [0,0,0,0,0,2|2,0,0]=4 6899 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1C 7a_100000759926_100000741374 [0,0,0,0,0,2|2,0,0]=4 6900 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1Cl 34a_100000759926_100000211432 [0,0,0,0,0,2|2,0,0]=4 6901 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1F 34a_100000759926_100000204681 [0,0,0,0,0,2|2,0,0]=4 6902 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1F 7a_100000759926_100000204681 [0,0,0,0,0,2|2,0,0]=4 6903 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1O 7a_100000759926_100000188908 [0,0,0,0,0,2|1,0,0]=3 6904 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1Br 62a_100000199116_100000053229 [0,0,0,0,0,2|2,0,0]=4 6905 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1C 62a_100000053229_100000741374 [0,0,0,0,0,2|2,0,0]=4 6906 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1C 62a_100000741374_100000053229 [0,0,0,0,0,2|2,0,0]=4 6907 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1Cl 62a_100000053229_100000211432 [0,0,0,0,0,2|2,0,0]=4 6908 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000053229 [0,0,0,0,0,2|2,0,0]=4 6909 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1F 62a_100000053229_100000204681 [0,0,0,0,0,2|2,0,0]=4 6910 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1F 62a_100000204681_100000053229 [0,0,0,0,0,2|2,0,0]=4 6911 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1O 62a_100000053229_100000188908 [0,0,0,0,0,2|1,0,0]=3 6912 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1O 62a_100000188908_100000053229 [0,0,0,0,0,2|1,0,0]=3 6913 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Br 240690a_100000209853_100000188424 [0,0,0,0,0,2|2,0,0]=4 6914 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Br 527a_100000209853_100000188424 [0,0,0,0,0,2|2,0,0]=4 6915 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1C 240690a_100000209853_100000212026 [0,0,0,0,0,2|2,0,0]=4 6916 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1C 527a_100000209853_100000212026 [0,0,0,0,0,2|2,0,0]=4 6917 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl 11a_100000737833_100015343762 [0,0,0,0,0,2|2,0,0]=4 6918 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl 1626a_100000737833_100015343762 [0,0,0,0,0,2|2,0,0]=4 6919 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl 240690a_100000209853_100000185844 [0,0,0,0,0,2|2,0,0]=4 6920 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl 240690a_100000737833_100015343762 [0,0,0,0,0,2|2,0,0]=4 6921 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl 527a_100000209853_100000185844 [0,0,0,0,0,2|2,0,0]=4 6922 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1Cl 527a_100000737833_100103153847 [0,0,0,0,0,2|2,0,0]=4 6923 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1F 240690a_100000209853_100000188656 [0,0,0,0,0,2|2,0,0]=4 6924 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1F 527a_100000209853_100000188656 [0,0,0,0,0,2|2,0,0]=4 6925 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1I 240690a_100000209853_100000187884 [0,0,0,0,0,2|2,0,0]=4 6926 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1I 527a_100000209853_100000187884 [0,0,0,0,0,2|2,0,0]=4 6927 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1O 240690a_100000209853_100015234032 [0,0,0,0,0,2|1,0,0]=3 6928 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1[O-] 240690a_100000209853_100009911694 [0,0,0,0,0,2|1,0,1]=4 6929 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1[O-] 527a_100000209853_100009911694 [0,0,0,0,0,2|1,0,1]=4 6930 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1Br 1458a_100000188424_100000042594 [0,0,0,0,0,2|2,0,0]=4 6931 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1C 1458a_100000212026_100000042594 [0,0,0,0,0,2|2,0,0]=4 6932 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000042594 [0,0,0,0,0,2|2,0,0]=4 6933 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1F 1458a_100000188656_100000042594 [0,0,0,0,0,2|2,0,0]=4 6934 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1I 1458a_100000187884_100000042594 [0,0,0,0,0,2|2,0,0]=4 6935 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1O 1458a_100015234032_100000042594 [0,0,0,0,0,2|1,0,0]=3 6936 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000042594 [0,0,0,0,0,2|1,0,1]=4 6937 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1Br 11a_100000724843_100000188424 [0,0,0,0,0,2|2,0,0]=4 6938 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1Br 240690a_100000724843_100000188424 [0,0,0,0,0,2|2,0,0]=4 6939 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1Br 527a_100000724843_100000188424 [0,0,0,0,0,2|2,0,0]=4 6940 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1C 11a_100000724843_100000212026 [0,0,0,0,0,2|2,0,0]=4 6941 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1C 240690a_100000724843_100000212026 [0,0,0,0,0,2|2,0,0]=4 6942 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1C 527a_100000724843_100000212026 [0,0,0,0,0,2|2,0,0]=4 6943 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1Cl 11a_100000724843_100000185844 [0,0,0,0,0,2|2,0,0]=4 6944 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1Cl 240690a_100000724843_100000185844 [0,0,0,0,0,2|2,0,0]=4 6945 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1Cl 527a_100000724843_100000185844 [0,0,0,0,0,2|2,0,0]=4 6946 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1F 11a_100000724843_100000188656 [0,0,0,0,0,2|2,0,0]=4 6947 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1F 240690a_100000724843_100000188656 [0,0,0,0,0,2|2,0,0]=4 6948 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1F 527a_100000724843_100000188656 [0,0,0,0,0,2|2,0,0]=4 6949 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1I 11a_100000724843_100000187884 [0,0,0,0,0,2|2,0,0]=4 6950 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1I 240690a_100000724843_100000187884 [0,0,0,0,0,2|2,0,0]=4 6951 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1I 527a_100000724843_100000187884 [0,0,0,0,0,2|2,0,0]=4 6952 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1O 240690a_100000724843_100015234032 [0,0,0,0,0,2|1,0,0]=3 6953 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1[O-] 240690a_100000724843_100009911694 [0,0,0,0,0,2|1,0,1]=4 6954 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1[O-] 527a_100000724843_100009911694 [0,0,0,0,0,2|1,0,1]=4 6955 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1Br 62a_100000199116_100000076356 [0,0,0,0,0,2|2,0,0]=4 6956 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1C 62a_100000076356_100000741374 [0,0,0,0,0,2|2,0,0]=4 6957 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1C 62a_100000741374_100000076356 [0,0,0,0,0,2|2,0,0]=4 6958 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1Cl 62a_100000076356_100000211432 [0,0,0,0,0,2|2,0,0]=4 6959 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1Cl 62a_100000211432_100000076356 [0,0,0,0,0,2|2,0,0]=4 6960 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1F 62a_100000076356_100000204681 [0,0,0,0,0,2|2,0,0]=4 6961 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1F 62a_100000204681_100000076356 [0,0,0,0,0,2|2,0,0]=4 6962 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1O 62a_100000076356_100000188908 [0,0,0,0,0,2|1,0,0]=3 6963 B16R1.10817 CC(=O)OCSCC(=O)c1ccccc1O 62a_100000188908_100000076356 [0,0,0,0,0,2|1,0,0]=3 6964 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1Br 1458a_100000188424_100000038929 [0,0,0,0,0,2|2,0,0]=4 6965 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1C 1458a_100000212026_100000038929 [0,0,0,0,0,2|2,0,0]=4 6966 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000038929 [0,0,0,0,0,2|2,0,0]=4 6967 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1F 1458a_100000188656_100000038929 [0,0,0,0,0,2|2,0,0]=4 6968 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1I 1458a_100000187884_100000038929 [0,0,0,0,0,2|2,0,0]=4 6969 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1O 1458a_100015234032_100000038929 [0,0,0,0,0,2|1,0,0]=3 6970 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000038929 [0,0,0,0,0,2|1,0,1]=4 6971 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1Br 11a_100020647217_100000188424 [0,0,0,0,0,2|2,0,0]=4 6972 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1Br 240690a_100020647217_100000188424 [0,0,0,0,0,2|2,0,0]=4 6973 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1Br 527a_100020647217_100000188424 [0,0,0,0,0,2|2,0,0]=4 6974 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1C 11a_100020647217_100000212026 [0,0,0,0,0,2|2,0,0]=4 6975 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1C 240690a_100020647217_100000212026 [0,0,0,0,0,2|2,0,0]=4 6976 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1C 527a_100020647217_100000212026 [0,0,0,0,0,2|2,0,0]=4 6977 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1Cl 11a_100020647217_100000185844 [0,0,0,0,0,2|2,0,0]=4 6978 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1Cl 240690a_100020647217_100000185844 [0,0,0,0,0,2|2,0,0]=4 6979 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1Cl 527a_100020647217_100000185844 [0,0,0,0,0,2|2,0,0]=4 6980 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1F 11a_100020647217_100000188656 [0,0,0,0,0,2|2,0,0]=4 6981 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1F 240690a_100020647217_100000188656 [0,0,0,0,0,2|2,0,0]=4 6982 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1F 527a_100020647217_100000188656 [0,0,0,0,0,2|2,0,0]=4 6983 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1I 11a_100020647217_100000187884 [0,0,0,0,0,2|2,0,0]=4 6984 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1I 240690a_100020647217_100000187884 [0,0,0,0,0,2|2,0,0]=4 6985 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1I 527a_100020647217_100000187884 [0,0,0,0,0,2|2,0,0]=4 6986 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1O 240690a_100020647217_100015234032 [0,0,0,0,0,2|1,0,0]=3 6987 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1[O-] 240690a_100020647217_100009911694 [0,0,0,0,0,2|1,0,1]=4 6988 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1[O-] 527a_100020647217_100009911694 [0,0,0,0,0,2|1,0,1]=4 6989 B16R1.10817 CC(=S)OCCCC(=O)c1ccccc1O 1458a_100015234032_200135323944 [0,0,0,0,0,2|1,1,0]=4 6990 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1O 62a_100000188908_100012276601 [0,0,0,0,0,2|1,0,1]=4 6991 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1O 62a_100012276601_100000188908 [0,0,0,0,0,2|1,0,1]=4 6992 B16R1.10817 CC(O)CSCCC(=O)c1ccccc1O 62a_100011218427_100009873196 [0,0,0,0,0,2|1,0,1]=4 6993 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1O 240690a_200000753449_100015234032 [0,0,0,0,0,2|2,0,0]=4 6994 B16R1.10817 C[C@@H](O)CSCCC(=O)c1ccccc1O 62a_100009817552_100009873196 [0,0,0,0,0,2|1,0,1]=4 6995 B16R1.10817 Cc1ccccc1C(=O)CCOCC(=O)N 1458a_100000212026_100000076697 [0,0,0,0,0,2|2,0,0]=4 6996 B16R1.10817 Cc1ccccc1C(=O)CNOCC(=O)O 269956a_100000106656_100000741374 [0,0,0,0,0,2|1,0,0]=3 6997 B16R1.10817 Cc1ccccc1C(=O)COCCC(=O)N 34a_100000757172_100000741374 [0,0,0,0,0,2|2,0,0]=4 6998 B16R1.10817 Cc1ccccc1C(=O)COCCC(=O)N 7a_100000757172_100000741374 [0,0,0,0,0,2|2,0,0]=4 6999 B16R1.10817 Cc1ccccc1C(=O)CSCCC(=O)N 62a_100000741374_100000744528 [0,0,0,0,0,2|2,0,0]=4 7000 B16R1.10817 Cc1ccccc1C(=O)CSCCC(=O)N 62a_100000744528_100000741374 [0,0,0,0,0,2|2,0,0]=4 7001 B16R1.10817 Cc1ccccc1C(=O)NCCCC(=O)N 240690a_100000739312_100000212026 [0,0,0,0,0,2|2,0,0]=4 7002 B16R1.10817 Cc1ccccc1C(=O)NCCCC(=O)N 527a_100000739312_100000212026 [0,0,0,0,0,2|2,0,0]=4 7003 B16R1.10817 Cc1ccccc1C(=O)NCCNC(=O)N 240690a_100020590234_100000212026 [0,0,0,0,0,2|2,0,0]=4 7004 B16R1.10817 Cc1ccccc1C(=O)NCCNC(=O)N 527a_100020590234_100000212026 [0,0,0,0,0,2|2,0,0]=4 7005 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1Br 240690a_100000739312_100000188424 [0,0,0,0,0,2|2,0,0]=4 7006 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1Br 527a_100000739312_100000188424 [0,0,0,0,0,2|2,0,0]=4 7007 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1Cl 240690a_100000739312_100000185844 [0,0,0,0,0,2|2,0,0]=4 7008 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1Cl 527a_100000739312_100000185844 [0,0,0,0,0,2|2,0,0]=4 7009 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1F 240690a_100000739312_100000188656 [0,0,0,0,0,2|2,0,0]=4 7010 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1F 527a_100000739312_100000188656 [0,0,0,0,0,2|2,0,0]=4 7011 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1I 240690a_100000739312_100000187884 [0,0,0,0,0,2|2,0,0]=4 7012 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1I 527a_100000739312_100000187884 [0,0,0,0,0,2|2,0,0]=4 7013 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1O 240690a_100000739312_100015234032 [0,0,0,0,0,2|1,0,0]=3 7014 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1[O-] 240690a_100000739312_100009911694 [0,0,0,0,0,2|1,0,1]=4 7015 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1[O-] 527a_100000739312_100009911694 [0,0,0,0,0,2|1,0,1]=4 7016 B16R1.10817 NC(=O)CCOCC(=O)c1ccccc1Br 34a_100000757172_100000199116 [0,0,0,0,0,2|2,0,0]=4 7017 B16R1.10817 NC(=O)CCOCC(=O)c1ccccc1Cl 34a_100000757172_100000211432 [0,0,0,0,0,2|2,0,0]=4 7018 B16R1.10817 NC(=O)CCOCC(=O)c1ccccc1F 34a_100000757172_100000204681 [0,0,0,0,0,2|2,0,0]=4 7019 B16R1.10817 NC(=O)CCOCC(=O)c1ccccc1F 7a_100000757172_100000204681 [0,0,0,0,0,2|2,0,0]=4 7020 B16R1.10817 NC(=O)CCOCC(=O)c1ccccc1O 7a_100000757172_100000188908 [0,0,0,0,0,2|1,0,0]=3 7021 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1Br 62a_100000199116_100000744528 [0,0,0,0,0,2|2,0,0]=4 7022 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000744528 [0,0,0,0,0,2|2,0,0]=4 7023 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1Cl 62a_100000744528_100000211432 [0,0,0,0,0,2|2,0,0]=4 7024 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1F 62a_100000204681_100000744528 [0,0,0,0,0,2|2,0,0]=4 7025 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1F 62a_100000744528_100000204681 [0,0,0,0,0,2|2,0,0]=4 7026 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1O 62a_100000188908_100000744528 [0,0,0,0,0,2|1,0,0]=3 7027 B16R1.10817 NC(=O)CCSCC(=O)c1ccccc1O 62a_100000744528_100000188908 [0,0,0,0,0,2|1,0,0]=3 7028 B16R1.10817 NC(=O)CNCCC(=O)c1ccccc1F 2230a_100000711301_100000086012 [0,0,0,0,0,2|2,0,0]=4 7029 B16R1.10817 NC(=O)COCCC(=O)c1ccccc1Br 1458a_100000188424_100000076697 [0,0,0,0,0,2|2,0,0]=4 7030 B16R1.10817 NC(=O)COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000076697 [0,0,0,0,0,2|2,0,0]=4 7031 B16R1.10817 NC(=O)COCCC(=O)c1ccccc1F 1458a_100000188656_100000076697 [0,0,0,0,0,2|2,0,0]=4 7032 B16R1.10817 NC(=O)COCCC(=O)c1ccccc1I 1458a_100000187884_100000076697 [0,0,0,0,0,2|2,0,0]=4 7033 B16R1.10817 NC(=O)COCCC(=O)c1ccccc1O 1458a_100015234032_100000076697 [0,0,0,0,0,2|1,0,0]=3 7034 B16R1.10817 NC(=O)COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000076697 [0,0,0,0,0,2|1,0,1]=4 7035 B16R1.10817 NC(=O)CSCCC(=O)c1ccccc1F 62a_100000086012_100000747473 [0,0,0,0,0,2|2,0,0]=4 7036 B16R1.10817 NC(=O)CSCCC(=O)c1ccccc1F 62a_100000747473_100000086012 [0,0,0,0,0,2|2,0,0]=4 7037 B16R1.10817 NC(=O)CSCCC(=O)c1ccccc1O 62a_100000747473_100009873196 [0,0,0,0,0,2|1,0,0]=3 7038 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1Br 240690a_100020590234_100000188424 [0,0,0,0,0,2|2,0,0]=4 7039 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1Br 527a_100020590234_100000188424 [0,0,0,0,0,2|2,0,0]=4 7040 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1Cl 240690a_100020590234_100000185844 [0,0,0,0,0,2|2,0,0]=4 7041 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1Cl 527a_100020590234_100000185844 [0,0,0,0,0,2|2,0,0]=4 7042 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1F 240690a_100020590234_100000188656 [0,0,0,0,0,2|2,0,0]=4 7043 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1F 527a_100020590234_100000188656 [0,0,0,0,0,2|2,0,0]=4 7044 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1I 240690a_100020590234_100000187884 [0,0,0,0,0,2|2,0,0]=4 7045 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1I 527a_100020590234_100000187884 [0,0,0,0,0,2|2,0,0]=4 7046 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1O 240690a_100020590234_100015234032 [0,0,0,0,0,2|1,0,0]=3 7047 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1[O-] 240690a_100020590234_100009911694 [0,0,0,0,0,2|1,0,1]=4 7048 B16R1.10817 NC(=O)NCCNC(=O)c1ccccc1[O-] 527a_100020590234_100009911694 [0,0,0,0,0,2|1,0,1]=4 7049 B16R1.10817 O=C(CCCCB(O)O)c1ccccc1O 1458a_100015234032_200009817182 [0,0,0,0,0,2|1,0,1]=4 7050 B16R1.10817 O=C(O)CNCCC(=O)c1ccccc1F 269956a_100016091260_100000086012 [0,0,0,0,0,2|1,0,0]=3 7051 B16R1.10817 O=C(O)CNCCC(=O)c1ccccc1O 269956a_100016091260_100009873196 [0,0,0,0,0,2|0,0,0]=2 7052 B16R1.10817 O=C(O)CONCC(=O)c1ccccc1Br 269956a_100000106656_100000199116 [0,0,0,0,0,2|1,0,0]=3 7053 B16R1.10817 O=C(O)CONCC(=O)c1ccccc1Cl 269956a_100000106656_100000211432 [0,0,0,0,0,2|1,0,0]=3 7054 B16R1.10817 O=C(O)CONCC(=O)c1ccccc1F 269956a_100000106656_100000204681 [0,0,0,0,0,2|1,0,0]=3 7055 B16R1.10817 O=C(O)CONCC(=O)c1ccccc1O 269956a_100000106656_100000188908 [0,0,0,0,0,2|0,0,0]=2 7056 B16R1.10817 O=C([O-])CSCCC(=O)c1ccccc1F 62a_100000086012_100020667443 [0,0,0,0,0,2|1,0,1]=4 7057 B16R1.10817 O=C([O-])CSCCC(=O)c1ccccc1F 62a_100020667443_100000086012 [0,0,0,0,0,2|1,0,1]=4 7058 B16R1.10817 O=C([O-])CSCCC(=O)c1ccccc1O 62a_100020667443_100009873196 [0,0,0,0,0,2|0,0,1]=3