0 B14R1.1035 C#CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000731252 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.1035 C#CCCCC(=O)c1ccccc1C 1458a_100000212026_100000731252 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.1035 C#CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000731252 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.1035 C#CCCCC(=O)c1ccccc1F 1458a_100000188656_100000731252 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.1035 C#CCCCC(=O)c1ccccc1I 1458a_100000187884_100000731252 [0,0,0,0,0,0|2,0,2]=4 5 B14R1.1035 C#CCCCC(=O)c1ccccc1O 1458a_100015234032_100000731252 [0,0,0,0,0,0|1,0,2]=3 6 B14R1.1035 C#CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000731252 [0,0,0,0,0,0|1,0,3]=4 7 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 11a_100000755551_100000188424 [0,0,0,0,0,0|2,0,2]=4 8 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 1626a_100000755551_100000188424 [0,0,0,0,0,0|2,0,2]=4 9 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 240690a_100000755551_100000188424 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.1035 C#CCCNC(=O)c1ccccc1Br 527a_100000755551_100000188424 [0,0,0,0,0,0|2,0,2]=4 11 B14R1.1035 C#CCCNC(=O)c1ccccc1C 11a_100000755551_100000212026 [0,0,0,0,0,0|2,0,2]=4 12 B14R1.1035 C#CCCNC(=O)c1ccccc1C 1626a_100000755551_100000212026 [0,0,0,0,0,0|2,0,2]=4 13 B14R1.1035 C#CCCNC(=O)c1ccccc1C 240690a_100000755551_100000212026 [0,0,0,0,0,0|2,0,2]=4 14 B14R1.1035 C#CCCNC(=O)c1ccccc1C 527a_100000755551_100000212026 [0,0,0,0,0,0|2,0,2]=4 15 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 11a_100000755551_100000185844 [0,0,0,0,0,0|2,0,2]=4 16 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 1626a_100000755551_100000185844 [0,0,0,0,0,0|2,0,2]=4 17 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 240690a_100000755551_100000185844 [0,0,0,0,0,0|2,0,2]=4 18 B14R1.1035 C#CCCNC(=O)c1ccccc1Cl 527a_100000755551_100000185844 [0,0,0,0,0,0|2,0,2]=4 19 B14R1.1035 C#CCCNC(=O)c1ccccc1F 11a_100000755551_100000188656 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.1035 C#CCCNC(=O)c1ccccc1F 1626a_100000755551_100000188656 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.1035 C#CCCNC(=O)c1ccccc1F 240690a_100000755551_100000188656 [0,0,0,0,0,0|2,0,2]=4 22 B14R1.1035 C#CCCNC(=O)c1ccccc1F 527a_100000755551_100000188656 [0,0,0,0,0,0|2,0,2]=4 23 B14R1.1035 C#CCCNC(=O)c1ccccc1I 11a_100000755551_100000187884 [0,0,0,0,0,0|2,0,2]=4 24 B14R1.1035 C#CCCNC(=O)c1ccccc1I 1626a_100000755551_100000187884 [0,0,0,0,0,0|2,0,2]=4 25 B14R1.1035 C#CCCNC(=O)c1ccccc1I 240690a_100000755551_100000187884 [0,0,0,0,0,0|2,0,2]=4 26 B14R1.1035 C#CCCNC(=O)c1ccccc1I 527a_100000755551_100000187884 [0,0,0,0,0,0|2,0,2]=4 27 B14R1.1035 C#CCCNC(=O)c1ccccc1O 240690a_100000755551_100015234032 [0,0,0,0,0,0|1,0,2]=3 28 B14R1.1035 C#CCCNC(=O)c1ccccc1[O-] 1626a_100000755551_100009911694 [0,0,0,0,0,0|1,0,3]=4 29 B14R1.1035 C#CCCNC(=O)c1ccccc1[O-] 240690a_100000755551_100009911694 [0,0,0,0,0,0|1,0,3]=4 30 B14R1.1035 C#CCCNC(=O)c1ccccc1[O-] 527a_100000755551_100009911694 [0,0,0,0,0,0|1,0,3]=4 31 B14R1.1035 C#CCSCC(=O)c1ccccc1O 62a_100000038162_100000188908 [0,0,0,0,0,0|2,0,2]=4 32 B14R1.1035 C=CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000757094 [0,0,0,0,0,0|2,0,2]=4 33 B14R1.1035 C=CCCCC(=O)c1ccccc1C 1458a_100000212026_100000757094 [0,0,0,0,0,0|2,0,2]=4 34 B14R1.1035 C=CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000757094 [0,0,0,0,0,0|2,0,2]=4 35 B14R1.1035 C=CCCCC(=O)c1ccccc1F 1458a_100000188656_100000757094 [0,0,0,0,0,0|2,0,2]=4 36 B14R1.1035 C=CCCCC(=O)c1ccccc1I 1458a_100000187884_100000757094 [0,0,0,0,0,0|2,0,2]=4 37 B14R1.1035 C=CCCCC(=O)c1ccccc1O 1458a_100015234032_100000757094 [0,0,0,0,0,0|1,0,2]=3 38 B14R1.1035 C=CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000757094 [0,0,0,0,0,0|1,0,3]=4 39 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 11a_100015191253_100000188424 [0,0,0,0,0,0|2,0,2]=4 40 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 1626a_100015191253_100000188424 [0,0,0,0,0,0|2,0,2]=4 41 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 240690a_100015191253_100000188424 [0,0,0,0,0,0|2,0,2]=4 42 B14R1.1035 C=CCCNC(=O)c1ccccc1Br 527a_100015191253_100000188424 [0,0,0,0,0,0|2,0,2]=4 43 B14R1.1035 C=CCCNC(=O)c1ccccc1C 11a_100015191253_100000212026 [0,0,0,0,0,0|2,0,2]=4 44 B14R1.1035 C=CCCNC(=O)c1ccccc1C 1626a_100015191253_100000212026 [0,0,0,0,0,0|2,0,2]=4 45 B14R1.1035 C=CCCNC(=O)c1ccccc1C 240690a_100015191253_100000212026 [0,0,0,0,0,0|2,0,2]=4 46 B14R1.1035 C=CCCNC(=O)c1ccccc1C 527a_100015191253_100000212026 [0,0,0,0,0,0|2,0,2]=4 47 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 11a_100015191253_100000185844 [0,0,0,0,0,0|2,0,2]=4 48 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 1626a_100015191253_100000185844 [0,0,0,0,0,0|2,0,2]=4 49 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 240690a_100015191253_100000185844 [0,0,0,0,0,0|2,0,2]=4 50 B14R1.1035 C=CCCNC(=O)c1ccccc1Cl 527a_100015191253_100000185844 [0,0,0,0,0,0|2,0,2]=4 51 B14R1.1035 C=CCCNC(=O)c1ccccc1F 11a_100015191253_100000188656 [0,0,0,0,0,0|2,0,2]=4 52 B14R1.1035 C=CCCNC(=O)c1ccccc1F 1626a_100015191253_100000188656 [0,0,0,0,0,0|2,0,2]=4 53 B14R1.1035 C=CCCNC(=O)c1ccccc1F 240690a_100015191253_100000188656 [0,0,0,0,0,0|2,0,2]=4 54 B14R1.1035 C=CCCNC(=O)c1ccccc1F 527a_100015191253_100000188656 [0,0,0,0,0,0|2,0,2]=4 55 B14R1.1035 C=CCCNC(=O)c1ccccc1I 11a_100015191253_100000187884 [0,0,0,0,0,0|2,0,2]=4 56 B14R1.1035 C=CCCNC(=O)c1ccccc1I 1626a_100015191253_100000187884 [0,0,0,0,0,0|2,0,2]=4 57 B14R1.1035 C=CCCNC(=O)c1ccccc1I 240690a_100015191253_100000187884 [0,0,0,0,0,0|2,0,2]=4 58 B14R1.1035 C=CCCNC(=O)c1ccccc1I 527a_100015191253_100000187884 [0,0,0,0,0,0|2,0,2]=4 59 B14R1.1035 C=CCCNC(=O)c1ccccc1O 240690a_100015191253_100015234032 [0,0,0,0,0,0|1,0,2]=3 60 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 1626a_100015191253_100009911694 [0,0,0,0,0,0|1,0,3]=4 61 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 240690a_100015191253_100009911694 [0,0,0,0,0,0|1,0,3]=4 62 B14R1.1035 C=CCCNC(=O)c1ccccc1[O-] 527a_100015191253_100009911694 [0,0,0,0,0,0|1,0,3]=4 63 B14R1.1035 C=CCNNC(=O)c1ccccc1O 22a_100020588587_100015234032 [0,0,0,0,0,0|2,0,2]=4 64 B14R1.1035 C=CCSCC(=O)c1ccccc1O 62a_100000188908_100000210623 [0,0,0,0,0,0|2,0,2]=4 65 B14R1.1035 C=CCSCC(=O)c1ccccc1O 62a_100000210623_100000188908 [0,0,0,0,0,0|2,0,2]=4 66 B14R1.1035 C=COCCC(=O)c1ccccc1O 1458a_100015234032_100000039644 [0,0,0,0,0,0|2,0,2]=4 67 B14R1.1035 CC#CCNC(=O)c1ccccc1Br 11a_100000685387_100000188424 [0,0,0,0,0,0|2,0,2]=4 68 B14R1.1035 CC#CCNC(=O)c1ccccc1Br 1626a_100000685387_100000188424 [0,0,0,0,0,0|2,0,2]=4 69 B14R1.1035 CC#CCNC(=O)c1ccccc1Br 527a_100000685387_100000188424 [0,0,0,0,0,0|2,0,2]=4 70 B14R1.1035 CC#CCNC(=O)c1ccccc1C 11a_100000685387_100000212026 [0,0,0,0,0,0|2,0,2]=4 71 B14R1.1035 CC#CCNC(=O)c1ccccc1C 1626a_100000685387_100000212026 [0,0,0,0,0,0|2,0,2]=4 72 B14R1.1035 CC#CCNC(=O)c1ccccc1C 527a_100000685387_100000212026 [0,0,0,0,0,0|2,0,2]=4 73 B14R1.1035 CC#CCNC(=O)c1ccccc1Cl 11a_100000685387_100000185844 [0,0,0,0,0,0|2,0,2]=4 74 B14R1.1035 CC#CCNC(=O)c1ccccc1Cl 1626a_100000685387_100000185844 [0,0,0,0,0,0|2,0,2]=4 75 B14R1.1035 CC#CCNC(=O)c1ccccc1Cl 527a_100000685387_100000185844 [0,0,0,0,0,0|2,0,2]=4 76 B14R1.1035 CC#CCNC(=O)c1ccccc1F 11a_100000685387_100000188656 [0,0,0,0,0,0|2,0,2]=4 77 B14R1.1035 CC#CCNC(=O)c1ccccc1F 1626a_100000685387_100000188656 [0,0,0,0,0,0|2,0,2]=4 78 B14R1.1035 CC#CCNC(=O)c1ccccc1F 527a_100000685387_100000188656 [0,0,0,0,0,0|2,0,2]=4 79 B14R1.1035 CC#CCNC(=O)c1ccccc1I 11a_100000685387_100000187884 [0,0,0,0,0,0|2,0,2]=4 80 B14R1.1035 CC#CCNC(=O)c1ccccc1I 1626a_100000685387_100000187884 [0,0,0,0,0,0|2,0,2]=4 81 B14R1.1035 CC#CCNC(=O)c1ccccc1I 527a_100000685387_100000187884 [0,0,0,0,0,0|2,0,2]=4 82 B14R1.1035 CC#CCNC(=O)c1ccccc1[O-] 1626a_100000685387_100009911694 [0,0,0,0,0,0|1,0,3]=4 83 B14R1.1035 CC#CCNC(=O)c1ccccc1[O-] 527a_100000685387_100009911694 [0,0,0,0,0,0|1,0,3]=4 84 B14R1.1035 CC(=NNCCO)c1ccccc1O 4a_100000210001_100000188907 [0,0,0,0,0,0|4,0,0]=4 85 B14R1.1035 CC(OCCCBr)c1ccccc1F 34a_100011217188_200000741388 [0,0,0,0,0,0|3,0,1]=4 86 B14R1.1035 CC(OCCCCl)c1ccccc1F 34a_100000230001_200000741388 [0,0,0,0,0,0|3,0,1]=4 87 B14R1.1035 CC(OCCCF)c1ccccc1Br 34a_100000702211_100011934791 [0,0,0,0,0,0|3,0,1]=4 88 B14R1.1035 CC(OCCCF)c1ccccc1Br 7a_100000702211_100011934791 [0,0,0,0,0,0|3,0,1]=4 89 B14R1.1035 CC(OCCCF)c1ccccc1Cl 34a_100000740796_100011934791 [0,0,0,0,0,0|3,0,1]=4 90 B14R1.1035 CC(OCCCF)c1ccccc1Cl 7a_100000740796_100011934791 [0,0,0,0,0,0|3,0,1]=4 91 B14R1.1035 CC(OCCCF)c1ccccc1F 34a_100000697922_100011934791 [0,0,0,0,0,0|3,0,1]=4 92 B14R1.1035 CC(OCCCF)c1ccccc1F 34a_100000759539_200000741388 [0,0,0,0,0,0|3,0,1]=4 93 B14R1.1035 CC(OCCCF)c1ccccc1F 7a_100000697922_100011934791 [0,0,0,0,0,0|3,0,1]=4 94 B14R1.1035 CC(OCCCF)c1ccccc1N 7a_100011405641_100011934791 [0,0,0,0,0,0|3,0,1]=4 95 B14R1.1035 CC(OCCCN)c1ccccc1F 34a_100000182051_200000741388 [0,0,0,0,0,0|3,0,1]=4 96 B14R1.1035 CC(OCCCO)c1ccccc1Br 34a_100000702211_100000230001 [0,0,0,0,0,0|3,0,1]=4 97 B14R1.1035 CC(OCCCO)c1ccccc1Br 7a_100000702211_100011215043 [0,0,0,0,0,0|3,0,1]=4 98 B14R1.1035 CC(OCCCO)c1ccccc1Cl 34a_100000740796_100000230001 [0,0,0,0,0,0|3,0,1]=4 99 B14R1.1035 CC(OCCCO)c1ccccc1Cl 7a_100000740796_100011215043 [0,0,0,0,0,0|3,0,1]=4 100 B14R1.1035 CC(OCCCO)c1ccccc1F 34a_100000697922_100000230001 [0,0,0,0,0,0|3,0,1]=4 101 B14R1.1035 CC(OCCCO)c1ccccc1F 7a_100000697922_100011215043 [0,0,0,0,0,0|3,0,1]=4 102 B14R1.1035 CC(OCCCO)c1ccccc1N 7a_100011405641_100011215043 [0,0,0,0,0,0|3,0,1]=4 103 B14R1.1035 CC/C=C\CC(=O)c1ccccc1Br 1458a_100000188424_100103147603 [0,0,0,0,0,0|2,0,2]=4 104 B14R1.1035 CC/C=C\CC(=O)c1ccccc1C 1458a_100000212026_100103147603 [0,0,0,0,0,0|2,0,2]=4 105 B14R1.1035 CC/C=C\CC(=O)c1ccccc1Cl 1458a_100000185844_100103147603 [0,0,0,0,0,0|2,0,2]=4 106 B14R1.1035 CC/C=C\CC(=O)c1ccccc1F 1458a_100000188656_100103147603 [0,0,0,0,0,0|2,0,2]=4 107 B14R1.1035 CC/C=C\CC(=O)c1ccccc1I 1458a_100000187884_100103147603 [0,0,0,0,0,0|2,0,2]=4 108 B14R1.1035 CC/C=C\CC(=O)c1ccccc1O 1458a_100015234032_100103147603 [0,0,0,0,0,0|1,0,2]=3 109 B14R1.1035 CC/C=C\CC(=O)c1ccccc1[O-] 1458a_100009911694_100103147603 [0,0,0,0,0,0|1,0,3]=4 110 B14R1.1035 CCC#CCC(=O)c1ccccc1Br 1458a_100000188424_100009813939 [0,0,0,0,0,0|2,0,2]=4 111 B14R1.1035 CCC#CCC(=O)c1ccccc1C 1458a_100000212026_100009813939 [0,0,0,0,0,0|2,0,2]=4 112 B14R1.1035 CCC#CCC(=O)c1ccccc1Cl 1458a_100000185844_100009813939 [0,0,0,0,0,0|2,0,2]=4 113 B14R1.1035 CCC#CCC(=O)c1ccccc1F 1458a_100000188656_100009813939 [0,0,0,0,0,0|2,0,2]=4 114 B14R1.1035 CCC#CCC(=O)c1ccccc1I 1458a_100000187884_100009813939 [0,0,0,0,0,0|2,0,2]=4 115 B14R1.1035 CCC#CCC(=O)c1ccccc1O 1458a_100015234032_100009813939 [0,0,0,0,0,0|1,0,2]=3 116 B14R1.1035 CCC#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100009813939 [0,0,0,0,0,0|1,0,3]=4 117 B14R1.1035 CCC=NNC(=O)c1ccccc1Br 4a_100000183644_100000210100 [0,0,0,0,0,0|3,0,1]=4 118 B14R1.1035 CCC=NNC(=O)c1ccccc1C 4a_100000181371_100000210100 [0,0,0,0,0,0|3,0,1]=4 119 B14R1.1035 CCC=NNC(=O)c1ccccc1Cl 4a_100000186534_100000210100 [0,0,0,0,0,0|3,0,1]=4 120 B14R1.1035 CCC=NNC(=O)c1ccccc1F 4a_100000183521_100000210100 [0,0,0,0,0,0|3,0,1]=4 121 B14R1.1035 CCC=NNC(=O)c1ccccc1I 4a_100000190081_100000210100 [0,0,0,0,0,0|3,0,1]=4 122 B14R1.1035 CCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210326 [0,0,0,0,0,0|2,0,0]=2 123 B14R1.1035 CCCCCC(=O)c1ccccc1C 1458a_100000212026_100000210326 [0,0,0,0,0,0|2,0,0]=2 124 B14R1.1035 CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210326 [0,0,0,0,0,0|2,0,0]=2 125 B14R1.1035 CCCCCC(=O)c1ccccc1F 1458a_100000188656_100000210326 [0,0,0,0,0,0|2,0,0]=2 126 B14R1.1035 CCCCCC(=O)c1ccccc1I 1458a_100000187884_100000210326 [0,0,0,0,0,0|2,0,0]=2 127 B14R1.1035 CCCCCC(=O)c1ccccc1O 1458a_100015234032_100000210326 [0,0,0,0,0,0|1,0,0]=1 128 B14R1.1035 CCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210326 [0,0,0,0,0,0|1,0,1]=2 129 B14R1.1035 CCCCCN(C)c1ccccc1Br 2230a_100020606079_100000210326 [0,0,0,0,0,0|4,0,0]=4 130 B14R1.1035 CCCCCN(C)c1ccccc1Br 269982a_100020606079_100000210215 [0,0,0,0,0,0|4,0,0]=4 131 B14R1.1035 CCCCCN(C)c1ccccc1Br 34a_100020606079_100000718602 [0,0,0,0,0,0|4,0,0]=4 132 B14R1.1035 CCCCCN(C)c1ccccc1C 2230a_100000219699_100000210326 [0,0,0,0,0,0|4,0,0]=4 133 B14R1.1035 CCCCCN(C)c1ccccc1C 269982a_100000219699_100000210215 [0,0,0,0,0,0|4,0,0]=4 134 B14R1.1035 CCCCCN(C)c1ccccc1C 34a_100000219699_100000718602 [0,0,0,0,0,0|4,0,0]=4 135 B14R1.1035 CCCCCN(C)c1ccccc1Cl 2230a_100000219374_100000210326 [0,0,0,0,0,0|4,0,0]=4 136 B14R1.1035 CCCCCN(C)c1ccccc1Cl 269982a_100000219374_100000210215 [0,0,0,0,0,0|4,0,0]=4 137 B14R1.1035 CCCCCN(C)c1ccccc1Cl 34a_100000219374_100000718602 [0,0,0,0,0,0|4,0,0]=4 138 B14R1.1035 CCCCCN(C)c1ccccc1F 2230a_100000220357_100000210326 [0,0,0,0,0,0|4,0,0]=4 139 B14R1.1035 CCCCCN(C)c1ccccc1F 269982a_100000220357_100000210215 [0,0,0,0,0,0|4,0,0]=4 140 B14R1.1035 CCCCCN(C)c1ccccc1F 34a_100000220357_100000718602 [0,0,0,0,0,0|4,0,0]=4 141 B14R1.1035 CCCCCN(C)c1ccccc1F 38a_100000220357_100000210215 [0,0,0,0,0,0|4,0,0]=4 142 B14R1.1035 CCCCCN(C)c1ccccc1O 269982a_100000033821_100000210215 [0,0,0,0,0,0|3,0,0]=3 143 B14R1.1035 CCCCNC(=O)c1ccccc1Br 11a_100000102301_100000188424 [0,0,0,0,0,0|2,0,0]=2 144 B14R1.1035 CCCCNC(=O)c1ccccc1Br 1626a_100000102301_100000188424 [0,0,0,0,0,0|2,0,0]=2 145 B14R1.1035 CCCCNC(=O)c1ccccc1Br 240690a_100000102301_100000188424 [0,0,0,0,0,0|2,0,0]=2 146 B14R1.1035 CCCCNC(=O)c1ccccc1Br 527a_100000102301_100000188424 [0,0,0,0,0,0|2,0,0]=2 147 B14R1.1035 CCCCNC(=O)c1ccccc1C 11a_100000102301_100000212026 [0,0,0,0,0,0|2,0,0]=2 148 B14R1.1035 CCCCNC(=O)c1ccccc1C 1626a_100000102301_100000212026 [0,0,0,0,0,0|2,0,0]=2 149 B14R1.1035 CCCCNC(=O)c1ccccc1C 240690a_100000102301_100000212026 [0,0,0,0,0,0|2,0,0]=2 150 B14R1.1035 CCCCNC(=O)c1ccccc1C 527a_100000102301_100000212026 [0,0,0,0,0,0|2,0,0]=2 151 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 11a_100000102301_100000185844 [0,0,0,0,0,0|2,0,0]=2 152 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 1626a_100000102301_100000185844 [0,0,0,0,0,0|2,0,0]=2 153 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 240690a_100000102301_100000185844 [0,0,0,0,0,0|2,0,0]=2 154 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 527a_100000102301_100000185844 [0,0,0,0,0,0|2,0,0]=2 155 B14R1.1035 CCCCNC(=O)c1ccccc1F 11a_100000102301_100000188656 [0,0,0,0,0,0|2,0,0]=2 156 B14R1.1035 CCCCNC(=O)c1ccccc1F 1626a_100000102301_100000188656 [0,0,0,0,0,0|2,0,0]=2 157 B14R1.1035 CCCCNC(=O)c1ccccc1F 240690a_100000102301_100000188656 [0,0,0,0,0,0|2,0,0]=2 158 B14R1.1035 CCCCNC(=O)c1ccccc1F 527a_100000102301_100000188656 [0,0,0,0,0,0|2,0,0]=2 159 B14R1.1035 CCCCNC(=O)c1ccccc1I 11a_100000102301_100000187884 [0,0,0,0,0,0|2,0,0]=2 160 B14R1.1035 CCCCNC(=O)c1ccccc1I 1626a_100000102301_100000187884 [0,0,0,0,0,0|2,0,0]=2 161 B14R1.1035 CCCCNC(=O)c1ccccc1I 240690a_100000102301_100000187884 [0,0,0,0,0,0|2,0,0]=2 162 B14R1.1035 CCCCNC(=O)c1ccccc1I 527a_100000102301_100000187884 [0,0,0,0,0,0|2,0,0]=2 163 B14R1.1035 CCCCNC(=O)c1ccccc1O 240690a_100000102301_100015234032 [0,0,0,0,0,0|1,0,0]=1 164 B14R1.1035 CCCCNC(=O)c1ccccc1O 271570a_203496583355_200000154865 [0,0,0,0,0,0|1,0,0]=1 165 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 1626a_100000102301_100009911694 [0,0,0,0,0,0|1,0,1]=2 166 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 240690a_100000102301_100009911694 [0,0,0,0,0,0|1,0,1]=2 167 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 527a_100000102301_100009911694 [0,0,0,0,0,0|1,0,1]=2 168 B14R1.1035 CCCCNC(C)c1ccccc1Br 2230a_100000181357_100000210211 [0,0,0,0,0,0|3,0,1]=4 169 B14R1.1035 CCCCNC(C)c1ccccc1Br 269862a_100000102301_100000187085 [0,0,0,0,0,0|3,0,1]=4 170 B14R1.1035 CCCCNC(C)c1ccccc1C 2230a_100000181355_100000210211 [0,0,0,0,0,0|3,0,1]=4 171 B14R1.1035 CCCCNC(C)c1ccccc1C 269862a_100000102301_100000211656 [0,0,0,0,0,0|3,0,1]=4 172 B14R1.1035 CCCCNC(C)c1ccccc1C 34a_100000181355_100000210210 [0,0,0,0,0,0|3,0,1]=4 173 B14R1.1035 CCCCNC(C)c1ccccc1Cl 2230a_100000102301_100000181259 [0,0,0,0,0,0|3,0,1]=4 174 B14R1.1035 CCCCNC(C)c1ccccc1Cl 2230a_100000174978_100000210211 [0,0,0,0,0,0|3,0,1]=4 175 B14R1.1035 CCCCNC(C)c1ccccc1Cl 269862a_100000102301_100000210134 [0,0,0,0,0,0|3,0,1]=4 176 B14R1.1035 CCCCNC(C)c1ccccc1Cl 34a_100000174978_100000210210 [0,0,0,0,0,0|3,0,1]=4 177 B14R1.1035 CCCCNC(C)c1ccccc1Cl 7a_106832991798_100000181259 [0,0,0,0,0,0|3,0,1]=4 178 B14R1.1035 CCCCNC(C)c1ccccc1F 2230a_100000102301_200000741388 [0,0,0,0,0,0|3,0,1]=4 179 B14R1.1035 CCCCNC(C)c1ccccc1F 2230a_100000181408_100000210211 [0,0,0,0,0,0|3,0,1]=4 180 B14R1.1035 CCCCNC(C)c1ccccc1F 269862a_100000102301_100000210632 [0,0,0,0,0,0|3,0,1]=4 181 B14R1.1035 CCCCNC(C)c1ccccc1F 34a_100000181408_100000210210 [0,0,0,0,0,0|3,0,1]=4 182 B14R1.1035 CCCCNC(C)c1ccccc1F 7a_106832991798_200000741388 [0,0,0,0,0,0|3,0,1]=4 183 B14R1.1035 CCCCNC(C)c1ccccc1I 269862a_100000102301_100000751169 [0,0,0,0,0,0|3,0,1]=4 184 B14R1.1035 CCCCNC(C)c1cccnc1O 2230a_100159269580_100000210211 [0,0,0,0,0,0|3,0,1]=4 185 B14R1.1035 CCCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210211 [0,0,0,0,0,0|2,0,1]=3 186 B14R1.1035 CCCCOC(C)c1ccccc1Br 34a_100000702211_100000210210 [0,0,0,0,0,0|2,0,1]=3 187 B14R1.1035 CCCCOC(C)c1ccccc1Br 7a_100000702211_100000210211 [0,0,0,0,0,0|2,0,1]=3 188 B14R1.1035 CCCCOC(C)c1ccccc1C 34a_100000742021_100000210210 [0,0,0,0,0,0|2,0,1]=3 189 B14R1.1035 CCCCOC(C)c1ccccc1C 7a_100000742021_100000210211 [0,0,0,0,0,0|2,0,1]=3 190 B14R1.1035 CCCCOC(C)c1ccccc1Cl 34a_100000740796_100000210210 [0,0,0,0,0,0|2,0,1]=3 191 B14R1.1035 CCCCOC(C)c1ccccc1Cl 7a_100000210227_100000181259 [0,0,0,0,0,0|2,0,1]=3 192 B14R1.1035 CCCCOC(C)c1ccccc1Cl 7a_100000740796_100000210211 [0,0,0,0,0,0|2,0,1]=3 193 B14R1.1035 CCCCOC(C)c1ccccc1F 34a_100000210227_200000741388 [0,0,0,0,0,0|2,0,1]=3 194 B14R1.1035 CCCCOC(C)c1ccccc1F 34a_100000697922_100000210210 [0,0,0,0,0,0|2,0,1]=3 195 B14R1.1035 CCCCOC(C)c1ccccc1F 7a_100000210227_200000741388 [0,0,0,0,0,0|2,0,1]=3 196 B14R1.1035 CCCCOC(C)c1ccccc1F 7a_100000697922_100000210211 [0,0,0,0,0,0|2,0,1]=3 197 B14R1.1035 CCCCOC(C)c1ccccc1N 7a_100011405641_100000210211 [0,0,0,0,0,0|2,0,1]=3 198 B14R1.1035 CCCCOC(C)c1cccnc1Cl 34a_100009865335_100000210210 [0,0,0,0,0,0|3,0,1]=4 199 B14R1.1035 CCCCOC(C)c1cccnc1Cl 7a_100009865335_100000210211 [0,0,0,0,0,0|3,0,1]=4 200 B14R1.1035 CCCCOC(C)c1ccncc1F 34a_100012180158_100000210210 [0,0,0,0,0,0|3,0,1]=4 201 B14R1.1035 CCCCO[C@@H](C)c1ncccc1Br 7a_100013325542_100000210211 [0,0,0,0,0,0|3,0,1]=4 202 B14R1.1035 CCCCSC(C)c1ccccc1Cl 62a_100000181259_100000210210 [0,0,0,0,0,0|2,1,1]=4 203 B14R1.1035 CCCCSC(C)c1ccccc1Cl 62a_100000210211_100000181259 [0,0,0,0,0,0|2,1,1]=4 204 B14R1.1035 CCCCSC(C)c1ccccc1F 62a_100000210211_200000741388 [0,0,0,0,0,0|2,1,1]=4 205 B14R1.1035 CCCCSC(C)c1ccccc1F 62a_200000741388_100000210210 [0,0,0,0,0,0|2,1,1]=4 206 B14R1.1035 CCCNN=C(C)c1ccccc1Br 4a_100000740057_100000187085 [0,0,0,0,0,0|4,0,0]=4 207 B14R1.1035 CCCNN=C(C)c1ccccc1C 4a_100000740057_100000211656 [0,0,0,0,0,0|4,0,0]=4 208 B14R1.1035 CCCNN=C(C)c1ccccc1Cl 4a_100000740057_100000210134 [0,0,0,0,0,0|4,0,0]=4 209 B14R1.1035 CCCNN=C(C)c1ccccc1F 4a_100000740057_100000210632 [0,0,0,0,0,0|4,0,0]=4 210 B14R1.1035 CCCNN=C(C)c1ccccc1I 4a_100000740057_100000751169 [0,0,0,0,0,0|4,0,0]=4 211 B14R1.1035 CCCNN=C(C)c1ccccc1O 4a_100000740057_100000188907 [0,0,0,0,0,0|3,0,0]=3 212 B14R1.1035 CCCNN=C(C)c1cccnc1O 4a_100000740057_100012024847 [0,0,0,0,0,0|4,0,0]=4 213 B14R1.1035 CCCNN=C(C)c1ccncc1O 4a_100000740057_100009872882 [0,0,0,0,0,0|4,0,0]=4 214 B14R1.1035 CCCNN=C(C)c1ncccc1O 4a_100000740057_100000087166 [0,0,0,0,0,0|4,0,0]=4 215 B14R1.1035 CCCNNC(=O)c1ccccc1Br 22a_100000740057_100000188424 [0,0,0,0,0,0|3,0,0]=3 216 B14R1.1035 CCCNNC(=O)c1ccccc1C 22a_100000740057_100000212026 [0,0,0,0,0,0|3,0,0]=3 217 B14R1.1035 CCCNNC(=O)c1ccccc1Cl 22a_100000740057_100000185844 [0,0,0,0,0,0|3,0,0]=3 218 B14R1.1035 CCCNNC(=O)c1ccccc1F 22a_100000740057_100000188656 [0,0,0,0,0,0|3,0,0]=3 219 B14R1.1035 CCCNNC(=O)c1ccccc1I 22a_100000740057_100000187884 [0,0,0,0,0,0|3,0,0]=3 220 B14R1.1035 CCCNNC(=O)c1ccccc1O 22a_100000740057_100015234032 [0,0,0,0,0,0|2,0,0]=2 221 B14R1.1035 CCCNNC(=O)c1ccccc1[O-] 22a_100000740057_100009911694 [0,0,0,0,0,0|2,0,1]=3 222 B14R1.1035 CCCOCC(=O)c1ccccc1Br 34a_100000210258_100000199116 [0,0,0,0,0,0|3,0,0]=3 223 B14R1.1035 CCCOCC(=O)c1ccccc1C 34a_100000210258_100000741374 [0,0,0,0,0,0|3,0,0]=3 224 B14R1.1035 CCCOCC(=O)c1ccccc1Cl 34a_100000210258_100000211432 [0,0,0,0,0,0|3,0,0]=3 225 B14R1.1035 CCCOCC(=O)c1ccccc1F 34a_100000210258_100000204681 [0,0,0,0,0,0|3,0,0]=3 226 B14R1.1035 CCCSCC(=O)c1ccccc1Br 62a_100000199116_100000210303 [0,0,0,0,0,0|3,0,0]=3 227 B14R1.1035 CCCSCC(=O)c1ccccc1C 62a_100000210303_100000741374 [0,0,0,0,0,0|3,0,0]=3 228 B14R1.1035 CCCSCC(=O)c1ccccc1C 62a_100000741374_100000210303 [0,0,0,0,0,0|3,0,0]=3 229 B14R1.1035 CCCSCC(=O)c1ccccc1Cl 62a_100000210303_100000211432 [0,0,0,0,0,0|3,0,0]=3 230 B14R1.1035 CCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210303 [0,0,0,0,0,0|3,0,0]=3 231 B14R1.1035 CCCSCC(=O)c1ccccc1F 62a_100000204681_100000210303 [0,0,0,0,0,0|3,0,0]=3 232 B14R1.1035 CCCSCC(=O)c1ccccc1F 62a_100000210303_100000204681 [0,0,0,0,0,0|3,0,0]=3 233 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000188908_100000210303 [0,0,0,0,0,0|2,0,0]=2 234 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000210303_100000188908 [0,0,0,0,0,0|2,0,0]=2 235 B14R1.1035 CCNCCC(=O)c1ccccc1F 2230a_100015525214_100000086012 [0,0,0,0,0,0|3,0,0]=3 236 B14R1.1035 CCOCCC(=O)c1ccccc1Br 1458a_100000188424_100011215890 [0,0,0,0,0,0|3,0,0]=3 237 B14R1.1035 CCOCCC(=O)c1ccccc1C 1458a_100000212026_100011215890 [0,0,0,0,0,0|3,0,0]=3 238 B14R1.1035 CCOCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215890 [0,0,0,0,0,0|3,0,0]=3 239 B14R1.1035 CCOCCC(=O)c1ccccc1F 1458a_100000188656_100011215890 [0,0,0,0,0,0|3,0,0]=3 240 B14R1.1035 CCOCCC(=O)c1ccccc1I 1458a_100000187884_100011215890 [0,0,0,0,0,0|3,0,0]=3 241 B14R1.1035 CCOCCC(=O)c1ccccc1O 1458a_100015234032_100011215890 [0,0,0,0,0,0|2,0,0]=2 242 B14R1.1035 CCOCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215890 [0,0,0,0,0,0|2,0,1]=3 243 B14R1.1035 CCOCCN(C)c1ccccc1O 269982a_100000033821_100011215890 [0,0,0,0,0,0|4,0,0]=4 244 B14R1.1035 CCSCCC(=O)c1ccccc1Br 1458a_100000188424_100000757381 [0,0,0,0,0,0|3,0,0]=3 245 B14R1.1035 CCSCCC(=O)c1ccccc1C 1458a_100000212026_100000757381 [0,0,0,0,0,0|3,0,0]=3 246 B14R1.1035 CCSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000757381 [0,0,0,0,0,0|3,0,0]=3 247 B14R1.1035 CCSCCC(=O)c1ccccc1F 1458a_100000188656_100000757381 [0,0,0,0,0,0|3,0,0]=3 248 B14R1.1035 CCSCCC(=O)c1ccccc1F 62a_100000086012_100000210202 [0,0,0,0,0,0|3,0,0]=3 249 B14R1.1035 CCSCCC(=O)c1ccccc1F 62a_100000210202_100000086012 [0,0,0,0,0,0|3,0,0]=3 250 B14R1.1035 CCSCCC(=O)c1ccccc1I 1458a_100000187884_100000757381 [0,0,0,0,0,0|3,0,0]=3 251 B14R1.1035 CCSCCC(=O)c1ccccc1O 1458a_100015234032_100000757381 [0,0,0,0,0,0|2,0,0]=2 252 B14R1.1035 CCSCCC(=O)c1ccccc1O 62a_100000210202_100009873196 [0,0,0,0,0,0|2,0,0]=2 253 B14R1.1035 CCSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000757381 [0,0,0,0,0,0|2,0,1]=3 254 B14R1.1035 CCSCCN(C)c1ccccc1O 269982a_100000033821_100000757381 [0,0,0,0,0,0|4,0,0]=4 255 B14R1.1035 CN(CCCCF)c1ccccc1O 269982a_100000033821_100000729493 [0,0,0,0,0,0|4,0,0]=4 256 B14R1.1035 CN(CCCCO)c1ccccc1O 269982a_100000033821_100000210776 [0,0,0,0,0,0|4,0,0]=4 257 B14R1.1035 CNCCNC(=O)c1ccccc1Cl 2230a_100000737833_200000210301 [0,0,0,0,0,0|3,0,0]=3 258 B14R1.1035 CNCCNC(=O)c1ccccc1Cl 34a_100000737833_200000210301 [0,0,0,0,0,0|3,0,0]=3 259 B14R1.1035 COCCCC(=O)c1ccccc1Br 1458a_100000188424_100000740836 [0,0,0,0,0,0|3,0,0]=3 260 B14R1.1035 COCCCC(=O)c1ccccc1C 1458a_100000212026_100000740836 [0,0,0,0,0,0|3,0,0]=3 261 B14R1.1035 COCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000740836 [0,0,0,0,0,0|3,0,0]=3 262 B14R1.1035 COCCCC(=O)c1ccccc1F 1458a_100000188656_100000740836 [0,0,0,0,0,0|3,0,0]=3 263 B14R1.1035 COCCCC(=O)c1ccccc1I 1458a_100000187884_100000740836 [0,0,0,0,0,0|3,0,0]=3 264 B14R1.1035 COCCCC(=O)c1ccccc1O 1458a_100015234032_100000740836 [0,0,0,0,0,0|2,0,0]=2 265 B14R1.1035 COCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000740836 [0,0,0,0,0,0|2,0,1]=3 266 B14R1.1035 COCCCN(C)c1ccccc1O 269982a_100000033821_100000740836 [0,0,0,0,0,0|4,0,0]=4 267 B14R1.1035 COCCNC(=O)c1ccccc1Br 1626a_100000209980_100000188424 [0,0,0,0,0,0|3,0,0]=3 268 B14R1.1035 COCCNC(=O)c1ccccc1Br 240690a_100000209980_100000188424 [0,0,0,0,0,0|3,0,0]=3 269 B14R1.1035 COCCNC(=O)c1ccccc1Br 34a_200000158863_200000210301 [0,0,0,0,0,0|3,0,0]=3 270 B14R1.1035 COCCNC(=O)c1ccccc1Br 527a_100000209980_100000188424 [0,0,0,0,0,0|3,0,0]=3 271 B14R1.1035 COCCNC(=O)c1ccccc1Br 7a_200000158863_200000210301 [0,0,0,0,0,0|3,0,0]=3 272 B14R1.1035 COCCNC(=O)c1ccccc1C 1626a_100000209980_100000212026 [0,0,0,0,0,0|3,0,0]=3 273 B14R1.1035 COCCNC(=O)c1ccccc1C 240690a_100000209980_100000212026 [0,0,0,0,0,0|3,0,0]=3 274 B14R1.1035 COCCNC(=O)c1ccccc1C 527a_100000209980_100000212026 [0,0,0,0,0,0|3,0,0]=3 275 B14R1.1035 COCCNC(=O)c1ccccc1Cl 1626a_100000209980_100000185844 [0,0,0,0,0,0|3,0,0]=3 276 B14R1.1035 COCCNC(=O)c1ccccc1Cl 240690a_100000209980_100000185844 [0,0,0,0,0,0|3,0,0]=3 277 B14R1.1035 COCCNC(=O)c1ccccc1Cl 527a_100000209980_100000185844 [0,0,0,0,0,0|3,0,0]=3 278 B14R1.1035 COCCNC(=O)c1ccccc1F 1626a_100000209980_100000188656 [0,0,0,0,0,0|3,0,0]=3 279 B14R1.1035 COCCNC(=O)c1ccccc1F 240690a_100000209980_100000188656 [0,0,0,0,0,0|3,0,0]=3 280 B14R1.1035 COCCNC(=O)c1ccccc1F 527a_100000209980_100000188656 [0,0,0,0,0,0|3,0,0]=3 281 B14R1.1035 COCCNC(=O)c1ccccc1I 1626a_100000209980_100000187884 [0,0,0,0,0,0|3,0,0]=3 282 B14R1.1035 COCCNC(=O)c1ccccc1I 240690a_100000209980_100000187884 [0,0,0,0,0,0|3,0,0]=3 283 B14R1.1035 COCCNC(=O)c1ccccc1I 527a_100000209980_100000187884 [0,0,0,0,0,0|3,0,0]=3 284 B14R1.1035 COCCNC(=O)c1ccccc1O 240690a_100000209980_100015234032 [0,0,0,0,0,0|2,0,0]=2 285 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 1626a_100000209980_100009911694 [0,0,0,0,0,0|2,0,1]=3 286 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 240690a_100000209980_100009911694 [0,0,0,0,0,0|2,0,1]=3 287 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 527a_100000209980_100009911694 [0,0,0,0,0,0|2,0,1]=3 288 B14R1.1035 COCCN[C@H](C)c1ccccc1O 2230a_100025703389_100011201679 [0,0,0,0,0,0|3,0,1]=4 289 B14R1.1035 COCCOC(C)c1ccccc1Br 34a_100000702211_100011201679 [0,0,0,0,0,0|3,0,1]=4 290 B14R1.1035 COCCOC(C)c1ccccc1Br 7a_100000702211_100000233755 [0,0,0,0,0,0|3,0,1]=4 291 B14R1.1035 COCCOC(C)c1ccccc1C 34a_100000742021_100011201679 [0,0,0,0,0,0|3,0,1]=4 292 B14R1.1035 COCCOC(C)c1ccccc1C 7a_100000742021_100000233755 [0,0,0,0,0,0|3,0,1]=4 293 B14R1.1035 COCCOC(C)c1ccccc1Cl 34a_100000740796_100011201679 [0,0,0,0,0,0|3,0,1]=4 294 B14R1.1035 COCCOC(C)c1ccccc1Cl 7a_100000740796_100000233755 [0,0,0,0,0,0|3,0,1]=4 295 B14R1.1035 COCCOC(C)c1ccccc1F 34a_100000210237_200000741388 [0,0,0,0,0,0|3,0,1]=4 296 B14R1.1035 COCCOC(C)c1ccccc1F 34a_100000697922_100011201679 [0,0,0,0,0,0|3,0,1]=4 297 B14R1.1035 COCCOC(C)c1ccccc1F 7a_100000697922_100000233755 [0,0,0,0,0,0|3,0,1]=4 298 B14R1.1035 COCCOC(C)c1ccccc1N 7a_100011405641_100000233755 [0,0,0,0,0,0|3,0,1]=4 299 B14R1.1035 COCSCC(=O)c1ccccc1Br 62a_100000199116_100000766300 [0,0,0,0,0,0|4,0,0]=4 300 B14R1.1035 COCSCC(=O)c1ccccc1C 62a_100000741374_100000766300 [0,0,0,0,0,0|4,0,0]=4 301 B14R1.1035 COCSCC(=O)c1ccccc1C 62a_100000766300_100000741374 [0,0,0,0,0,0|4,0,0]=4 302 B14R1.1035 COCSCC(=O)c1ccccc1Cl 62a_100000211432_100000766300 [0,0,0,0,0,0|4,0,0]=4 303 B14R1.1035 COCSCC(=O)c1ccccc1Cl 62a_100000766300_100000211432 [0,0,0,0,0,0|4,0,0]=4 304 B14R1.1035 COCSCC(=O)c1ccccc1F 62a_100000204681_100000766300 [0,0,0,0,0,0|4,0,0]=4 305 B14R1.1035 COCSCC(=O)c1ccccc1F 62a_100000766300_100000204681 [0,0,0,0,0,0|4,0,0]=4 306 B14R1.1035 COCSCC(=O)c1ccccc1O 62a_100000188908_100000766300 [0,0,0,0,0,0|3,0,0]=3 307 B14R1.1035 COCSCC(=O)c1ccccc1O 62a_100000766300_100000188908 [0,0,0,0,0,0|3,0,0]=3 308 B14R1.1035 CSCCNC(=O)c1ccccc1Br 11a_100020590264_100000188424 [0,0,0,0,0,0|3,0,0]=3 309 B14R1.1035 CSCCNC(=O)c1ccccc1Br 1626a_100020590264_100000188424 [0,0,0,0,0,0|3,0,0]=3 310 B14R1.1035 CSCCNC(=O)c1ccccc1Br 240690a_100020590264_100000188424 [0,0,0,0,0,0|3,0,0]=3 311 B14R1.1035 CSCCNC(=O)c1ccccc1Br 527a_100020590264_100000188424 [0,0,0,0,0,0|3,0,0]=3 312 B14R1.1035 CSCCNC(=O)c1ccccc1C 11a_100020590264_100000212026 [0,0,0,0,0,0|3,0,0]=3 313 B14R1.1035 CSCCNC(=O)c1ccccc1C 1626a_100020590264_100000212026 [0,0,0,0,0,0|3,0,0]=3 314 B14R1.1035 CSCCNC(=O)c1ccccc1C 240690a_100020590264_100000212026 [0,0,0,0,0,0|3,0,0]=3 315 B14R1.1035 CSCCNC(=O)c1ccccc1C 527a_100020590264_100000212026 [0,0,0,0,0,0|3,0,0]=3 316 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 11a_100020590264_100000185844 [0,0,0,0,0,0|3,0,0]=3 317 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 1626a_100020590264_100000185844 [0,0,0,0,0,0|3,0,0]=3 318 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 240690a_100020590264_100000185844 [0,0,0,0,0,0|3,0,0]=3 319 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 527a_100020590264_100000185844 [0,0,0,0,0,0|3,0,0]=3 320 B14R1.1035 CSCCNC(=O)c1ccccc1F 11a_100020590264_100000188656 [0,0,0,0,0,0|3,0,0]=3 321 B14R1.1035 CSCCNC(=O)c1ccccc1F 1626a_100020590264_100000188656 [0,0,0,0,0,0|3,0,0]=3 322 B14R1.1035 CSCCNC(=O)c1ccccc1F 240690a_100020590264_100000188656 [0,0,0,0,0,0|3,0,0]=3 323 B14R1.1035 CSCCNC(=O)c1ccccc1F 527a_100020590264_100000188656 [0,0,0,0,0,0|3,0,0]=3 324 B14R1.1035 CSCCNC(=O)c1ccccc1I 11a_100020590264_100000187884 [0,0,0,0,0,0|3,0,0]=3 325 B14R1.1035 CSCCNC(=O)c1ccccc1I 1626a_100020590264_100000187884 [0,0,0,0,0,0|3,0,0]=3 326 B14R1.1035 CSCCNC(=O)c1ccccc1I 240690a_100020590264_100000187884 [0,0,0,0,0,0|3,0,0]=3 327 B14R1.1035 CSCCNC(=O)c1ccccc1I 527a_100020590264_100000187884 [0,0,0,0,0,0|3,0,0]=3 328 B14R1.1035 CSCCNC(=O)c1ccccc1O 240690a_100020590264_100015234032 [0,0,0,0,0,0|2,0,0]=2 329 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 1626a_100020590264_100009911694 [0,0,0,0,0,0|2,0,1]=3 330 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 240690a_100020590264_100009911694 [0,0,0,0,0,0|2,0,1]=3 331 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 527a_100020590264_100009911694 [0,0,0,0,0,0|2,0,1]=3 332 B14R1.1035 CSCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000751147 [0,0,0,0,0,0|3,0,1]=4 333 B14R1.1035 CSCCOC(C)c1ccccc1Br 34a_100000702211_100000212216 [0,0,0,0,0,0|3,0,1]=4 334 B14R1.1035 CSCCOC(C)c1ccccc1Br 7a_100000702211_100000212216 [0,0,0,0,0,0|3,0,1]=4 335 B14R1.1035 CSCCOC(C)c1ccccc1C 34a_100000742021_100000212216 [0,0,0,0,0,0|3,0,1]=4 336 B14R1.1035 CSCCOC(C)c1ccccc1C 7a_100000742021_100000212216 [0,0,0,0,0,0|3,0,1]=4 337 B14R1.1035 CSCCOC(C)c1ccccc1Cl 34a_100000740796_100000212216 [0,0,0,0,0,0|3,0,1]=4 338 B14R1.1035 CSCCOC(C)c1ccccc1Cl 7a_100000230434_100000181259 [0,0,0,0,0,0|3,0,1]=4 339 B14R1.1035 CSCCOC(C)c1ccccc1Cl 7a_100000740796_100000212216 [0,0,0,0,0,0|3,0,1]=4 340 B14R1.1035 CSCCOC(C)c1ccccc1F 34a_100000230434_200000741388 [0,0,0,0,0,0|3,0,1]=4 341 B14R1.1035 CSCCOC(C)c1ccccc1F 34a_100000697922_100000212216 [0,0,0,0,0,0|3,0,1]=4 342 B14R1.1035 CSCCOC(C)c1ccccc1F 7a_100000230434_200000741388 [0,0,0,0,0,0|3,0,1]=4 343 B14R1.1035 CSCCOC(C)c1ccccc1F 7a_100000697922_100000212216 [0,0,0,0,0,0|3,0,1]=4 344 B14R1.1035 CSCCOC(C)c1ccccc1N 7a_100011405641_100000212216 [0,0,0,0,0,0|3,0,1]=4 345 B14R1.1035 CSCSCC(=O)c1ccccc1Br 62a_100000199116_100011218213 [0,0,0,0,0,0|4,0,0]=4 346 B14R1.1035 CSCSCC(=O)c1ccccc1C 62a_100000741374_100011218213 [0,0,0,0,0,0|4,0,0]=4 347 B14R1.1035 CSCSCC(=O)c1ccccc1C 62a_100011218213_100000741374 [0,0,0,0,0,0|4,0,0]=4 348 B14R1.1035 CSCSCC(=O)c1ccccc1Cl 62a_100000211432_100011218213 [0,0,0,0,0,0|4,0,0]=4 349 B14R1.1035 CSCSCC(=O)c1ccccc1Cl 62a_100011218213_100000211432 [0,0,0,0,0,0|4,0,0]=4 350 B14R1.1035 CSCSCC(=O)c1ccccc1F 62a_100000204681_100011218213 [0,0,0,0,0,0|4,0,0]=4 351 B14R1.1035 CSCSCC(=O)c1ccccc1F 62a_100011218213_100000204681 [0,0,0,0,0,0|4,0,0]=4 352 B14R1.1035 CSCSCC(=O)c1ccccc1O 62a_100000188908_100011218213 [0,0,0,0,0,0|3,0,0]=3 353 B14R1.1035 CSCSCC(=O)c1ccccc1O 62a_100011218213_100000188908 [0,0,0,0,0,0|3,0,0]=3 354 B14R1.1035 C[C@@H](NCCCF)c1ccccc1O 2230a_100025703389_100011934791 [0,0,0,0,0,0|3,0,1]=4 355 B14R1.1035 C[C@@H](NCCCO)c1ccccc1O 2230a_100025703389_100000230001 [0,0,0,0,0,0|3,0,1]=4 356 B14R1.1035 Cc1ccccc1C(=O)CCCC#N 1458a_100000212026_100000211468 [0,0,0,0,0,0|3,0,1]=4 357 B14R1.1035 Cc1ccccc1C(=O)CCCCF 1458a_100000212026_100000729493 [0,0,0,0,0,0|3,0,0]=3 358 B14R1.1035 Cc1ccccc1C(=O)CCCCO 1458a_100000212026_100000210776 [0,0,0,0,0,0|3,0,0]=3 359 B14R1.1035 Cc1ccccc1C(=O)CNCCF 34a_100000724931_100000741374 [0,0,0,0,0,0|4,0,0]=4 360 B14R1.1035 Cc1ccccc1C(=O)CNCCO 2230a_100016997473_100000741374 [0,0,0,0,0,0|4,0,0]=4 361 B14R1.1035 Cc1ccccc1C(=O)CNCCO 34a_100016990907_100000741374 [0,0,0,0,0,0|4,0,0]=4 362 B14R1.1035 Cc1ccccc1C(=O)COCCBr 34a_100000211926_100000741374 [0,0,0,0,0,0|4,0,0]=4 363 B14R1.1035 Cc1ccccc1C(=O)COCCN 34a_100000210304_100000741374 [0,0,0,0,0,0|4,0,0]=4 364 B14R1.1035 Cc1ccccc1C(=O)CSCCF 62a_100000741374_100011217306 [0,0,0,0,0,0|4,0,0]=4 365 B14R1.1035 Cc1ccccc1C(=O)CSCCF 62a_100011217306_100000741374 [0,0,0,0,0,0|4,0,0]=4 366 B14R1.1035 Cc1ccccc1C(=O)CSCCO 62a_100000211926_100000741374 [0,0,0,0,0,0|4,0,0]=4 367 B14R1.1035 Cc1ccccc1C(=O)CSCCO 62a_100000741374_100000211926 [0,0,0,0,0,0|4,0,0]=4 368 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 11a_100000720768_100000212026 [0,0,0,0,0,0|3,0,1]=4 369 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 1626a_100000720768_100000212026 [0,0,0,0,0,0|3,0,1]=4 370 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 240690a_100000720768_100000212026 [0,0,0,0,0,0|3,0,1]=4 371 B14R1.1035 Cc1ccccc1C(=O)NCCC#N 527a_100000720768_100000212026 [0,0,0,0,0,0|3,0,1]=4 372 B14R1.1035 Cc1ccccc1C(=O)NCCCF 11a_100015189416_100000212026 [0,0,0,0,0,0|3,0,0]=3 373 B14R1.1035 Cc1ccccc1C(=O)NCCCF 1626a_100015189416_100000212026 [0,0,0,0,0,0|3,0,0]=3 374 B14R1.1035 Cc1ccccc1C(=O)NCCCF 240690a_100015189416_100000212026 [0,0,0,0,0,0|3,0,0]=3 375 B14R1.1035 Cc1ccccc1C(=O)NCCCF 527a_100015189416_100000212026 [0,0,0,0,0,0|3,0,0]=3 376 B14R1.1035 Cc1ccccc1C(=O)NCCCO 240690a_100000182051_100000212026 [0,0,0,0,0,0|3,0,0]=3 377 B14R1.1035 Cc1ccccc1C(=O)NCCCO 527a_100000182051_100000212026 [0,0,0,0,0,0|3,0,0]=3 378 B14R1.1035 Cc1ccccc1C(=O)NNCCO 22a_100000210001_100000212026 [0,0,0,0,0,0|4,0,0]=4 379 B14R1.1035 Cc1ccccc1C(C)OCCCF 34a_100000742021_100011934791 [0,0,0,0,0,0|3,0,1]=4 380 B14R1.1035 Cc1ccccc1C(C)OCCCF 7a_100000742021_100011934791 [0,0,0,0,0,0|3,0,1]=4 381 B14R1.1035 Cc1ccccc1C(C)OCCCO 34a_100000742021_100000230001 [0,0,0,0,0,0|3,0,1]=4 382 B14R1.1035 Cc1ccccc1C(C)OCCCO 7a_100000742021_100011215043 [0,0,0,0,0,0|3,0,1]=4 383 B14R1.1035 N#CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000211468 [0,0,0,0,0,0|3,0,1]=4 384 B14R1.1035 N#CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000211468 [0,0,0,0,0,0|3,0,1]=4 385 B14R1.1035 N#CCCCC(=O)c1ccccc1F 1458a_100000188656_100000211468 [0,0,0,0,0,0|3,0,1]=4 386 B14R1.1035 N#CCCCC(=O)c1ccccc1I 1458a_100000187884_100000211468 [0,0,0,0,0,0|3,0,1]=4 387 B14R1.1035 N#CCCCC(=O)c1ccccc1O 1458a_100015234032_100000211468 [0,0,0,0,0,0|2,0,1]=3 388 B14R1.1035 N#CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000211468 [0,0,0,0,0,0|2,0,2]=4 389 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 11a_100000720768_100000188424 [0,0,0,0,0,0|3,0,1]=4 390 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 1626a_100000720768_100000188424 [0,0,0,0,0,0|3,0,1]=4 391 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 240690a_100000720768_100000188424 [0,0,0,0,0,0|3,0,1]=4 392 B14R1.1035 N#CCCNC(=O)c1ccccc1Br 527a_100000720768_100000188424 [0,0,0,0,0,0|3,0,1]=4 393 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 11a_100000720768_100000185844 [0,0,0,0,0,0|3,0,1]=4 394 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 1626a_100000720768_100000185844 [0,0,0,0,0,0|3,0,1]=4 395 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 240690a_100000720768_100000185844 [0,0,0,0,0,0|3,0,1]=4 396 B14R1.1035 N#CCCNC(=O)c1ccccc1Cl 527a_100000720768_100000185844 [0,0,0,0,0,0|3,0,1]=4 397 B14R1.1035 N#CCCNC(=O)c1ccccc1F 11a_100000720768_100000188656 [0,0,0,0,0,0|3,0,1]=4 398 B14R1.1035 N#CCCNC(=O)c1ccccc1F 1626a_100000720768_100000188656 [0,0,0,0,0,0|3,0,1]=4 399 B14R1.1035 N#CCCNC(=O)c1ccccc1F 240690a_100000720768_100000188656 [0,0,0,0,0,0|3,0,1]=4 400 B14R1.1035 N#CCCNC(=O)c1ccccc1F 527a_100000720768_100000188656 [0,0,0,0,0,0|3,0,1]=4 401 B14R1.1035 N#CCCNC(=O)c1ccccc1I 11a_100000720768_100000187884 [0,0,0,0,0,0|3,0,1]=4 402 B14R1.1035 N#CCCNC(=O)c1ccccc1I 1626a_100000720768_100000187884 [0,0,0,0,0,0|3,0,1]=4 403 B14R1.1035 N#CCCNC(=O)c1ccccc1I 240690a_100000720768_100000187884 [0,0,0,0,0,0|3,0,1]=4 404 B14R1.1035 N#CCCNC(=O)c1ccccc1I 527a_100000720768_100000187884 [0,0,0,0,0,0|3,0,1]=4 405 B14R1.1035 N#CCCNC(=O)c1ccccc1O 240690a_100000720768_100015234032 [0,0,0,0,0,0|2,0,1]=3 406 B14R1.1035 N#CCCNC(=O)c1ccccc1[O-] 1626a_100000720768_100009911694 [0,0,0,0,0,0|2,0,2]=4 407 B14R1.1035 N#CCCNC(=O)c1ccccc1[O-] 240690a_100000720768_100009911694 [0,0,0,0,0,0|2,0,2]=4 408 B14R1.1035 N#CCCNC(=O)c1ccccc1[O-] 527a_100000720768_100009911694 [0,0,0,0,0,0|2,0,2]=4 409 B14R1.1035 N#CCSCC(=O)c1ccccc1O 62a_100000188908_100011215382 [0,0,0,0,0,0|3,0,1]=4 410 B14R1.1035 N#CCSCC(=O)c1ccccc1O 62a_100011215382_100000188908 [0,0,0,0,0,0|3,0,1]=4 411 B14R1.1035 NCCOCC(=O)c1ccccc1Br 34a_100000210304_100000199116 [0,0,0,0,0,0|4,0,0]=4 412 B14R1.1035 NCCOCC(=O)c1ccccc1Cl 34a_100000210304_100000211432 [0,0,0,0,0,0|4,0,0]=4 413 B14R1.1035 NCCOCC(=O)c1ccccc1F 34a_100000210304_100000204681 [0,0,0,0,0,0|4,0,0]=4 414 B14R1.1035 O=C(CC#CCO)c1ccccc1O 1458a_100015234032_200000047223 [0,0,0,0,0,0|2,0,2]=4 415 B14R1.1035 O=C(CCCCF)c1ccccc1Br 1458a_100000188424_100000729493 [0,0,0,0,0,0|3,0,0]=3 416 B14R1.1035 O=C(CCCCF)c1ccccc1Cl 1458a_100000185844_100000729493 [0,0,0,0,0,0|3,0,0]=3 417 B14R1.1035 O=C(CCCCF)c1ccccc1F 1458a_100000188656_100000729493 [0,0,0,0,0,0|3,0,0]=3 418 B14R1.1035 O=C(CCCCF)c1ccccc1I 1458a_100000187884_100000729493 [0,0,0,0,0,0|3,0,0]=3 419 B14R1.1035 O=C(CCCCF)c1ccccc1O 1458a_100015234032_100000729493 [0,0,0,0,0,0|2,0,0]=2 420 B14R1.1035 O=C(CCCCF)c1ccccc1[O-] 1458a_100009911694_100000729493 [0,0,0,0,0,0|2,0,1]=3 421 B14R1.1035 O=C(CCCCO)c1ccccc1Br 1458a_100000188424_100000210776 [0,0,0,0,0,0|3,0,0]=3 422 B14R1.1035 O=C(CCCCO)c1ccccc1Cl 1458a_100000185844_100000210776 [0,0,0,0,0,0|3,0,0]=3 423 B14R1.1035 O=C(CCCCO)c1ccccc1F 1458a_100000188656_100000210776 [0,0,0,0,0,0|3,0,0]=3 424 B14R1.1035 O=C(CCCCO)c1ccccc1I 1458a_100000187884_100000210776 [0,0,0,0,0,0|3,0,0]=3 425 B14R1.1035 O=C(CCCCO)c1ccccc1O 1458a_100015234032_100000210776 [0,0,0,0,0,0|2,0,0]=2 426 B14R1.1035 O=C(CCCCO)c1ccccc1[O-] 1458a_100009911694_100000210776 [0,0,0,0,0,0|2,0,1]=3 427 B14R1.1035 O=C(CCSCF)c1ccccc1F 62a_100000086012_100015361967 [0,0,0,0,0,0|4,0,0]=4 428 B14R1.1035 O=C(CCSCF)c1ccccc1F 62a_100015361967_100000086012 [0,0,0,0,0,0|4,0,0]=4 429 B14R1.1035 O=C(CCSCF)c1ccccc1O 62a_100015361967_100009873196 [0,0,0,0,0,0|3,0,0]=3 430 B14R1.1035 O=C(CNCCF)c1ccccc1Br 34a_100000724931_100000199116 [0,0,0,0,0,0|4,0,0]=4 431 B14R1.1035 O=C(CNCCF)c1ccccc1Cl 34a_100000724931_100000211432 [0,0,0,0,0,0|4,0,0]=4 432 B14R1.1035 O=C(CNCCF)c1ccccc1F 34a_100000724931_100000204681 [0,0,0,0,0,0|4,0,0]=4 433 B14R1.1035 O=C(CNCCO)c1ccccc1Br 34a_100016990907_100000199116 [0,0,0,0,0,0|4,0,0]=4 434 B14R1.1035 O=C(CNCCO)c1ccccc1Cl 34a_100016990907_100000211432 [0,0,0,0,0,0|4,0,0]=4 435 B14R1.1035 O=C(CNCCO)c1ccccc1F 34a_100016990907_100000204681 [0,0,0,0,0,0|4,0,0]=4 436 B14R1.1035 O=C(COCCBr)c1ccccc1Br 34a_100000211926_100000199116 [0,0,0,0,0,0|4,0,0]=4 437 B14R1.1035 O=C(COCCBr)c1ccccc1Cl 34a_100000211926_100000211432 [0,0,0,0,0,0|4,0,0]=4 438 B14R1.1035 O=C(COCCBr)c1ccccc1F 34a_100000211926_100000204681 [0,0,0,0,0,0|4,0,0]=4 439 B14R1.1035 O=C(CSCCF)c1ccccc1Br 62a_100000199116_100011217306 [0,0,0,0,0,0|4,0,0]=4 440 B14R1.1035 O=C(CSCCF)c1ccccc1Cl 62a_100000211432_100011217306 [0,0,0,0,0,0|4,0,0]=4 441 B14R1.1035 O=C(CSCCF)c1ccccc1Cl 62a_100011217306_100000211432 [0,0,0,0,0,0|4,0,0]=4 442 B14R1.1035 O=C(CSCCF)c1ccccc1F 62a_100000204681_100011217306 [0,0,0,0,0,0|4,0,0]=4 443 B14R1.1035 O=C(CSCCF)c1ccccc1F 62a_100011217306_100000204681 [0,0,0,0,0,0|4,0,0]=4 444 B14R1.1035 O=C(CSCCF)c1ccccc1O 62a_100000188908_100011217306 [0,0,0,0,0,0|3,0,0]=3 445 B14R1.1035 O=C(CSCCF)c1ccccc1O 62a_100011217306_100000188908 [0,0,0,0,0,0|3,0,0]=3 446 B14R1.1035 O=C(CSCCO)c1ccccc1Br 62a_100000199116_100000211926 [0,0,0,0,0,0|4,0,0]=4 447 B14R1.1035 O=C(CSCCO)c1ccccc1Cl 62a_100000211432_100000211926 [0,0,0,0,0,0|4,0,0]=4 448 B14R1.1035 O=C(CSCCO)c1ccccc1Cl 62a_100000211926_100000211432 [0,0,0,0,0,0|4,0,0]=4 449 B14R1.1035 O=C(CSCCO)c1ccccc1F 62a_100000204681_100000211926 [0,0,0,0,0,0|4,0,0]=4 450 B14R1.1035 O=C(CSCCO)c1ccccc1F 62a_100000211926_100000204681 [0,0,0,0,0,0|4,0,0]=4 451 B14R1.1035 O=C(CSCCO)c1ccccc1O 62a_100000188908_100000211926 [0,0,0,0,0,0|3,0,0]=3 452 B14R1.1035 O=C(CSCCO)c1ccccc1O 62a_100000211926_100000188908 [0,0,0,0,0,0|3,0,0]=3 453 B14R1.1035 O=C(NCCCF)c1ccccc1Br 11a_100015189416_100000188424 [0,0,0,0,0,0|3,0,0]=3 454 B14R1.1035 O=C(NCCCF)c1ccccc1Br 1626a_100015189416_100000188424 [0,0,0,0,0,0|3,0,0]=3 455 B14R1.1035 O=C(NCCCF)c1ccccc1Br 240690a_100015189416_100000188424 [0,0,0,0,0,0|3,0,0]=3 456 B14R1.1035 O=C(NCCCF)c1ccccc1Br 527a_100015189416_100000188424 [0,0,0,0,0,0|3,0,0]=3 457 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 11a_100015189416_100000185844 [0,0,0,0,0,0|3,0,0]=3 458 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 1626a_100015189416_100000185844 [0,0,0,0,0,0|3,0,0]=3 459 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 240690a_100015189416_100000185844 [0,0,0,0,0,0|3,0,0]=3 460 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 527a_100015189416_100000185844 [0,0,0,0,0,0|3,0,0]=3 461 B14R1.1035 O=C(NCCCF)c1ccccc1F 11a_100015189416_100000188656 [0,0,0,0,0,0|3,0,0]=3 462 B14R1.1035 O=C(NCCCF)c1ccccc1F 1626a_100015189416_100000188656 [0,0,0,0,0,0|3,0,0]=3 463 B14R1.1035 O=C(NCCCF)c1ccccc1F 240690a_100015189416_100000188656 [0,0,0,0,0,0|3,0,0]=3 464 B14R1.1035 O=C(NCCCF)c1ccccc1F 527a_100015189416_100000188656 [0,0,0,0,0,0|3,0,0]=3 465 B14R1.1035 O=C(NCCCF)c1ccccc1I 11a_100015189416_100000187884 [0,0,0,0,0,0|3,0,0]=3 466 B14R1.1035 O=C(NCCCF)c1ccccc1I 1626a_100015189416_100000187884 [0,0,0,0,0,0|3,0,0]=3 467 B14R1.1035 O=C(NCCCF)c1ccccc1I 240690a_100015189416_100000187884 [0,0,0,0,0,0|3,0,0]=3 468 B14R1.1035 O=C(NCCCF)c1ccccc1I 527a_100015189416_100000187884 [0,0,0,0,0,0|3,0,0]=3 469 B14R1.1035 O=C(NCCCF)c1ccccc1O 240690a_100015189416_100015234032 [0,0,0,0,0,0|2,0,0]=2 470 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 1626a_100015189416_100009911694 [0,0,0,0,0,0|2,0,1]=3 471 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 240690a_100015189416_100009911694 [0,0,0,0,0,0|2,0,1]=3 472 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 527a_100015189416_100009911694 [0,0,0,0,0,0|2,0,1]=3 473 B14R1.1035 O=C(NCCCO)c1ccccc1Br 240690a_100000182051_100000188424 [0,0,0,0,0,0|3,0,0]=3 474 B14R1.1035 O=C(NCCCO)c1ccccc1Br 527a_100000182051_100000188424 [0,0,0,0,0,0|3,0,0]=3 475 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 240690a_100000182051_100000185844 [0,0,0,0,0,0|3,0,0]=3 476 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 527a_100000182051_100000185844 [0,0,0,0,0,0|3,0,0]=3 477 B14R1.1035 O=C(NCCCO)c1ccccc1F 240690a_100000182051_100000188656 [0,0,0,0,0,0|3,0,0]=3 478 B14R1.1035 O=C(NCCCO)c1ccccc1F 527a_100000182051_100000188656 [0,0,0,0,0,0|3,0,0]=3 479 B14R1.1035 O=C(NCCCO)c1ccccc1I 240690a_100000182051_100000187884 [0,0,0,0,0,0|3,0,0]=3 480 B14R1.1035 O=C(NCCCO)c1ccccc1I 527a_100000182051_100000187884 [0,0,0,0,0,0|3,0,0]=3 481 B14R1.1035 O=C(NCCCO)c1ccccc1O 240690a_100000182051_100015234032 [0,0,0,0,0,0|2,0,0]=2 482 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 240690a_100000182051_100009911694 [0,0,0,0,0,0|2,0,1]=3 483 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 527a_100000182051_100009911694 [0,0,0,0,0,0|2,0,1]=3 484 B14R1.1035 O=C(NNCCO)c1ccccc1Br 22a_100000210001_100000188424 [0,0,0,0,0,0|4,0,0]=4 485 B14R1.1035 O=C(NNCCO)c1ccccc1Cl 22a_100000210001_100000185844 [0,0,0,0,0,0|4,0,0]=4 486 B14R1.1035 O=C(NNCCO)c1ccccc1F 22a_100000210001_100000188656 [0,0,0,0,0,0|4,0,0]=4 487 B14R1.1035 O=C(NNCCO)c1ccccc1I 22a_100000210001_100000187884 [0,0,0,0,0,0|4,0,0]=4 488 B14R1.1035 O=C(NNCCO)c1ccccc1O 22a_100000210001_100015234032 [0,0,0,0,0,0|3,0,0]=3 489 B14R1.1035 O=C(NNCCO)c1ccccc1[O-] 22a_100000210001_100009911694 [0,0,0,0,0,0|3,0,1]=4 490 B14R1.1035 O=CCSCC(=O)c1ccccc1O 62a_100000188908_200015260668 [0,0,0,0,0,0|3,0,1]=4 491 B14R1.1035 O=CCSCC(=O)c1ccccc1O 62a_200015260668_100000188908 [0,0,0,0,0,0|3,0,1]=4 492 B14R1.1035 [13CH3]NCCNC(=O)c1ccccc1Cl 2230a_100000737833_200025704644 [0,0,0,0,0,0|3,0,0]=3 493 B14R1.1035 [13CH3]NCCNC(=O)c1ccccc1Cl 34a_100000737833_200025704644 [0,0,0,0,0,0|3,0,0]=3 494 B14R1.1035 [13CH3]OCCNC(=O)c1ccccc1Br 34a_200000158863_200025704644 [0,0,0,0,0,0|3,0,0]=3 495 B14R1.1035 [13CH3]OCCNC(=O)c1ccccc1Br 7a_200000158863_200025704644 [0,0,0,0,0,0|3,0,0]=3 496 B13R1.24 C#CCCCC(=O)c1ccccc1 1458a_100000185807_100000731252 [1,0,0,0,0,0|1,0,2]=4 497 B13R1.24 C#CCCNC(=O)c1ccccc1 11a_100000755551_100000185807 [1,0,0,0,0,0|1,0,2]=4 498 B13R1.24 C#CCCNC(=O)c1ccccc1 1626a_100000755551_100000185807 [1,0,0,0,0,0|1,0,2]=4 499 B13R1.24 C#CCCNC(=O)c1ccccc1 240690a_100000755551_100000185807 [1,0,0,0,0,0|1,0,2]=4 500 B13R1.24 C#CCCNC(=O)c1ccccc1 527a_100000755551_100000185807 [1,0,0,0,0,0|1,0,2]=4 501 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [1,0,0,0,0,0|1,0,2]=4 502 B13R1.24 C=CCCNC(=O)c1ccccc1 11a_100015191253_100000185807 [1,0,0,0,0,0|1,0,2]=4 503 B13R1.24 C=CCCNC(=O)c1ccccc1 1626a_100015191253_100000185807 [1,0,0,0,0,0|1,0,2]=4 504 B13R1.24 C=CCCNC(=O)c1ccccc1 240690a_100015191253_100000185807 [1,0,0,0,0,0|1,0,2]=4 505 B13R1.24 C=CCCNC(=O)c1ccccc1 527a_100015191253_100000185807 [1,0,0,0,0,0|1,0,2]=4 506 B13R1.24 CC#CCNC(=O)c1ccccc1 11a_100000685387_100000185807 [1,0,0,0,0,0|1,0,2]=4 507 B13R1.24 CC#CCNC(=O)c1ccccc1 1626a_100000685387_100000185807 [1,0,0,0,0,0|1,0,2]=4 508 B13R1.24 CC#CCNC(=O)c1ccccc1 527a_100000685387_100000185807 [1,0,0,0,0,0|1,0,2]=4 509 B13R1.24 CC(OCCCBr)c1ccccc1 34a_100011217188_100000211855 [1,0,0,0,0,0|2,0,1]=4 510 B13R1.24 CC(OCCCCl)c1ccccc1 34a_100000230001_100000211855 [1,0,0,0,0,0|2,0,1]=4 511 B13R1.24 CC(OCCCF)c1ccccc1 34a_100000759539_100000211855 [1,0,0,0,0,0|2,0,1]=4 512 B13R1.24 CC(OCCCN)c1ccccc1 34a_100000182051_100000211855 [1,0,0,0,0,0|2,0,1]=4 513 B13R1.24 CC/C=C\CC(=O)c1ccccc1 1458a_100000185807_100103147603 [1,0,0,0,0,0|1,0,2]=4 514 B13R1.24 CCC#CCC(=O)c1ccccc1 1458a_100000185807_100009813939 [1,0,0,0,0,0|1,0,2]=4 515 B13R1.24 CCC=NNC(=O)c1ccccc1 4a_100000184135_100000210100 [1,0,0,0,0,0|2,0,1]=4 516 B13R1.24 CCCCCC(=O)c1ccccc1 1458a_100000185807_100000210326 [1,0,0,0,0,0|1,0,0]=2 517 B13R1.24 CCCCCN(C)c1ccccc1 2230a_100000210012_100000210326 [1,0,0,0,0,0|3,0,0]=4 518 B13R1.24 CCCCCN(C)c1ccccc1 2230a_200000219563_200000210301 [1,0,0,0,0,0|3,0,0]=4 519 B13R1.24 CCCCCN(C)c1ccccc1 269982a_100000210012_100000210215 [1,0,0,0,0,0|3,0,0]=4 520 B13R1.24 CCCCCN(C)c1ccccc1 269982a_200000219563_200000210301 [1,0,0,0,0,0|3,0,0]=4 521 B13R1.24 CCCCCN(C)c1ccccc1 34a_100000210012_100000718602 [1,0,0,0,0,0|3,0,0]=4 522 B13R1.24 CCCCCN(C)c1ccccc1 34a_200000219563_200000210301 [1,0,0,0,0,0|3,0,0]=4 523 B13R1.24 CCCCCN(C)c1ccccc1 7a_200000219563_200000210301 [1,0,0,0,0,0|3,0,0]=4 524 B13R1.24 CCCCCN([13CH3])c1ccccc1 2230a_200000219563_200025704644 [1,0,0,0,0,0|3,0,0]=4 525 B13R1.24 CCCCCN([13CH3])c1ccccc1 269982a_200000219563_200025704644 [1,0,0,0,0,0|3,0,0]=4 526 B13R1.24 CCCCCN([13CH3])c1ccccc1 34a_200000219563_200025704644 [1,0,0,0,0,0|3,0,0]=4 527 B13R1.24 CCCCCN([13CH3])c1ccccc1 7a_200000219563_200025704644 [1,0,0,0,0,0|3,0,0]=4 528 B13R1.24 CCCCNC(=O)c1ccccc1 11a_100000102301_100000185807 [1,0,0,0,0,0|1,0,0]=2 529 B13R1.24 CCCCNC(=O)c1ccccc1 1626a_100000102301_100000185807 [1,0,0,0,0,0|1,0,0]=2 530 B13R1.24 CCCCNC(=O)c1ccccc1 240690a_100000102301_100000185807 [1,0,0,0,0,0|1,0,0]=2 531 B13R1.24 CCCCNC(=O)c1ccccc1 527a_100000102301_100000185807 [1,0,0,0,0,0|1,0,0]=2 532 B13R1.24 CCCCNC(C)c1ccccc1 2230a_100000102301_100000230085 [1,0,0,0,0,0|2,0,1]=4 533 B13R1.24 CCCCNC(C)c1ccccc1 269862a_100000102301_100000185851 [1,0,0,0,0,0|2,0,1]=4 534 B13R1.24 CCCCNC(C)c1ccccc1 7a_106832991798_100000230085 [1,0,0,0,0,0|2,0,1]=4 535 B13R1.24 CCCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210211 [1,0,0,0,0,0|2,0,1]=4 536 B13R1.24 CCCCOC(C)c1ccccc1 34a_100000210227_100000211855 [1,0,0,0,0,0|1,0,1]=3 537 B13R1.24 CCCCOC(C)c1ccccc1 7a_100000210227_100000230085 [1,0,0,0,0,0|1,0,1]=3 538 B13R1.24 CCCCO[C@H](C)c1ccccc1 34a_100000761318_100000210210 [1,0,0,0,0,0|1,0,1]=3 539 B13R1.24 CCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210211 [1,0,0,0,0,0|1,0,1]=3 540 B13R1.24 CCCCSC(C)c1ccccc1 62a_100000210211_100000230085 [1,0,0,0,0,0|1,1,1]=4 541 B13R1.24 CCCCSC(C)c1ccccc1 62a_100000230085_100000210210 [1,0,0,0,0,0|1,1,1]=4 542 B13R1.24 CCCNN=C(C)c1ccccc1 4a_100000740057_100000185851 [1,0,0,0,0,0|3,0,0]=4 543 B13R1.24 CCCNNC(=O)c1ccccc1 22a_100000740057_100000185807 [1,0,0,0,0,0|2,0,0]=3 544 B13R1.24 CCCOCC(=O)c1ccccn1 34a_100000210258_100000027445 [1,0,0,0,0,0|3,0,0]=4 545 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000210303_100000211460 [1,0,0,0,0,0|2,0,0]=3 546 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000211460_100000210303 [1,0,0,0,0,0|2,0,0]=3 547 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000027445_100000210303 [1,0,0,0,0,0|3,0,0]=4 548 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000210303_100000027445 [1,0,0,0,0,0|3,0,0]=4 549 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000210303_100000757877 [1,0,0,0,0,0|3,0,0]=4 550 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000757877_100000210303 [1,0,0,0,0,0|3,0,0]=4 551 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000027454_100000210303 [1,0,0,0,0,0|3,0,0]=4 552 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000210303_100000027454 [1,0,0,0,0,0|3,0,0]=4 553 B13R1.24 CCCSCS(=O)c1ccccc1 62a_100000210303_100000031784 [1,0,0,0,0,0|3,0,0]=4 554 B13R1.24 CCNCCC(=O)c1ccccc1 2230a_100015525214_100000750707 [1,0,0,0,0,0|2,0,0]=3 555 B13R1.24 CCNCCS(=O)c1ccccc1 2230a_100015525214_100000740319 [1,0,0,0,0,0|3,0,0]=4 556 B13R1.24 CCOCCC(=O)c1ccccc1 1458a_100000185807_100011215890 [1,0,0,0,0,0|2,0,0]=3 557 B13R1.24 CCSCCC(=O)c1ccccc1 1458a_100000185807_100000757381 [1,0,0,0,0,0|2,0,0]=3 558 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000210202_100000750707 [1,0,0,0,0,0|2,0,0]=3 559 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000750707_100000210202 [1,0,0,0,0,0|2,0,0]=3 560 B13R1.24 CCSCCS(=O)c1ccccc1 62a_100000210202_100000740319 [1,0,0,0,0,0|3,0,0]=4 561 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000073877_100000210202 [1,0,0,0,0,0|1,0,0]=2 562 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000210202_100000073877 [1,0,0,0,0,0|1,0,0]=2 563 B13R1.24 CNCCCC(=O)c1ccccc1 2230a_106832991635_100000211006 [1,0,0,0,0,0|2,0,0]=3 564 B13R1.24 CNCCCC(=O)c1ccccc1 7a_106832991635_100000211006 [1,0,0,0,0,0|2,0,0]=3 565 B13R1.24 CNCCNC(=O)c1ccccc1 2230a_100000736134_200000210301 [1,0,0,0,0,0|2,0,0]=3 566 B13R1.24 CNCCNC(=O)c1ccccc1 7a_106832991635_200011215302 [1,0,0,0,0,0|2,0,0]=3 567 B13R1.24 CNCCNC(=O)c1ccncc1 2230a_200011198449_200000210301 [1,0,0,0,0,0|3,0,0]=4 568 B13R1.24 CNCCOC(=O)c1ccccc1 34a_100102657272_100009812718 [1,0,0,0,0,0|1,0,0]=2 569 B13R1.24 CNCCOC(=O)c1ccccc1 7a_106832991635_100000184176 [1,0,0,0,0,0|1,0,0]=2 570 B13R1.24 COCCCC(=O)c1ccccc1 1458a_100000185807_100000740836 [1,0,0,0,0,0|2,0,0]=3 571 B13R1.24 COCCNC(=O)c1ccccc1 1626a_100000209980_100000185807 [1,0,0,0,0,0|2,0,0]=3 572 B13R1.24 COCCNC(=O)c1ccccc1 240690a_100000209980_100000185807 [1,0,0,0,0,0|2,0,0]=3 573 B13R1.24 COCCNC(=O)c1ccccc1 34a_200000158897_200000210301 [1,0,0,0,0,0|2,0,0]=3 574 B13R1.24 COCCNC(=O)c1ccccc1 527a_100000209980_100000185807 [1,0,0,0,0,0|2,0,0]=3 575 B13R1.24 COCCNC(=O)c1ccccc1 7a_200000158897_200000210301 [1,0,0,0,0,0|2,0,0]=3 576 B13R1.24 COCCOC(=O)c1ccccc1 34a_100138415774_100009812718 [1,0,0,0,0,0|1,0,0]=2 577 B13R1.24 COCCOC(=O)c1ccccc1 7a_100000025465_200000210301 [1,0,0,0,0,0|1,0,0]=2 578 B13R1.24 COCCOC(C)c1ccccc1 34a_100000210237_100000211855 [1,0,0,0,0,0|2,0,1]=4 579 B13R1.24 COCCO[C@H](C)c1ccccc1 34a_100000761318_100011201679 [1,0,0,0,0,0|2,0,1]=4 580 B13R1.24 COCCO[C@H](C)c1ccccc1 7a_100000761318_100000233755 [1,0,0,0,0,0|2,0,1]=4 581 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000211460_100000766300 [1,0,0,0,0,0|3,0,0]=4 582 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000766300_100000211460 [1,0,0,0,0,0|3,0,0]=4 583 B13R1.24 CSCCCC(=O)c1ccccc1 62a_100000211006_200000210301 [1,0,0,0,0,0|2,0,0]=3 584 B13R1.24 CSCCCC(=O)c1ccccc1 62a_200000210301_100000211006 [1,0,0,0,0,0|2,0,0]=3 585 B13R1.24 CSCCNC(=O)c1ccccc1 11a_100020590264_100000185807 [1,0,0,0,0,0|2,0,0]=3 586 B13R1.24 CSCCNC(=O)c1ccccc1 1626a_100020590264_100000185807 [1,0,0,0,0,0|2,0,0]=3 587 B13R1.24 CSCCNC(=O)c1ccccc1 240690a_100020590264_100000185807 [1,0,0,0,0,0|2,0,0]=3 588 B13R1.24 CSCCNC(=O)c1ccccc1 527a_100020590264_100000185807 [1,0,0,0,0,0|2,0,0]=3 589 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200000210301_200011215302 [1,0,0,0,0,0|2,0,0]=3 590 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200011215302_200000210301 [1,0,0,0,0,0|2,0,0]=3 591 B13R1.24 CSCCOC(=O)c1ccccc1 62a_100009812718_200000210301 [1,0,0,0,0,0|1,0,0]=2 592 B13R1.24 CSCCOC(=O)c1ccccc1 62a_200000210301_100009812718 [1,0,0,0,0,0|1,0,0]=2 593 B13R1.24 CSCCOC(C)c1ccccc1 34a_100000230434_100000211855 [1,0,0,0,0,0|2,0,1]=4 594 B13R1.24 CSCCOC(C)c1ccccc1 7a_100000230434_100000230085 [1,0,0,0,0,0|2,0,1]=4 595 B13R1.24 CSCCO[C@H](C)c1ccccc1 34a_100000761318_100000212216 [1,0,0,0,0,0|2,0,1]=4 596 B13R1.24 CSCCO[C@H](C)c1ccccc1 7a_100000761318_100000212216 [1,0,0,0,0,0|2,0,1]=4 597 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100000211460_100011218213 [1,0,0,0,0,0|3,0,0]=4 598 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100011218213_100000211460 [1,0,0,0,0,0|3,0,0]=4 599 B13R1.24 C[C@@H](OCCCF)c1ccccc1 34a_100000761318_100011934791 [1,0,0,0,0,0|2,0,1]=4 600 B13R1.24 C[C@@H](OCCCF)c1ccccc1 7a_100000761318_100011934791 [1,0,0,0,0,0|2,0,1]=4 601 B13R1.24 C[C@@H](OCCCO)c1ccccc1 34a_100000761318_100000230001 [1,0,0,0,0,0|2,0,1]=4 602 B13R1.24 C[C@@H](OCCCO)c1ccccc1 7a_100000761318_100011215043 [1,0,0,0,0,0|2,0,1]=4 603 B13R1.24 N#CCCCC(=O)c1ccccc1 1458a_100000185807_100000211468 [1,0,0,0,0,0|2,0,1]=4 604 B13R1.24 N#CCCNC(=O)c1ccccc1 11a_100000720768_100000185807 [1,0,0,0,0,0|2,0,1]=4 605 B13R1.24 N#CCCNC(=O)c1ccccc1 1626a_100000720768_100000185807 [1,0,0,0,0,0|2,0,1]=4 606 B13R1.24 N#CCCNC(=O)c1ccccc1 240690a_100000720768_100000185807 [1,0,0,0,0,0|2,0,1]=4 607 B13R1.24 N#CCCNC(=O)c1ccccc1 527a_100000720768_100000185807 [1,0,0,0,0,0|2,0,1]=4 608 B13R1.24 O=C(CCCCF)c1ccccc1 1458a_100000185807_100000729493 [1,0,0,0,0,0|2,0,0]=3 609 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [1,0,0,0,0,0|2,0,0]=3 610 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100000750707_100015361967 [1,0,0,0,0,0|3,0,0]=4 611 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100015361967_100000750707 [1,0,0,0,0,0|3,0,0]=4 612 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100000211460_100011217306 [1,0,0,0,0,0|3,0,0]=4 613 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100011217306_100000211460 [1,0,0,0,0,0|3,0,0]=4 614 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211460_100000211926 [1,0,0,0,0,0|3,0,0]=4 615 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211926_100000211460 [1,0,0,0,0,0|3,0,0]=4 616 B13R1.24 O=C(NCCCF)c1ccccc1 11a_100015189416_100000185807 [1,0,0,0,0,0|2,0,0]=3 617 B13R1.24 O=C(NCCCF)c1ccccc1 1626a_100015189416_100000185807 [1,0,0,0,0,0|2,0,0]=3 618 B13R1.24 O=C(NCCCF)c1ccccc1 240690a_100015189416_100000185807 [1,0,0,0,0,0|2,0,0]=3 619 B13R1.24 O=C(NCCCF)c1ccccc1 527a_100015189416_100000185807 [1,0,0,0,0,0|2,0,0]=3 620 B13R1.24 O=C(NCCCO)c1ccccc1 240690a_100000182051_100000185807 [1,0,0,0,0,0|2,0,0]=3 621 B13R1.24 O=C(NCCCO)c1ccccc1 527a_100000182051_100000185807 [1,0,0,0,0,0|2,0,0]=3 622 B13R1.24 O=C(NNCCO)c1ccccc1 22a_100000210001_100000185807 [1,0,0,0,0,0|3,0,0]=4 623 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100000073877_100015361967 [1,0,0,0,0,0|2,0,0]=3 624 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100015361967_100000073877 [1,0,0,0,0,0|2,0,0]=3 625 B13R1.24 [13CH3]NCCNC(=O)c1ccccc1 2230a_100000736134_200025704644 [1,0,0,0,0,0|2,0,0]=3 626 B13R1.24 [13CH3]NCCNC(=O)c1ccncc1 2230a_200011198449_200025704644 [1,0,0,0,0,0|3,0,0]=4 627 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 34a_200000158897_200025704644 [1,0,0,0,0,0|2,0,0]=3 628 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 7a_200000158897_200025704644 [1,0,0,0,0,0|2,0,0]=3 629 B13R1.24 [13CH3]OCCOC(=O)c1ccccc1 7a_100000025465_200025704644 [1,0,0,0,0,0|1,0,0]=2 630 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_100000211006_200025704644 [1,0,0,0,0,0|2,0,0]=3 631 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_200025704644_100000211006 [1,0,0,0,0,0|2,0,0]=3 632 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200011215302_200025704644 [1,0,0,0,0,0|2,0,0]=3 633 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200025704644_200011215302 [1,0,0,0,0,0|2,0,0]=3 634 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_100009812718_200025704644 [1,0,0,0,0,0|1,0,0]=2 635 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_200025704644_100009812718 [1,0,0,0,0,0|1,0,0]=2 636 B13R1.555 BrCCCOCc1ccccc1Br 34a_100011217188_100000184730 [1,0,0,0,0,0|2,0,1]=4 637 B13R1.555 BrCCCOCc1ccccc1I 34a_100011217188_100011215278 [1,0,0,0,0,0|2,0,1]=4 638 B13R1.555 CCCCC=Cc1c[nH]ccc1=O 271570a_100016275911_100009998708 [1,0,0,0,0,0|2,0,1]=4 639 B13R1.555 CCCCC=Cc1c[nH]ccc1=S 271570a_100016275911_200012280681 [1,0,0,0,0,0|2,1,0]=4 640 B13R1.555 CCCCC=Cc1ccc[nH]c1=O 271570a_100016275911_100000050042 [1,0,0,0,0,0|2,0,1]=4 641 B13R1.555 CCCCC=Cc1cccc[n+]1C 271570a_100016275911_100000212160 [1,0,0,0,0,0|3,0,0]=4 642 B13R1.555 CCCCC=Cc1cccc[n+]1[O-] 271570a_100016275911_200000042595 [1,0,0,0,0,0|2,0,1]=4 643 B13R1.555 CCCCC=Cc1ccccc1Br 271570a_100016275911_100000695589 [1,0,0,0,0,0|2,0,0]=3 644 B13R1.555 CCCCC=Cc1ccccc1C 271570a_100016275911_100000210755 [1,0,0,0,0,0|2,0,0]=3 645 B13R1.555 CCCCC=Cc1ccccc1Cl 271570a_100016275911_100000764095 [1,0,0,0,0,0|2,0,0]=3 646 B13R1.555 CCCCC=Cc1ccccc1F 271570a_100016275911_100011215700 [1,0,0,0,0,0|2,0,0]=3 647 B13R1.555 CCCCC=Cc1ccccc1N 271570a_100016275911_100000210017 [1,0,0,0,0,0|2,0,0]=3 648 B13R1.555 CCCCC=Cc1ccccc1O 271570a_100016275911_100000739446 [1,0,0,0,0,0|1,0,0]=2 649 B13R1.555 CCCCC=Cc1cccnc1Br 271570a_100016275911_100010202626 [1,0,0,0,0,0|3,0,0]=4 650 B13R1.555 CCCCC=Cc1cccnc1C 271570a_100016275911_100000751574 [1,0,0,0,0,0|3,0,0]=4 651 B13R1.555 CCCCC=Cc1cccnc1Cl 271570a_100016275911_100000036424 [1,0,0,0,0,0|3,0,0]=4 652 B13R1.555 CCCCC=Cc1cccnc1F 271570a_100016275911_100009816115 [1,0,0,0,0,0|3,0,0]=4 653 B13R1.555 CCCCC=Cc1cccnc1N 271570a_100016275911_100000045569 [1,0,0,0,0,0|3,0,0]=4 654 B13R1.555 CCCCC=Cc1ccncc1Br 271570a_100016275911_100000726257 [1,0,0,0,0,0|3,0,0]=4 655 B13R1.555 CCCCC=Cc1ccncc1C 271570a_100016275911_100015191297 [1,0,0,0,0,0|3,0,0]=4 656 B13R1.555 CCCCC=Cc1ccncc1Cl 271570a_100016275911_100000708259 [1,0,0,0,0,0|3,0,0]=4 657 B13R1.555 CCCCC=Cc1ccncc1F 271570a_100016275911_100000047030 [1,0,0,0,0,0|3,0,0]=4 658 B13R1.555 CCCCC=Cc1ccncc1N 271570a_100016275911_100009815883 [1,0,0,0,0,0|3,0,0]=4 659 B13R1.555 CCCCC=Cc1ccncc1O 271570a_100016275911_100009817591 [1,0,0,0,0,0|2,0,0]=3 660 B13R1.555 CCCCC=Cc1cnccc1Br 271570a_100016275911_100010138639 [1,0,0,0,0,0|3,0,0]=4 661 B13R1.555 CCCCC=Cc1cnccc1C 271570a_100016275911_100000761580 [1,0,0,0,0,0|3,0,0]=4 662 B13R1.555 CCCCC=Cc1cnccc1Cl 271570a_100016275911_100009995489 [1,0,0,0,0,0|3,0,0]=4 663 B13R1.555 CCCCC=Cc1cnccc1F 271570a_100016275911_100009820683 [1,0,0,0,0,0|3,0,0]=4 664 B13R1.555 CCCCC=Cc1cnccc1N 271570a_100016275911_100000047001 [1,0,0,0,0,0|3,0,0]=4 665 B13R1.555 CCCCC=Cc1cncnc1O 271570a_100016275911_100000751107 [1,0,0,0,0,0|3,0,0]=4 666 B13R1.555 CCCCC=Cc1ncccc1Br 271570a_100016275911_100000696092 [1,0,0,0,0,0|3,0,0]=4 667 B13R1.555 CCCCC=Cc1ncccc1C 271570a_100016275911_100000751373 [1,0,0,0,0,0|3,0,0]=4 668 B13R1.555 CCCCC=Cc1ncccc1Cl 271570a_100016275911_100011356963 [1,0,0,0,0,0|3,0,0]=4 669 B13R1.555 CCCCC=Cc1ncccc1F 271570a_100016275911_100000685392 [1,0,0,0,0,0|3,0,0]=4 670 B13R1.555 CCCCC=Cc1ncccc1N 271570a_100016275911_100000688686 [1,0,0,0,0,0|3,0,0]=4 671 B13R1.555 CCCCC=Cc1ncccc1O 271570a_100016275911_100000034122 [1,0,0,0,0,0|2,0,0]=3 672 B13R1.555 CCCCCNc1ccccc1Br 34a_100000210017_100000718602 [1,0,0,0,0,0|3,0,0]=4 673 B13R1.555 CCCCCNc1ccccc1C 34a_100015192222_100000718602 [1,0,0,0,0,0|3,0,0]=4 674 B13R1.555 CCCCCNc1ccccc1Cl 34a_100000185783_100000718602 [1,0,0,0,0,0|3,0,0]=4 675 B13R1.555 CCCCCNc1ccccc1F 34a_100000210422_100000718602 [1,0,0,0,0,0|3,0,0]=4 676 B13R1.555 CCCCCNc1ccccc1I 34a_100000210053_100000718602 [1,0,0,0,0,0|3,0,0]=4 677 B13R1.555 CCCCCNc1ccccc1O 34a_100000185747_100000718602 [1,0,0,0,0,0|2,0,0]=3 678 B13R1.555 CCCCCOc1ccccc1Br 34a_100000181306_100000718602 [1,0,0,0,0,0|3,0,0]=4 679 B13R1.555 CCCCCOc1ccccc1Br 7a_100000181306_100000210326 [1,0,0,0,0,0|3,0,0]=4 680 B13R1.555 CCCCCOc1ccccc1C 34a_100000210338_100000718602 [1,0,0,0,0,0|3,0,0]=4 681 B13R1.555 CCCCCOc1ccccc1C 7a_100000210338_100000210326 [1,0,0,0,0,0|3,0,0]=4 682 B13R1.555 CCCCCOc1ccccc1Cl 34a_100000210172_100000718602 [1,0,0,0,0,0|3,0,0]=4 683 B13R1.555 CCCCCOc1ccccc1Cl 7a_100000210172_100000210326 [1,0,0,0,0,0|3,0,0]=4 684 B13R1.555 CCCCCOc1ccccc1F 34a_100000210171_100000718602 [1,0,0,0,0,0|3,0,0]=4 685 B13R1.555 CCCCCOc1ccccc1F 7a_100000210171_100000210326 [1,0,0,0,0,0|3,0,0]=4 686 B13R1.555 CCCCCOc1ccccc1I 34a_100000739446_100000718602 [1,0,0,0,0,0|3,0,0]=4 687 B13R1.555 CCCCCOc1ccccc1I 7a_100000739446_100000210326 [1,0,0,0,0,0|3,0,0]=4 688 B13R1.555 CCCCCOc1ccccc1N 34a_100000185747_100000718602 [1,0,0,0,0,0|3,0,0]=4 689 B13R1.555 CCCCCOc1ccccc1N 7a_100000185747_100000210326 [1,0,0,0,0,0|3,0,0]=4 690 B13R1.555 CCCCCSc1ccccc1Br 62a_100000210326_100000695589 [1,0,0,0,0,0|3,0,0]=4 691 B13R1.555 CCCCCSc1ccccc1Br 62a_100000695589_100000210326 [1,0,0,0,0,0|3,0,0]=4 692 B13R1.555 CCCCCSc1ccccc1C 62a_100000210326_100000210755 [1,0,0,0,0,0|3,0,0]=4 693 B13R1.555 CCCCCSc1ccccc1C 62a_100000210755_100000210326 [1,0,0,0,0,0|3,0,0]=4 694 B13R1.555 CCCCCSc1ccccc1Cl 62a_100000210326_100000764095 [1,0,0,0,0,0|3,0,0]=4 695 B13R1.555 CCCCCSc1ccccc1Cl 62a_100000764095_100000210326 [1,0,0,0,0,0|3,0,0]=4 696 B13R1.555 CCCCCSc1ccccc1F 62a_100000210326_100011215700 [1,0,0,0,0,0|3,0,0]=4 697 B13R1.555 CCCCCSc1ccccc1F 62a_100011215700_100000210326 [1,0,0,0,0,0|3,0,0]=4 698 B13R1.555 CCCCCSc1ccccc1N 62a_100000210017_100000210326 [1,0,0,0,0,0|3,0,0]=4 699 B13R1.555 CCCCCSc1ccccc1N 62a_100000210326_100000210017 [1,0,0,0,0,0|3,0,0]=4 700 B13R1.555 CCCCCSc1ccccc1O 62a_100000210326_100000739446 [1,0,0,0,0,0|2,0,0]=3 701 B13R1.555 CCCCCSc1ccccc1O 62a_100000739446_100000210326 [1,0,0,0,0,0|2,0,0]=3 702 B13R1.555 CCCCCSc1cccnc1O 62a_100000210326_100000760158 [1,0,0,0,0,0|3,0,0]=4 703 B13R1.555 CCCCCSc1cccnc1O 62a_100000760158_100000210326 [1,0,0,0,0,0|3,0,0]=4 704 B13R1.555 CCCCCSc1ccncc1O 62a_100000210326_100009817591 [1,0,0,0,0,0|3,0,0]=4 705 B13R1.555 CCCCCSc1ccncc1O 62a_100009817591_100000210326 [1,0,0,0,0,0|3,0,0]=4 706 B13R1.555 CCCCCSc1ncccc1O 62a_100000034122_100000210326 [1,0,0,0,0,0|3,0,0]=4 707 B13R1.555 CCCCCSc1ncccc1O 62a_100000210326_100000034122 [1,0,0,0,0,0|3,0,0]=4 708 B13R1.555 CCCCNCc1ccccc1Br 207a_100000102301_100000211189 [1,0,0,0,0,0|2,0,1]=4 709 B13R1.555 CCCCNCc1ccccc1Br 2230a_100000102301_100000184730 [1,0,0,0,0,0|2,0,1]=4 710 B13R1.555 CCCCNCc1ccccc1Br 2230a_100000689332_100000210211 [1,0,0,0,0,0|2,0,1]=4 711 B13R1.555 CCCCNCc1ccccc1Br 270004a_100000102301_100000211189 [1,0,0,0,0,0|2,0,1]=4 712 B13R1.555 CCCCNCc1ccccc1Br 34a_100000689332_100000210210 [1,0,0,0,0,0|2,0,1]=4 713 B13R1.555 CCCCNCc1ccccc1Br 7a_106832991798_100000184730 [1,0,0,0,0,0|2,0,1]=4 714 B13R1.555 CCCCNCc1ccccc1C 207a_100000102301_100000211143 [1,0,0,0,0,0|2,0,1]=4 715 B13R1.555 CCCCNCc1ccccc1C 2230a_100000102301_100000211839 [1,0,0,0,0,0|2,0,1]=4 716 B13R1.555 CCCCNCc1ccccc1C 270004a_100000102301_100000211143 [1,0,0,0,0,0|2,0,1]=4 717 B13R1.555 CCCCNCc1ccccc1C 34a_100000174972_100000210210 [1,0,0,0,0,0|2,0,1]=4 718 B13R1.555 CCCCNCc1ccccc1C 7a_106832991798_100000211839 [1,0,0,0,0,0|2,0,1]=4 719 B13R1.555 CCCCNCc1ccccc1Cl 207a_100000102301_100000210073 [1,0,0,0,0,0|2,0,1]=4 720 B13R1.555 CCCCNCc1ccccc1Cl 2230a_100000102301_100000187162 [1,0,0,0,0,0|2,0,1]=4 721 B13R1.555 CCCCNCc1ccccc1Cl 2230a_100000174879_100000210211 [1,0,0,0,0,0|2,0,1]=4 722 B13R1.555 CCCCNCc1ccccc1Cl 270004a_100000102301_100000210073 [1,0,0,0,0,0|2,0,1]=4 723 B13R1.555 CCCCNCc1ccccc1Cl 34a_100000174879_100000210210 [1,0,0,0,0,0|2,0,1]=4 724 B13R1.555 CCCCNCc1ccccc1Cl 7a_106832991798_100000187162 [1,0,0,0,0,0|2,0,1]=4 725 B13R1.555 CCCCNCc1ccccc1F 207a_100000102301_100000210811 [1,0,0,0,0,0|2,0,1]=4 726 B13R1.555 CCCCNCc1ccccc1F 2230a_100000102301_100000211605 [1,0,0,0,0,0|2,0,1]=4 727 B13R1.555 CCCCNCc1ccccc1F 270004a_100000102301_100000210811 [1,0,0,0,0,0|2,0,1]=4 728 B13R1.555 CCCCNCc1ccccc1F 34a_100000174869_100000210210 [1,0,0,0,0,0|2,0,1]=4 729 B13R1.555 CCCCNCc1ccccc1F 7a_106832991798_100000211605 [1,0,0,0,0,0|2,0,1]=4 730 B13R1.555 CCCCNCc1ccccc1I 207a_100000102301_100000010305 [1,0,0,0,0,0|2,0,1]=4 731 B13R1.555 CCCCNCc1ccccc1I 2230a_100000102301_100011215278 [1,0,0,0,0,0|2,0,1]=4 732 B13R1.555 CCCCNCc1ccccc1I 270004a_100000102301_100000010305 [1,0,0,0,0,0|2,0,1]=4 733 B13R1.555 CCCCNCc1ccccc1I 7a_106832991798_100011215278 [1,0,0,0,0,0|2,0,1]=4 734 B13R1.555 CCCCNCc1ccccc1O 34a_100000185550_100000210210 [1,0,0,0,0,0|1,0,1]=3 735 B13R1.555 CCCCNCc1cccnc1O 207a_100000102301_100011998315 [1,0,0,0,0,0|2,0,1]=4 736 B13R1.555 CCCCNCc1cccnc1O 270004a_100000102301_100011998315 [1,0,0,0,0,0|2,0,1]=4 737 B13R1.555 CCCCNCc1ncccc1O 7a_106832991798_200020655725 [1,0,0,0,0,0|2,0,1]=4 738 B13R1.555 CCCCOCc1ccccc1Br 34a_100000210227_100000184730 [1,0,0,0,0,0|1,0,1]=3 739 B13R1.555 CCCCOCc1ccccc1Br 34a_100000756307_100000210210 [1,0,0,0,0,0|1,0,1]=3 740 B13R1.555 CCCCOCc1ccccc1Br 7a_100000210227_100000184730 [1,0,0,0,0,0|1,0,1]=3 741 B13R1.555 CCCCOCc1ccccc1Br 7a_100000756307_100000210211 [1,0,0,0,0,0|1,0,1]=3 742 B13R1.555 CCCCOCc1ccccc1C 34a_100000210227_100000211839 [1,0,0,0,0,0|1,0,1]=3 743 B13R1.555 CCCCOCc1ccccc1C 34a_100000698903_100000210210 [1,0,0,0,0,0|1,0,1]=3 744 B13R1.555 CCCCOCc1ccccc1C 7a_100000210227_100000211839 [1,0,0,0,0,0|1,0,1]=3 745 B13R1.555 CCCCOCc1ccccc1C 7a_100000698903_100000210211 [1,0,0,0,0,0|1,0,1]=3 746 B13R1.555 CCCCOCc1ccccc1Cl 34a_100000210227_100000187162 [1,0,0,0,0,0|1,0,1]=3 747 B13R1.555 CCCCOCc1ccccc1Cl 34a_100000210847_100000210210 [1,0,0,0,0,0|1,0,1]=3 748 B13R1.555 CCCCOCc1ccccc1Cl 7a_100000210227_100000187162 [1,0,0,0,0,0|1,0,1]=3 749 B13R1.555 CCCCOCc1ccccc1Cl 7a_100000210847_100000210211 [1,0,0,0,0,0|1,0,1]=3 750 B13R1.555 CCCCOCc1ccccc1F 34a_100000210227_100000211605 [1,0,0,0,0,0|1,0,1]=3 751 B13R1.555 CCCCOCc1ccccc1F 34a_100000211962_100000210210 [1,0,0,0,0,0|1,0,1]=3 752 B13R1.555 CCCCOCc1ccccc1F 7a_100000210227_100000211605 [1,0,0,0,0,0|1,0,1]=3 753 B13R1.555 CCCCOCc1ccccc1F 7a_100000211962_100000210211 [1,0,0,0,0,0|1,0,1]=3 754 B13R1.555 CCCCOCc1ccccc1I 34a_100000187465_100000210210 [1,0,0,0,0,0|1,0,1]=3 755 B13R1.555 CCCCOCc1ccccc1I 34a_100000210227_100011215278 [1,0,0,0,0,0|1,0,1]=3 756 B13R1.555 CCCCOCc1ccccc1I 7a_100000187465_100000210211 [1,0,0,0,0,0|1,0,1]=3 757 B13R1.555 CCCCOCc1ccccc1I 7a_100000210227_100011215278 [1,0,0,0,0,0|1,0,1]=3 758 B13R1.555 CCCCOCc1ccccc1N 34a_100000212039_100000210210 [1,0,0,0,0,0|1,0,1]=3 759 B13R1.555 CCCCOCc1cccnc1Br 34a_100000210227_100010140945 [1,0,0,0,0,0|2,0,1]=4 760 B13R1.555 CCCCOCc1cccnc1Br 34a_100000719692_100000210210 [1,0,0,0,0,0|2,0,1]=4 761 B13R1.555 CCCCOCc1cccnc1Br 7a_100000210227_100010140945 [1,0,0,0,0,0|2,0,1]=4 762 B13R1.555 CCCCOCc1cccnc1Br 7a_100000719692_100000210211 [1,0,0,0,0,0|2,0,1]=4 763 B13R1.555 CCCCOCc1cccnc1C 34a_100000210227_100000732876 [1,0,0,0,0,0|2,0,1]=4 764 B13R1.555 CCCCOCc1cccnc1C 34a_100000729262_100000210210 [1,0,0,0,0,0|2,0,1]=4 765 B13R1.555 CCCCOCc1cccnc1C 7a_100000210227_100000732876 [1,0,0,0,0,0|2,0,1]=4 766 B13R1.555 CCCCOCc1cccnc1C 7a_100000729262_100000210211 [1,0,0,0,0,0|2,0,1]=4 767 B13R1.555 CCCCOCc1cccnc1Cl 34a_100000210227_100000045678 [1,0,0,0,0,0|2,0,1]=4 768 B13R1.555 CCCCOCc1cccnc1Cl 34a_100000748726_100000210210 [1,0,0,0,0,0|2,0,1]=4 769 B13R1.555 CCCCOCc1cccnc1Cl 7a_100000210227_100000045678 [1,0,0,0,0,0|2,0,1]=4 770 B13R1.555 CCCCOCc1cccnc1Cl 7a_100000748726_100000210211 [1,0,0,0,0,0|2,0,1]=4 771 B13R1.555 CCCCOCc1cccnc1F 34a_100000079888_100000210210 [1,0,0,0,0,0|2,0,1]=4 772 B13R1.555 CCCCOCc1cccnc1F 34a_100000210227_100000099810 [1,0,0,0,0,0|2,0,1]=4 773 B13R1.555 CCCCOCc1cccnc1F 7a_100000079888_100000210211 [1,0,0,0,0,0|2,0,1]=4 774 B13R1.555 CCCCOCc1cccnc1F 7a_100000210227_100000099810 [1,0,0,0,0,0|2,0,1]=4 775 B13R1.555 CCCCOCc1ccncc1C 34a_100000210227_100020672809 [1,0,0,0,0,0|2,0,1]=4 776 B13R1.555 CCCCOCc1ccncc1C 34a_100011997032_100000210210 [1,0,0,0,0,0|2,0,1]=4 777 B13R1.555 CCCCOCc1ccncc1C 7a_100000210227_100020672808 [1,0,0,0,0,0|2,0,1]=4 778 B13R1.555 CCCCOCc1ccncc1Cl 7a_100000210227_100000763264 [1,0,0,0,0,0|2,0,1]=4 779 B13R1.555 CCCCOCc1ccncc1F 34a_100012172863_100000210210 [1,0,0,0,0,0|2,0,1]=4 780 B13R1.555 CCCCOCc1cnccc1C 34a_100000210227_100000690890 [1,0,0,0,0,0|2,0,1]=4 781 B13R1.555 CCCCOCc1cnccc1C 34a_100011996381_100000210210 [1,0,0,0,0,0|2,0,1]=4 782 B13R1.555 CCCCOCc1cnccc1C 7a_100000210227_100000690890 [1,0,0,0,0,0|2,0,1]=4 783 B13R1.555 CCCCOCc1cnccc1Cl 34a_100000117392_100000210210 [1,0,0,0,0,0|2,0,1]=4 784 B13R1.555 CCCCOCc1ncccc1Br 34a_100000210227_100025702911 [1,0,0,0,0,0|2,0,1]=4 785 B13R1.555 CCCCOCc1ncccc1Br 34a_100011996772_100000210210 [1,0,0,0,0,0|2,0,1]=4 786 B13R1.555 CCCCOCc1ncccc1Br 7a_100000210227_100025702911 [1,0,0,0,0,0|2,0,1]=4 787 B13R1.555 CCCCOCc1ncccc1C 34a_100000210227_100000696600 [1,0,0,0,0,0|2,0,1]=4 788 B13R1.555 CCCCOCc1ncccc1C 34a_100000698912_100000210210 [1,0,0,0,0,0|2,0,1]=4 789 B13R1.555 CCCCOCc1ncccc1C 7a_100000210227_100000696600 [1,0,0,0,0,0|2,0,1]=4 790 B13R1.555 CCCCOCc1ncccc1Cl 34a_100012002383_100000210210 [1,0,0,0,0,0|2,0,1]=4 791 B13R1.555 CCCCOCc1ncccc1Cl 7a_100000210227_100000099807 [1,0,0,0,0,0|2,0,1]=4 792 B13R1.555 CCCCOCc1ncccc1F 34a_100000210227_100000104219 [1,0,0,0,0,0|2,0,1]=4 793 B13R1.555 CCCCOCc1ncccc1F 34a_100011934865_100000210210 [1,0,0,0,0,0|2,0,1]=4 794 B13R1.555 CCCCOCc1ncccc1F 7a_100000210227_100000104219 [1,0,0,0,0,0|2,0,1]=4 795 B13R1.555 CCCCOCc1ncccc1N 34a_114873767017_100000210210 [1,0,0,0,0,0|2,0,1]=4 796 B13R1.555 CCCCOCc1ncccc1O 34a_100000210227_200020655725 [1,0,0,0,0,0|1,0,1]=3 797 B13R1.555 CCCCOCc1ncccc1O 7a_100000210227_200020655725 [1,0,0,0,0,0|1,0,1]=3 798 B13R1.555 CCCCSCc1ccccc1Br 62a_100000184730_100000210210 [1,0,0,0,0,0|1,1,1]=4 799 B13R1.555 CCCCSCc1ccccc1Br 62a_100000210211_100000184730 [1,0,0,0,0,0|1,1,1]=4 800 B13R1.555 CCCCSCc1ccccc1C 62a_100000210211_100000211839 [1,0,0,0,0,0|1,1,1]=4 801 B13R1.555 CCCCSCc1ccccc1C 62a_100000211839_100000210210 [1,0,0,0,0,0|1,1,1]=4 802 B13R1.555 CCCCSCc1ccccc1Cl 62a_100000187162_100000210210 [1,0,0,0,0,0|1,1,1]=4 803 B13R1.555 CCCCSCc1ccccc1Cl 62a_100000210211_100000187162 [1,0,0,0,0,0|1,1,1]=4 804 B13R1.555 CCCCSCc1ccccc1F 62a_100000210211_100000211605 [1,0,0,0,0,0|1,1,1]=4 805 B13R1.555 CCCCSCc1ccccc1F 62a_100000211605_100000210210 [1,0,0,0,0,0|1,1,1]=4 806 B13R1.555 CCCCSCc1ccccc1I 62a_100000210211_100011216222 [1,0,0,0,0,0|1,1,1]=4 807 B13R1.555 CCCCSCc1ccccc1I 62a_100011216222_100000210210 [1,0,0,0,0,0|1,1,1]=4 808 B13R1.555 CCCCSCc1ccccc1O 271570a_203496583355_200011870348 [1,0,0,0,0,0|0,1,1]=3 809 B13R1.555 CCCCSCc1ncccc1O 62a_100000210211_200020655725 [1,0,0,0,0,0|1,1,1]=4 810 B13R1.555 CCCCSCc1ncccc1O 62a_200020655725_100000210210 [1,0,0,0,0,0|1,1,1]=4 811 B13R1.555 CCCNCCc1ccccc1O 34a_100011207237_100000210303 [1,0,0,0,0,0|2,0,1]=4 812 B13R1.555 CCCNN=Cc1ccccc1Br 4a_100000740057_100000211189 [1,0,0,0,0,0|3,0,0]=4 813 B13R1.555 CCCNN=Cc1ccccc1C 4a_100000740057_100000211143 [1,0,0,0,0,0|3,0,0]=4 814 B13R1.555 CCCNN=Cc1ccccc1Cl 4a_100000740057_100000210073 [1,0,0,0,0,0|3,0,0]=4 815 B13R1.555 CCCNN=Cc1ccccc1F 4a_100000740057_100000210811 [1,0,0,0,0,0|3,0,0]=4 816 B13R1.555 CCCNN=Cc1ccccc1I 4a_100000740057_100000010305 [1,0,0,0,0,0|3,0,0]=4 817 B13R1.555 CCCNN=Cc1ccccc1O 4a_100000740057_100000185834 [1,0,0,0,0,0|2,0,0]=3 818 B13R1.555 CCCNN=Cc1cccnc1O 4a_100000740057_100011998315 [1,0,0,0,0,0|3,0,0]=4 819 B13R1.555 CCCNN=Cc1ccncc1O 4a_100000740057_100000077405 [1,0,0,0,0,0|3,0,0]=4 820 B13R1.555 CCCNN=Cc1ncccc1O 4a_100000740057_100000042352 [1,0,0,0,0,0|3,0,0]=4 821 B13R1.555 CCCOCCc1ccccc1O 34a_100000210258_100000722297 [1,0,0,0,0,0|2,0,1]=4 822 B13R1.555 CCCSCCc1ccccc1O 62a_100000210303_100000722297 [1,0,0,0,0,0|2,0,1]=4 823 B13R1.555 CCCSCCc1ccccc1O 62a_100000722297_100000210303 [1,0,0,0,0,0|2,0,1]=4 824 B13R1.555 CCNCC=Cc1ccccc1Br 270004a_100015525214_200016268969 [1,0,0,0,0,0|3,0,0]=4 825 B13R1.555 CCNCC=Cc1ccccc1Cl 270004a_100015525214_200102525841 [1,0,0,0,0,0|3,0,0]=4 826 B13R1.555 CCNCC=Cc1ccccc1F 270004a_100015525214_200102525844 [1,0,0,0,0,0|3,0,0]=4 827 B13R1.555 CCOCCNc1ccccc1O 34a_100000185747_100000210147 [1,0,0,0,0,0|3,0,0]=4 828 B13R1.555 CCOCCSc1ccccc1O 62a_100000210147_100000739446 [1,0,0,0,0,0|3,0,0]=4 829 B13R1.555 CCOCCSc1ccccc1O 62a_100000739446_100011215890 [1,0,0,0,0,0|3,0,0]=4 830 B13R1.555 CCSCCNc1ccccc1O 34a_100000185747_100000757381 [1,0,0,0,0,0|3,0,0]=4 831 B13R1.555 CCSCCSc1ccccc1O 62a_100000739446_100000757381 [1,0,0,0,0,0|3,0,0]=4 832 B13R1.555 CCSCCSc1ccccc1O 62a_100000757381_100000739446 [1,0,0,0,0,0|3,0,0]=4 833 B13R1.555 CNCCCOc1ccccc1O 271570a_203496583355_100015186278 [1,0,0,0,0,0|3,0,0]=4 834 B13R1.555 CNCCOCc1ccccc1Cl 2230a_100000745786_200000210301 [1,0,0,0,0,0|2,0,1]=4 835 B13R1.555 CNCCOCc1ccccc1Cl 34a_100000745786_200000210301 [1,0,0,0,0,0|2,0,1]=4 836 B13R1.555 COCCCNc1ccccc1O 34a_100000185747_100000740836 [1,0,0,0,0,0|3,0,0]=4 837 B13R1.555 COCCCSc1ccccc1O 62a_100000709357_100000739446 [1,0,0,0,0,0|3,0,0]=4 838 B13R1.555 COCCCSc1ccccc1O 62a_100000739446_100000709357 [1,0,0,0,0,0|3,0,0]=4 839 B13R1.555 COCCNCc1ccccc1O 34a_100000185550_100011201679 [1,0,0,0,0,0|2,0,1]=4 840 B13R1.555 COCCOCc1ccccc1Br 34a_100000210237_100000184730 [1,0,0,0,0,0|2,0,1]=4 841 B13R1.555 COCCOCc1ccccc1Br 34a_100000756307_100011201679 [1,0,0,0,0,0|2,0,1]=4 842 B13R1.555 COCCOCc1ccccc1Br 7a_100000756307_100000233755 [1,0,0,0,0,0|2,0,1]=4 843 B13R1.555 COCCOCc1ccccc1C 34a_100000210237_100000211839 [1,0,0,0,0,0|2,0,1]=4 844 B13R1.555 COCCOCc1ccccc1C 34a_100000698903_100011201679 [1,0,0,0,0,0|2,0,1]=4 845 B13R1.555 COCCOCc1ccccc1C 7a_100000698903_100000233755 [1,0,0,0,0,0|2,0,1]=4 846 B13R1.555 COCCOCc1ccccc1Cl 34a_100000210237_100000187162 [1,0,0,0,0,0|2,0,1]=4 847 B13R1.555 COCCOCc1ccccc1Cl 34a_100000210847_100011201679 [1,0,0,0,0,0|2,0,1]=4 848 B13R1.555 COCCOCc1ccccc1Cl 7a_100000210847_100000233755 [1,0,0,0,0,0|2,0,1]=4 849 B13R1.555 COCCOCc1ccccc1F 34a_100000210237_100000211605 [1,0,0,0,0,0|2,0,1]=4 850 B13R1.555 COCCOCc1ccccc1F 34a_100000211962_100011201679 [1,0,0,0,0,0|2,0,1]=4 851 B13R1.555 COCCOCc1ccccc1F 7a_100000211962_100000233755 [1,0,0,0,0,0|2,0,1]=4 852 B13R1.555 COCCOCc1ccccc1I 34a_100000187465_100011201679 [1,0,0,0,0,0|2,0,1]=4 853 B13R1.555 COCCOCc1ccccc1I 34a_100000210237_100011215278 [1,0,0,0,0,0|2,0,1]=4 854 B13R1.555 COCCOCc1ccccc1I 7a_100000187465_100000233755 [1,0,0,0,0,0|2,0,1]=4 855 B13R1.555 COCCOCc1ccccc1N 34a_100000212039_100011201679 [1,0,0,0,0,0|2,0,1]=4 856 B13R1.555 COCCOCc1ncccc1O 34a_100000210237_200020655725 [1,0,0,0,0,0|2,0,1]=4 857 B13R1.555 CSCCNCc1ccccc1O 34a_100000185550_100000212216 [1,0,0,0,0,0|2,0,1]=4 858 B13R1.555 CSCCOCc1ccccc1Br 34a_100000230434_100000184730 [1,0,0,0,0,0|2,0,1]=4 859 B13R1.555 CSCCOCc1ccccc1Br 34a_100000756307_100000212216 [1,0,0,0,0,0|2,0,1]=4 860 B13R1.555 CSCCOCc1ccccc1Br 7a_100000230434_100000184730 [1,0,0,0,0,0|2,0,1]=4 861 B13R1.555 CSCCOCc1ccccc1Br 7a_100000756307_100000212216 [1,0,0,0,0,0|2,0,1]=4 862 B13R1.555 CSCCOCc1ccccc1C 34a_100000230434_100000211839 [1,0,0,0,0,0|2,0,1]=4 863 B13R1.555 CSCCOCc1ccccc1C 34a_100000698903_100000212216 [1,0,0,0,0,0|2,0,1]=4 864 B13R1.555 CSCCOCc1ccccc1C 7a_100000230434_100000211839 [1,0,0,0,0,0|2,0,1]=4 865 B13R1.555 CSCCOCc1ccccc1C 7a_100000698903_100000212216 [1,0,0,0,0,0|2,0,1]=4 866 B13R1.555 CSCCOCc1ccccc1Cl 34a_100000210847_100000212216 [1,0,0,0,0,0|2,0,1]=4 867 B13R1.555 CSCCOCc1ccccc1Cl 34a_100000230434_100000187162 [1,0,0,0,0,0|2,0,1]=4 868 B13R1.555 CSCCOCc1ccccc1Cl 7a_100000210847_100000212216 [1,0,0,0,0,0|2,0,1]=4 869 B13R1.555 CSCCOCc1ccccc1Cl 7a_100000230434_100000187162 [1,0,0,0,0,0|2,0,1]=4 870 B13R1.555 CSCCOCc1ccccc1F 34a_100000211962_100000212216 [1,0,0,0,0,0|2,0,1]=4 871 B13R1.555 CSCCOCc1ccccc1F 34a_100000230434_100000211605 [1,0,0,0,0,0|2,0,1]=4 872 B13R1.555 CSCCOCc1ccccc1F 7a_100000211962_100000212216 [1,0,0,0,0,0|2,0,1]=4 873 B13R1.555 CSCCOCc1ccccc1F 7a_100000230434_100000211605 [1,0,0,0,0,0|2,0,1]=4 874 B13R1.555 CSCCOCc1ccccc1I 34a_100000187465_100000212216 [1,0,0,0,0,0|2,0,1]=4 875 B13R1.555 CSCCOCc1ccccc1I 34a_100000230434_100011215278 [1,0,0,0,0,0|2,0,1]=4 876 B13R1.555 CSCCOCc1ccccc1I 7a_100000187465_100000212216 [1,0,0,0,0,0|2,0,1]=4 877 B13R1.555 CSCCOCc1ccccc1I 7a_100000230434_100011215278 [1,0,0,0,0,0|2,0,1]=4 878 B13R1.555 CSCCOCc1ccccc1N 34a_100000212039_100000212216 [1,0,0,0,0,0|2,0,1]=4 879 B13R1.555 CSCCOCc1ncccc1O 34a_100000230434_200020655725 [1,0,0,0,0,0|2,0,1]=4 880 B13R1.555 CSCCOCc1ncccc1O 7a_100000230434_200020655725 [1,0,0,0,0,0|2,0,1]=4 881 B13R1.555 Cc1ccccc1COCCCBr 34a_100011217188_100000211839 [1,0,0,0,0,0|2,0,1]=4 882 B13R1.555 Cc1ccccc1COCCCCl 34a_100000230001_100000211839 [1,0,0,0,0,0|2,0,1]=4 883 B13R1.555 Cc1ccccc1COCCCF 34a_100000698903_100011934791 [1,0,0,0,0,0|2,0,1]=4 884 B13R1.555 Cc1ccccc1COCCCF 34a_100000759539_100000211839 [1,0,0,0,0,0|2,0,1]=4 885 B13R1.555 Cc1ccccc1COCCCF 7a_100000698903_100011934791 [1,0,0,0,0,0|2,0,1]=4 886 B13R1.555 Cc1ccccc1COCCCN 34a_100000182051_100000211839 [1,0,0,0,0,0|2,0,1]=4 887 B13R1.555 Cc1ccccc1COCCCO 34a_100000698903_100000230001 [1,0,0,0,0,0|2,0,1]=4 888 B13R1.555 Cc1ccccc1COCCCO 7a_100000698903_100011215043 [1,0,0,0,0,0|2,0,1]=4 889 B13R1.555 ClCCCOCc1ccccc1Br 34a_100000230001_100000184730 [1,0,0,0,0,0|2,0,1]=4 890 B13R1.555 ClCCCOCc1ccccc1Cl 34a_100000230001_100000187162 [1,0,0,0,0,0|2,0,1]=4 891 B13R1.555 ClCCCOCc1ccccc1I 34a_100000230001_100011215278 [1,0,0,0,0,0|2,0,1]=4 892 B13R1.555 Clc1ccccc1COCCCBr 34a_100011217188_100000187162 [1,0,0,0,0,0|2,0,1]=4 893 B13R1.555 FCCCOCc1ccccc1Br 34a_100000756307_100011934791 [1,0,0,0,0,0|2,0,1]=4 894 B13R1.555 FCCCOCc1ccccc1Br 34a_100000759539_100000184730 [1,0,0,0,0,0|2,0,1]=4 895 B13R1.555 FCCCOCc1ccccc1Br 7a_100000756307_100011934791 [1,0,0,0,0,0|2,0,1]=4 896 B13R1.555 FCCCOCc1ccccc1Cl 34a_100000210847_100011934791 [1,0,0,0,0,0|2,0,1]=4 897 B13R1.555 FCCCOCc1ccccc1Cl 34a_100000759539_100000187162 [1,0,0,0,0,0|2,0,1]=4 898 B13R1.555 FCCCOCc1ccccc1Cl 7a_100000210847_100011934791 [1,0,0,0,0,0|2,0,1]=4 899 B13R1.555 FCCCOCc1ccccc1F 34a_100000211962_100011934791 [1,0,0,0,0,0|2,0,1]=4 900 B13R1.555 FCCCOCc1ccccc1F 34a_100000759539_100000211605 [1,0,0,0,0,0|2,0,1]=4 901 B13R1.555 FCCCOCc1ccccc1F 7a_100000211962_100011934791 [1,0,0,0,0,0|2,0,1]=4 902 B13R1.555 FCCCOCc1ccccc1I 34a_100000187465_100011934791 [1,0,0,0,0,0|2,0,1]=4 903 B13R1.555 FCCCOCc1ccccc1I 34a_100000759539_100011215278 [1,0,0,0,0,0|2,0,1]=4 904 B13R1.555 FCCCOCc1ccccc1I 7a_100000187465_100011934791 [1,0,0,0,0,0|2,0,1]=4 905 B13R1.555 Fc1ccccc1COCCCBr 34a_100011217188_100000211605 [1,0,0,0,0,0|2,0,1]=4 906 B13R1.555 Fc1ccccc1COCCCCl 34a_100000230001_100000211605 [1,0,0,0,0,0|2,0,1]=4 907 B13R1.555 NCCCOCc1ccccc1Br 34a_100000182051_100000184730 [1,0,0,0,0,0|2,0,1]=4 908 B13R1.555 NCCCOCc1ccccc1Cl 34a_100000182051_100000187162 [1,0,0,0,0,0|2,0,1]=4 909 B13R1.555 NCCCOCc1ccccc1F 34a_100000182051_100000211605 [1,0,0,0,0,0|2,0,1]=4 910 B13R1.555 NCCCOCc1ccccc1I 34a_100000182051_100011215278 [1,0,0,0,0,0|2,0,1]=4 911 B13R1.555 NCCCOCc1ncccc1O 34a_100000182051_200020655725 [1,0,0,0,0,0|2,0,1]=4 912 B13R1.555 Nc1ccccc1COCCCF 34a_100000212039_100011934791 [1,0,0,0,0,0|2,0,1]=4 913 B13R1.555 Nc1ccccc1COCCCO 34a_100000212039_100000230001 [1,0,0,0,0,0|2,0,1]=4 914 B13R1.555 OCCCCNc1ccccc1O 34a_100000185747_100011216708 [1,0,0,0,0,0|3,0,0]=4 915 B13R1.555 OCCCCSc1ccccc1O 62a_100000210776_100000739446 [1,0,0,0,0,0|3,0,0]=4 916 B13R1.555 OCCCCSc1ccccc1O 62a_100000739446_100000210776 [1,0,0,0,0,0|3,0,0]=4 917 B13R1.555 OCCCNCc1ccccc1O 34a_100000185550_100000230001 [1,0,0,0,0,0|2,0,1]=4 918 B13R1.555 OCCCOCc1ccccc1Br 34a_100000756307_100000230001 [1,0,0,0,0,0|2,0,1]=4 919 B13R1.555 OCCCOCc1ccccc1Br 7a_100000756307_100011215043 [1,0,0,0,0,0|2,0,1]=4 920 B13R1.555 OCCCOCc1ccccc1Cl 34a_100000210847_100000230001 [1,0,0,0,0,0|2,0,1]=4 921 B13R1.555 OCCCOCc1ccccc1Cl 7a_100000210847_100011215043 [1,0,0,0,0,0|2,0,1]=4 922 B13R1.555 OCCCOCc1ccccc1F 34a_100000211962_100000230001 [1,0,0,0,0,0|2,0,1]=4 923 B13R1.555 OCCCOCc1ccccc1F 7a_100000211962_100011215043 [1,0,0,0,0,0|2,0,1]=4 924 B13R1.555 OCCCOCc1ccccc1I 34a_100000187465_100000230001 [1,0,0,0,0,0|2,0,1]=4 925 B13R1.555 OCCCOCc1ccccc1I 7a_100000187465_100011215043 [1,0,0,0,0,0|2,0,1]=4 926 B13R1.555 OCCNN=Cc1ccccc1O 4a_100000210001_100000185834 [1,0,0,0,0,0|3,0,0]=4 927 B13R1.555 Oc1ccccc1CNCCCF 34a_100000185550_100011934791 [1,0,0,0,0,0|2,0,1]=4 928 B13R1.555 Oc1ccccc1NCCCCF 34a_100000185747_100000729493 [1,0,0,0,0,0|3,0,0]=4 929 B13R1.555 Oc1ccccc1SCCCCF 62a_100000729493_100000739446 [1,0,0,0,0,0|3,0,0]=4 930 B13R1.555 Oc1ccccc1SCCCCF 62a_100000739446_100000729493 [1,0,0,0,0,0|3,0,0]=4 931 B13R1.555 Oc1cccnc1COCCCBr 34a_100011217188_200020655725 [1,0,0,0,0,0|2,0,1]=4 932 B13R1.555 Oc1cccnc1COCCCCl 34a_100000230001_200020655725 [1,0,0,0,0,0|2,0,1]=4 933 B13R1.555 Oc1cccnc1COCCCF 34a_100000759539_200020655725 [1,0,0,0,0,0|2,0,1]=4 934 B13R1.555 [13CH3]NCCOCc1ccccc1Cl 2230a_100000745786_200025704644 [1,0,0,0,0,0|2,0,1]=4 935 B13R1.555 [13CH3]NCCOCc1ccccc1Cl 34a_100000745786_200025704644 [1,0,0,0,0,0|2,0,1]=4 936 B13R1.674 C#CCCC(=O)c1ccccc1Br 1458a_100000188424_100000753159 [1,0,0,0,0,0|1,0,2]=4 937 B13R1.674 C#CCCC(=O)c1ccccc1C 1458a_100000212026_100000753159 [1,0,0,0,0,0|1,0,2]=4 938 B13R1.674 C#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000753159 [1,0,0,0,0,0|1,0,2]=4 939 B13R1.674 C#CCCC(=O)c1ccccc1F 1458a_100000188656_100000753159 [1,0,0,0,0,0|1,0,2]=4 940 B13R1.674 C#CCCC(=O)c1ccccc1I 1458a_100000187884_100000753159 [1,0,0,0,0,0|1,0,2]=4 941 B13R1.674 C#CCCC(=O)c1ccccc1O 1458a_100015234032_100000753159 [1,0,0,0,0,0|0,0,2]=3 942 B13R1.674 C#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000753159 [1,0,0,0,0,0|0,0,3]=4 943 B13R1.674 C#CCNC(=O)c1ccccc1O 240690a_100000212058_100015234032 [1,0,0,0,0,0|1,0,2]=4 944 B13R1.674 C/C=C/CC(=O)c1ccccc1Br 1458a_100000188424_100102629194 [1,0,0,0,0,0|1,0,2]=4 945 B13R1.674 C/C=C/CC(=O)c1ccccc1C 1458a_100000212026_100102629194 [1,0,0,0,0,0|1,0,2]=4 946 B13R1.674 C/C=C/CC(=O)c1ccccc1Cl 1458a_100000185844_100102629194 [1,0,0,0,0,0|1,0,2]=4 947 B13R1.674 C/C=C/CC(=O)c1ccccc1F 1458a_100000188656_100102629194 [1,0,0,0,0,0|1,0,2]=4 948 B13R1.674 C/C=C/CC(=O)c1ccccc1I 1458a_100000187884_100102629194 [1,0,0,0,0,0|1,0,2]=4 949 B13R1.674 C/C=C/CC(=O)c1ccccc1O 1458a_100015234032_100102629194 [1,0,0,0,0,0|0,0,2]=3 950 B13R1.674 C/C=C/CC(=O)c1ccccc1[O-] 1458a_100009911694_100102629194 [1,0,0,0,0,0|0,0,3]=4 951 B13R1.674 C=CCCC(=O)c1ccccc1Br 1458a_100000188424_100000754431 [1,0,0,0,0,0|1,0,2]=4 952 B13R1.674 C=CCCC(=O)c1ccccc1C 1458a_100000212026_100000754431 [1,0,0,0,0,0|1,0,2]=4 953 B13R1.674 C=CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000754431 [1,0,0,0,0,0|1,0,2]=4 954 B13R1.674 C=CCCC(=O)c1ccccc1F 1458a_100000188656_100000754431 [1,0,0,0,0,0|1,0,2]=4 955 B13R1.674 C=CCCC(=O)c1ccccc1I 1458a_100000187884_100000754431 [1,0,0,0,0,0|1,0,2]=4 956 B13R1.674 C=CCCC(=O)c1ccccc1O 1458a_100015234032_100000754431 [1,0,0,0,0,0|0,0,2]=3 957 B13R1.674 C=CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000754431 [1,0,0,0,0,0|0,0,3]=4 958 B13R1.674 C=CCNC(=O)c1ccccc1O 240690a_100020586998_100015234032 [1,0,0,0,0,0|1,0,2]=4 959 B13R1.674 CC#CCC(=O)c1ccccc1Br 1458a_100000188424_100000748600 [1,0,0,0,0,0|1,0,2]=4 960 B13R1.674 CC#CCC(=O)c1ccccc1C 1458a_100000212026_100000748600 [1,0,0,0,0,0|1,0,2]=4 961 B13R1.674 CC#CCC(=O)c1ccccc1Cl 1458a_100000185844_100000748600 [1,0,0,0,0,0|1,0,2]=4 962 B13R1.674 CC#CCC(=O)c1ccccc1F 1458a_100000188656_100000748600 [1,0,0,0,0,0|1,0,2]=4 963 B13R1.674 CC#CCC(=O)c1ccccc1I 1458a_100000187884_100000748600 [1,0,0,0,0,0|1,0,2]=4 964 B13R1.674 CC#CCC(=O)c1ccccc1O 1458a_100015234032_100000748600 [1,0,0,0,0,0|0,0,2]=3 965 B13R1.674 CC#CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000748600 [1,0,0,0,0,0|0,0,3]=4 966 B13R1.674 CC=CCC(=O)c1ccccc1Br 1458a_100000188424_100000070051 [1,0,0,0,0,0|1,0,2]=4 967 B13R1.674 CC=CCC(=O)c1ccccc1C 1458a_100000212026_100000070051 [1,0,0,0,0,0|1,0,2]=4 968 B13R1.674 CC=CCC(=O)c1ccccc1Cl 1458a_100000185844_100000070051 [1,0,0,0,0,0|1,0,2]=4 969 B13R1.674 CC=CCC(=O)c1ccccc1F 1458a_100000188656_100000070051 [1,0,0,0,0,0|1,0,2]=4 970 B13R1.674 CC=CCC(=O)c1ccccc1I 1458a_100000187884_100000070051 [1,0,0,0,0,0|1,0,2]=4 971 B13R1.674 CC=CCC(=O)c1ccccc1O 1458a_100015234032_100000070051 [1,0,0,0,0,0|0,0,2]=3 972 B13R1.674 CC=CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000070051 [1,0,0,0,0,0|0,0,3]=4 973 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [1,0,0,0,0,0|1,0,0]=2 974 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [1,0,0,0,0,0|1,0,0]=2 975 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [1,0,0,0,0,0|1,0,0]=2 976 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [1,0,0,0,0,0|1,0,0]=2 977 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [1,0,0,0,0,0|1,0,0]=2 978 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [1,0,0,0,0,0|0,0,0]=1 979 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [1,0,0,0,0,0|0,0,1]=2 980 B13R1.674 CCCCN(C)c1ccccc1Br 2230a_100020606079_100000210211 [1,0,0,0,0,0|3,0,0]=4 981 B13R1.674 CCCCN(C)c1ccccc1Br 269982a_100020606079_100000210211 [1,0,0,0,0,0|3,0,0]=4 982 B13R1.674 CCCCN(C)c1ccccc1Br 34a_100020606079_100000210210 [1,0,0,0,0,0|3,0,0]=4 983 B13R1.674 CCCCN(C)c1ccccc1C 2230a_100000219699_100000210211 [1,0,0,0,0,0|3,0,0]=4 984 B13R1.674 CCCCN(C)c1ccccc1C 269982a_100000219699_100000210211 [1,0,0,0,0,0|3,0,0]=4 985 B13R1.674 CCCCN(C)c1ccccc1C 34a_100000219699_100000210210 [1,0,0,0,0,0|3,0,0]=4 986 B13R1.674 CCCCN(C)c1ccccc1Cl 2230a_100000219374_100000210211 [1,0,0,0,0,0|3,0,0]=4 987 B13R1.674 CCCCN(C)c1ccccc1Cl 269982a_100000219374_100000210211 [1,0,0,0,0,0|3,0,0]=4 988 B13R1.674 CCCCN(C)c1ccccc1Cl 34a_100000219374_100000210210 [1,0,0,0,0,0|3,0,0]=4 989 B13R1.674 CCCCN(C)c1ccccc1F 2230a_100000220357_100000210211 [1,0,0,0,0,0|3,0,0]=4 990 B13R1.674 CCCCN(C)c1ccccc1F 269982a_100000220357_100000210211 [1,0,0,0,0,0|3,0,0]=4 991 B13R1.674 CCCCN(C)c1ccccc1F 34a_100000220357_100000210210 [1,0,0,0,0,0|3,0,0]=4 992 B13R1.674 CCCCN(C)c1ccccc1F 38a_100000220357_100000210211 [1,0,0,0,0,0|3,0,0]=4 993 B13R1.674 CCCCN(C)c1ccccc1O 269982a_100000033821_100000210211 [1,0,0,0,0,0|2,0,0]=3 994 B13R1.674 CCCNC(=O)c1ccccc1Br 11a_100020643023_100000188424 [1,0,0,0,0,0|2,0,0]=3 995 B13R1.674 CCCNC(=O)c1ccccc1Br 1626a_100020643023_100000188424 [1,0,0,0,0,0|2,0,0]=3 996 B13R1.674 CCCNC(=O)c1ccccc1Br 240690a_100020643023_100000188424 [1,0,0,0,0,0|2,0,0]=3 997 B13R1.674 CCCNC(=O)c1ccccc1Br 527a_100020643023_100000188424 [1,0,0,0,0,0|2,0,0]=3 998 B13R1.674 CCCNC(=O)c1ccccc1C 11a_100020643023_100000212026 [1,0,0,0,0,0|2,0,0]=3 999 B13R1.674 CCCNC(=O)c1ccccc1C 1626a_100020643023_100000212026 [1,0,0,0,0,0|2,0,0]=3 1000 B13R1.674 CCCNC(=O)c1ccccc1C 240690a_100020643023_100000212026 [1,0,0,0,0,0|2,0,0]=3 1001 B13R1.674 CCCNC(=O)c1ccccc1C 527a_100020643023_100000212026 [1,0,0,0,0,0|2,0,0]=3 1002 B13R1.674 CCCNC(=O)c1ccccc1Cl 11a_100020643023_100000185844 [1,0,0,0,0,0|2,0,0]=3 1003 B13R1.674 CCCNC(=O)c1ccccc1Cl 1626a_100020643023_100000185844 [1,0,0,0,0,0|2,0,0]=3 1004 B13R1.674 CCCNC(=O)c1ccccc1Cl 240690a_100020643023_100000185844 [1,0,0,0,0,0|2,0,0]=3 1005 B13R1.674 CCCNC(=O)c1ccccc1Cl 527a_100020643023_100000185844 [1,0,0,0,0,0|2,0,0]=3 1006 B13R1.674 CCCNC(=O)c1ccccc1F 11a_100020643023_100000188656 [1,0,0,0,0,0|2,0,0]=3 1007 B13R1.674 CCCNC(=O)c1ccccc1F 1626a_100020643023_100000188656 [1,0,0,0,0,0|2,0,0]=3 1008 B13R1.674 CCCNC(=O)c1ccccc1F 240690a_100020643023_100000188656 [1,0,0,0,0,0|2,0,0]=3 1009 B13R1.674 CCCNC(=O)c1ccccc1F 527a_100020643023_100000188656 [1,0,0,0,0,0|2,0,0]=3 1010 B13R1.674 CCCNC(=O)c1ccccc1I 11a_100020643023_100000187884 [1,0,0,0,0,0|2,0,0]=3 1011 B13R1.674 CCCNC(=O)c1ccccc1I 1626a_100020643023_100000187884 [1,0,0,0,0,0|2,0,0]=3 1012 B13R1.674 CCCNC(=O)c1ccccc1I 240690a_100020643023_100000187884 [1,0,0,0,0,0|2,0,0]=3 1013 B13R1.674 CCCNC(=O)c1ccccc1I 527a_100020643023_100000187884 [1,0,0,0,0,0|2,0,0]=3 1014 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [1,0,0,0,0,0|1,0,0]=2 1015 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [1,0,0,0,0,0|1,0,0]=2 1016 B13R1.674 CCCNC(=O)c1ccccc1[O-] 1626a_100020643023_100009911694 [1,0,0,0,0,0|1,0,1]=3 1017 B13R1.674 CCCNC(=O)c1ccccc1[O-] 240690a_100020643023_100009911694 [1,0,0,0,0,0|1,0,1]=3 1018 B13R1.674 CCCNC(=O)c1ccccc1[O-] 527a_100020643023_100009911694 [1,0,0,0,0,0|1,0,1]=3 1019 B13R1.674 CCCNC(=O)c1cccnc1O 271570a_203496583355_100000161721 [1,0,0,0,0,0|2,0,0]=3 1020 B13R1.674 CCCNC(C)c1ccccc1O 271570a_203496583355_100000741022 [1,0,0,0,0,0|2,0,1]=4 1021 B13R1.674 CCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210303 [1,0,0,0,0,0|2,0,1]=4 1022 B13R1.674 CCCOC(C)c1ccccc1Br 34a_100000702211_100000210303 [1,0,0,0,0,0|2,0,1]=4 1023 B13R1.674 CCCOC(C)c1ccccc1Br 7a_100000702211_100000210303 [1,0,0,0,0,0|2,0,1]=4 1024 B13R1.674 CCCOC(C)c1ccccc1C 34a_100000742021_100000210303 [1,0,0,0,0,0|2,0,1]=4 1025 B13R1.674 CCCOC(C)c1ccccc1C 7a_100000742021_100000210303 [1,0,0,0,0,0|2,0,1]=4 1026 B13R1.674 CCCOC(C)c1ccccc1Cl 34a_100000740796_100000210303 [1,0,0,0,0,0|2,0,1]=4 1027 B13R1.674 CCCOC(C)c1ccccc1Cl 7a_100000740796_100000210303 [1,0,0,0,0,0|2,0,1]=4 1028 B13R1.674 CCCOC(C)c1ccccc1F 34a_100000210258_200000741388 [1,0,0,0,0,0|2,0,1]=4 1029 B13R1.674 CCCOC(C)c1ccccc1F 34a_100000697922_100000210303 [1,0,0,0,0,0|2,0,1]=4 1030 B13R1.674 CCCOC(C)c1ccccc1F 7a_100000697922_100000210303 [1,0,0,0,0,0|2,0,1]=4 1031 B13R1.674 CCCOC(C)c1ccccc1N 7a_100011405641_100000210303 [1,0,0,0,0,0|2,0,1]=4 1032 B13R1.674 CCNCC(=O)c1ccccc1C 2230a_100015525214_100000741374 [1,0,0,0,0,0|2,0,0]=3 1033 B13R1.674 CCNN=C(C)c1ccccc1O 4a_100000756455_100000188907 [1,0,0,0,0,0|3,0,0]=4 1034 B13R1.674 CCNNC(=O)c1ccccc1Br 22a_100000756455_100000188424 [1,0,0,0,0,0|3,0,0]=4 1035 B13R1.674 CCNNC(=O)c1ccccc1C 22a_100000756455_100000212026 [1,0,0,0,0,0|3,0,0]=4 1036 B13R1.674 CCNNC(=O)c1ccccc1Cl 22a_100000756455_100000185844 [1,0,0,0,0,0|3,0,0]=4 1037 B13R1.674 CCNNC(=O)c1ccccc1F 22a_100000756455_100000188656 [1,0,0,0,0,0|3,0,0]=4 1038 B13R1.674 CCNNC(=O)c1ccccc1I 22a_100000756455_100000187884 [1,0,0,0,0,0|3,0,0]=4 1039 B13R1.674 CCNNC(=O)c1ccccc1O 22a_100000756455_100015234032 [1,0,0,0,0,0|2,0,0]=3 1040 B13R1.674 CCNNC(=O)c1ccccc1[O-] 22a_100000756455_100009911694 [1,0,0,0,0,0|2,0,1]=4 1041 B13R1.674 CCOCC(=O)c1ccccc1Br 34a_100121572206_100000199116 [1,0,0,0,0,0|2,0,0]=3 1042 B13R1.674 CCOCC(=O)c1ccccc1C 34a_100121572206_100000741374 [1,0,0,0,0,0|2,0,0]=3 1043 B13R1.674 CCOCC(=O)c1ccccc1Cl 34a_100121572206_100000211432 [1,0,0,0,0,0|2,0,0]=3 1044 B13R1.674 CCOCC(=O)c1ccccc1F 34a_100121572206_100000204681 [1,0,0,0,0,0|2,0,0]=3 1045 B13R1.674 CCOCN(C)c1ccccc1O 269982a_100000033821_100000739092 [1,0,0,0,0,0|3,0,0]=4 1046 B13R1.674 CCSCC(=O)c1ccccc1Br 62a_100000199116_100000210202 [1,0,0,0,0,0|2,0,0]=3 1047 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000210202_100000741374 [1,0,0,0,0,0|2,0,0]=3 1048 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000741374_100000210202 [1,0,0,0,0,0|2,0,0]=3 1049 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000210202_100000211432 [1,0,0,0,0,0|2,0,0]=3 1050 B13R1.674 CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210202 [1,0,0,0,0,0|2,0,0]=3 1051 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000204681_100000210202 [1,0,0,0,0,0|2,0,0]=3 1052 B13R1.674 CCSCC(=O)c1ccccc1F 62a_100000210202_100000204681 [1,0,0,0,0,0|2,0,0]=3 1053 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000188908_100000210202 [1,0,0,0,0,0|1,0,0]=2 1054 B13R1.674 CCSCC(=O)c1ccccc1O 62a_100000210202_100000188908 [1,0,0,0,0,0|1,0,0]=2 1055 B13R1.674 CN(CCCF)c1ccccc1O 269982a_100000033821_100011934791 [1,0,0,0,0,0|3,0,0]=4 1056 B13R1.674 CN(CCCO)c1ccccc1O 269982a_100000033821_100011215043 [1,0,0,0,0,0|3,0,0]=4 1057 B13R1.674 CNCCC(=O)c1ccccc1F 2230a_106832991635_100000086012 [1,0,0,0,0,0|2,0,0]=3 1058 B13R1.674 CNCCC(=O)c1ccccc1F 7a_106832991635_100000086012 [1,0,0,0,0,0|2,0,0]=3 1059 B13R1.674 CNCCC(=O)c1ccccc1O 7a_106832991635_100009873196 [1,0,0,0,0,0|1,0,0]=2 1060 B13R1.674 COCCC(=O)c1ccccc1Br 1458a_100000188424_100000233755 [1,0,0,0,0,0|2,0,0]=3 1061 B13R1.674 COCCC(=O)c1ccccc1C 1458a_100000212026_100000233755 [1,0,0,0,0,0|2,0,0]=3 1062 B13R1.674 COCCC(=O)c1ccccc1Cl 1458a_100000185844_100000233755 [1,0,0,0,0,0|2,0,0]=3 1063 B13R1.674 COCCC(=O)c1ccccc1F 1458a_100000188656_100000233755 [1,0,0,0,0,0|2,0,0]=3 1064 B13R1.674 COCCC(=O)c1ccccc1I 1458a_100000187884_100000233755 [1,0,0,0,0,0|2,0,0]=3 1065 B13R1.674 COCCC(=O)c1ccccc1O 1458a_100015234032_100000233755 [1,0,0,0,0,0|1,0,0]=2 1066 B13R1.674 COCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000233755 [1,0,0,0,0,0|1,0,1]=3 1067 B13R1.674 COCCN(C)c1ccccc1O 269982a_100000033821_100000233755 [1,0,0,0,0,0|3,0,0]=4 1068 B13R1.674 CSCCC(=O)c1ccccc1Br 1458a_100000188424_100000751147 [1,0,0,0,0,0|2,0,0]=3 1069 B13R1.674 CSCCC(=O)c1ccccc1C 1458a_100000212026_100000751147 [1,0,0,0,0,0|2,0,0]=3 1070 B13R1.674 CSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000751147 [1,0,0,0,0,0|2,0,0]=3 1071 B13R1.674 CSCCC(=O)c1ccccc1F 1458a_100000188656_100000751147 [1,0,0,0,0,0|2,0,0]=3 1072 B13R1.674 CSCCC(=O)c1ccccc1F 62a_100000086012_200000210301 [1,0,0,0,0,0|2,0,0]=3 1073 B13R1.674 CSCCC(=O)c1ccccc1F 62a_200000210301_100000086012 [1,0,0,0,0,0|2,0,0]=3 1074 B13R1.674 CSCCC(=O)c1ccccc1I 1458a_100000187884_100000751147 [1,0,0,0,0,0|2,0,0]=3 1075 B13R1.674 CSCCC(=O)c1ccccc1O 1458a_100015234032_100000751147 [1,0,0,0,0,0|1,0,0]=2 1076 B13R1.674 CSCCC(=O)c1ccccc1O 62a_200000210301_100009873196 [1,0,0,0,0,0|1,0,0]=2 1077 B13R1.674 CSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000751147 [1,0,0,0,0,0|1,0,1]=3 1078 B13R1.674 CSCCN(C)c1ccccc1O 269982a_100000033821_100000212216 [1,0,0,0,0,0|3,0,0]=4 1079 B13R1.674 Cc1ccccc1C(=O)CCC#N 1458a_100000212026_100011215226 [1,0,0,0,0,0|2,0,1]=4 1080 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [1,0,0,0,0,0|2,0,0]=3 1081 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [1,0,0,0,0,0|2,0,0]=3 1082 B13R1.674 Cc1ccccc1C(=O)CSCF 62a_100000741374_100015361967 [1,0,0,0,0,0|3,0,0]=4 1083 B13R1.674 Cc1ccccc1C(=O)CSCF 62a_100015361967_100000741374 [1,0,0,0,0,0|3,0,0]=4 1084 B13R1.674 Cc1ccccc1C(=O)NCCF 11a_100000724931_100000212026 [1,0,0,0,0,0|3,0,0]=4 1085 B13R1.674 Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000212026 [1,0,0,0,0,0|3,0,0]=4 1086 B13R1.674 Cc1ccccc1C(=O)NCCF 240690a_100000724931_100000212026 [1,0,0,0,0,0|3,0,0]=4 1087 B13R1.674 Cc1ccccc1C(=O)NCCF 527a_100000724931_100000212026 [1,0,0,0,0,0|3,0,0]=4 1088 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [1,0,0,0,0,0|3,0,0]=4 1089 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [1,0,0,0,0,0|3,0,0]=4 1090 B13R1.674 N#CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215226 [1,0,0,0,0,0|2,0,1]=4 1091 B13R1.674 N#CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215226 [1,0,0,0,0,0|2,0,1]=4 1092 B13R1.674 N#CCCC(=O)c1ccccc1F 1458a_100000188656_100011215226 [1,0,0,0,0,0|2,0,1]=4 1093 B13R1.674 N#CCCC(=O)c1ccccc1I 1458a_100000187884_100011215226 [1,0,0,0,0,0|2,0,1]=4 1094 B13R1.674 N#CCCC(=O)c1ccccc1O 1458a_100015234032_100011215226 [1,0,0,0,0,0|1,0,1]=3 1095 B13R1.674 N#CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215226 [1,0,0,0,0,0|1,0,2]=4 1096 B13R1.674 O=C(CCCF)c1ccccc1Br 1458a_100000188424_100011934791 [1,0,0,0,0,0|2,0,0]=3 1097 B13R1.674 O=C(CCCF)c1ccccc1Cl 1458a_100000185844_100011934791 [1,0,0,0,0,0|2,0,0]=3 1098 B13R1.674 O=C(CCCF)c1ccccc1F 1458a_100000188656_100011934791 [1,0,0,0,0,0|2,0,0]=3 1099 B13R1.674 O=C(CCCF)c1ccccc1I 1458a_100000187884_100011934791 [1,0,0,0,0,0|2,0,0]=3 1100 B13R1.674 O=C(CCCF)c1ccccc1O 1458a_100015234032_100011934791 [1,0,0,0,0,0|1,0,0]=2 1101 B13R1.674 O=C(CCCF)c1ccccc1[O-] 1458a_100009911694_100011934791 [1,0,0,0,0,0|1,0,1]=3 1102 B13R1.674 O=C(CCCO)c1ccccc1Br 1458a_100000188424_100011215043 [1,0,0,0,0,0|2,0,0]=3 1103 B13R1.674 O=C(CCCO)c1ccccc1Cl 1458a_100000185844_100011215043 [1,0,0,0,0,0|2,0,0]=3 1104 B13R1.674 O=C(CCCO)c1ccccc1F 1458a_100000188656_100011215043 [1,0,0,0,0,0|2,0,0]=3 1105 B13R1.674 O=C(CCCO)c1ccccc1I 1458a_100000187884_100011215043 [1,0,0,0,0,0|2,0,0]=3 1106 B13R1.674 O=C(CCCO)c1ccccc1O 1458a_100015234032_100011215043 [1,0,0,0,0,0|1,0,0]=2 1107 B13R1.674 O=C(CCCO)c1ccccc1[O-] 1458a_100009911694_100011215043 [1,0,0,0,0,0|1,0,1]=3 1108 B13R1.674 O=C(CSCF)c1ccccc1Br 62a_100000199116_100015361967 [1,0,0,0,0,0|3,0,0]=4 1109 B13R1.674 O=C(CSCF)c1ccccc1Cl 62a_100000211432_100015361967 [1,0,0,0,0,0|3,0,0]=4 1110 B13R1.674 O=C(CSCF)c1ccccc1Cl 62a_100015361967_100000211432 [1,0,0,0,0,0|3,0,0]=4 1111 B13R1.674 O=C(CSCF)c1ccccc1F 62a_100000204681_100015361967 [1,0,0,0,0,0|3,0,0]=4 1112 B13R1.674 O=C(CSCF)c1ccccc1F 62a_100015361967_100000204681 [1,0,0,0,0,0|3,0,0]=4 1113 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100000188908_100015361967 [1,0,0,0,0,0|2,0,0]=3 1114 B13R1.674 O=C(CSCF)c1ccccc1O 62a_100015361967_100000188908 [1,0,0,0,0,0|2,0,0]=3 1115 B13R1.674 O=C(NCCF)c1ccccc1Br 11a_100000724931_100000188424 [1,0,0,0,0,0|3,0,0]=4 1116 B13R1.674 O=C(NCCF)c1ccccc1Br 1626a_100000724931_100000188424 [1,0,0,0,0,0|3,0,0]=4 1117 B13R1.674 O=C(NCCF)c1ccccc1Br 240690a_100000724931_100000188424 [1,0,0,0,0,0|3,0,0]=4 1118 B13R1.674 O=C(NCCF)c1ccccc1Br 527a_100000724931_100000188424 [1,0,0,0,0,0|3,0,0]=4 1119 B13R1.674 O=C(NCCF)c1ccccc1Cl 11a_100000724931_100000185844 [1,0,0,0,0,0|3,0,0]=4 1120 B13R1.674 O=C(NCCF)c1ccccc1Cl 1626a_100000724931_100000185844 [1,0,0,0,0,0|3,0,0]=4 1121 B13R1.674 O=C(NCCF)c1ccccc1Cl 240690a_100000724931_100000185844 [1,0,0,0,0,0|3,0,0]=4 1122 B13R1.674 O=C(NCCF)c1ccccc1Cl 527a_100000724931_100000185844 [1,0,0,0,0,0|3,0,0]=4 1123 B13R1.674 O=C(NCCF)c1ccccc1F 11a_100000724931_100000188656 [1,0,0,0,0,0|3,0,0]=4 1124 B13R1.674 O=C(NCCF)c1ccccc1F 1626a_100000724931_100000188656 [1,0,0,0,0,0|3,0,0]=4 1125 B13R1.674 O=C(NCCF)c1ccccc1F 240690a_100000724931_100000188656 [1,0,0,0,0,0|3,0,0]=4 1126 B13R1.674 O=C(NCCF)c1ccccc1F 527a_100000724931_100000188656 [1,0,0,0,0,0|3,0,0]=4 1127 B13R1.674 O=C(NCCF)c1ccccc1I 11a_100000724931_100000187884 [1,0,0,0,0,0|3,0,0]=4 1128 B13R1.674 O=C(NCCF)c1ccccc1I 1626a_100000724931_100000187884 [1,0,0,0,0,0|3,0,0]=4 1129 B13R1.674 O=C(NCCF)c1ccccc1I 240690a_100000724931_100000187884 [1,0,0,0,0,0|3,0,0]=4 1130 B13R1.674 O=C(NCCF)c1ccccc1I 527a_100000724931_100000187884 [1,0,0,0,0,0|3,0,0]=4 1131 B13R1.674 O=C(NCCF)c1ccccc1O 240690a_100000724931_100015234032 [1,0,0,0,0,0|2,0,0]=3 1132 B13R1.674 O=C(NCCF)c1ccccc1[O-] 1626a_100000724931_100009911694 [1,0,0,0,0,0|2,0,1]=4 1133 B13R1.674 O=C(NCCF)c1ccccc1[O-] 240690a_100000724931_100009911694 [1,0,0,0,0,0|2,0,1]=4 1134 B13R1.674 O=C(NCCF)c1ccccc1[O-] 527a_100000724931_100009911694 [1,0,0,0,0,0|2,0,1]=4 1135 B13R1.674 O=C(NCCO)c1ccccc1Br 240690a_100000210304_100000188424 [1,0,0,0,0,0|3,0,0]=4 1136 B13R1.674 O=C(NCCO)c1ccccc1Br 527a_100000210304_100000188424 [1,0,0,0,0,0|3,0,0]=4 1137 B13R1.674 O=C(NCCO)c1ccccc1Cl 240690a_100000210304_100000185844 [1,0,0,0,0,0|3,0,0]=4 1138 B13R1.674 O=C(NCCO)c1ccccc1Cl 527a_100000210304_100000185844 [1,0,0,0,0,0|3,0,0]=4 1139 B13R1.674 O=C(NCCO)c1ccccc1F 240690a_100000210304_100000188656 [1,0,0,0,0,0|3,0,0]=4 1140 B13R1.674 O=C(NCCO)c1ccccc1F 527a_100000210304_100000188656 [1,0,0,0,0,0|3,0,0]=4 1141 B13R1.674 O=C(NCCO)c1ccccc1I 240690a_100000210304_100000187884 [1,0,0,0,0,0|3,0,0]=4 1142 B13R1.674 O=C(NCCO)c1ccccc1I 527a_100000210304_100000187884 [1,0,0,0,0,0|3,0,0]=4 1143 B13R1.674 O=C(NCCO)c1ccccc1O 240690a_100000210304_100015234032 [1,0,0,0,0,0|2,0,0]=3 1144 B13R1.674 O=C(NCCO)c1ccccc1O 271570a_203496583355_200000158863 [1,0,0,0,0,0|2,0,0]=3 1145 B13R1.674 O=C(NCCO)c1ccccc1[O-] 240690a_100000210304_100009911694 [1,0,0,0,0,0|2,0,1]=4 1146 B13R1.674 O=C(NCCO)c1ccccc1[O-] 527a_100000210304_100009911694 [1,0,0,0,0,0|2,0,1]=4 1147 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_100000086012_200025704644 [1,0,0,0,0,0|2,0,0]=3 1148 B13R1.674 [13CH3]SCCC(=O)c1ccccc1F 62a_200025704644_100000086012 [1,0,0,0,0,0|2,0,0]=3 1149 B13R1.674 [13CH3]SCCC(=O)c1ccccc1O 62a_200025704644_100009873196 [1,0,0,0,0,0|1,0,0]=2 1150 B15R1.13 C#CCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000731252 [0,1,0,0,0,0|1,0,2]=4 1151 B15R1.13 C#CCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000731252 [0,1,0,0,0,0|1,0,2]=4 1152 B15R1.13 C#CCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000731252 [0,1,0,0,0,0|1,0,2]=4 1153 B15R1.13 C#CCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000731252 [0,1,0,0,0,0|1,0,2]=4 1154 B15R1.13 C#CCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000731252 [0,1,0,0,0,0|1,0,2]=4 1155 B15R1.13 C#CCCNC(=O)c1cccc(c1O)Br 240690a_100000755551_100000752940 [0,1,0,0,0,0|1,0,2]=4 1156 B15R1.13 C#CCCNC(=O)c1cccc(c1O)Br 527a_100000755551_100000752940 [0,1,0,0,0,0|1,0,2]=4 1157 B15R1.13 C#CCCNC(=O)c1cccc(c1O)C 240690a_100000755551_100000183896 [0,1,0,0,0,0|1,0,2]=4 1158 B15R1.13 C#CCCNC(=O)c1cccc(c1O)C 527a_100000755551_100000183896 [0,1,0,0,0,0|1,0,2]=4 1159 B15R1.13 C#CCCNC(=O)c1cccc(c1O)Cl 240690a_100000755551_100000742801 [0,1,0,0,0,0|1,0,2]=4 1160 B15R1.13 C#CCCNC(=O)c1cccc(c1O)Cl 527a_100000755551_100000742801 [0,1,0,0,0,0|1,0,2]=4 1161 B15R1.13 C#CCCNC(=O)c1cccc(c1O)F 240690a_100000755551_100011217230 [0,1,0,0,0,0|1,0,2]=4 1162 B15R1.13 C#CCCNC(=O)c1cccc(c1O)F 527a_100000755551_100011217230 [0,1,0,0,0,0|1,0,2]=4 1163 B15R1.13 C#CCCNC(=O)c1cccc(c1O)O 527a_100000755551_100000690420 [0,1,0,0,0,0|1,0,2]=4 1164 B15R1.13 C=CCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000757094 [0,1,0,0,0,0|1,0,2]=4 1165 B15R1.13 C=CCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000757094 [0,1,0,0,0,0|1,0,2]=4 1166 B15R1.13 C=CCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000757094 [0,1,0,0,0,0|1,0,2]=4 1167 B15R1.13 C=CCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000757094 [0,1,0,0,0,0|1,0,2]=4 1168 B15R1.13 C=CCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000757094 [0,1,0,0,0,0|1,0,2]=4 1169 B15R1.13 C=CCCNC(=O)c1cccc(c1O)Br 240690a_100015191253_100000752940 [0,1,0,0,0,0|1,0,2]=4 1170 B15R1.13 C=CCCNC(=O)c1cccc(c1O)Br 527a_100015191253_100000752940 [0,1,0,0,0,0|1,0,2]=4 1171 B15R1.13 C=CCCNC(=O)c1cccc(c1O)C 240690a_100015191253_100000183896 [0,1,0,0,0,0|1,0,2]=4 1172 B15R1.13 C=CCCNC(=O)c1cccc(c1O)C 527a_100015191253_100000183896 [0,1,0,0,0,0|1,0,2]=4 1173 B15R1.13 C=CCCNC(=O)c1cccc(c1O)Cl 240690a_100015191253_100000742801 [0,1,0,0,0,0|1,0,2]=4 1174 B15R1.13 C=CCCNC(=O)c1cccc(c1O)Cl 527a_100015191253_100000742801 [0,1,0,0,0,0|1,0,2]=4 1175 B15R1.13 C=CCCNC(=O)c1cccc(c1O)F 240690a_100015191253_100011217230 [0,1,0,0,0,0|1,0,2]=4 1176 B15R1.13 C=CCCNC(=O)c1cccc(c1O)F 527a_100015191253_100011217230 [0,1,0,0,0,0|1,0,2]=4 1177 B15R1.13 C=CCCNC(=O)c1cccc(c1O)O 527a_100015191253_100000690420 [0,1,0,0,0,0|1,0,2]=4 1178 B15R1.13 CC#CCNC(=O)c1cccc(c1O)Br 527a_100000685387_100000752940 [0,1,0,0,0,0|1,0,2]=4 1179 B15R1.13 CC#CCNC(=O)c1cccc(c1O)C 527a_100000685387_100000183896 [0,1,0,0,0,0|1,0,2]=4 1180 B15R1.13 CC#CCNC(=O)c1cccc(c1O)Cl 527a_100000685387_100000742801 [0,1,0,0,0,0|1,0,2]=4 1181 B15R1.13 CC#CCNC(=O)c1cccc(c1O)F 527a_100000685387_100011217230 [0,1,0,0,0,0|1,0,2]=4 1182 B15R1.13 CC#CCNC(=O)c1cccc(c1O)O 527a_100000685387_100000690420 [0,1,0,0,0,0|1,0,2]=4 1183 B15R1.13 CC/C=C\CC(=O)c1cccc(c1O)Br 1458a_100000752940_100103147603 [0,1,0,0,0,0|1,0,2]=4 1184 B15R1.13 CC/C=C\CC(=O)c1cccc(c1O)C 1458a_100000183896_100103147603 [0,1,0,0,0,0|1,0,2]=4 1185 B15R1.13 CC/C=C\CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100103147603 [0,1,0,0,0,0|1,0,2]=4 1186 B15R1.13 CC/C=C\CC(=O)c1cccc(c1O)F 1458a_100011217230_100103147603 [0,1,0,0,0,0|1,0,2]=4 1187 B15R1.13 CC/C=C\CC(=O)c1cccc(c1O)O 1458a_100000690420_100103147603 [0,1,0,0,0,0|1,0,2]=4 1188 B15R1.13 CCC#CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100009813939 [0,1,0,0,0,0|1,0,2]=4 1189 B15R1.13 CCC#CCC(=O)c1cccc(c1O)C 1458a_100000183896_100009813939 [0,1,0,0,0,0|1,0,2]=4 1190 B15R1.13 CCC#CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100009813939 [0,1,0,0,0,0|1,0,2]=4 1191 B15R1.13 CCC#CCC(=O)c1cccc(c1O)F 1458a_100011217230_100009813939 [0,1,0,0,0,0|1,0,2]=4 1192 B15R1.13 CCC#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100009813939 [0,1,0,0,0,0|1,0,2]=4 1193 B15R1.13 CCCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210326 [0,1,0,0,0,0|2,0,0]=3 1194 B15R1.13 CCCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210326 [0,1,0,0,0,0|2,0,0]=3 1195 B15R1.13 CCCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210326 [0,1,0,0,0,0|2,0,0]=3 1196 B15R1.13 CCCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210326 [0,1,0,0,0,0|2,0,0]=3 1197 B15R1.13 CCCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210326 [0,1,0,0,0,0|2,0,0]=3 1198 B15R1.13 CCCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210326 [0,1,0,0,0,0|2,0,0]=3 1199 B15R1.13 CCCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210326 [0,1,0,0,0,0|2,0,0]=3 1200 B15R1.13 CCCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210326 [0,1,0,0,0,0|2,0,0]=3 1201 B15R1.13 CCCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210326 [0,1,0,0,0,0|2,0,0]=3 1202 B15R1.13 CCCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210326 [0,1,0,0,0,0|2,0,0]=3 1203 B15R1.13 CCCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210326 [0,1,0,0,0,0|2,0,0]=3 1204 B15R1.13 CCCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210326 [0,1,0,0,0,0|2,0,0]=3 1205 B15R1.13 CCCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210326 [0,1,0,0,0,0|2,0,0]=3 1206 B15R1.13 CCCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210326 [0,1,0,0,0,0|2,0,0]=3 1207 B15R1.13 CCCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210326 [0,1,0,0,0,0|2,0,0]=3 1208 B15R1.13 CCCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210326 [0,1,0,0,0,0|2,0,0]=3 1209 B15R1.13 CCCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210326 [0,1,0,0,0,0|2,0,0]=3 1210 B15R1.13 CCCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210326 [0,1,0,0,0,0|2,0,0]=3 1211 B15R1.13 CCCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210326 [0,1,0,0,0,0|2,0,0]=3 1212 B15R1.13 CCCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210326 [0,1,0,0,0,0|2,0,0]=3 1213 B15R1.13 CCCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210326 [0,1,0,0,0,0|2,0,0]=3 1214 B15R1.13 CCCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210326 [0,1,0,0,0,0|2,0,0]=3 1215 B15R1.13 CCCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210326 [0,1,0,0,0,0|2,0,0]=3 1216 B15R1.13 CCCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210326 [0,1,0,0,0,0|2,0,0]=3 1217 B15R1.13 CCCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210326 [0,1,0,0,0,0|2,0,0]=3 1218 B15R1.13 CCCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210326 [0,1,0,0,0,0|2,0,0]=3 1219 B15R1.13 CCCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210326 [0,1,0,0,0,0|2,0,0]=3 1220 B15R1.13 CCCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210326 [0,1,0,0,0,0|2,0,0]=3 1221 B15R1.13 CCCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210326 [0,1,0,0,0,0|2,0,0]=3 1222 B15R1.13 CCCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210326 [0,1,0,0,0,0|1,0,0]=2 1223 B15R1.13 CCCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210326 [0,1,0,0,0,0|1,0,0]=2 1224 B15R1.13 CCCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210326 [0,1,0,0,0,0|1,0,0]=2 1225 B15R1.13 CCCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210326 [0,1,0,0,0,0|1,0,0]=2 1226 B15R1.13 CCCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210326 [0,1,0,0,0,0|1,0,0]=2 1227 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Br 11a_100000102301_100012360534 [0,1,0,0,0,0|2,0,0]=3 1228 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Br 1626a_100000102301_100012360534 [0,1,0,0,0,0|2,0,0]=3 1229 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Br 240690a_100000102301_100012360534 [0,1,0,0,0,0|2,0,0]=3 1230 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Br 527a_100000102301_100012360534 [0,1,0,0,0,0|2,0,0]=3 1231 B15R1.13 CCCCNC(=O)c1cccc(c1Br)C 11a_100000102301_100000692419 [0,1,0,0,0,0|2,0,0]=3 1232 B15R1.13 CCCCNC(=O)c1cccc(c1Br)C 1626a_100000102301_100000692419 [0,1,0,0,0,0|2,0,0]=3 1233 B15R1.13 CCCCNC(=O)c1cccc(c1Br)C 240690a_100000102301_100000692419 [0,1,0,0,0,0|2,0,0]=3 1234 B15R1.13 CCCCNC(=O)c1cccc(c1Br)C 527a_100000102301_100000692419 [0,1,0,0,0,0|2,0,0]=3 1235 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Cl 11a_100000102301_100012339722 [0,1,0,0,0,0|2,0,0]=3 1236 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Cl 1626a_100000102301_100012339722 [0,1,0,0,0,0|2,0,0]=3 1237 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Cl 240690a_100000102301_100012339722 [0,1,0,0,0,0|2,0,0]=3 1238 B15R1.13 CCCCNC(=O)c1cccc(c1Br)Cl 527a_100000102301_100012339722 [0,1,0,0,0,0|2,0,0]=3 1239 B15R1.13 CCCCNC(=O)c1cccc(c1Br)F 11a_100000102301_100011217547 [0,1,0,0,0,0|2,0,0]=3 1240 B15R1.13 CCCCNC(=O)c1cccc(c1Br)F 1626a_100000102301_100011217547 [0,1,0,0,0,0|2,0,0]=3 1241 B15R1.13 CCCCNC(=O)c1cccc(c1Br)F 240690a_100000102301_100011217547 [0,1,0,0,0,0|2,0,0]=3 1242 B15R1.13 CCCCNC(=O)c1cccc(c1Br)F 527a_100000102301_100011217547 [0,1,0,0,0,0|2,0,0]=3 1243 B15R1.13 CCCCNC(=O)c1cccc(c1Br)I 11a_100000102301_100010232522 [0,1,0,0,0,0|2,0,0]=3 1244 B15R1.13 CCCCNC(=O)c1cccc(c1Br)I 1626a_100000102301_100010232522 [0,1,0,0,0,0|2,0,0]=3 1245 B15R1.13 CCCCNC(=O)c1cccc(c1Br)I 240690a_100000102301_100010232522 [0,1,0,0,0,0|2,0,0]=3 1246 B15R1.13 CCCCNC(=O)c1cccc(c1Br)I 527a_100000102301_100010232522 [0,1,0,0,0,0|2,0,0]=3 1247 B15R1.13 CCCCNC(=O)c1cccc(c1Br)O 240690a_100000102301_100010230362 [0,1,0,0,0,0|2,0,0]=3 1248 B15R1.13 CCCCNC(=O)c1cccc(c1Br)O 527a_100000102301_100010230362 [0,1,0,0,0,0|2,0,0]=3 1249 B15R1.13 CCCCNC(=O)c1cccc(c1C)Br 11a_100000102301_100000760464 [0,1,0,0,0,0|2,0,0]=3 1250 B15R1.13 CCCCNC(=O)c1cccc(c1C)Br 1626a_100000102301_100000760464 [0,1,0,0,0,0|2,0,0]=3 1251 B15R1.13 CCCCNC(=O)c1cccc(c1C)Br 240690a_100000102301_100000760464 [0,1,0,0,0,0|2,0,0]=3 1252 B15R1.13 CCCCNC(=O)c1cccc(c1C)Br 527a_100000102301_100000760464 [0,1,0,0,0,0|2,0,0]=3 1253 B15R1.13 CCCCNC(=O)c1cccc(c1C)C 11a_100000102301_100000183679 [0,1,0,0,0,0|2,0,0]=3 1254 B15R1.13 CCCCNC(=O)c1cccc(c1C)C 1626a_100000102301_100000183679 [0,1,0,0,0,0|2,0,0]=3 1255 B15R1.13 CCCCNC(=O)c1cccc(c1C)C 240690a_100000102301_100000183679 [0,1,0,0,0,0|2,0,0]=3 1256 B15R1.13 CCCCNC(=O)c1cccc(c1C)C 527a_100000102301_100000183679 [0,1,0,0,0,0|2,0,0]=3 1257 B15R1.13 CCCCNC(=O)c1cccc(c1C)Cl 11a_100000102301_100000690184 [0,1,0,0,0,0|2,0,0]=3 1258 B15R1.13 CCCCNC(=O)c1cccc(c1C)Cl 1626a_100000102301_100000690184 [0,1,0,0,0,0|2,0,0]=3 1259 B15R1.13 CCCCNC(=O)c1cccc(c1C)Cl 240690a_100000102301_100000690184 [0,1,0,0,0,0|2,0,0]=3 1260 B15R1.13 CCCCNC(=O)c1cccc(c1C)Cl 527a_100000102301_100000690184 [0,1,0,0,0,0|2,0,0]=3 1261 B15R1.13 CCCCNC(=O)c1cccc(c1C)F 11a_100000102301_100011218272 [0,1,0,0,0,0|2,0,0]=3 1262 B15R1.13 CCCCNC(=O)c1cccc(c1C)F 1626a_100000102301_100011218272 [0,1,0,0,0,0|2,0,0]=3 1263 B15R1.13 CCCCNC(=O)c1cccc(c1C)F 240690a_100000102301_100011218272 [0,1,0,0,0,0|2,0,0]=3 1264 B15R1.13 CCCCNC(=O)c1cccc(c1C)F 527a_100000102301_100011218272 [0,1,0,0,0,0|2,0,0]=3 1265 B15R1.13 CCCCNC(=O)c1cccc(c1C)I 11a_100000102301_100000751865 [0,1,0,0,0,0|2,0,0]=3 1266 B15R1.13 CCCCNC(=O)c1cccc(c1C)I 1626a_100000102301_100000751865 [0,1,0,0,0,0|2,0,0]=3 1267 B15R1.13 CCCCNC(=O)c1cccc(c1C)I 240690a_100000102301_100000751865 [0,1,0,0,0,0|2,0,0]=3 1268 B15R1.13 CCCCNC(=O)c1cccc(c1C)I 527a_100000102301_100000751865 [0,1,0,0,0,0|2,0,0]=3 1269 B15R1.13 CCCCNC(=O)c1cccc(c1C)O 240690a_100000102301_100000766327 [0,1,0,0,0,0|2,0,0]=3 1270 B15R1.13 CCCCNC(=O)c1cccc(c1C)O 527a_100000102301_100000766327 [0,1,0,0,0,0|2,0,0]=3 1271 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Br 11a_100000102301_100000760540 [0,1,0,0,0,0|2,0,0]=3 1272 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Br 1626a_100000102301_100000760540 [0,1,0,0,0,0|2,0,0]=3 1273 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Br 240690a_100000102301_100000760540 [0,1,0,0,0,0|2,0,0]=3 1274 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Br 527a_100000102301_100000760540 [0,1,0,0,0,0|2,0,0]=3 1275 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)C 11a_100000102301_100000693142 [0,1,0,0,0,0|2,0,0]=3 1276 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)C 1626a_100000102301_100000693142 [0,1,0,0,0,0|2,0,0]=3 1277 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)C 240690a_100000102301_100000693142 [0,1,0,0,0,0|2,0,0]=3 1278 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)C 527a_100000102301_100000693142 [0,1,0,0,0,0|2,0,0]=3 1279 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Cl 11a_100000102301_100000183631 [0,1,0,0,0,0|2,0,0]=3 1280 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Cl 1626a_100000102301_100000183631 [0,1,0,0,0,0|2,0,0]=3 1281 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Cl 240690a_100000102301_100000183631 [0,1,0,0,0,0|2,0,0]=3 1282 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)Cl 527a_100000102301_100000183631 [0,1,0,0,0,0|2,0,0]=3 1283 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)F 11a_100000102301_100000759904 [0,1,0,0,0,0|2,0,0]=3 1284 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)F 1626a_100000102301_100000759904 [0,1,0,0,0,0|2,0,0]=3 1285 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)F 240690a_100000102301_100000759904 [0,1,0,0,0,0|2,0,0]=3 1286 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)F 527a_100000102301_100000759904 [0,1,0,0,0,0|2,0,0]=3 1287 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)I 11a_100000102301_100010176783 [0,1,0,0,0,0|2,0,0]=3 1288 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)I 1626a_100000102301_100010176783 [0,1,0,0,0,0|2,0,0]=3 1289 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)I 240690a_100000102301_100010176783 [0,1,0,0,0,0|2,0,0]=3 1290 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)I 527a_100000102301_100010176783 [0,1,0,0,0,0|2,0,0]=3 1291 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)O 240690a_100000102301_100000092362 [0,1,0,0,0,0|2,0,0]=3 1292 B15R1.13 CCCCNC(=O)c1cccc(c1Cl)O 527a_100000102301_100000092362 [0,1,0,0,0,0|2,0,0]=3 1293 B15R1.13 CCCCNC(=O)c1cccc(c1F)Br 11a_100000102301_100000756403 [0,1,0,0,0,0|2,0,0]=3 1294 B15R1.13 CCCCNC(=O)c1cccc(c1F)Br 1626a_100000102301_100000756403 [0,1,0,0,0,0|2,0,0]=3 1295 B15R1.13 CCCCNC(=O)c1cccc(c1F)Br 240690a_100000102301_100000756403 [0,1,0,0,0,0|2,0,0]=3 1296 B15R1.13 CCCCNC(=O)c1cccc(c1F)Br 527a_100000102301_100000756403 [0,1,0,0,0,0|2,0,0]=3 1297 B15R1.13 CCCCNC(=O)c1cccc(c1F)C 11a_100000102301_100000766181 [0,1,0,0,0,0|2,0,0]=3 1298 B15R1.13 CCCCNC(=O)c1cccc(c1F)C 1626a_100000102301_100000766181 [0,1,0,0,0,0|2,0,0]=3 1299 B15R1.13 CCCCNC(=O)c1cccc(c1F)C 240690a_100000102301_100000766181 [0,1,0,0,0,0|2,0,0]=3 1300 B15R1.13 CCCCNC(=O)c1cccc(c1F)C 527a_100000102301_100000766181 [0,1,0,0,0,0|2,0,0]=3 1301 B15R1.13 CCCCNC(=O)c1cccc(c1F)Cl 11a_100000102301_100000688816 [0,1,0,0,0,0|2,0,0]=3 1302 B15R1.13 CCCCNC(=O)c1cccc(c1F)Cl 1626a_100000102301_100000688816 [0,1,0,0,0,0|2,0,0]=3 1303 B15R1.13 CCCCNC(=O)c1cccc(c1F)Cl 240690a_100000102301_100000688816 [0,1,0,0,0,0|2,0,0]=3 1304 B15R1.13 CCCCNC(=O)c1cccc(c1F)Cl 527a_100000102301_100000688816 [0,1,0,0,0,0|2,0,0]=3 1305 B15R1.13 CCCCNC(=O)c1cccc(c1F)F 11a_100000102301_100000748134 [0,1,0,0,0,0|2,0,0]=3 1306 B15R1.13 CCCCNC(=O)c1cccc(c1F)F 1626a_100000102301_100000748134 [0,1,0,0,0,0|2,0,0]=3 1307 B15R1.13 CCCCNC(=O)c1cccc(c1F)F 240690a_100000102301_100000748134 [0,1,0,0,0,0|2,0,0]=3 1308 B15R1.13 CCCCNC(=O)c1cccc(c1F)F 527a_100000102301_100000748134 [0,1,0,0,0,0|2,0,0]=3 1309 B15R1.13 CCCCNC(=O)c1cccc(c1F)I 11a_100000102301_100010185205 [0,1,0,0,0,0|2,0,0]=3 1310 B15R1.13 CCCCNC(=O)c1cccc(c1F)I 1626a_100000102301_100010185205 [0,1,0,0,0,0|2,0,0]=3 1311 B15R1.13 CCCCNC(=O)c1cccc(c1F)I 240690a_100000102301_100010185205 [0,1,0,0,0,0|2,0,0]=3 1312 B15R1.13 CCCCNC(=O)c1cccc(c1F)I 527a_100000102301_100010185205 [0,1,0,0,0,0|2,0,0]=3 1313 B15R1.13 CCCCNC(=O)c1cccc(c1F)O 240690a_100000102301_100000037433 [0,1,0,0,0,0|2,0,0]=3 1314 B15R1.13 CCCCNC(=O)c1cccc(c1F)O 527a_100000102301_100000037433 [0,1,0,0,0,0|2,0,0]=3 1315 B15R1.13 CCCCNC(=O)c1cccc(c1I)Br 11a_100000102301_100000688019 [0,1,0,0,0,0|2,0,0]=3 1316 B15R1.13 CCCCNC(=O)c1cccc(c1I)Br 1626a_100000102301_100000688019 [0,1,0,0,0,0|2,0,0]=3 1317 B15R1.13 CCCCNC(=O)c1cccc(c1I)Br 240690a_100000102301_100000688019 [0,1,0,0,0,0|2,0,0]=3 1318 B15R1.13 CCCCNC(=O)c1cccc(c1I)Br 527a_100000102301_100000688019 [0,1,0,0,0,0|2,0,0]=3 1319 B15R1.13 CCCCNC(=O)c1cccc(c1I)C 11a_100000102301_100000739377 [0,1,0,0,0,0|2,0,0]=3 1320 B15R1.13 CCCCNC(=O)c1cccc(c1I)C 1626a_100000102301_100000739377 [0,1,0,0,0,0|2,0,0]=3 1321 B15R1.13 CCCCNC(=O)c1cccc(c1I)C 240690a_100000102301_100000739377 [0,1,0,0,0,0|2,0,0]=3 1322 B15R1.13 CCCCNC(=O)c1cccc(c1I)C 527a_100000102301_100000739377 [0,1,0,0,0,0|2,0,0]=3 1323 B15R1.13 CCCCNC(=O)c1cccc(c1I)Cl 11a_100000102301_100010176784 [0,1,0,0,0,0|2,0,0]=3 1324 B15R1.13 CCCCNC(=O)c1cccc(c1I)Cl 1626a_100000102301_100010176784 [0,1,0,0,0,0|2,0,0]=3 1325 B15R1.13 CCCCNC(=O)c1cccc(c1I)Cl 240690a_100000102301_100010176784 [0,1,0,0,0,0|2,0,0]=3 1326 B15R1.13 CCCCNC(=O)c1cccc(c1I)Cl 527a_100000102301_100010176784 [0,1,0,0,0,0|2,0,0]=3 1327 B15R1.13 CCCCNC(=O)c1cccc(c1I)F 11a_100000102301_100000690930 [0,1,0,0,0,0|2,0,0]=3 1328 B15R1.13 CCCCNC(=O)c1cccc(c1I)F 1626a_100000102301_100000690930 [0,1,0,0,0,0|2,0,0]=3 1329 B15R1.13 CCCCNC(=O)c1cccc(c1I)F 240690a_100000102301_100000690930 [0,1,0,0,0,0|2,0,0]=3 1330 B15R1.13 CCCCNC(=O)c1cccc(c1I)F 527a_100000102301_100000690930 [0,1,0,0,0,0|2,0,0]=3 1331 B15R1.13 CCCCNC(=O)c1cccc(c1I)O 527a_100000102301_100010084636 [0,1,0,0,0,0|2,0,0]=3 1332 B15R1.13 CCCCNC(=O)c1cccc(c1O)Br 240690a_100000102301_100000752940 [0,1,0,0,0,0|1,0,0]=2 1333 B15R1.13 CCCCNC(=O)c1cccc(c1O)Br 527a_100000102301_100000752940 [0,1,0,0,0,0|1,0,0]=2 1334 B15R1.13 CCCCNC(=O)c1cccc(c1O)C 240690a_100000102301_100000183896 [0,1,0,0,0,0|1,0,0]=2 1335 B15R1.13 CCCCNC(=O)c1cccc(c1O)C 527a_100000102301_100000183896 [0,1,0,0,0,0|1,0,0]=2 1336 B15R1.13 CCCCNC(=O)c1cccc(c1O)Cl 240690a_100000102301_100000742801 [0,1,0,0,0,0|1,0,0]=2 1337 B15R1.13 CCCCNC(=O)c1cccc(c1O)Cl 527a_100000102301_100000742801 [0,1,0,0,0,0|1,0,0]=2 1338 B15R1.13 CCCCNC(=O)c1cccc(c1O)F 240690a_100000102301_100011217230 [0,1,0,0,0,0|1,0,0]=2 1339 B15R1.13 CCCCNC(=O)c1cccc(c1O)F 527a_100000102301_100011217230 [0,1,0,0,0,0|1,0,0]=2 1340 B15R1.13 CCCCNC(=O)c1cccc(c1O)O 527a_100000102301_100000690420 [0,1,0,0,0,0|1,0,0]=2 1341 B15R1.13 CCCCNC(C)c1cccc(c1O)Br 269862a_100000102301_100009815558 [0,1,0,0,0,0|2,0,1]=4 1342 B15R1.13 CCCCNC(C)c1cccc(c1O)C 269862a_100000102301_100009847209 [0,1,0,0,0,0|2,0,1]=4 1343 B15R1.13 CCCCNC(C)c1cccc(c1O)Cl 269862a_100000102301_100000043392 [0,1,0,0,0,0|2,0,1]=4 1344 B15R1.13 CCCCNC(C)c1cccc(c1O)F 269862a_100000102301_100011246037 [0,1,0,0,0,0|2,0,1]=4 1345 B15R1.13 CCCCOC(C)c1cccc(c1C)C 34a_100000210227_100012183177 [0,1,0,0,0,0|2,0,1]=4 1346 B15R1.13 CCCCOC(C)c1cccc(c1C)C 7a_100000210227_100012183177 [0,1,0,0,0,0|2,0,1]=4 1347 B15R1.13 CCCCOC(C)c1cccc(c1F)Br 34a_200012356376_100000210210 [0,1,0,0,0,0|2,0,1]=4 1348 B15R1.13 CCCCOC(C)c1cccc(c1F)Br 7a_200012356376_100000210211 [0,1,0,0,0,0|2,0,1]=4 1349 B15R1.13 CCCCOC(C)c1cccc(c1F)F 34a_100011944069_100000210210 [0,1,0,0,0,0|2,0,1]=4 1350 B15R1.13 CCCCOC(C)c1cccc(c1F)F 7a_100011944069_100000210211 [0,1,0,0,0,0|2,0,1]=4 1351 B15R1.13 CCCNN=C(C)c1cccc(c1O)Br 4a_100000740057_100009815558 [0,1,0,0,0,0|3,0,0]=4 1352 B15R1.13 CCCNN=C(C)c1cccc(c1O)C 4a_100000740057_100009847209 [0,1,0,0,0,0|3,0,0]=4 1353 B15R1.13 CCCNN=C(C)c1cccc(c1O)Cl 4a_100000740057_100000043392 [0,1,0,0,0,0|3,0,0]=4 1354 B15R1.13 CCCNN=C(C)c1cccc(c1O)F 4a_100000740057_100011246037 [0,1,0,0,0,0|3,0,0]=4 1355 B15R1.13 CCCNN=C(C)c1cccc(c1O)O 4a_100000740057_200000080400 [0,1,0,0,0,0|3,0,0]=4 1356 B15R1.13 CCCNNC(=O)c1cccc(c1Br)Br 22a_100000740057_100012360534 [0,1,0,0,0,0|3,0,0]=4 1357 B15R1.13 CCCNNC(=O)c1cccc(c1Br)C 22a_100000740057_100000692419 [0,1,0,0,0,0|3,0,0]=4 1358 B15R1.13 CCCNNC(=O)c1cccc(c1Br)Cl 22a_100000740057_100012339722 [0,1,0,0,0,0|3,0,0]=4 1359 B15R1.13 CCCNNC(=O)c1cccc(c1Br)F 22a_100000740057_100011217547 [0,1,0,0,0,0|3,0,0]=4 1360 B15R1.13 CCCNNC(=O)c1cccc(c1Br)I 22a_100000740057_100010232522 [0,1,0,0,0,0|3,0,0]=4 1361 B15R1.13 CCCNNC(=O)c1cccc(c1Br)O 22a_100000740057_100010230362 [0,1,0,0,0,0|3,0,0]=4 1362 B15R1.13 CCCNNC(=O)c1cccc(c1C)Br 22a_100000740057_100000760464 [0,1,0,0,0,0|3,0,0]=4 1363 B15R1.13 CCCNNC(=O)c1cccc(c1C)C 22a_100000740057_100000183679 [0,1,0,0,0,0|3,0,0]=4 1364 B15R1.13 CCCNNC(=O)c1cccc(c1C)Cl 22a_100000740057_100000690184 [0,1,0,0,0,0|3,0,0]=4 1365 B15R1.13 CCCNNC(=O)c1cccc(c1C)F 22a_100000740057_100011218272 [0,1,0,0,0,0|3,0,0]=4 1366 B15R1.13 CCCNNC(=O)c1cccc(c1C)I 22a_100000740057_100000751865 [0,1,0,0,0,0|3,0,0]=4 1367 B15R1.13 CCCNNC(=O)c1cccc(c1C)O 22a_100000740057_100000766327 [0,1,0,0,0,0|3,0,0]=4 1368 B15R1.13 CCCNNC(=O)c1cccc(c1Cl)Br 22a_100000740057_100000760540 [0,1,0,0,0,0|3,0,0]=4 1369 B15R1.13 CCCNNC(=O)c1cccc(c1Cl)C 22a_100000740057_100000693142 [0,1,0,0,0,0|3,0,0]=4 1370 B15R1.13 CCCNNC(=O)c1cccc(c1Cl)Cl 22a_100000740057_100000183631 [0,1,0,0,0,0|3,0,0]=4 1371 B15R1.13 CCCNNC(=O)c1cccc(c1Cl)F 22a_100000740057_100000759904 [0,1,0,0,0,0|3,0,0]=4 1372 B15R1.13 CCCNNC(=O)c1cccc(c1Cl)I 22a_100000740057_100010176783 [0,1,0,0,0,0|3,0,0]=4 1373 B15R1.13 CCCNNC(=O)c1cccc(c1Cl)O 22a_100000740057_100000092362 [0,1,0,0,0,0|3,0,0]=4 1374 B15R1.13 CCCNNC(=O)c1cccc(c1F)Br 22a_100000740057_100000756403 [0,1,0,0,0,0|3,0,0]=4 1375 B15R1.13 CCCNNC(=O)c1cccc(c1F)C 22a_100000740057_100000766181 [0,1,0,0,0,0|3,0,0]=4 1376 B15R1.13 CCCNNC(=O)c1cccc(c1F)Cl 22a_100000740057_100000688816 [0,1,0,0,0,0|3,0,0]=4 1377 B15R1.13 CCCNNC(=O)c1cccc(c1F)F 22a_100000740057_100000748134 [0,1,0,0,0,0|3,0,0]=4 1378 B15R1.13 CCCNNC(=O)c1cccc(c1F)I 22a_100000740057_100010185205 [0,1,0,0,0,0|3,0,0]=4 1379 B15R1.13 CCCNNC(=O)c1cccc(c1F)O 22a_100000740057_100000037433 [0,1,0,0,0,0|3,0,0]=4 1380 B15R1.13 CCCNNC(=O)c1cccc(c1I)Br 22a_100000740057_100000688019 [0,1,0,0,0,0|3,0,0]=4 1381 B15R1.13 CCCNNC(=O)c1cccc(c1I)C 22a_100000740057_100000739377 [0,1,0,0,0,0|3,0,0]=4 1382 B15R1.13 CCCNNC(=O)c1cccc(c1I)Cl 22a_100000740057_100010176784 [0,1,0,0,0,0|3,0,0]=4 1383 B15R1.13 CCCNNC(=O)c1cccc(c1I)F 22a_100000740057_100000690930 [0,1,0,0,0,0|3,0,0]=4 1384 B15R1.13 CCCNNC(=O)c1cccc(c1I)O 22a_100000740057_100010084636 [0,1,0,0,0,0|3,0,0]=4 1385 B15R1.13 CCCNNC(=O)c1cccc(c1O)Br 22a_100000740057_100000752940 [0,1,0,0,0,0|2,0,0]=3 1386 B15R1.13 CCCNNC(=O)c1cccc(c1O)C 22a_100000740057_100000183896 [0,1,0,0,0,0|2,0,0]=3 1387 B15R1.13 CCCNNC(=O)c1cccc(c1O)Cl 22a_100000740057_100000742801 [0,1,0,0,0,0|2,0,0]=3 1388 B15R1.13 CCCNNC(=O)c1cccc(c1O)F 22a_100000740057_100011217230 [0,1,0,0,0,0|2,0,0]=3 1389 B15R1.13 CCCNNC(=O)c1cccc(c1O)O 22a_100000740057_100000690420 [0,1,0,0,0,0|2,0,0]=3 1390 B15R1.13 CCCOCC(=O)c1cccc(c1C)I 34a_100000210258_100160470822 [0,1,0,0,0,0|3,0,0]=4 1391 B15R1.13 CCCOCC(=O)c1cccc(c1F)Br 34a_100000210258_100012356374 [0,1,0,0,0,0|3,0,0]=4 1392 B15R1.13 CCCOCC(=O)c1cccc(c1F)Cl 34a_100000210258_200012351890 [0,1,0,0,0,0|3,0,0]=4 1393 B15R1.13 CCCSCC(=O)c1cccc(c1C)I 62a_100000210303_100160470822 [0,1,0,0,0,0|3,0,0]=4 1394 B15R1.13 CCCSCC(=O)c1cccc(c1C)I 62a_100160470822_100000210303 [0,1,0,0,0,0|3,0,0]=4 1395 B15R1.13 CCCSCC(=O)c1cccc(c1F)Br 62a_100000210303_100012356374 [0,1,0,0,0,0|3,0,0]=4 1396 B15R1.13 CCCSCC(=O)c1cccc(c1F)Br 62a_100012356374_100000210303 [0,1,0,0,0,0|3,0,0]=4 1397 B15R1.13 CCCSCC(=O)c1cccc(c1F)Cl 62a_100000210303_200012351890 [0,1,0,0,0,0|3,0,0]=4 1398 B15R1.13 CCCSCC(=O)c1cccc(c1F)Cl 62a_200012351890_100000210303 [0,1,0,0,0,0|3,0,0]=4 1399 B15R1.13 CCOCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011215890 [0,1,0,0,0,0|3,0,0]=4 1400 B15R1.13 CCOCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100011215890 [0,1,0,0,0,0|3,0,0]=4 1401 B15R1.13 CCOCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011215890 [0,1,0,0,0,0|3,0,0]=4 1402 B15R1.13 CCOCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100011215890 [0,1,0,0,0,0|3,0,0]=4 1403 B15R1.13 CCOCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100011215890 [0,1,0,0,0,0|3,0,0]=4 1404 B15R1.13 CCOCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100011215890 [0,1,0,0,0,0|3,0,0]=4 1405 B15R1.13 CCOCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100011215890 [0,1,0,0,0,0|3,0,0]=4 1406 B15R1.13 CCOCCC(=O)c1cccc(c1C)C 1458a_100000183679_100011215890 [0,1,0,0,0,0|3,0,0]=4 1407 B15R1.13 CCOCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100011215890 [0,1,0,0,0,0|3,0,0]=4 1408 B15R1.13 CCOCCC(=O)c1cccc(c1C)F 1458a_100011218272_100011215890 [0,1,0,0,0,0|3,0,0]=4 1409 B15R1.13 CCOCCC(=O)c1cccc(c1C)I 1458a_100000751865_100011215890 [0,1,0,0,0,0|3,0,0]=4 1410 B15R1.13 CCOCCC(=O)c1cccc(c1C)O 1458a_100000766327_100011215890 [0,1,0,0,0,0|3,0,0]=4 1411 B15R1.13 CCOCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011215890 [0,1,0,0,0,0|3,0,0]=4 1412 B15R1.13 CCOCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100011215890 [0,1,0,0,0,0|3,0,0]=4 1413 B15R1.13 CCOCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011215890 [0,1,0,0,0,0|3,0,0]=4 1414 B15R1.13 CCOCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011215890 [0,1,0,0,0,0|3,0,0]=4 1415 B15R1.13 CCOCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011215890 [0,1,0,0,0,0|3,0,0]=4 1416 B15R1.13 CCOCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011215890 [0,1,0,0,0,0|3,0,0]=4 1417 B15R1.13 CCOCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100011215890 [0,1,0,0,0,0|3,0,0]=4 1418 B15R1.13 CCOCCC(=O)c1cccc(c1F)C 1458a_100000766181_100011215890 [0,1,0,0,0,0|3,0,0]=4 1419 B15R1.13 CCOCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011215890 [0,1,0,0,0,0|3,0,0]=4 1420 B15R1.13 CCOCCC(=O)c1cccc(c1F)F 1458a_100000748134_100011215890 [0,1,0,0,0,0|3,0,0]=4 1421 B15R1.13 CCOCCC(=O)c1cccc(c1F)I 1458a_100010185205_100011215890 [0,1,0,0,0,0|3,0,0]=4 1422 B15R1.13 CCOCCC(=O)c1cccc(c1F)O 1458a_100000037433_100011215890 [0,1,0,0,0,0|3,0,0]=4 1423 B15R1.13 CCOCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100011215890 [0,1,0,0,0,0|3,0,0]=4 1424 B15R1.13 CCOCCC(=O)c1cccc(c1I)C 1458a_100000739377_100011215890 [0,1,0,0,0,0|3,0,0]=4 1425 B15R1.13 CCOCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011215890 [0,1,0,0,0,0|3,0,0]=4 1426 B15R1.13 CCOCCC(=O)c1cccc(c1I)F 1458a_100000690930_100011215890 [0,1,0,0,0,0|3,0,0]=4 1427 B15R1.13 CCOCCC(=O)c1cccc(c1I)O 1458a_100010084636_100011215890 [0,1,0,0,0,0|3,0,0]=4 1428 B15R1.13 CCOCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215890 [0,1,0,0,0,0|2,0,0]=3 1429 B15R1.13 CCOCCC(=O)c1cccc(c1O)C 1458a_100000183896_100011215890 [0,1,0,0,0,0|2,0,0]=3 1430 B15R1.13 CCOCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215890 [0,1,0,0,0,0|2,0,0]=3 1431 B15R1.13 CCOCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215890 [0,1,0,0,0,0|2,0,0]=3 1432 B15R1.13 CCOCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215890 [0,1,0,0,0,0|2,0,0]=3 1433 B15R1.13 CCSCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000757381 [0,1,0,0,0,0|3,0,0]=4 1434 B15R1.13 CCSCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000757381 [0,1,0,0,0,0|3,0,0]=4 1435 B15R1.13 CCSCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000757381 [0,1,0,0,0,0|3,0,0]=4 1436 B15R1.13 CCSCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000757381 [0,1,0,0,0,0|3,0,0]=4 1437 B15R1.13 CCSCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000757381 [0,1,0,0,0,0|3,0,0]=4 1438 B15R1.13 CCSCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000757381 [0,1,0,0,0,0|3,0,0]=4 1439 B15R1.13 CCSCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000757381 [0,1,0,0,0,0|3,0,0]=4 1440 B15R1.13 CCSCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000757381 [0,1,0,0,0,0|3,0,0]=4 1441 B15R1.13 CCSCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000757381 [0,1,0,0,0,0|3,0,0]=4 1442 B15R1.13 CCSCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000757381 [0,1,0,0,0,0|3,0,0]=4 1443 B15R1.13 CCSCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000757381 [0,1,0,0,0,0|3,0,0]=4 1444 B15R1.13 CCSCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000757381 [0,1,0,0,0,0|3,0,0]=4 1445 B15R1.13 CCSCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000757381 [0,1,0,0,0,0|3,0,0]=4 1446 B15R1.13 CCSCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000757381 [0,1,0,0,0,0|3,0,0]=4 1447 B15R1.13 CCSCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000757381 [0,1,0,0,0,0|3,0,0]=4 1448 B15R1.13 CCSCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000757381 [0,1,0,0,0,0|3,0,0]=4 1449 B15R1.13 CCSCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000757381 [0,1,0,0,0,0|3,0,0]=4 1450 B15R1.13 CCSCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000757381 [0,1,0,0,0,0|3,0,0]=4 1451 B15R1.13 CCSCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000757381 [0,1,0,0,0,0|3,0,0]=4 1452 B15R1.13 CCSCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000757381 [0,1,0,0,0,0|3,0,0]=4 1453 B15R1.13 CCSCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000757381 [0,1,0,0,0,0|3,0,0]=4 1454 B15R1.13 CCSCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000757381 [0,1,0,0,0,0|3,0,0]=4 1455 B15R1.13 CCSCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000757381 [0,1,0,0,0,0|3,0,0]=4 1456 B15R1.13 CCSCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000757381 [0,1,0,0,0,0|3,0,0]=4 1457 B15R1.13 CCSCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000757381 [0,1,0,0,0,0|3,0,0]=4 1458 B15R1.13 CCSCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000757381 [0,1,0,0,0,0|3,0,0]=4 1459 B15R1.13 CCSCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000757381 [0,1,0,0,0,0|3,0,0]=4 1460 B15R1.13 CCSCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000757381 [0,1,0,0,0,0|3,0,0]=4 1461 B15R1.13 CCSCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000757381 [0,1,0,0,0,0|3,0,0]=4 1462 B15R1.13 CCSCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000757381 [0,1,0,0,0,0|2,0,0]=3 1463 B15R1.13 CCSCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000757381 [0,1,0,0,0,0|2,0,0]=3 1464 B15R1.13 CCSCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000757381 [0,1,0,0,0,0|2,0,0]=3 1465 B15R1.13 CCSCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000757381 [0,1,0,0,0,0|2,0,0]=3 1466 B15R1.13 CCSCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000757381 [0,1,0,0,0,0|2,0,0]=3 1467 B15R1.13 COCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000740836 [0,1,0,0,0,0|3,0,0]=4 1468 B15R1.13 COCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000740836 [0,1,0,0,0,0|3,0,0]=4 1469 B15R1.13 COCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000740836 [0,1,0,0,0,0|3,0,0]=4 1470 B15R1.13 COCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000740836 [0,1,0,0,0,0|3,0,0]=4 1471 B15R1.13 COCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000740836 [0,1,0,0,0,0|3,0,0]=4 1472 B15R1.13 COCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000740836 [0,1,0,0,0,0|3,0,0]=4 1473 B15R1.13 COCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000740836 [0,1,0,0,0,0|3,0,0]=4 1474 B15R1.13 COCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000740836 [0,1,0,0,0,0|3,0,0]=4 1475 B15R1.13 COCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000740836 [0,1,0,0,0,0|3,0,0]=4 1476 B15R1.13 COCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000740836 [0,1,0,0,0,0|3,0,0]=4 1477 B15R1.13 COCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000740836 [0,1,0,0,0,0|3,0,0]=4 1478 B15R1.13 COCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000740836 [0,1,0,0,0,0|3,0,0]=4 1479 B15R1.13 COCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000740836 [0,1,0,0,0,0|3,0,0]=4 1480 B15R1.13 COCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000740836 [0,1,0,0,0,0|3,0,0]=4 1481 B15R1.13 COCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000740836 [0,1,0,0,0,0|3,0,0]=4 1482 B15R1.13 COCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000740836 [0,1,0,0,0,0|3,0,0]=4 1483 B15R1.13 COCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000740836 [0,1,0,0,0,0|3,0,0]=4 1484 B15R1.13 COCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000740836 [0,1,0,0,0,0|3,0,0]=4 1485 B15R1.13 COCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000740836 [0,1,0,0,0,0|3,0,0]=4 1486 B15R1.13 COCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000740836 [0,1,0,0,0,0|3,0,0]=4 1487 B15R1.13 COCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000740836 [0,1,0,0,0,0|3,0,0]=4 1488 B15R1.13 COCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000740836 [0,1,0,0,0,0|3,0,0]=4 1489 B15R1.13 COCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000740836 [0,1,0,0,0,0|3,0,0]=4 1490 B15R1.13 COCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000740836 [0,1,0,0,0,0|3,0,0]=4 1491 B15R1.13 COCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000740836 [0,1,0,0,0,0|3,0,0]=4 1492 B15R1.13 COCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000740836 [0,1,0,0,0,0|3,0,0]=4 1493 B15R1.13 COCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000740836 [0,1,0,0,0,0|3,0,0]=4 1494 B15R1.13 COCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000740836 [0,1,0,0,0,0|3,0,0]=4 1495 B15R1.13 COCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000740836 [0,1,0,0,0,0|3,0,0]=4 1496 B15R1.13 COCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000740836 [0,1,0,0,0,0|2,0,0]=3 1497 B15R1.13 COCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000740836 [0,1,0,0,0,0|2,0,0]=3 1498 B15R1.13 COCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000740836 [0,1,0,0,0,0|2,0,0]=3 1499 B15R1.13 COCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000740836 [0,1,0,0,0,0|2,0,0]=3 1500 B15R1.13 COCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000740836 [0,1,0,0,0,0|2,0,0]=3 1501 B15R1.13 COCCNC(=O)c1cccc(c1Br)Br 1626a_100000209980_100012360534 [0,1,0,0,0,0|3,0,0]=4 1502 B15R1.13 COCCNC(=O)c1cccc(c1Br)Br 240690a_100000209980_100012360534 [0,1,0,0,0,0|3,0,0]=4 1503 B15R1.13 COCCNC(=O)c1cccc(c1Br)Br 527a_100000209980_100012360534 [0,1,0,0,0,0|3,0,0]=4 1504 B15R1.13 COCCNC(=O)c1cccc(c1Br)C 1626a_100000209980_100000692419 [0,1,0,0,0,0|3,0,0]=4 1505 B15R1.13 COCCNC(=O)c1cccc(c1Br)C 240690a_100000209980_100000692419 [0,1,0,0,0,0|3,0,0]=4 1506 B15R1.13 COCCNC(=O)c1cccc(c1Br)C 527a_100000209980_100000692419 [0,1,0,0,0,0|3,0,0]=4 1507 B15R1.13 COCCNC(=O)c1cccc(c1Br)Cl 1626a_100000209980_100012339722 [0,1,0,0,0,0|3,0,0]=4 1508 B15R1.13 COCCNC(=O)c1cccc(c1Br)Cl 240690a_100000209980_100012339722 [0,1,0,0,0,0|3,0,0]=4 1509 B15R1.13 COCCNC(=O)c1cccc(c1Br)Cl 527a_100000209980_100012339722 [0,1,0,0,0,0|3,0,0]=4 1510 B15R1.13 COCCNC(=O)c1cccc(c1Br)F 1626a_100000209980_100011217547 [0,1,0,0,0,0|3,0,0]=4 1511 B15R1.13 COCCNC(=O)c1cccc(c1Br)F 240690a_100000209980_100011217547 [0,1,0,0,0,0|3,0,0]=4 1512 B15R1.13 COCCNC(=O)c1cccc(c1Br)F 527a_100000209980_100011217547 [0,1,0,0,0,0|3,0,0]=4 1513 B15R1.13 COCCNC(=O)c1cccc(c1Br)I 1626a_100000209980_100010232522 [0,1,0,0,0,0|3,0,0]=4 1514 B15R1.13 COCCNC(=O)c1cccc(c1Br)I 240690a_100000209980_100010232522 [0,1,0,0,0,0|3,0,0]=4 1515 B15R1.13 COCCNC(=O)c1cccc(c1Br)I 527a_100000209980_100010232522 [0,1,0,0,0,0|3,0,0]=4 1516 B15R1.13 COCCNC(=O)c1cccc(c1Br)O 240690a_100000209980_100010230362 [0,1,0,0,0,0|3,0,0]=4 1517 B15R1.13 COCCNC(=O)c1cccc(c1Br)O 527a_100000209980_100010230362 [0,1,0,0,0,0|3,0,0]=4 1518 B15R1.13 COCCNC(=O)c1cccc(c1C)Br 1626a_100000209980_100000760464 [0,1,0,0,0,0|3,0,0]=4 1519 B15R1.13 COCCNC(=O)c1cccc(c1C)Br 240690a_100000209980_100000760464 [0,1,0,0,0,0|3,0,0]=4 1520 B15R1.13 COCCNC(=O)c1cccc(c1C)Br 527a_100000209980_100000760464 [0,1,0,0,0,0|3,0,0]=4 1521 B15R1.13 COCCNC(=O)c1cccc(c1C)C 1626a_100000209980_100000183679 [0,1,0,0,0,0|3,0,0]=4 1522 B15R1.13 COCCNC(=O)c1cccc(c1C)C 240690a_100000209980_100000183679 [0,1,0,0,0,0|3,0,0]=4 1523 B15R1.13 COCCNC(=O)c1cccc(c1C)C 527a_100000209980_100000183679 [0,1,0,0,0,0|3,0,0]=4 1524 B15R1.13 COCCNC(=O)c1cccc(c1C)Cl 1626a_100000209980_100000690184 [0,1,0,0,0,0|3,0,0]=4 1525 B15R1.13 COCCNC(=O)c1cccc(c1C)Cl 240690a_100000209980_100000690184 [0,1,0,0,0,0|3,0,0]=4 1526 B15R1.13 COCCNC(=O)c1cccc(c1C)Cl 527a_100000209980_100000690184 [0,1,0,0,0,0|3,0,0]=4 1527 B15R1.13 COCCNC(=O)c1cccc(c1C)F 1626a_100000209980_100011218272 [0,1,0,0,0,0|3,0,0]=4 1528 B15R1.13 COCCNC(=O)c1cccc(c1C)F 240690a_100000209980_100011218272 [0,1,0,0,0,0|3,0,0]=4 1529 B15R1.13 COCCNC(=O)c1cccc(c1C)F 527a_100000209980_100011218272 [0,1,0,0,0,0|3,0,0]=4 1530 B15R1.13 COCCNC(=O)c1cccc(c1C)I 1626a_100000209980_100000751865 [0,1,0,0,0,0|3,0,0]=4 1531 B15R1.13 COCCNC(=O)c1cccc(c1C)I 240690a_100000209980_100000751865 [0,1,0,0,0,0|3,0,0]=4 1532 B15R1.13 COCCNC(=O)c1cccc(c1C)I 527a_100000209980_100000751865 [0,1,0,0,0,0|3,0,0]=4 1533 B15R1.13 COCCNC(=O)c1cccc(c1C)O 240690a_100000209980_100000766327 [0,1,0,0,0,0|3,0,0]=4 1534 B15R1.13 COCCNC(=O)c1cccc(c1C)O 527a_100000209980_100000766327 [0,1,0,0,0,0|3,0,0]=4 1535 B15R1.13 COCCNC(=O)c1cccc(c1Cl)Br 1626a_100000209980_100000760540 [0,1,0,0,0,0|3,0,0]=4 1536 B15R1.13 COCCNC(=O)c1cccc(c1Cl)Br 240690a_100000209980_100000760540 [0,1,0,0,0,0|3,0,0]=4 1537 B15R1.13 COCCNC(=O)c1cccc(c1Cl)Br 527a_100000209980_100000760540 [0,1,0,0,0,0|3,0,0]=4 1538 B15R1.13 COCCNC(=O)c1cccc(c1Cl)C 1626a_100000209980_100000693142 [0,1,0,0,0,0|3,0,0]=4 1539 B15R1.13 COCCNC(=O)c1cccc(c1Cl)C 240690a_100000209980_100000693142 [0,1,0,0,0,0|3,0,0]=4 1540 B15R1.13 COCCNC(=O)c1cccc(c1Cl)C 527a_100000209980_100000693142 [0,1,0,0,0,0|3,0,0]=4 1541 B15R1.13 COCCNC(=O)c1cccc(c1Cl)Cl 1626a_100000209980_100000183631 [0,1,0,0,0,0|3,0,0]=4 1542 B15R1.13 COCCNC(=O)c1cccc(c1Cl)Cl 240690a_100000209980_100000183631 [0,1,0,0,0,0|3,0,0]=4 1543 B15R1.13 COCCNC(=O)c1cccc(c1Cl)Cl 527a_100000209980_100000183631 [0,1,0,0,0,0|3,0,0]=4 1544 B15R1.13 COCCNC(=O)c1cccc(c1Cl)F 1626a_100000209980_100000759904 [0,1,0,0,0,0|3,0,0]=4 1545 B15R1.13 COCCNC(=O)c1cccc(c1Cl)F 240690a_100000209980_100000759904 [0,1,0,0,0,0|3,0,0]=4 1546 B15R1.13 COCCNC(=O)c1cccc(c1Cl)F 527a_100000209980_100000759904 [0,1,0,0,0,0|3,0,0]=4 1547 B15R1.13 COCCNC(=O)c1cccc(c1Cl)I 1626a_100000209980_100010176783 [0,1,0,0,0,0|3,0,0]=4 1548 B15R1.13 COCCNC(=O)c1cccc(c1Cl)I 240690a_100000209980_100010176783 [0,1,0,0,0,0|3,0,0]=4 1549 B15R1.13 COCCNC(=O)c1cccc(c1Cl)I 527a_100000209980_100010176783 [0,1,0,0,0,0|3,0,0]=4 1550 B15R1.13 COCCNC(=O)c1cccc(c1Cl)O 240690a_100000209980_100000092362 [0,1,0,0,0,0|3,0,0]=4 1551 B15R1.13 COCCNC(=O)c1cccc(c1Cl)O 527a_100000209980_100000092362 [0,1,0,0,0,0|3,0,0]=4 1552 B15R1.13 COCCNC(=O)c1cccc(c1F)Br 1626a_100000209980_100000756403 [0,1,0,0,0,0|3,0,0]=4 1553 B15R1.13 COCCNC(=O)c1cccc(c1F)Br 240690a_100000209980_100000756403 [0,1,0,0,0,0|3,0,0]=4 1554 B15R1.13 COCCNC(=O)c1cccc(c1F)Br 527a_100000209980_100000756403 [0,1,0,0,0,0|3,0,0]=4 1555 B15R1.13 COCCNC(=O)c1cccc(c1F)C 1626a_100000209980_100000766181 [0,1,0,0,0,0|3,0,0]=4 1556 B15R1.13 COCCNC(=O)c1cccc(c1F)C 240690a_100000209980_100000766181 [0,1,0,0,0,0|3,0,0]=4 1557 B15R1.13 COCCNC(=O)c1cccc(c1F)C 527a_100000209980_100000766181 [0,1,0,0,0,0|3,0,0]=4 1558 B15R1.13 COCCNC(=O)c1cccc(c1F)Cl 1626a_100000209980_100000688816 [0,1,0,0,0,0|3,0,0]=4 1559 B15R1.13 COCCNC(=O)c1cccc(c1F)Cl 240690a_100000209980_100000688816 [0,1,0,0,0,0|3,0,0]=4 1560 B15R1.13 COCCNC(=O)c1cccc(c1F)Cl 527a_100000209980_100000688816 [0,1,0,0,0,0|3,0,0]=4 1561 B15R1.13 COCCNC(=O)c1cccc(c1F)F 1626a_100000209980_100000748134 [0,1,0,0,0,0|3,0,0]=4 1562 B15R1.13 COCCNC(=O)c1cccc(c1F)F 240690a_100000209980_100000748134 [0,1,0,0,0,0|3,0,0]=4 1563 B15R1.13 COCCNC(=O)c1cccc(c1F)F 527a_100000209980_100000748134 [0,1,0,0,0,0|3,0,0]=4 1564 B15R1.13 COCCNC(=O)c1cccc(c1F)I 1626a_100000209980_100010185205 [0,1,0,0,0,0|3,0,0]=4 1565 B15R1.13 COCCNC(=O)c1cccc(c1F)I 240690a_100000209980_100010185205 [0,1,0,0,0,0|3,0,0]=4 1566 B15R1.13 COCCNC(=O)c1cccc(c1F)I 527a_100000209980_100010185205 [0,1,0,0,0,0|3,0,0]=4 1567 B15R1.13 COCCNC(=O)c1cccc(c1F)O 240690a_100000209980_100000037433 [0,1,0,0,0,0|3,0,0]=4 1568 B15R1.13 COCCNC(=O)c1cccc(c1F)O 527a_100000209980_100000037433 [0,1,0,0,0,0|3,0,0]=4 1569 B15R1.13 COCCNC(=O)c1cccc(c1I)Br 1626a_100000209980_100000688019 [0,1,0,0,0,0|3,0,0]=4 1570 B15R1.13 COCCNC(=O)c1cccc(c1I)Br 240690a_100000209980_100000688019 [0,1,0,0,0,0|3,0,0]=4 1571 B15R1.13 COCCNC(=O)c1cccc(c1I)Br 527a_100000209980_100000688019 [0,1,0,0,0,0|3,0,0]=4 1572 B15R1.13 COCCNC(=O)c1cccc(c1I)C 1626a_100000209980_100000739377 [0,1,0,0,0,0|3,0,0]=4 1573 B15R1.13 COCCNC(=O)c1cccc(c1I)C 240690a_100000209980_100000739377 [0,1,0,0,0,0|3,0,0]=4 1574 B15R1.13 COCCNC(=O)c1cccc(c1I)C 527a_100000209980_100000739377 [0,1,0,0,0,0|3,0,0]=4 1575 B15R1.13 COCCNC(=O)c1cccc(c1I)Cl 1626a_100000209980_100010176784 [0,1,0,0,0,0|3,0,0]=4 1576 B15R1.13 COCCNC(=O)c1cccc(c1I)Cl 240690a_100000209980_100010176784 [0,1,0,0,0,0|3,0,0]=4 1577 B15R1.13 COCCNC(=O)c1cccc(c1I)Cl 527a_100000209980_100010176784 [0,1,0,0,0,0|3,0,0]=4 1578 B15R1.13 COCCNC(=O)c1cccc(c1I)F 1626a_100000209980_100000690930 [0,1,0,0,0,0|3,0,0]=4 1579 B15R1.13 COCCNC(=O)c1cccc(c1I)F 240690a_100000209980_100000690930 [0,1,0,0,0,0|3,0,0]=4 1580 B15R1.13 COCCNC(=O)c1cccc(c1I)F 527a_100000209980_100000690930 [0,1,0,0,0,0|3,0,0]=4 1581 B15R1.13 COCCNC(=O)c1cccc(c1I)O 527a_100000209980_100010084636 [0,1,0,0,0,0|3,0,0]=4 1582 B15R1.13 COCCNC(=O)c1cccc(c1O)Br 240690a_100000209980_100000752940 [0,1,0,0,0,0|2,0,0]=3 1583 B15R1.13 COCCNC(=O)c1cccc(c1O)Br 527a_100000209980_100000752940 [0,1,0,0,0,0|2,0,0]=3 1584 B15R1.13 COCCNC(=O)c1cccc(c1O)C 240690a_100000209980_100000183896 [0,1,0,0,0,0|2,0,0]=3 1585 B15R1.13 COCCNC(=O)c1cccc(c1O)C 527a_100000209980_100000183896 [0,1,0,0,0,0|2,0,0]=3 1586 B15R1.13 COCCNC(=O)c1cccc(c1O)Cl 240690a_100000209980_100000742801 [0,1,0,0,0,0|2,0,0]=3 1587 B15R1.13 COCCNC(=O)c1cccc(c1O)Cl 527a_100000209980_100000742801 [0,1,0,0,0,0|2,0,0]=3 1588 B15R1.13 COCCNC(=O)c1cccc(c1O)F 240690a_100000209980_100011217230 [0,1,0,0,0,0|2,0,0]=3 1589 B15R1.13 COCCNC(=O)c1cccc(c1O)F 527a_100000209980_100011217230 [0,1,0,0,0,0|2,0,0]=3 1590 B15R1.13 COCCNC(=O)c1cccc(c1O)O 527a_100000209980_100000690420 [0,1,0,0,0,0|2,0,0]=3 1591 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Br 11a_100020590264_100012360534 [0,1,0,0,0,0|3,0,0]=4 1592 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Br 1626a_100020590264_100012360534 [0,1,0,0,0,0|3,0,0]=4 1593 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Br 240690a_100020590264_100012360534 [0,1,0,0,0,0|3,0,0]=4 1594 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Br 527a_100020590264_100012360534 [0,1,0,0,0,0|3,0,0]=4 1595 B15R1.13 CSCCNC(=O)c1cccc(c1Br)C 11a_100020590264_100000692419 [0,1,0,0,0,0|3,0,0]=4 1596 B15R1.13 CSCCNC(=O)c1cccc(c1Br)C 1626a_100020590264_100000692419 [0,1,0,0,0,0|3,0,0]=4 1597 B15R1.13 CSCCNC(=O)c1cccc(c1Br)C 240690a_100020590264_100000692419 [0,1,0,0,0,0|3,0,0]=4 1598 B15R1.13 CSCCNC(=O)c1cccc(c1Br)C 527a_100020590264_100000692419 [0,1,0,0,0,0|3,0,0]=4 1599 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Cl 11a_100020590264_100012339722 [0,1,0,0,0,0|3,0,0]=4 1600 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Cl 1626a_100020590264_100012339722 [0,1,0,0,0,0|3,0,0]=4 1601 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Cl 240690a_100020590264_100012339722 [0,1,0,0,0,0|3,0,0]=4 1602 B15R1.13 CSCCNC(=O)c1cccc(c1Br)Cl 527a_100020590264_100012339722 [0,1,0,0,0,0|3,0,0]=4 1603 B15R1.13 CSCCNC(=O)c1cccc(c1Br)F 11a_100020590264_100011217547 [0,1,0,0,0,0|3,0,0]=4 1604 B15R1.13 CSCCNC(=O)c1cccc(c1Br)F 1626a_100020590264_100011217547 [0,1,0,0,0,0|3,0,0]=4 1605 B15R1.13 CSCCNC(=O)c1cccc(c1Br)F 240690a_100020590264_100011217547 [0,1,0,0,0,0|3,0,0]=4 1606 B15R1.13 CSCCNC(=O)c1cccc(c1Br)F 527a_100020590264_100011217547 [0,1,0,0,0,0|3,0,0]=4 1607 B15R1.13 CSCCNC(=O)c1cccc(c1Br)I 11a_100020590264_100010232522 [0,1,0,0,0,0|3,0,0]=4 1608 B15R1.13 CSCCNC(=O)c1cccc(c1Br)I 1626a_100020590264_100010232522 [0,1,0,0,0,0|3,0,0]=4 1609 B15R1.13 CSCCNC(=O)c1cccc(c1Br)I 240690a_100020590264_100010232522 [0,1,0,0,0,0|3,0,0]=4 1610 B15R1.13 CSCCNC(=O)c1cccc(c1Br)I 527a_100020590264_100010232522 [0,1,0,0,0,0|3,0,0]=4 1611 B15R1.13 CSCCNC(=O)c1cccc(c1Br)O 240690a_100020590264_100010230362 [0,1,0,0,0,0|3,0,0]=4 1612 B15R1.13 CSCCNC(=O)c1cccc(c1Br)O 527a_100020590264_100010230362 [0,1,0,0,0,0|3,0,0]=4 1613 B15R1.13 CSCCNC(=O)c1cccc(c1C)Br 11a_100020590264_100000760464 [0,1,0,0,0,0|3,0,0]=4 1614 B15R1.13 CSCCNC(=O)c1cccc(c1C)Br 1626a_100020590264_100000760464 [0,1,0,0,0,0|3,0,0]=4 1615 B15R1.13 CSCCNC(=O)c1cccc(c1C)Br 240690a_100020590264_100000760464 [0,1,0,0,0,0|3,0,0]=4 1616 B15R1.13 CSCCNC(=O)c1cccc(c1C)Br 527a_100020590264_100000760464 [0,1,0,0,0,0|3,0,0]=4 1617 B15R1.13 CSCCNC(=O)c1cccc(c1C)C 11a_100020590264_100000183679 [0,1,0,0,0,0|3,0,0]=4 1618 B15R1.13 CSCCNC(=O)c1cccc(c1C)C 1626a_100020590264_100000183679 [0,1,0,0,0,0|3,0,0]=4 1619 B15R1.13 CSCCNC(=O)c1cccc(c1C)C 240690a_100020590264_100000183679 [0,1,0,0,0,0|3,0,0]=4 1620 B15R1.13 CSCCNC(=O)c1cccc(c1C)C 527a_100020590264_100000183679 [0,1,0,0,0,0|3,0,0]=4 1621 B15R1.13 CSCCNC(=O)c1cccc(c1C)Cl 11a_100020590264_100000690184 [0,1,0,0,0,0|3,0,0]=4 1622 B15R1.13 CSCCNC(=O)c1cccc(c1C)Cl 1626a_100020590264_100000690184 [0,1,0,0,0,0|3,0,0]=4 1623 B15R1.13 CSCCNC(=O)c1cccc(c1C)Cl 240690a_100020590264_100000690184 [0,1,0,0,0,0|3,0,0]=4 1624 B15R1.13 CSCCNC(=O)c1cccc(c1C)Cl 527a_100020590264_100000690184 [0,1,0,0,0,0|3,0,0]=4 1625 B15R1.13 CSCCNC(=O)c1cccc(c1C)F 11a_100020590264_100011218272 [0,1,0,0,0,0|3,0,0]=4 1626 B15R1.13 CSCCNC(=O)c1cccc(c1C)F 1626a_100020590264_100011218272 [0,1,0,0,0,0|3,0,0]=4 1627 B15R1.13 CSCCNC(=O)c1cccc(c1C)F 240690a_100020590264_100011218272 [0,1,0,0,0,0|3,0,0]=4 1628 B15R1.13 CSCCNC(=O)c1cccc(c1C)F 527a_100020590264_100011218272 [0,1,0,0,0,0|3,0,0]=4 1629 B15R1.13 CSCCNC(=O)c1cccc(c1C)I 11a_100020590264_100000751865 [0,1,0,0,0,0|3,0,0]=4 1630 B15R1.13 CSCCNC(=O)c1cccc(c1C)I 1626a_100020590264_100000751865 [0,1,0,0,0,0|3,0,0]=4 1631 B15R1.13 CSCCNC(=O)c1cccc(c1C)I 240690a_100020590264_100000751865 [0,1,0,0,0,0|3,0,0]=4 1632 B15R1.13 CSCCNC(=O)c1cccc(c1C)I 527a_100020590264_100000751865 [0,1,0,0,0,0|3,0,0]=4 1633 B15R1.13 CSCCNC(=O)c1cccc(c1C)O 240690a_100020590264_100000766327 [0,1,0,0,0,0|3,0,0]=4 1634 B15R1.13 CSCCNC(=O)c1cccc(c1C)O 527a_100020590264_100000766327 [0,1,0,0,0,0|3,0,0]=4 1635 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Br 11a_100020590264_100000760540 [0,1,0,0,0,0|3,0,0]=4 1636 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Br 1626a_100020590264_100000760540 [0,1,0,0,0,0|3,0,0]=4 1637 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Br 240690a_100020590264_100000760540 [0,1,0,0,0,0|3,0,0]=4 1638 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Br 527a_100020590264_100000760540 [0,1,0,0,0,0|3,0,0]=4 1639 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)C 11a_100020590264_100000693142 [0,1,0,0,0,0|3,0,0]=4 1640 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)C 1626a_100020590264_100000693142 [0,1,0,0,0,0|3,0,0]=4 1641 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)C 240690a_100020590264_100000693142 [0,1,0,0,0,0|3,0,0]=4 1642 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)C 527a_100020590264_100000693142 [0,1,0,0,0,0|3,0,0]=4 1643 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Cl 11a_100020590264_100000183631 [0,1,0,0,0,0|3,0,0]=4 1644 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Cl 1626a_100020590264_100000183631 [0,1,0,0,0,0|3,0,0]=4 1645 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Cl 240690a_100020590264_100000183631 [0,1,0,0,0,0|3,0,0]=4 1646 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)Cl 527a_100020590264_100000183631 [0,1,0,0,0,0|3,0,0]=4 1647 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)F 11a_100020590264_100000759904 [0,1,0,0,0,0|3,0,0]=4 1648 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)F 1626a_100020590264_100000759904 [0,1,0,0,0,0|3,0,0]=4 1649 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)F 240690a_100020590264_100000759904 [0,1,0,0,0,0|3,0,0]=4 1650 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)F 527a_100020590264_100000759904 [0,1,0,0,0,0|3,0,0]=4 1651 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)I 11a_100020590264_100010176783 [0,1,0,0,0,0|3,0,0]=4 1652 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)I 1626a_100020590264_100010176783 [0,1,0,0,0,0|3,0,0]=4 1653 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)I 240690a_100020590264_100010176783 [0,1,0,0,0,0|3,0,0]=4 1654 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)I 527a_100020590264_100010176783 [0,1,0,0,0,0|3,0,0]=4 1655 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)O 240690a_100020590264_100000092362 [0,1,0,0,0,0|3,0,0]=4 1656 B15R1.13 CSCCNC(=O)c1cccc(c1Cl)O 527a_100020590264_100000092362 [0,1,0,0,0,0|3,0,0]=4 1657 B15R1.13 CSCCNC(=O)c1cccc(c1F)Br 11a_100020590264_100000756403 [0,1,0,0,0,0|3,0,0]=4 1658 B15R1.13 CSCCNC(=O)c1cccc(c1F)Br 1626a_100020590264_100000756403 [0,1,0,0,0,0|3,0,0]=4 1659 B15R1.13 CSCCNC(=O)c1cccc(c1F)Br 240690a_100020590264_100000756403 [0,1,0,0,0,0|3,0,0]=4 1660 B15R1.13 CSCCNC(=O)c1cccc(c1F)Br 527a_100020590264_100000756403 [0,1,0,0,0,0|3,0,0]=4 1661 B15R1.13 CSCCNC(=O)c1cccc(c1F)C 11a_100020590264_100000766181 [0,1,0,0,0,0|3,0,0]=4 1662 B15R1.13 CSCCNC(=O)c1cccc(c1F)C 1626a_100020590264_100000766181 [0,1,0,0,0,0|3,0,0]=4 1663 B15R1.13 CSCCNC(=O)c1cccc(c1F)C 240690a_100020590264_100000766181 [0,1,0,0,0,0|3,0,0]=4 1664 B15R1.13 CSCCNC(=O)c1cccc(c1F)C 527a_100020590264_100000766181 [0,1,0,0,0,0|3,0,0]=4 1665 B15R1.13 CSCCNC(=O)c1cccc(c1F)Cl 11a_100020590264_100000688816 [0,1,0,0,0,0|3,0,0]=4 1666 B15R1.13 CSCCNC(=O)c1cccc(c1F)Cl 1626a_100020590264_100000688816 [0,1,0,0,0,0|3,0,0]=4 1667 B15R1.13 CSCCNC(=O)c1cccc(c1F)Cl 240690a_100020590264_100000688816 [0,1,0,0,0,0|3,0,0]=4 1668 B15R1.13 CSCCNC(=O)c1cccc(c1F)Cl 527a_100020590264_100000688816 [0,1,0,0,0,0|3,0,0]=4 1669 B15R1.13 CSCCNC(=O)c1cccc(c1F)F 11a_100020590264_100000748134 [0,1,0,0,0,0|3,0,0]=4 1670 B15R1.13 CSCCNC(=O)c1cccc(c1F)F 1626a_100020590264_100000748134 [0,1,0,0,0,0|3,0,0]=4 1671 B15R1.13 CSCCNC(=O)c1cccc(c1F)F 240690a_100020590264_100000748134 [0,1,0,0,0,0|3,0,0]=4 1672 B15R1.13 CSCCNC(=O)c1cccc(c1F)F 527a_100020590264_100000748134 [0,1,0,0,0,0|3,0,0]=4 1673 B15R1.13 CSCCNC(=O)c1cccc(c1F)I 11a_100020590264_100010185205 [0,1,0,0,0,0|3,0,0]=4 1674 B15R1.13 CSCCNC(=O)c1cccc(c1F)I 1626a_100020590264_100010185205 [0,1,0,0,0,0|3,0,0]=4 1675 B15R1.13 CSCCNC(=O)c1cccc(c1F)I 240690a_100020590264_100010185205 [0,1,0,0,0,0|3,0,0]=4 1676 B15R1.13 CSCCNC(=O)c1cccc(c1F)I 527a_100020590264_100010185205 [0,1,0,0,0,0|3,0,0]=4 1677 B15R1.13 CSCCNC(=O)c1cccc(c1F)O 240690a_100020590264_100000037433 [0,1,0,0,0,0|3,0,0]=4 1678 B15R1.13 CSCCNC(=O)c1cccc(c1F)O 527a_100020590264_100000037433 [0,1,0,0,0,0|3,0,0]=4 1679 B15R1.13 CSCCNC(=O)c1cccc(c1I)Br 11a_100020590264_100000688019 [0,1,0,0,0,0|3,0,0]=4 1680 B15R1.13 CSCCNC(=O)c1cccc(c1I)Br 1626a_100020590264_100000688019 [0,1,0,0,0,0|3,0,0]=4 1681 B15R1.13 CSCCNC(=O)c1cccc(c1I)Br 240690a_100020590264_100000688019 [0,1,0,0,0,0|3,0,0]=4 1682 B15R1.13 CSCCNC(=O)c1cccc(c1I)Br 527a_100020590264_100000688019 [0,1,0,0,0,0|3,0,0]=4 1683 B15R1.13 CSCCNC(=O)c1cccc(c1I)C 11a_100020590264_100000739377 [0,1,0,0,0,0|3,0,0]=4 1684 B15R1.13 CSCCNC(=O)c1cccc(c1I)C 1626a_100020590264_100000739377 [0,1,0,0,0,0|3,0,0]=4 1685 B15R1.13 CSCCNC(=O)c1cccc(c1I)C 240690a_100020590264_100000739377 [0,1,0,0,0,0|3,0,0]=4 1686 B15R1.13 CSCCNC(=O)c1cccc(c1I)C 527a_100020590264_100000739377 [0,1,0,0,0,0|3,0,0]=4 1687 B15R1.13 CSCCNC(=O)c1cccc(c1I)Cl 11a_100020590264_100010176784 [0,1,0,0,0,0|3,0,0]=4 1688 B15R1.13 CSCCNC(=O)c1cccc(c1I)Cl 1626a_100020590264_100010176784 [0,1,0,0,0,0|3,0,0]=4 1689 B15R1.13 CSCCNC(=O)c1cccc(c1I)Cl 240690a_100020590264_100010176784 [0,1,0,0,0,0|3,0,0]=4 1690 B15R1.13 CSCCNC(=O)c1cccc(c1I)Cl 527a_100020590264_100010176784 [0,1,0,0,0,0|3,0,0]=4 1691 B15R1.13 CSCCNC(=O)c1cccc(c1I)F 11a_100020590264_100000690930 [0,1,0,0,0,0|3,0,0]=4 1692 B15R1.13 CSCCNC(=O)c1cccc(c1I)F 1626a_100020590264_100000690930 [0,1,0,0,0,0|3,0,0]=4 1693 B15R1.13 CSCCNC(=O)c1cccc(c1I)F 240690a_100020590264_100000690930 [0,1,0,0,0,0|3,0,0]=4 1694 B15R1.13 CSCCNC(=O)c1cccc(c1I)F 527a_100020590264_100000690930 [0,1,0,0,0,0|3,0,0]=4 1695 B15R1.13 CSCCNC(=O)c1cccc(c1I)O 527a_100020590264_100010084636 [0,1,0,0,0,0|3,0,0]=4 1696 B15R1.13 CSCCNC(=O)c1cccc(c1O)Br 240690a_100020590264_100000752940 [0,1,0,0,0,0|2,0,0]=3 1697 B15R1.13 CSCCNC(=O)c1cccc(c1O)Br 527a_100020590264_100000752940 [0,1,0,0,0,0|2,0,0]=3 1698 B15R1.13 CSCCNC(=O)c1cccc(c1O)C 240690a_100020590264_100000183896 [0,1,0,0,0,0|2,0,0]=3 1699 B15R1.13 CSCCNC(=O)c1cccc(c1O)C 527a_100020590264_100000183896 [0,1,0,0,0,0|2,0,0]=3 1700 B15R1.13 CSCCNC(=O)c1cccc(c1O)Cl 240690a_100020590264_100000742801 [0,1,0,0,0,0|2,0,0]=3 1701 B15R1.13 CSCCNC(=O)c1cccc(c1O)Cl 527a_100020590264_100000742801 [0,1,0,0,0,0|2,0,0]=3 1702 B15R1.13 CSCCNC(=O)c1cccc(c1O)F 240690a_100020590264_100011217230 [0,1,0,0,0,0|2,0,0]=3 1703 B15R1.13 CSCCNC(=O)c1cccc(c1O)F 527a_100020590264_100011217230 [0,1,0,0,0,0|2,0,0]=3 1704 B15R1.13 CSCCNC(=O)c1cccc(c1O)O 527a_100020590264_100000690420 [0,1,0,0,0,0|2,0,0]=3 1705 B15R1.13 Cc1c(cccc1C(=O)CCCCF)Br 1458a_100000760464_100000729493 [0,1,0,0,0,0|3,0,0]=4 1706 B15R1.13 Cc1c(cccc1C(=O)CCCCF)Cl 1458a_100000690184_100000729493 [0,1,0,0,0,0|3,0,0]=4 1707 B15R1.13 Cc1c(cccc1C(=O)CCCCF)F 1458a_100011218272_100000729493 [0,1,0,0,0,0|3,0,0]=4 1708 B15R1.13 Cc1c(cccc1C(=O)CCCCF)I 1458a_100000751865_100000729493 [0,1,0,0,0,0|3,0,0]=4 1709 B15R1.13 Cc1c(cccc1C(=O)CCCCF)O 1458a_100000766327_100000729493 [0,1,0,0,0,0|3,0,0]=4 1710 B15R1.13 Cc1c(cccc1C(=O)CCCCO)Br 1458a_100000760464_100000210776 [0,1,0,0,0,0|3,0,0]=4 1711 B15R1.13 Cc1c(cccc1C(=O)CCCCO)Cl 1458a_100000690184_100000210776 [0,1,0,0,0,0|3,0,0]=4 1712 B15R1.13 Cc1c(cccc1C(=O)CCCCO)F 1458a_100011218272_100000210776 [0,1,0,0,0,0|3,0,0]=4 1713 B15R1.13 Cc1c(cccc1C(=O)CCCCO)I 1458a_100000751865_100000210776 [0,1,0,0,0,0|3,0,0]=4 1714 B15R1.13 Cc1c(cccc1C(=O)CCCCO)O 1458a_100000766327_100000210776 [0,1,0,0,0,0|3,0,0]=4 1715 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Br 11a_100015189416_100000760464 [0,1,0,0,0,0|3,0,0]=4 1716 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Br 1626a_100015189416_100000760464 [0,1,0,0,0,0|3,0,0]=4 1717 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Br 240690a_100015189416_100000760464 [0,1,0,0,0,0|3,0,0]=4 1718 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Br 527a_100015189416_100000760464 [0,1,0,0,0,0|3,0,0]=4 1719 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Cl 11a_100015189416_100000690184 [0,1,0,0,0,0|3,0,0]=4 1720 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Cl 1626a_100015189416_100000690184 [0,1,0,0,0,0|3,0,0]=4 1721 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Cl 240690a_100015189416_100000690184 [0,1,0,0,0,0|3,0,0]=4 1722 B15R1.13 Cc1c(cccc1C(=O)NCCCF)Cl 527a_100015189416_100000690184 [0,1,0,0,0,0|3,0,0]=4 1723 B15R1.13 Cc1c(cccc1C(=O)NCCCF)F 11a_100015189416_100011218272 [0,1,0,0,0,0|3,0,0]=4 1724 B15R1.13 Cc1c(cccc1C(=O)NCCCF)F 1626a_100015189416_100011218272 [0,1,0,0,0,0|3,0,0]=4 1725 B15R1.13 Cc1c(cccc1C(=O)NCCCF)F 240690a_100015189416_100011218272 [0,1,0,0,0,0|3,0,0]=4 1726 B15R1.13 Cc1c(cccc1C(=O)NCCCF)F 527a_100015189416_100011218272 [0,1,0,0,0,0|3,0,0]=4 1727 B15R1.13 Cc1c(cccc1C(=O)NCCCF)I 11a_100015189416_100000751865 [0,1,0,0,0,0|3,0,0]=4 1728 B15R1.13 Cc1c(cccc1C(=O)NCCCF)I 1626a_100015189416_100000751865 [0,1,0,0,0,0|3,0,0]=4 1729 B15R1.13 Cc1c(cccc1C(=O)NCCCF)I 240690a_100015189416_100000751865 [0,1,0,0,0,0|3,0,0]=4 1730 B15R1.13 Cc1c(cccc1C(=O)NCCCF)I 527a_100015189416_100000751865 [0,1,0,0,0,0|3,0,0]=4 1731 B15R1.13 Cc1c(cccc1C(=O)NCCCF)O 240690a_100015189416_100000766327 [0,1,0,0,0,0|3,0,0]=4 1732 B15R1.13 Cc1c(cccc1C(=O)NCCCF)O 527a_100015189416_100000766327 [0,1,0,0,0,0|3,0,0]=4 1733 B15R1.13 Cc1c(cccc1C(=O)NCCCO)Br 240690a_100000182051_100000760464 [0,1,0,0,0,0|3,0,0]=4 1734 B15R1.13 Cc1c(cccc1C(=O)NCCCO)Br 527a_100000182051_100000760464 [0,1,0,0,0,0|3,0,0]=4 1735 B15R1.13 Cc1c(cccc1C(=O)NCCCO)Cl 240690a_100000182051_100000690184 [0,1,0,0,0,0|3,0,0]=4 1736 B15R1.13 Cc1c(cccc1C(=O)NCCCO)Cl 527a_100000182051_100000690184 [0,1,0,0,0,0|3,0,0]=4 1737 B15R1.13 Cc1c(cccc1C(=O)NCCCO)F 240690a_100000182051_100011218272 [0,1,0,0,0,0|3,0,0]=4 1738 B15R1.13 Cc1c(cccc1C(=O)NCCCO)F 527a_100000182051_100011218272 [0,1,0,0,0,0|3,0,0]=4 1739 B15R1.13 Cc1c(cccc1C(=O)NCCCO)I 240690a_100000182051_100000751865 [0,1,0,0,0,0|3,0,0]=4 1740 B15R1.13 Cc1c(cccc1C(=O)NCCCO)I 527a_100000182051_100000751865 [0,1,0,0,0,0|3,0,0]=4 1741 B15R1.13 Cc1c(cccc1C(=O)NCCCO)O 240690a_100000182051_100000766327 [0,1,0,0,0,0|3,0,0]=4 1742 B15R1.13 Cc1c(cccc1C(=O)NCCCO)O 527a_100000182051_100000766327 [0,1,0,0,0,0|3,0,0]=4 1743 B15R1.13 Cc1cccc(c1Br)C(=O)CCCCF 1458a_100000692419_100000729493 [0,1,0,0,0,0|3,0,0]=4 1744 B15R1.13 Cc1cccc(c1Br)C(=O)CCCCO 1458a_100000692419_100000210776 [0,1,0,0,0,0|3,0,0]=4 1745 B15R1.13 Cc1cccc(c1Br)C(=O)NCCCF 11a_100015189416_100000692419 [0,1,0,0,0,0|3,0,0]=4 1746 B15R1.13 Cc1cccc(c1Br)C(=O)NCCCF 1626a_100015189416_100000692419 [0,1,0,0,0,0|3,0,0]=4 1747 B15R1.13 Cc1cccc(c1Br)C(=O)NCCCF 240690a_100015189416_100000692419 [0,1,0,0,0,0|3,0,0]=4 1748 B15R1.13 Cc1cccc(c1Br)C(=O)NCCCF 527a_100015189416_100000692419 [0,1,0,0,0,0|3,0,0]=4 1749 B15R1.13 Cc1cccc(c1Br)C(=O)NCCCO 240690a_100000182051_100000692419 [0,1,0,0,0,0|3,0,0]=4 1750 B15R1.13 Cc1cccc(c1Br)C(=O)NCCCO 527a_100000182051_100000692419 [0,1,0,0,0,0|3,0,0]=4 1751 B15R1.13 Cc1cccc(c1C)C(=O)CCCCF 1458a_100000183679_100000729493 [0,1,0,0,0,0|3,0,0]=4 1752 B15R1.13 Cc1cccc(c1C)C(=O)CCCCO 1458a_100000183679_100000210776 [0,1,0,0,0,0|3,0,0]=4 1753 B15R1.13 Cc1cccc(c1C)C(=O)NCCCF 11a_100015189416_100000183679 [0,1,0,0,0,0|3,0,0]=4 1754 B15R1.13 Cc1cccc(c1C)C(=O)NCCCF 1626a_100015189416_100000183679 [0,1,0,0,0,0|3,0,0]=4 1755 B15R1.13 Cc1cccc(c1C)C(=O)NCCCF 240690a_100015189416_100000183679 [0,1,0,0,0,0|3,0,0]=4 1756 B15R1.13 Cc1cccc(c1C)C(=O)NCCCF 527a_100015189416_100000183679 [0,1,0,0,0,0|3,0,0]=4 1757 B15R1.13 Cc1cccc(c1C)C(=O)NCCCO 240690a_100000182051_100000183679 [0,1,0,0,0,0|3,0,0]=4 1758 B15R1.13 Cc1cccc(c1C)C(=O)NCCCO 527a_100000182051_100000183679 [0,1,0,0,0,0|3,0,0]=4 1759 B15R1.13 Cc1cccc(c1Cl)C(=O)CCCCF 1458a_100000693142_100000729493 [0,1,0,0,0,0|3,0,0]=4 1760 B15R1.13 Cc1cccc(c1Cl)C(=O)CCCCO 1458a_100000693142_100000210776 [0,1,0,0,0,0|3,0,0]=4 1761 B15R1.13 Cc1cccc(c1Cl)C(=O)NCCCF 11a_100015189416_100000693142 [0,1,0,0,0,0|3,0,0]=4 1762 B15R1.13 Cc1cccc(c1Cl)C(=O)NCCCF 1626a_100015189416_100000693142 [0,1,0,0,0,0|3,0,0]=4 1763 B15R1.13 Cc1cccc(c1Cl)C(=O)NCCCF 240690a_100015189416_100000693142 [0,1,0,0,0,0|3,0,0]=4 1764 B15R1.13 Cc1cccc(c1Cl)C(=O)NCCCF 527a_100015189416_100000693142 [0,1,0,0,0,0|3,0,0]=4 1765 B15R1.13 Cc1cccc(c1Cl)C(=O)NCCCO 240690a_100000182051_100000693142 [0,1,0,0,0,0|3,0,0]=4 1766 B15R1.13 Cc1cccc(c1Cl)C(=O)NCCCO 527a_100000182051_100000693142 [0,1,0,0,0,0|3,0,0]=4 1767 B15R1.13 Cc1cccc(c1F)C(=O)CCCCF 1458a_100000766181_100000729493 [0,1,0,0,0,0|3,0,0]=4 1768 B15R1.13 Cc1cccc(c1F)C(=O)CCCCO 1458a_100000766181_100000210776 [0,1,0,0,0,0|3,0,0]=4 1769 B15R1.13 Cc1cccc(c1F)C(=O)NCCCF 11a_100015189416_100000766181 [0,1,0,0,0,0|3,0,0]=4 1770 B15R1.13 Cc1cccc(c1F)C(=O)NCCCF 1626a_100015189416_100000766181 [0,1,0,0,0,0|3,0,0]=4 1771 B15R1.13 Cc1cccc(c1F)C(=O)NCCCF 240690a_100015189416_100000766181 [0,1,0,0,0,0|3,0,0]=4 1772 B15R1.13 Cc1cccc(c1F)C(=O)NCCCF 527a_100015189416_100000766181 [0,1,0,0,0,0|3,0,0]=4 1773 B15R1.13 Cc1cccc(c1F)C(=O)NCCCO 240690a_100000182051_100000766181 [0,1,0,0,0,0|3,0,0]=4 1774 B15R1.13 Cc1cccc(c1F)C(=O)NCCCO 527a_100000182051_100000766181 [0,1,0,0,0,0|3,0,0]=4 1775 B15R1.13 Cc1cccc(c1I)C(=O)CCCCF 1458a_100000739377_100000729493 [0,1,0,0,0,0|3,0,0]=4 1776 B15R1.13 Cc1cccc(c1I)C(=O)CCCCO 1458a_100000739377_100000210776 [0,1,0,0,0,0|3,0,0]=4 1777 B15R1.13 Cc1cccc(c1I)C(=O)NCCCF 11a_100015189416_100000739377 [0,1,0,0,0,0|3,0,0]=4 1778 B15R1.13 Cc1cccc(c1I)C(=O)NCCCF 1626a_100015189416_100000739377 [0,1,0,0,0,0|3,0,0]=4 1779 B15R1.13 Cc1cccc(c1I)C(=O)NCCCF 240690a_100015189416_100000739377 [0,1,0,0,0,0|3,0,0]=4 1780 B15R1.13 Cc1cccc(c1I)C(=O)NCCCF 527a_100015189416_100000739377 [0,1,0,0,0,0|3,0,0]=4 1781 B15R1.13 Cc1cccc(c1I)C(=O)NCCCO 240690a_100000182051_100000739377 [0,1,0,0,0,0|3,0,0]=4 1782 B15R1.13 Cc1cccc(c1I)C(=O)NCCCO 527a_100000182051_100000739377 [0,1,0,0,0,0|3,0,0]=4 1783 B15R1.13 Cc1cccc(c1O)C(=O)CCCC#N 1458a_100000183896_100000211468 [0,1,0,0,0,0|2,0,1]=4 1784 B15R1.13 Cc1cccc(c1O)C(=O)CCCCF 1458a_100000183896_100000729493 [0,1,0,0,0,0|2,0,0]=3 1785 B15R1.13 Cc1cccc(c1O)C(=O)CCCCO 1458a_100000183896_100000210776 [0,1,0,0,0,0|2,0,0]=3 1786 B15R1.13 Cc1cccc(c1O)C(=O)NCCC#N 240690a_100000720768_100000183896 [0,1,0,0,0,0|2,0,1]=4 1787 B15R1.13 Cc1cccc(c1O)C(=O)NCCC#N 527a_100000720768_100000183896 [0,1,0,0,0,0|2,0,1]=4 1788 B15R1.13 Cc1cccc(c1O)C(=O)NCCCF 240690a_100015189416_100000183896 [0,1,0,0,0,0|2,0,0]=3 1789 B15R1.13 Cc1cccc(c1O)C(=O)NCCCF 527a_100015189416_100000183896 [0,1,0,0,0,0|2,0,0]=3 1790 B15R1.13 Cc1cccc(c1O)C(=O)NCCCO 240690a_100000182051_100000183896 [0,1,0,0,0,0|2,0,0]=3 1791 B15R1.13 Cc1cccc(c1O)C(=O)NCCCO 527a_100000182051_100000183896 [0,1,0,0,0,0|2,0,0]=3 1792 B15R1.13 Cc1cccc(c1O)C(=O)NNCCO 22a_100000210001_100000183896 [0,1,0,0,0,0|3,0,0]=4 1793 B15R1.13 N#CCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000211468 [0,1,0,0,0,0|2,0,1]=4 1794 B15R1.13 N#CCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000211468 [0,1,0,0,0,0|2,0,1]=4 1795 B15R1.13 N#CCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000211468 [0,1,0,0,0,0|2,0,1]=4 1796 B15R1.13 N#CCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000211468 [0,1,0,0,0,0|2,0,1]=4 1797 B15R1.13 N#CCCNC(=O)c1cccc(c1O)Br 240690a_100000720768_100000752940 [0,1,0,0,0,0|2,0,1]=4 1798 B15R1.13 N#CCCNC(=O)c1cccc(c1O)Br 527a_100000720768_100000752940 [0,1,0,0,0,0|2,0,1]=4 1799 B15R1.13 N#CCCNC(=O)c1cccc(c1O)Cl 240690a_100000720768_100000742801 [0,1,0,0,0,0|2,0,1]=4 1800 B15R1.13 N#CCCNC(=O)c1cccc(c1O)Cl 527a_100000720768_100000742801 [0,1,0,0,0,0|2,0,1]=4 1801 B15R1.13 N#CCCNC(=O)c1cccc(c1O)F 240690a_100000720768_100011217230 [0,1,0,0,0,0|2,0,1]=4 1802 B15R1.13 N#CCCNC(=O)c1cccc(c1O)F 527a_100000720768_100011217230 [0,1,0,0,0,0|2,0,1]=4 1803 B15R1.13 N#CCCNC(=O)c1cccc(c1O)O 527a_100000720768_100000690420 [0,1,0,0,0,0|2,0,1]=4 1804 B15R1.13 O=C(CCCCF)c1cccc(c1Br)Br 1458a_100012360534_100000729493 [0,1,0,0,0,0|3,0,0]=4 1805 B15R1.13 O=C(CCCCF)c1cccc(c1Br)Cl 1458a_100012339722_100000729493 [0,1,0,0,0,0|3,0,0]=4 1806 B15R1.13 O=C(CCCCF)c1cccc(c1Br)F 1458a_100011217547_100000729493 [0,1,0,0,0,0|3,0,0]=4 1807 B15R1.13 O=C(CCCCF)c1cccc(c1Br)I 1458a_100010232522_100000729493 [0,1,0,0,0,0|3,0,0]=4 1808 B15R1.13 O=C(CCCCF)c1cccc(c1Br)O 1458a_100010230362_100000729493 [0,1,0,0,0,0|3,0,0]=4 1809 B15R1.13 O=C(CCCCF)c1cccc(c1Cl)Br 1458a_100000760540_100000729493 [0,1,0,0,0,0|3,0,0]=4 1810 B15R1.13 O=C(CCCCF)c1cccc(c1Cl)Cl 1458a_100000183631_100000729493 [0,1,0,0,0,0|3,0,0]=4 1811 B15R1.13 O=C(CCCCF)c1cccc(c1Cl)F 1458a_100000759904_100000729493 [0,1,0,0,0,0|3,0,0]=4 1812 B15R1.13 O=C(CCCCF)c1cccc(c1Cl)I 1458a_100010176783_100000729493 [0,1,0,0,0,0|3,0,0]=4 1813 B15R1.13 O=C(CCCCF)c1cccc(c1Cl)O 1458a_100000092362_100000729493 [0,1,0,0,0,0|3,0,0]=4 1814 B15R1.13 O=C(CCCCF)c1cccc(c1F)Br 1458a_100000756403_100000729493 [0,1,0,0,0,0|3,0,0]=4 1815 B15R1.13 O=C(CCCCF)c1cccc(c1F)Cl 1458a_100000688816_100000729493 [0,1,0,0,0,0|3,0,0]=4 1816 B15R1.13 O=C(CCCCF)c1cccc(c1F)F 1458a_100000748134_100000729493 [0,1,0,0,0,0|3,0,0]=4 1817 B15R1.13 O=C(CCCCF)c1cccc(c1F)I 1458a_100010185205_100000729493 [0,1,0,0,0,0|3,0,0]=4 1818 B15R1.13 O=C(CCCCF)c1cccc(c1F)O 1458a_100000037433_100000729493 [0,1,0,0,0,0|3,0,0]=4 1819 B15R1.13 O=C(CCCCF)c1cccc(c1I)Br 1458a_100000688019_100000729493 [0,1,0,0,0,0|3,0,0]=4 1820 B15R1.13 O=C(CCCCF)c1cccc(c1I)Cl 1458a_100010176784_100000729493 [0,1,0,0,0,0|3,0,0]=4 1821 B15R1.13 O=C(CCCCF)c1cccc(c1I)F 1458a_100000690930_100000729493 [0,1,0,0,0,0|3,0,0]=4 1822 B15R1.13 O=C(CCCCF)c1cccc(c1I)O 1458a_100010084636_100000729493 [0,1,0,0,0,0|3,0,0]=4 1823 B15R1.13 O=C(CCCCF)c1cccc(c1O)Br 1458a_100000752940_100000729493 [0,1,0,0,0,0|2,0,0]=3 1824 B15R1.13 O=C(CCCCF)c1cccc(c1O)Cl 1458a_100000742801_100000729493 [0,1,0,0,0,0|2,0,0]=3 1825 B15R1.13 O=C(CCCCF)c1cccc(c1O)F 1458a_100011217230_100000729493 [0,1,0,0,0,0|2,0,0]=3 1826 B15R1.13 O=C(CCCCF)c1cccc(c1O)O 1458a_100000690420_100000729493 [0,1,0,0,0,0|2,0,0]=3 1827 B15R1.13 O=C(CCCCO)c1cccc(c1Br)Br 1458a_100012360534_100000210776 [0,1,0,0,0,0|3,0,0]=4 1828 B15R1.13 O=C(CCCCO)c1cccc(c1Br)Cl 1458a_100012339722_100000210776 [0,1,0,0,0,0|3,0,0]=4 1829 B15R1.13 O=C(CCCCO)c1cccc(c1Br)F 1458a_100011217547_100000210776 [0,1,0,0,0,0|3,0,0]=4 1830 B15R1.13 O=C(CCCCO)c1cccc(c1Br)I 1458a_100010232522_100000210776 [0,1,0,0,0,0|3,0,0]=4 1831 B15R1.13 O=C(CCCCO)c1cccc(c1Br)O 1458a_100010230362_100000210776 [0,1,0,0,0,0|3,0,0]=4 1832 B15R1.13 O=C(CCCCO)c1cccc(c1Cl)Br 1458a_100000760540_100000210776 [0,1,0,0,0,0|3,0,0]=4 1833 B15R1.13 O=C(CCCCO)c1cccc(c1Cl)Cl 1458a_100000183631_100000210776 [0,1,0,0,0,0|3,0,0]=4 1834 B15R1.13 O=C(CCCCO)c1cccc(c1Cl)F 1458a_100000759904_100000210776 [0,1,0,0,0,0|3,0,0]=4 1835 B15R1.13 O=C(CCCCO)c1cccc(c1Cl)I 1458a_100010176783_100000210776 [0,1,0,0,0,0|3,0,0]=4 1836 B15R1.13 O=C(CCCCO)c1cccc(c1Cl)O 1458a_100000092362_100000210776 [0,1,0,0,0,0|3,0,0]=4 1837 B15R1.13 O=C(CCCCO)c1cccc(c1F)Br 1458a_100000756403_100000210776 [0,1,0,0,0,0|3,0,0]=4 1838 B15R1.13 O=C(CCCCO)c1cccc(c1F)Cl 1458a_100000688816_100000210776 [0,1,0,0,0,0|3,0,0]=4 1839 B15R1.13 O=C(CCCCO)c1cccc(c1F)F 1458a_100000748134_100000210776 [0,1,0,0,0,0|3,0,0]=4 1840 B15R1.13 O=C(CCCCO)c1cccc(c1F)I 1458a_100010185205_100000210776 [0,1,0,0,0,0|3,0,0]=4 1841 B15R1.13 O=C(CCCCO)c1cccc(c1F)O 1458a_100000037433_100000210776 [0,1,0,0,0,0|3,0,0]=4 1842 B15R1.13 O=C(CCCCO)c1cccc(c1I)Br 1458a_100000688019_100000210776 [0,1,0,0,0,0|3,0,0]=4 1843 B15R1.13 O=C(CCCCO)c1cccc(c1I)Cl 1458a_100010176784_100000210776 [0,1,0,0,0,0|3,0,0]=4 1844 B15R1.13 O=C(CCCCO)c1cccc(c1I)F 1458a_100000690930_100000210776 [0,1,0,0,0,0|3,0,0]=4 1845 B15R1.13 O=C(CCCCO)c1cccc(c1I)O 1458a_100010084636_100000210776 [0,1,0,0,0,0|3,0,0]=4 1846 B15R1.13 O=C(CCCCO)c1cccc(c1O)Br 1458a_100000752940_100000210776 [0,1,0,0,0,0|2,0,0]=3 1847 B15R1.13 O=C(CCCCO)c1cccc(c1O)Cl 1458a_100000742801_100000210776 [0,1,0,0,0,0|2,0,0]=3 1848 B15R1.13 O=C(CCCCO)c1cccc(c1O)F 1458a_100011217230_100000210776 [0,1,0,0,0,0|2,0,0]=3 1849 B15R1.13 O=C(CCCCO)c1cccc(c1O)O 1458a_100000690420_100000210776 [0,1,0,0,0,0|2,0,0]=3 1850 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Br 11a_100015189416_100012360534 [0,1,0,0,0,0|3,0,0]=4 1851 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Br 1626a_100015189416_100012360534 [0,1,0,0,0,0|3,0,0]=4 1852 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Br 240690a_100015189416_100012360534 [0,1,0,0,0,0|3,0,0]=4 1853 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Br 527a_100015189416_100012360534 [0,1,0,0,0,0|3,0,0]=4 1854 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Cl 11a_100015189416_100012339722 [0,1,0,0,0,0|3,0,0]=4 1855 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Cl 1626a_100015189416_100012339722 [0,1,0,0,0,0|3,0,0]=4 1856 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Cl 240690a_100015189416_100012339722 [0,1,0,0,0,0|3,0,0]=4 1857 B15R1.13 O=C(NCCCF)c1cccc(c1Br)Cl 527a_100015189416_100012339722 [0,1,0,0,0,0|3,0,0]=4 1858 B15R1.13 O=C(NCCCF)c1cccc(c1Br)F 11a_100015189416_100011217547 [0,1,0,0,0,0|3,0,0]=4 1859 B15R1.13 O=C(NCCCF)c1cccc(c1Br)F 1626a_100015189416_100011217547 [0,1,0,0,0,0|3,0,0]=4 1860 B15R1.13 O=C(NCCCF)c1cccc(c1Br)F 240690a_100015189416_100011217547 [0,1,0,0,0,0|3,0,0]=4 1861 B15R1.13 O=C(NCCCF)c1cccc(c1Br)F 527a_100015189416_100011217547 [0,1,0,0,0,0|3,0,0]=4 1862 B15R1.13 O=C(NCCCF)c1cccc(c1Br)I 11a_100015189416_100010232522 [0,1,0,0,0,0|3,0,0]=4 1863 B15R1.13 O=C(NCCCF)c1cccc(c1Br)I 1626a_100015189416_100010232522 [0,1,0,0,0,0|3,0,0]=4 1864 B15R1.13 O=C(NCCCF)c1cccc(c1Br)I 240690a_100015189416_100010232522 [0,1,0,0,0,0|3,0,0]=4 1865 B15R1.13 O=C(NCCCF)c1cccc(c1Br)I 527a_100015189416_100010232522 [0,1,0,0,0,0|3,0,0]=4 1866 B15R1.13 O=C(NCCCF)c1cccc(c1Br)O 240690a_100015189416_100010230362 [0,1,0,0,0,0|3,0,0]=4 1867 B15R1.13 O=C(NCCCF)c1cccc(c1Br)O 527a_100015189416_100010230362 [0,1,0,0,0,0|3,0,0]=4 1868 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Br 11a_100015189416_100000760540 [0,1,0,0,0,0|3,0,0]=4 1869 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Br 1626a_100015189416_100000760540 [0,1,0,0,0,0|3,0,0]=4 1870 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Br 240690a_100015189416_100000760540 [0,1,0,0,0,0|3,0,0]=4 1871 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Br 527a_100015189416_100000760540 [0,1,0,0,0,0|3,0,0]=4 1872 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Cl 11a_100015189416_100000183631 [0,1,0,0,0,0|3,0,0]=4 1873 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Cl 1626a_100015189416_100000183631 [0,1,0,0,0,0|3,0,0]=4 1874 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Cl 240690a_100015189416_100000183631 [0,1,0,0,0,0|3,0,0]=4 1875 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)Cl 527a_100015189416_100000183631 [0,1,0,0,0,0|3,0,0]=4 1876 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)F 11a_100015189416_100000759904 [0,1,0,0,0,0|3,0,0]=4 1877 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)F 1626a_100015189416_100000759904 [0,1,0,0,0,0|3,0,0]=4 1878 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)F 240690a_100015189416_100000759904 [0,1,0,0,0,0|3,0,0]=4 1879 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)F 527a_100015189416_100000759904 [0,1,0,0,0,0|3,0,0]=4 1880 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)I 11a_100015189416_100010176783 [0,1,0,0,0,0|3,0,0]=4 1881 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)I 1626a_100015189416_100010176783 [0,1,0,0,0,0|3,0,0]=4 1882 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)I 240690a_100015189416_100010176783 [0,1,0,0,0,0|3,0,0]=4 1883 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)I 527a_100015189416_100010176783 [0,1,0,0,0,0|3,0,0]=4 1884 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)O 240690a_100015189416_100000092362 [0,1,0,0,0,0|3,0,0]=4 1885 B15R1.13 O=C(NCCCF)c1cccc(c1Cl)O 527a_100015189416_100000092362 [0,1,0,0,0,0|3,0,0]=4 1886 B15R1.13 O=C(NCCCF)c1cccc(c1F)Br 11a_100015189416_100000756403 [0,1,0,0,0,0|3,0,0]=4 1887 B15R1.13 O=C(NCCCF)c1cccc(c1F)Br 1626a_100015189416_100000756403 [0,1,0,0,0,0|3,0,0]=4 1888 B15R1.13 O=C(NCCCF)c1cccc(c1F)Br 240690a_100015189416_100000756403 [0,1,0,0,0,0|3,0,0]=4 1889 B15R1.13 O=C(NCCCF)c1cccc(c1F)Br 527a_100015189416_100000756403 [0,1,0,0,0,0|3,0,0]=4 1890 B15R1.13 O=C(NCCCF)c1cccc(c1F)Cl 11a_100015189416_100000688816 [0,1,0,0,0,0|3,0,0]=4 1891 B15R1.13 O=C(NCCCF)c1cccc(c1F)Cl 1626a_100015189416_100000688816 [0,1,0,0,0,0|3,0,0]=4 1892 B15R1.13 O=C(NCCCF)c1cccc(c1F)Cl 240690a_100015189416_100000688816 [0,1,0,0,0,0|3,0,0]=4 1893 B15R1.13 O=C(NCCCF)c1cccc(c1F)Cl 527a_100015189416_100000688816 [0,1,0,0,0,0|3,0,0]=4 1894 B15R1.13 O=C(NCCCF)c1cccc(c1F)F 11a_100015189416_100000748134 [0,1,0,0,0,0|3,0,0]=4 1895 B15R1.13 O=C(NCCCF)c1cccc(c1F)F 1626a_100015189416_100000748134 [0,1,0,0,0,0|3,0,0]=4 1896 B15R1.13 O=C(NCCCF)c1cccc(c1F)F 240690a_100015189416_100000748134 [0,1,0,0,0,0|3,0,0]=4 1897 B15R1.13 O=C(NCCCF)c1cccc(c1F)F 527a_100015189416_100000748134 [0,1,0,0,0,0|3,0,0]=4 1898 B15R1.13 O=C(NCCCF)c1cccc(c1F)I 11a_100015189416_100010185205 [0,1,0,0,0,0|3,0,0]=4 1899 B15R1.13 O=C(NCCCF)c1cccc(c1F)I 1626a_100015189416_100010185205 [0,1,0,0,0,0|3,0,0]=4 1900 B15R1.13 O=C(NCCCF)c1cccc(c1F)I 240690a_100015189416_100010185205 [0,1,0,0,0,0|3,0,0]=4 1901 B15R1.13 O=C(NCCCF)c1cccc(c1F)I 527a_100015189416_100010185205 [0,1,0,0,0,0|3,0,0]=4 1902 B15R1.13 O=C(NCCCF)c1cccc(c1F)O 240690a_100015189416_100000037433 [0,1,0,0,0,0|3,0,0]=4 1903 B15R1.13 O=C(NCCCF)c1cccc(c1F)O 527a_100015189416_100000037433 [0,1,0,0,0,0|3,0,0]=4 1904 B15R1.13 O=C(NCCCF)c1cccc(c1I)Br 11a_100015189416_100000688019 [0,1,0,0,0,0|3,0,0]=4 1905 B15R1.13 O=C(NCCCF)c1cccc(c1I)Br 1626a_100015189416_100000688019 [0,1,0,0,0,0|3,0,0]=4 1906 B15R1.13 O=C(NCCCF)c1cccc(c1I)Br 240690a_100015189416_100000688019 [0,1,0,0,0,0|3,0,0]=4 1907 B15R1.13 O=C(NCCCF)c1cccc(c1I)Br 527a_100015189416_100000688019 [0,1,0,0,0,0|3,0,0]=4 1908 B15R1.13 O=C(NCCCF)c1cccc(c1I)Cl 11a_100015189416_100010176784 [0,1,0,0,0,0|3,0,0]=4 1909 B15R1.13 O=C(NCCCF)c1cccc(c1I)Cl 1626a_100015189416_100010176784 [0,1,0,0,0,0|3,0,0]=4 1910 B15R1.13 O=C(NCCCF)c1cccc(c1I)Cl 240690a_100015189416_100010176784 [0,1,0,0,0,0|3,0,0]=4 1911 B15R1.13 O=C(NCCCF)c1cccc(c1I)Cl 527a_100015189416_100010176784 [0,1,0,0,0,0|3,0,0]=4 1912 B15R1.13 O=C(NCCCF)c1cccc(c1I)F 11a_100015189416_100000690930 [0,1,0,0,0,0|3,0,0]=4 1913 B15R1.13 O=C(NCCCF)c1cccc(c1I)F 1626a_100015189416_100000690930 [0,1,0,0,0,0|3,0,0]=4 1914 B15R1.13 O=C(NCCCF)c1cccc(c1I)F 240690a_100015189416_100000690930 [0,1,0,0,0,0|3,0,0]=4 1915 B15R1.13 O=C(NCCCF)c1cccc(c1I)F 527a_100015189416_100000690930 [0,1,0,0,0,0|3,0,0]=4 1916 B15R1.13 O=C(NCCCF)c1cccc(c1I)O 527a_100015189416_100010084636 [0,1,0,0,0,0|3,0,0]=4 1917 B15R1.13 O=C(NCCCF)c1cccc(c1O)Br 240690a_100015189416_100000752940 [0,1,0,0,0,0|2,0,0]=3 1918 B15R1.13 O=C(NCCCF)c1cccc(c1O)Br 527a_100015189416_100000752940 [0,1,0,0,0,0|2,0,0]=3 1919 B15R1.13 O=C(NCCCF)c1cccc(c1O)Cl 240690a_100015189416_100000742801 [0,1,0,0,0,0|2,0,0]=3 1920 B15R1.13 O=C(NCCCF)c1cccc(c1O)Cl 527a_100015189416_100000742801 [0,1,0,0,0,0|2,0,0]=3 1921 B15R1.13 O=C(NCCCF)c1cccc(c1O)F 240690a_100015189416_100011217230 [0,1,0,0,0,0|2,0,0]=3 1922 B15R1.13 O=C(NCCCF)c1cccc(c1O)F 527a_100015189416_100011217230 [0,1,0,0,0,0|2,0,0]=3 1923 B15R1.13 O=C(NCCCF)c1cccc(c1O)O 527a_100015189416_100000690420 [0,1,0,0,0,0|2,0,0]=3 1924 B15R1.13 O=C(NCCCO)c1cccc(c1Br)Br 240690a_100000182051_100012360534 [0,1,0,0,0,0|3,0,0]=4 1925 B15R1.13 O=C(NCCCO)c1cccc(c1Br)Br 527a_100000182051_100012360534 [0,1,0,0,0,0|3,0,0]=4 1926 B15R1.13 O=C(NCCCO)c1cccc(c1Br)Cl 240690a_100000182051_100012339722 [0,1,0,0,0,0|3,0,0]=4 1927 B15R1.13 O=C(NCCCO)c1cccc(c1Br)Cl 527a_100000182051_100012339722 [0,1,0,0,0,0|3,0,0]=4 1928 B15R1.13 O=C(NCCCO)c1cccc(c1Br)F 240690a_100000182051_100011217547 [0,1,0,0,0,0|3,0,0]=4 1929 B15R1.13 O=C(NCCCO)c1cccc(c1Br)F 527a_100000182051_100011217547 [0,1,0,0,0,0|3,0,0]=4 1930 B15R1.13 O=C(NCCCO)c1cccc(c1Br)I 240690a_100000182051_100010232522 [0,1,0,0,0,0|3,0,0]=4 1931 B15R1.13 O=C(NCCCO)c1cccc(c1Br)I 527a_100000182051_100010232522 [0,1,0,0,0,0|3,0,0]=4 1932 B15R1.13 O=C(NCCCO)c1cccc(c1Br)O 240690a_100000182051_100010230362 [0,1,0,0,0,0|3,0,0]=4 1933 B15R1.13 O=C(NCCCO)c1cccc(c1Br)O 527a_100000182051_100010230362 [0,1,0,0,0,0|3,0,0]=4 1934 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)Br 240690a_100000182051_100000760540 [0,1,0,0,0,0|3,0,0]=4 1935 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)Br 527a_100000182051_100000760540 [0,1,0,0,0,0|3,0,0]=4 1936 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)Cl 240690a_100000182051_100000183631 [0,1,0,0,0,0|3,0,0]=4 1937 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)Cl 527a_100000182051_100000183631 [0,1,0,0,0,0|3,0,0]=4 1938 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)F 240690a_100000182051_100000759904 [0,1,0,0,0,0|3,0,0]=4 1939 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)F 527a_100000182051_100000759904 [0,1,0,0,0,0|3,0,0]=4 1940 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)I 240690a_100000182051_100010176783 [0,1,0,0,0,0|3,0,0]=4 1941 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)I 527a_100000182051_100010176783 [0,1,0,0,0,0|3,0,0]=4 1942 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)O 240690a_100000182051_100000092362 [0,1,0,0,0,0|3,0,0]=4 1943 B15R1.13 O=C(NCCCO)c1cccc(c1Cl)O 527a_100000182051_100000092362 [0,1,0,0,0,0|3,0,0]=4 1944 B15R1.13 O=C(NCCCO)c1cccc(c1F)Br 240690a_100000182051_100000756403 [0,1,0,0,0,0|3,0,0]=4 1945 B15R1.13 O=C(NCCCO)c1cccc(c1F)Br 527a_100000182051_100000756403 [0,1,0,0,0,0|3,0,0]=4 1946 B15R1.13 O=C(NCCCO)c1cccc(c1F)Cl 240690a_100000182051_100000688816 [0,1,0,0,0,0|3,0,0]=4 1947 B15R1.13 O=C(NCCCO)c1cccc(c1F)Cl 527a_100000182051_100000688816 [0,1,0,0,0,0|3,0,0]=4 1948 B15R1.13 O=C(NCCCO)c1cccc(c1F)F 240690a_100000182051_100000748134 [0,1,0,0,0,0|3,0,0]=4 1949 B15R1.13 O=C(NCCCO)c1cccc(c1F)F 527a_100000182051_100000748134 [0,1,0,0,0,0|3,0,0]=4 1950 B15R1.13 O=C(NCCCO)c1cccc(c1F)I 240690a_100000182051_100010185205 [0,1,0,0,0,0|3,0,0]=4 1951 B15R1.13 O=C(NCCCO)c1cccc(c1F)I 527a_100000182051_100010185205 [0,1,0,0,0,0|3,0,0]=4 1952 B15R1.13 O=C(NCCCO)c1cccc(c1F)O 240690a_100000182051_100000037433 [0,1,0,0,0,0|3,0,0]=4 1953 B15R1.13 O=C(NCCCO)c1cccc(c1F)O 527a_100000182051_100000037433 [0,1,0,0,0,0|3,0,0]=4 1954 B15R1.13 O=C(NCCCO)c1cccc(c1I)Br 240690a_100000182051_100000688019 [0,1,0,0,0,0|3,0,0]=4 1955 B15R1.13 O=C(NCCCO)c1cccc(c1I)Br 527a_100000182051_100000688019 [0,1,0,0,0,0|3,0,0]=4 1956 B15R1.13 O=C(NCCCO)c1cccc(c1I)Cl 240690a_100000182051_100010176784 [0,1,0,0,0,0|3,0,0]=4 1957 B15R1.13 O=C(NCCCO)c1cccc(c1I)Cl 527a_100000182051_100010176784 [0,1,0,0,0,0|3,0,0]=4 1958 B15R1.13 O=C(NCCCO)c1cccc(c1I)F 240690a_100000182051_100000690930 [0,1,0,0,0,0|3,0,0]=4 1959 B15R1.13 O=C(NCCCO)c1cccc(c1I)F 527a_100000182051_100000690930 [0,1,0,0,0,0|3,0,0]=4 1960 B15R1.13 O=C(NCCCO)c1cccc(c1I)O 527a_100000182051_100010084636 [0,1,0,0,0,0|3,0,0]=4 1961 B15R1.13 O=C(NCCCO)c1cccc(c1O)Br 240690a_100000182051_100000752940 [0,1,0,0,0,0|2,0,0]=3 1962 B15R1.13 O=C(NCCCO)c1cccc(c1O)Br 527a_100000182051_100000752940 [0,1,0,0,0,0|2,0,0]=3 1963 B15R1.13 O=C(NCCCO)c1cccc(c1O)Cl 240690a_100000182051_100000742801 [0,1,0,0,0,0|2,0,0]=3 1964 B15R1.13 O=C(NCCCO)c1cccc(c1O)Cl 527a_100000182051_100000742801 [0,1,0,0,0,0|2,0,0]=3 1965 B15R1.13 O=C(NCCCO)c1cccc(c1O)F 240690a_100000182051_100011217230 [0,1,0,0,0,0|2,0,0]=3 1966 B15R1.13 O=C(NCCCO)c1cccc(c1O)F 527a_100000182051_100011217230 [0,1,0,0,0,0|2,0,0]=3 1967 B15R1.13 O=C(NCCCO)c1cccc(c1O)O 527a_100000182051_100000690420 [0,1,0,0,0,0|2,0,0]=3 1968 B15R1.13 O=C(NNCCO)c1cccc(c1O)Br 22a_100000210001_100000752940 [0,1,0,0,0,0|3,0,0]=4 1969 B15R1.13 O=C(NNCCO)c1cccc(c1O)Cl 22a_100000210001_100000742801 [0,1,0,0,0,0|3,0,0]=4 1970 B15R1.13 O=C(NNCCO)c1cccc(c1O)F 22a_100000210001_100011217230 [0,1,0,0,0,0|3,0,0]=4 1971 B15R1.13 O=C(NNCCO)c1cccc(c1O)O 22a_100000210001_100000690420 [0,1,0,0,0,0|3,0,0]=4 1972 B15R1.1380 C#CCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000731252 [0,1,0,0,0,0|1,0,2]=4 1973 B15R1.1380 C#CCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000731252 [0,1,0,0,0,0|1,0,2]=4 1974 B15R1.1380 C#CCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000731252 [0,1,0,0,0,0|1,0,2]=4 1975 B15R1.1380 C#CCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000731252 [0,1,0,0,0,0|1,0,2]=4 1976 B15R1.1380 C#CCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000731252 [0,1,0,0,0,0|1,0,2]=4 1977 B15R1.1380 C#CCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000731252 [0,1,0,0,0,0|1,0,2]=4 1978 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Br 1626a_100000755551_100000212140 [0,1,0,0,0,0|1,0,2]=4 1979 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Br 240690a_100000755551_100000212140 [0,1,0,0,0,0|1,0,2]=4 1980 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Br 527a_100000755551_100000212140 [0,1,0,0,0,0|1,0,2]=4 1981 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)C 240690a_100000755551_100000229998 [0,1,0,0,0,0|1,0,2]=4 1982 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)C 527a_100000755551_100000229998 [0,1,0,0,0,0|1,0,2]=4 1983 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Cl 11a_100000755551_100000212143 [0,1,0,0,0,0|1,0,2]=4 1984 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Cl 1626a_100000755551_100000212143 [0,1,0,0,0,0|1,0,2]=4 1985 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Cl 240690a_100000755551_100000212143 [0,1,0,0,0,0|1,0,2]=4 1986 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)Cl 527a_100000755551_100000212143 [0,1,0,0,0,0|1,0,2]=4 1987 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)F 240690a_100000755551_100000742286 [0,1,0,0,0,0|1,0,2]=4 1988 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)F 527a_100000755551_100000742286 [0,1,0,0,0,0|1,0,2]=4 1989 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)I 240690a_100000755551_100000212111 [0,1,0,0,0,0|1,0,2]=4 1990 B15R1.1380 C#CCCNC(=O)c1cc(ccc1O)I 527a_100000755551_100000212111 [0,1,0,0,0,0|1,0,2]=4 1991 B15R1.1380 C=CCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000757094 [0,1,0,0,0,0|1,0,2]=4 1992 B15R1.1380 C=CCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000757094 [0,1,0,0,0,0|1,0,2]=4 1993 B15R1.1380 C=CCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000757094 [0,1,0,0,0,0|1,0,2]=4 1994 B15R1.1380 C=CCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000757094 [0,1,0,0,0,0|1,0,2]=4 1995 B15R1.1380 C=CCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000757094 [0,1,0,0,0,0|1,0,2]=4 1996 B15R1.1380 C=CCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000757094 [0,1,0,0,0,0|1,0,2]=4 1997 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Br 1626a_100015191253_100000212140 [0,1,0,0,0,0|1,0,2]=4 1998 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Br 240690a_100015191253_100000212140 [0,1,0,0,0,0|1,0,2]=4 1999 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Br 527a_100015191253_100000212140 [0,1,0,0,0,0|1,0,2]=4 2000 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)C 240690a_100015191253_100000229998 [0,1,0,0,0,0|1,0,2]=4 2001 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)C 527a_100015191253_100000229998 [0,1,0,0,0,0|1,0,2]=4 2002 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Cl 11a_100015191253_100000212143 [0,1,0,0,0,0|1,0,2]=4 2003 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Cl 1626a_100015191253_100000212143 [0,1,0,0,0,0|1,0,2]=4 2004 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Cl 240690a_100015191253_100000212143 [0,1,0,0,0,0|1,0,2]=4 2005 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)Cl 527a_100015191253_100000212143 [0,1,0,0,0,0|1,0,2]=4 2006 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)F 240690a_100015191253_100000742286 [0,1,0,0,0,0|1,0,2]=4 2007 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)F 527a_100015191253_100000742286 [0,1,0,0,0,0|1,0,2]=4 2008 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)I 240690a_100015191253_100000212111 [0,1,0,0,0,0|1,0,2]=4 2009 B15R1.1380 C=CCCNC(=O)c1cc(ccc1O)I 527a_100015191253_100000212111 [0,1,0,0,0,0|1,0,2]=4 2010 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)Br 1626a_100000685387_100000212140 [0,1,0,0,0,0|1,0,2]=4 2011 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)Br 527a_100000685387_100000212140 [0,1,0,0,0,0|1,0,2]=4 2012 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)C 527a_100000685387_100000229998 [0,1,0,0,0,0|1,0,2]=4 2013 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)Cl 11a_100000685387_100000212143 [0,1,0,0,0,0|1,0,2]=4 2014 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)Cl 1626a_100000685387_100000212143 [0,1,0,0,0,0|1,0,2]=4 2015 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)Cl 527a_100000685387_100000212143 [0,1,0,0,0,0|1,0,2]=4 2016 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)F 527a_100000685387_100000742286 [0,1,0,0,0,0|1,0,2]=4 2017 B15R1.1380 CC#CCNC(=O)c1cc(ccc1O)I 527a_100000685387_100000212111 [0,1,0,0,0,0|1,0,2]=4 2018 B15R1.1380 CC/C=C\CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100103147603 [0,1,0,0,0,0|1,0,2]=4 2019 B15R1.1380 CC/C=C\CC(=O)c1cc(ccc1O)C 1458a_100000229998_100103147603 [0,1,0,0,0,0|1,0,2]=4 2020 B15R1.1380 CC/C=C\CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100103147603 [0,1,0,0,0,0|1,0,2]=4 2021 B15R1.1380 CC/C=C\CC(=O)c1cc(ccc1O)F 1458a_100000742286_100103147603 [0,1,0,0,0,0|1,0,2]=4 2022 B15R1.1380 CC/C=C\CC(=O)c1cc(ccc1O)I 1458a_100000212111_100103147603 [0,1,0,0,0,0|1,0,2]=4 2023 B15R1.1380 CC/C=C\CC(=O)c1cc(ccc1O)O 1458a_100000758025_100103147603 [0,1,0,0,0,0|1,0,2]=4 2024 B15R1.1380 CCC#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100009813939 [0,1,0,0,0,0|1,0,2]=4 2025 B15R1.1380 CCC#CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100009813939 [0,1,0,0,0,0|1,0,2]=4 2026 B15R1.1380 CCC#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100009813939 [0,1,0,0,0,0|1,0,2]=4 2027 B15R1.1380 CCC#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100009813939 [0,1,0,0,0,0|1,0,2]=4 2028 B15R1.1380 CCC#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100009813939 [0,1,0,0,0,0|1,0,2]=4 2029 B15R1.1380 CCC#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100009813939 [0,1,0,0,0,0|1,0,2]=4 2030 B15R1.1380 CCCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210326 [0,1,0,0,0,0|2,0,0]=3 2031 B15R1.1380 CCCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210326 [0,1,0,0,0,0|2,0,0]=3 2032 B15R1.1380 CCCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210326 [0,1,0,0,0,0|2,0,0]=3 2033 B15R1.1380 CCCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210326 [0,1,0,0,0,0|2,0,0]=3 2034 B15R1.1380 CCCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210326 [0,1,0,0,0,0|2,0,0]=3 2035 B15R1.1380 CCCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210326 [0,1,0,0,0,0|2,0,0]=3 2036 B15R1.1380 CCCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210326 [0,1,0,0,0,0|2,0,0]=3 2037 B15R1.1380 CCCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210326 [0,1,0,0,0,0|2,0,0]=3 2038 B15R1.1380 CCCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210326 [0,1,0,0,0,0|2,0,0]=3 2039 B15R1.1380 CCCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210326 [0,1,0,0,0,0|2,0,0]=3 2040 B15R1.1380 CCCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210326 [0,1,0,0,0,0|2,0,0]=3 2041 B15R1.1380 CCCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210326 [0,1,0,0,0,0|2,0,0]=3 2042 B15R1.1380 CCCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210326 [0,1,0,0,0,0|2,0,0]=3 2043 B15R1.1380 CCCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210326 [0,1,0,0,0,0|2,0,0]=3 2044 B15R1.1380 CCCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210326 [0,1,0,0,0,0|2,0,0]=3 2045 B15R1.1380 CCCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210326 [0,1,0,0,0,0|2,0,0]=3 2046 B15R1.1380 CCCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210326 [0,1,0,0,0,0|2,0,0]=3 2047 B15R1.1380 CCCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210326 [0,1,0,0,0,0|2,0,0]=3 2048 B15R1.1380 CCCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210326 [0,1,0,0,0,0|2,0,0]=3 2049 B15R1.1380 CCCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210326 [0,1,0,0,0,0|2,0,0]=3 2050 B15R1.1380 CCCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210326 [0,1,0,0,0,0|2,0,0]=3 2051 B15R1.1380 CCCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210326 [0,1,0,0,0,0|2,0,0]=3 2052 B15R1.1380 CCCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210326 [0,1,0,0,0,0|2,0,0]=3 2053 B15R1.1380 CCCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210326 [0,1,0,0,0,0|2,0,0]=3 2054 B15R1.1380 CCCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210326 [0,1,0,0,0,0|2,0,0]=3 2055 B15R1.1380 CCCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210326 [0,1,0,0,0,0|2,0,0]=3 2056 B15R1.1380 CCCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210326 [0,1,0,0,0,0|2,0,0]=3 2057 B15R1.1380 CCCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210326 [0,1,0,0,0,0|2,0,0]=3 2058 B15R1.1380 CCCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210326 [0,1,0,0,0,0|2,0,0]=3 2059 B15R1.1380 CCCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210326 [0,1,0,0,0,0|2,0,0]=3 2060 B15R1.1380 CCCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210326 [0,1,0,0,0,0|1,0,0]=2 2061 B15R1.1380 CCCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210326 [0,1,0,0,0,0|1,0,0]=2 2062 B15R1.1380 CCCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210326 [0,1,0,0,0,0|1,0,0]=2 2063 B15R1.1380 CCCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210326 [0,1,0,0,0,0|1,0,0]=2 2064 B15R1.1380 CCCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210326 [0,1,0,0,0,0|1,0,0]=2 2065 B15R1.1380 CCCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210326 [0,1,0,0,0,0|1,0,0]=2 2066 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Br 11a_100000102301_100000690610 [0,1,0,0,0,0|2,0,0]=3 2067 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Br 1626a_100000102301_100000690610 [0,1,0,0,0,0|2,0,0]=3 2068 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Br 240690a_100000102301_100000690610 [0,1,0,0,0,0|2,0,0]=3 2069 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Br 527a_100000102301_100000690610 [0,1,0,0,0,0|2,0,0]=3 2070 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)C 11a_100000102301_100000689033 [0,1,0,0,0,0|2,0,0]=3 2071 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)C 1626a_100000102301_100000689033 [0,1,0,0,0,0|2,0,0]=3 2072 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)C 240690a_100000102301_100000689033 [0,1,0,0,0,0|2,0,0]=3 2073 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)C 527a_100000102301_100000689033 [0,1,0,0,0,0|2,0,0]=3 2074 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Cl 11a_100000102301_100000736951 [0,1,0,0,0,0|2,0,0]=3 2075 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Cl 1626a_100000102301_100000736951 [0,1,0,0,0,0|2,0,0]=3 2076 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Cl 240690a_100000102301_100000736951 [0,1,0,0,0,0|2,0,0]=3 2077 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)Cl 527a_100000102301_100000736951 [0,1,0,0,0,0|2,0,0]=3 2078 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)F 11a_100000102301_100000212315 [0,1,0,0,0,0|2,0,0]=3 2079 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)F 1626a_100000102301_100000212315 [0,1,0,0,0,0|2,0,0]=3 2080 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)F 240690a_100000102301_100000212315 [0,1,0,0,0,0|2,0,0]=3 2081 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)F 527a_100000102301_100000212315 [0,1,0,0,0,0|2,0,0]=3 2082 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)I 11a_100000102301_100000698340 [0,1,0,0,0,0|2,0,0]=3 2083 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)I 1626a_100000102301_100000698340 [0,1,0,0,0,0|2,0,0]=3 2084 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)I 240690a_100000102301_100000698340 [0,1,0,0,0,0|2,0,0]=3 2085 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)I 527a_100000102301_100000698340 [0,1,0,0,0,0|2,0,0]=3 2086 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)O 240690a_100000102301_100012352043 [0,1,0,0,0,0|2,0,0]=3 2087 B15R1.1380 CCCCNC(=O)c1cc(ccc1Br)O 527a_100000102301_100012352043 [0,1,0,0,0,0|2,0,0]=3 2088 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Br 11a_100000102301_100000759961 [0,1,0,0,0,0|2,0,0]=3 2089 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Br 1626a_100000102301_100000759961 [0,1,0,0,0,0|2,0,0]=3 2090 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Br 240690a_100000102301_100000759961 [0,1,0,0,0,0|2,0,0]=3 2091 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Br 527a_100000102301_100000759961 [0,1,0,0,0,0|2,0,0]=3 2092 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)C 11a_100000102301_100000195421 [0,1,0,0,0,0|2,0,0]=3 2093 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)C 1626a_100000102301_100000195421 [0,1,0,0,0,0|2,0,0]=3 2094 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)C 240690a_100000102301_100000195421 [0,1,0,0,0,0|2,0,0]=3 2095 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)C 527a_100000102301_100000195421 [0,1,0,0,0,0|2,0,0]=3 2096 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Cl 11a_100000102301_100000692595 [0,1,0,0,0,0|2,0,0]=3 2097 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Cl 1626a_100000102301_100000692595 [0,1,0,0,0,0|2,0,0]=3 2098 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Cl 240690a_100000102301_100000692595 [0,1,0,0,0,0|2,0,0]=3 2099 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)Cl 527a_100000102301_100000692595 [0,1,0,0,0,0|2,0,0]=3 2100 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)F 11a_100000102301_100000240043 [0,1,0,0,0,0|2,0,0]=3 2101 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)F 1626a_100000102301_100000240043 [0,1,0,0,0,0|2,0,0]=3 2102 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)F 240690a_100000102301_100000240043 [0,1,0,0,0,0|2,0,0]=3 2103 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)F 527a_100000102301_100000240043 [0,1,0,0,0,0|2,0,0]=3 2104 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)I 11a_100000102301_100000688012 [0,1,0,0,0,0|2,0,0]=3 2105 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)I 1626a_100000102301_100000688012 [0,1,0,0,0,0|2,0,0]=3 2106 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)I 240690a_100000102301_100000688012 [0,1,0,0,0,0|2,0,0]=3 2107 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)I 527a_100000102301_100000688012 [0,1,0,0,0,0|2,0,0]=3 2108 B15R1.1380 CCCCNC(=O)c1cc(ccc1C)O 240690a_100000102301_100000687834 [0,1,0,0,0,0|2,0,0]=3 2109 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Br 11a_100000102301_100000211212 [0,1,0,0,0,0|2,0,0]=3 2110 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Br 1626a_100000102301_100000211212 [0,1,0,0,0,0|2,0,0]=3 2111 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Br 240690a_100000102301_100000211212 [0,1,0,0,0,0|2,0,0]=3 2112 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Br 527a_100000102301_100000211212 [0,1,0,0,0,0|2,0,0]=3 2113 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)C 11a_100000102301_100011290873 [0,1,0,0,0,0|2,0,0]=3 2114 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)C 1626a_100000102301_100011290873 [0,1,0,0,0,0|2,0,0]=3 2115 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)C 240690a_100000102301_100011290873 [0,1,0,0,0,0|2,0,0]=3 2116 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)C 527a_100000102301_100011290873 [0,1,0,0,0,0|2,0,0]=3 2117 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Cl 11a_100000102301_100000210642 [0,1,0,0,0,0|2,0,0]=3 2118 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100000102301_100000210642 [0,1,0,0,0,0|2,0,0]=3 2119 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000102301_100000210642 [0,1,0,0,0,0|2,0,0]=3 2120 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)Cl 527a_100000102301_100000210642 [0,1,0,0,0,0|2,0,0]=3 2121 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)F 11a_100000102301_100011219680 [0,1,0,0,0,0|2,0,0]=3 2122 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)F 1626a_100000102301_100011219680 [0,1,0,0,0,0|2,0,0]=3 2123 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)F 240690a_100000102301_100011219680 [0,1,0,0,0,0|2,0,0]=3 2124 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)F 527a_100000102301_100011219680 [0,1,0,0,0,0|2,0,0]=3 2125 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)I 11a_100000102301_100000688013 [0,1,0,0,0,0|2,0,0]=3 2126 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)I 1626a_100000102301_100000688013 [0,1,0,0,0,0|2,0,0]=3 2127 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)I 240690a_100000102301_100000688013 [0,1,0,0,0,0|2,0,0]=3 2128 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)I 527a_100000102301_100000688013 [0,1,0,0,0,0|2,0,0]=3 2129 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)O 240690a_100000102301_100000719527 [0,1,0,0,0,0|2,0,0]=3 2130 B15R1.1380 CCCCNC(=O)c1cc(ccc1Cl)O 527a_100000102301_100000719527 [0,1,0,0,0,0|2,0,0]=3 2131 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Br 11a_100000102301_100000212322 [0,1,0,0,0,0|2,0,0]=3 2132 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Br 1626a_100000102301_100000212322 [0,1,0,0,0,0|2,0,0]=3 2133 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Br 240690a_100000102301_100000212322 [0,1,0,0,0,0|2,0,0]=3 2134 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Br 527a_100000102301_100000212322 [0,1,0,0,0,0|2,0,0]=3 2135 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)C 11a_100000102301_100000749327 [0,1,0,0,0,0|2,0,0]=3 2136 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)C 1626a_100000102301_100000749327 [0,1,0,0,0,0|2,0,0]=3 2137 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)C 240690a_100000102301_100000749327 [0,1,0,0,0,0|2,0,0]=3 2138 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)C 527a_100000102301_100000749327 [0,1,0,0,0,0|2,0,0]=3 2139 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Cl 11a_100000102301_100000214954 [0,1,0,0,0,0|2,0,0]=3 2140 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Cl 1626a_100000102301_100000214954 [0,1,0,0,0,0|2,0,0]=3 2141 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Cl 240690a_100000102301_100000214954 [0,1,0,0,0,0|2,0,0]=3 2142 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)Cl 527a_100000102301_100000214954 [0,1,0,0,0,0|2,0,0]=3 2143 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)F 11a_100000102301_100000198512 [0,1,0,0,0,0|2,0,0]=3 2144 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)F 1626a_100000102301_100000198512 [0,1,0,0,0,0|2,0,0]=3 2145 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)F 240690a_100000102301_100000198512 [0,1,0,0,0,0|2,0,0]=3 2146 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)F 527a_100000102301_100000198512 [0,1,0,0,0,0|2,0,0]=3 2147 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)I 11a_100000102301_100000688014 [0,1,0,0,0,0|2,0,0]=3 2148 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)I 1626a_100000102301_100000688014 [0,1,0,0,0,0|2,0,0]=3 2149 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)I 240690a_100000102301_100000688014 [0,1,0,0,0,0|2,0,0]=3 2150 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)I 527a_100000102301_100000688014 [0,1,0,0,0,0|2,0,0]=3 2151 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)O 240690a_100000102301_100000037260 [0,1,0,0,0,0|2,0,0]=3 2152 B15R1.1380 CCCCNC(=O)c1cc(ccc1F)O 527a_100000102301_100000037260 [0,1,0,0,0,0|2,0,0]=3 2153 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Br 11a_100000102301_100000183945 [0,1,0,0,0,0|2,0,0]=3 2154 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Br 1626a_100000102301_100000183945 [0,1,0,0,0,0|2,0,0]=3 2155 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Br 240690a_100000102301_100000183945 [0,1,0,0,0,0|2,0,0]=3 2156 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)C 11a_100000102301_100000057929 [0,1,0,0,0,0|2,0,0]=3 2157 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)C 1626a_100000102301_100000057929 [0,1,0,0,0,0|2,0,0]=3 2158 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)C 240690a_100000102301_100000057929 [0,1,0,0,0,0|2,0,0]=3 2159 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)C 527a_100000102301_100000057929 [0,1,0,0,0,0|2,0,0]=3 2160 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Cl 11a_100000102301_100000739379 [0,1,0,0,0,0|2,0,0]=3 2161 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Cl 1626a_100000102301_100000739379 [0,1,0,0,0,0|2,0,0]=3 2162 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Cl 240690a_100000102301_100000739379 [0,1,0,0,0,0|2,0,0]=3 2163 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)Cl 527a_100000102301_100000739379 [0,1,0,0,0,0|2,0,0]=3 2164 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)F 11a_100000102301_100000748905 [0,1,0,0,0,0|2,0,0]=3 2165 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)F 1626a_100000102301_100000748905 [0,1,0,0,0,0|2,0,0]=3 2166 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)F 240690a_100000102301_100000748905 [0,1,0,0,0,0|2,0,0]=3 2167 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)F 527a_100000102301_100000748905 [0,1,0,0,0,0|2,0,0]=3 2168 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)I 11a_100000102301_100000750460 [0,1,0,0,0,0|2,0,0]=3 2169 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)I 1626a_100000102301_100000750460 [0,1,0,0,0,0|2,0,0]=3 2170 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)I 240690a_100000102301_100000750460 [0,1,0,0,0,0|2,0,0]=3 2171 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)I 527a_100000102301_100000750460 [0,1,0,0,0,0|2,0,0]=3 2172 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)O 1626a_100000102301_200009995701 [0,1,0,0,0,0|2,0,0]=3 2173 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)O 240690a_100000102301_200009995701 [0,1,0,0,0,0|2,0,0]=3 2174 B15R1.1380 CCCCNC(=O)c1cc(ccc1I)O 527a_100000102301_200009995701 [0,1,0,0,0,0|2,0,0]=3 2175 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Br 1626a_100000102301_100000212140 [0,1,0,0,0,0|1,0,0]=2 2176 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Br 240690a_100000102301_100000212140 [0,1,0,0,0,0|1,0,0]=2 2177 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Br 527a_100000102301_100000212140 [0,1,0,0,0,0|1,0,0]=2 2178 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)C 240690a_100000102301_100000229998 [0,1,0,0,0,0|1,0,0]=2 2179 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)C 527a_100000102301_100000229998 [0,1,0,0,0,0|1,0,0]=2 2180 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Cl 11a_100000102301_100000212143 [0,1,0,0,0,0|1,0,0]=2 2181 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Cl 1626a_100000102301_100000212143 [0,1,0,0,0,0|1,0,0]=2 2182 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Cl 240690a_100000102301_100000212143 [0,1,0,0,0,0|1,0,0]=2 2183 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)Cl 527a_100000102301_100000212143 [0,1,0,0,0,0|1,0,0]=2 2184 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)F 240690a_100000102301_100000742286 [0,1,0,0,0,0|1,0,0]=2 2185 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000205868 [0,1,0,0,0,0|1,0,0]=2 2186 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)F 527a_100000102301_100000742286 [0,1,0,0,0,0|1,0,0]=2 2187 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)I 240690a_100000102301_100000212111 [0,1,0,0,0,0|1,0,0]=2 2188 B15R1.1380 CCCCNC(=O)c1cc(ccc1O)I 527a_100000102301_100000212111 [0,1,0,0,0,0|1,0,0]=2 2189 B15R1.1380 CCCCNC(C)c1cc(ccc1O)Br 269862a_100000102301_100000212127 [0,1,0,0,0,0|2,0,1]=4 2190 B15R1.1380 CCCCNC(C)c1cc(ccc1O)C 269862a_100000102301_100000195442 [0,1,0,0,0,0|2,0,1]=4 2191 B15R1.1380 CCCCNC(C)c1cc(ccc1O)Cl 269862a_100000102301_100000185566 [0,1,0,0,0,0|2,0,1]=4 2192 B15R1.1380 CCCCNC(C)c1cc(ccc1O)F 269862a_100000102301_100000182812 [0,1,0,0,0,0|2,0,1]=4 2193 B15R1.1380 CCCCNC(C)c1cc(ccc1O)I 269862a_100000102301_100010712555 [0,1,0,0,0,0|2,0,1]=4 2194 B15R1.1380 CCCCN[C@@H](C)c1cc(ccc1O)F 2230a_100160469477_100000210211 [0,1,0,0,0,0|2,0,1]=4 2195 B15R1.1380 CCCCN[C@@H](C)c1cc(ccc1O)F 34a_100160469477_100000210210 [0,1,0,0,0,0|2,0,1]=4 2196 B15R1.1380 CCCCN[C@H](C)c1cc(ccc1O)Cl 2230a_100011853016_100000210211 [0,1,0,0,0,0|2,0,1]=4 2197 B15R1.1380 CCCCN[C@H](C)c1cc(ccc1O)Cl 34a_100011853016_100000210210 [0,1,0,0,0,0|2,0,1]=4 2198 B15R1.1380 CCCCOC(C)c1cc(ccc1C)C 34a_200000246511_100000210210 [0,1,0,0,0,0|2,0,1]=4 2199 B15R1.1380 CCCCOC(C)c1cc(ccc1C)C 7a_200000246511_100000210211 [0,1,0,0,0,0|2,0,1]=4 2200 B15R1.1380 CCCCOC(C)c1cc(ccc1C)Cl 34a_100012002745_100000210210 [0,1,0,0,0,0|2,0,1]=4 2201 B15R1.1380 CCCCOC(C)c1cc(ccc1C)Cl 7a_100012002745_100000210211 [0,1,0,0,0,0|2,0,1]=4 2202 B15R1.1380 CCCCOC(C)c1cc(ccc1Cl)Cl 34a_100000742519_100000210210 [0,1,0,0,0,0|2,0,1]=4 2203 B15R1.1380 CCCCOC(C)c1cc(ccc1Cl)Cl 7a_100000742519_100000210211 [0,1,0,0,0,0|2,0,1]=4 2204 B15R1.1380 CCCCOC(C)c1cc(ccc1F)Br 34a_100011943926_100000210210 [0,1,0,0,0,0|2,0,1]=4 2205 B15R1.1380 CCCCOC(C)c1cc(ccc1F)Br 7a_100011943926_100000210211 [0,1,0,0,0,0|2,0,1]=4 2206 B15R1.1380 CCCCOC(C)c1cc(ccc1F)F 34a_100000246540_100000210210 [0,1,0,0,0,0|2,0,1]=4 2207 B15R1.1380 CCCCOC(C)c1cc(ccc1F)F 7a_100000246540_100000210211 [0,1,0,0,0,0|2,0,1]=4 2208 B15R1.1380 CCCCO[C@@H](C)c1cc(ccc1I)F 34a_100134768474_100000210210 [0,1,0,0,0,0|2,0,1]=4 2209 B15R1.1380 CCCCO[C@@H](C)c1cc(ccc1I)F 7a_100134768474_100000210211 [0,1,0,0,0,0|2,0,1]=4 2210 B15R1.1380 CCCNN=C(C)c1cc(ccc1O)Br 4a_100000740057_100000212127 [0,1,0,0,0,0|3,0,0]=4 2211 B15R1.1380 CCCNN=C(C)c1cc(ccc1O)C 4a_100000740057_100000195442 [0,1,0,0,0,0|3,0,0]=4 2212 B15R1.1380 CCCNN=C(C)c1cc(ccc1O)Cl 4a_100000740057_100000185566 [0,1,0,0,0,0|3,0,0]=4 2213 B15R1.1380 CCCNN=C(C)c1cc(ccc1O)F 4a_100000740057_100000182812 [0,1,0,0,0,0|3,0,0]=4 2214 B15R1.1380 CCCNN=C(C)c1cc(ccc1O)I 4a_100000740057_100010712555 [0,1,0,0,0,0|3,0,0]=4 2215 B15R1.1380 CCCNN=C(C)c1cc(ccc1O)O 4a_100000740057_100000183313 [0,1,0,0,0,0|3,0,0]=4 2216 B15R1.1380 CCCNNC(=O)c1cc(ccc1Br)Br 22a_100000740057_100000690610 [0,1,0,0,0,0|3,0,0]=4 2217 B15R1.1380 CCCNNC(=O)c1cc(ccc1Br)C 22a_100000740057_100000689033 [0,1,0,0,0,0|3,0,0]=4 2218 B15R1.1380 CCCNNC(=O)c1cc(ccc1Br)Cl 22a_100000740057_100000736951 [0,1,0,0,0,0|3,0,0]=4 2219 B15R1.1380 CCCNNC(=O)c1cc(ccc1Br)F 22a_100000740057_100000212315 [0,1,0,0,0,0|3,0,0]=4 2220 B15R1.1380 CCCNNC(=O)c1cc(ccc1Br)I 22a_100000740057_100000698340 [0,1,0,0,0,0|3,0,0]=4 2221 B15R1.1380 CCCNNC(=O)c1cc(ccc1Br)O 22a_100000740057_100012352043 [0,1,0,0,0,0|3,0,0]=4 2222 B15R1.1380 CCCNNC(=O)c1cc(ccc1C)Br 22a_100000740057_100000759961 [0,1,0,0,0,0|3,0,0]=4 2223 B15R1.1380 CCCNNC(=O)c1cc(ccc1C)C 22a_100000740057_100000195421 [0,1,0,0,0,0|3,0,0]=4 2224 B15R1.1380 CCCNNC(=O)c1cc(ccc1C)Cl 22a_100000740057_100000692595 [0,1,0,0,0,0|3,0,0]=4 2225 B15R1.1380 CCCNNC(=O)c1cc(ccc1C)F 22a_100000740057_100000240043 [0,1,0,0,0,0|3,0,0]=4 2226 B15R1.1380 CCCNNC(=O)c1cc(ccc1C)I 22a_100000740057_100000688012 [0,1,0,0,0,0|3,0,0]=4 2227 B15R1.1380 CCCNNC(=O)c1cc(ccc1C)O 22a_100000740057_100000687834 [0,1,0,0,0,0|3,0,0]=4 2228 B15R1.1380 CCCNNC(=O)c1cc(ccc1Cl)Br 22a_100000740057_100000211212 [0,1,0,0,0,0|3,0,0]=4 2229 B15R1.1380 CCCNNC(=O)c1cc(ccc1Cl)C 22a_100000740057_100011290873 [0,1,0,0,0,0|3,0,0]=4 2230 B15R1.1380 CCCNNC(=O)c1cc(ccc1Cl)Cl 22a_100000740057_100000210642 [0,1,0,0,0,0|3,0,0]=4 2231 B15R1.1380 CCCNNC(=O)c1cc(ccc1Cl)F 22a_100000740057_100011219680 [0,1,0,0,0,0|3,0,0]=4 2232 B15R1.1380 CCCNNC(=O)c1cc(ccc1Cl)I 22a_100000740057_100000688013 [0,1,0,0,0,0|3,0,0]=4 2233 B15R1.1380 CCCNNC(=O)c1cc(ccc1Cl)O 22a_100000740057_100000719527 [0,1,0,0,0,0|3,0,0]=4 2234 B15R1.1380 CCCNNC(=O)c1cc(ccc1F)Br 22a_100000740057_100000212322 [0,1,0,0,0,0|3,0,0]=4 2235 B15R1.1380 CCCNNC(=O)c1cc(ccc1F)C 22a_100000740057_100000749327 [0,1,0,0,0,0|3,0,0]=4 2236 B15R1.1380 CCCNNC(=O)c1cc(ccc1F)Cl 22a_100000740057_100000214954 [0,1,0,0,0,0|3,0,0]=4 2237 B15R1.1380 CCCNNC(=O)c1cc(ccc1F)F 22a_100000740057_100000198512 [0,1,0,0,0,0|3,0,0]=4 2238 B15R1.1380 CCCNNC(=O)c1cc(ccc1F)I 22a_100000740057_100000688014 [0,1,0,0,0,0|3,0,0]=4 2239 B15R1.1380 CCCNNC(=O)c1cc(ccc1F)O 22a_100000740057_100000037260 [0,1,0,0,0,0|3,0,0]=4 2240 B15R1.1380 CCCNNC(=O)c1cc(ccc1I)Br 22a_100000740057_100000183945 [0,1,0,0,0,0|3,0,0]=4 2241 B15R1.1380 CCCNNC(=O)c1cc(ccc1I)C 22a_100000740057_100000057929 [0,1,0,0,0,0|3,0,0]=4 2242 B15R1.1380 CCCNNC(=O)c1cc(ccc1I)Cl 22a_100000740057_100000739379 [0,1,0,0,0,0|3,0,0]=4 2243 B15R1.1380 CCCNNC(=O)c1cc(ccc1I)F 22a_100000740057_100000748905 [0,1,0,0,0,0|3,0,0]=4 2244 B15R1.1380 CCCNNC(=O)c1cc(ccc1I)I 22a_100000740057_100000750460 [0,1,0,0,0,0|3,0,0]=4 2245 B15R1.1380 CCCNNC(=O)c1cc(ccc1I)O 22a_100000740057_200009995701 [0,1,0,0,0,0|3,0,0]=4 2246 B15R1.1380 CCCNNC(=O)c1cc(ccc1O)Br 22a_100000740057_100000212140 [0,1,0,0,0,0|2,0,0]=3 2247 B15R1.1380 CCCNNC(=O)c1cc(ccc1O)C 22a_100000740057_100000229998 [0,1,0,0,0,0|2,0,0]=3 2248 B15R1.1380 CCCNNC(=O)c1cc(ccc1O)Cl 22a_100000740057_100000212143 [0,1,0,0,0,0|2,0,0]=3 2249 B15R1.1380 CCCNNC(=O)c1cc(ccc1O)F 22a_100000740057_100000742286 [0,1,0,0,0,0|2,0,0]=3 2250 B15R1.1380 CCCNNC(=O)c1cc(ccc1O)I 22a_100000740057_100000212111 [0,1,0,0,0,0|2,0,0]=3 2251 B15R1.1380 CCCOCC(=O)c1cc(ccc1Br)Cl 34a_100000210258_100012361344 [0,1,0,0,0,0|3,0,0]=4 2252 B15R1.1380 CCCOCC(=O)c1cc(ccc1C)C 34a_100000210258_100000183774 [0,1,0,0,0,0|3,0,0]=4 2253 B15R1.1380 CCCOCC(=O)c1cc(ccc1Cl)F 34a_100000210258_200010187420 [0,1,0,0,0,0|3,0,0]=4 2254 B15R1.1380 CCCOCC(=O)c1cc(ccc1F)F 34a_100000210258_100000211571 [0,1,0,0,0,0|3,0,0]=4 2255 B15R1.1380 CCCOCC(=O)c1cc(ccc1O)Br 34a_100000210258_200009828000 [0,1,0,0,0,0|2,0,0]=3 2256 B15R1.1380 CCCOCC(=O)c1cc(ccc1O)F 34a_100000210258_100009814381 [0,1,0,0,0,0|2,0,0]=3 2257 B15R1.1380 CCCOCC(=O)c1cc(ccc1O)O 34a_100000210258_100009814097 [0,1,0,0,0,0|2,0,0]=3 2258 B15R1.1380 CCCSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100000210303 [0,1,0,0,0,0|3,0,0]=4 2259 B15R1.1380 CCCSCC(=O)c1cc(ccc1C)C 62a_100000183774_100000210303 [0,1,0,0,0,0|3,0,0]=4 2260 B15R1.1380 CCCSCC(=O)c1cc(ccc1C)C 62a_100000210303_100000183774 [0,1,0,0,0,0|3,0,0]=4 2261 B15R1.1380 CCCSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100000210303 [0,1,0,0,0,0|3,0,0]=4 2262 B15R1.1380 CCCSCC(=O)c1cc(ccc1Cl)F 62a_100000210303_200010187420 [0,1,0,0,0,0|3,0,0]=4 2263 B15R1.1380 CCCSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100000210303 [0,1,0,0,0,0|3,0,0]=4 2264 B15R1.1380 CCCSCC(=O)c1cc(ccc1F)F 62a_100000210303_100000211571 [0,1,0,0,0,0|3,0,0]=4 2265 B15R1.1380 CCCSCC(=O)c1cc(ccc1F)F 62a_100000211571_100000210303 [0,1,0,0,0,0|3,0,0]=4 2266 B15R1.1380 CCCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000210303 [0,1,0,0,0,0|2,0,0]=3 2267 B15R1.1380 CCCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000210303 [0,1,0,0,0,0|2,0,0]=3 2268 B15R1.1380 CCCSCC(=O)c1cc(ccc1O)F 62a_100000210303_100009814381 [0,1,0,0,0,0|2,0,0]=3 2269 B15R1.1380 CCCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000210303 [0,1,0,0,0,0|2,0,0]=3 2270 B15R1.1380 CCCSCC(=O)c1cc(ccc1O)O 62a_100000210303_100009814097 [0,1,0,0,0,0|2,0,0]=3 2271 B15R1.1380 CCCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000210303 [0,1,0,0,0,0|2,0,0]=3 2272 B15R1.1380 CCOCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011215890 [0,1,0,0,0,0|3,0,0]=4 2273 B15R1.1380 CCOCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100011215890 [0,1,0,0,0,0|3,0,0]=4 2274 B15R1.1380 CCOCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011215890 [0,1,0,0,0,0|3,0,0]=4 2275 B15R1.1380 CCOCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011215890 [0,1,0,0,0,0|3,0,0]=4 2276 B15R1.1380 CCOCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011215890 [0,1,0,0,0,0|3,0,0]=4 2277 B15R1.1380 CCOCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011215890 [0,1,0,0,0,0|3,0,0]=4 2278 B15R1.1380 CCOCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100011215890 [0,1,0,0,0,0|3,0,0]=4 2279 B15R1.1380 CCOCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100011215890 [0,1,0,0,0,0|3,0,0]=4 2280 B15R1.1380 CCOCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100011215890 [0,1,0,0,0,0|3,0,0]=4 2281 B15R1.1380 CCOCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100011215890 [0,1,0,0,0,0|3,0,0]=4 2282 B15R1.1380 CCOCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100011215890 [0,1,0,0,0,0|3,0,0]=4 2283 B15R1.1380 CCOCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100011215890 [0,1,0,0,0,0|3,0,0]=4 2284 B15R1.1380 CCOCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011215890 [0,1,0,0,0,0|3,0,0]=4 2285 B15R1.1380 CCOCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100011215890 [0,1,0,0,0,0|3,0,0]=4 2286 B15R1.1380 CCOCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011215890 [0,1,0,0,0,0|3,0,0]=4 2287 B15R1.1380 CCOCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011215890 [0,1,0,0,0,0|3,0,0]=4 2288 B15R1.1380 CCOCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011215890 [0,1,0,0,0,0|3,0,0]=4 2289 B15R1.1380 CCOCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011215890 [0,1,0,0,0,0|3,0,0]=4 2290 B15R1.1380 CCOCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011215890 [0,1,0,0,0,0|3,0,0]=4 2291 B15R1.1380 CCOCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100011215890 [0,1,0,0,0,0|3,0,0]=4 2292 B15R1.1380 CCOCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011215890 [0,1,0,0,0,0|3,0,0]=4 2293 B15R1.1380 CCOCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100011215890 [0,1,0,0,0,0|3,0,0]=4 2294 B15R1.1380 CCOCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100011215890 [0,1,0,0,0,0|3,0,0]=4 2295 B15R1.1380 CCOCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100011215890 [0,1,0,0,0,0|3,0,0]=4 2296 B15R1.1380 CCOCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011215890 [0,1,0,0,0,0|3,0,0]=4 2297 B15R1.1380 CCOCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100011215890 [0,1,0,0,0,0|3,0,0]=4 2298 B15R1.1380 CCOCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011215890 [0,1,0,0,0,0|3,0,0]=4 2299 B15R1.1380 CCOCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100011215890 [0,1,0,0,0,0|3,0,0]=4 2300 B15R1.1380 CCOCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100011215890 [0,1,0,0,0,0|3,0,0]=4 2301 B15R1.1380 CCOCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100011215890 [0,1,0,0,0,0|3,0,0]=4 2302 B15R1.1380 CCOCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215890 [0,1,0,0,0,0|2,0,0]=3 2303 B15R1.1380 CCOCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100011215890 [0,1,0,0,0,0|2,0,0]=3 2304 B15R1.1380 CCOCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215890 [0,1,0,0,0,0|2,0,0]=3 2305 B15R1.1380 CCOCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215890 [0,1,0,0,0,0|2,0,0]=3 2306 B15R1.1380 CCOCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215890 [0,1,0,0,0,0|2,0,0]=3 2307 B15R1.1380 CCOCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215890 [0,1,0,0,0,0|2,0,0]=3 2308 B15R1.1380 CCSCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000757381 [0,1,0,0,0,0|3,0,0]=4 2309 B15R1.1380 CCSCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000757381 [0,1,0,0,0,0|3,0,0]=4 2310 B15R1.1380 CCSCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000757381 [0,1,0,0,0,0|3,0,0]=4 2311 B15R1.1380 CCSCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000757381 [0,1,0,0,0,0|3,0,0]=4 2312 B15R1.1380 CCSCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000757381 [0,1,0,0,0,0|3,0,0]=4 2313 B15R1.1380 CCSCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000757381 [0,1,0,0,0,0|3,0,0]=4 2314 B15R1.1380 CCSCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000757381 [0,1,0,0,0,0|3,0,0]=4 2315 B15R1.1380 CCSCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000757381 [0,1,0,0,0,0|3,0,0]=4 2316 B15R1.1380 CCSCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000757381 [0,1,0,0,0,0|3,0,0]=4 2317 B15R1.1380 CCSCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000757381 [0,1,0,0,0,0|3,0,0]=4 2318 B15R1.1380 CCSCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000757381 [0,1,0,0,0,0|3,0,0]=4 2319 B15R1.1380 CCSCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000757381 [0,1,0,0,0,0|3,0,0]=4 2320 B15R1.1380 CCSCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000757381 [0,1,0,0,0,0|3,0,0]=4 2321 B15R1.1380 CCSCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000757381 [0,1,0,0,0,0|3,0,0]=4 2322 B15R1.1380 CCSCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000757381 [0,1,0,0,0,0|3,0,0]=4 2323 B15R1.1380 CCSCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000757381 [0,1,0,0,0,0|3,0,0]=4 2324 B15R1.1380 CCSCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000757381 [0,1,0,0,0,0|3,0,0]=4 2325 B15R1.1380 CCSCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000757381 [0,1,0,0,0,0|3,0,0]=4 2326 B15R1.1380 CCSCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000757381 [0,1,0,0,0,0|3,0,0]=4 2327 B15R1.1380 CCSCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000757381 [0,1,0,0,0,0|3,0,0]=4 2328 B15R1.1380 CCSCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000757381 [0,1,0,0,0,0|3,0,0]=4 2329 B15R1.1380 CCSCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000757381 [0,1,0,0,0,0|3,0,0]=4 2330 B15R1.1380 CCSCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000757381 [0,1,0,0,0,0|3,0,0]=4 2331 B15R1.1380 CCSCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000757381 [0,1,0,0,0,0|3,0,0]=4 2332 B15R1.1380 CCSCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000757381 [0,1,0,0,0,0|3,0,0]=4 2333 B15R1.1380 CCSCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000757381 [0,1,0,0,0,0|3,0,0]=4 2334 B15R1.1380 CCSCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000757381 [0,1,0,0,0,0|3,0,0]=4 2335 B15R1.1380 CCSCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000757381 [0,1,0,0,0,0|3,0,0]=4 2336 B15R1.1380 CCSCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000757381 [0,1,0,0,0,0|3,0,0]=4 2337 B15R1.1380 CCSCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000757381 [0,1,0,0,0,0|3,0,0]=4 2338 B15R1.1380 CCSCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000757381 [0,1,0,0,0,0|2,0,0]=3 2339 B15R1.1380 CCSCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000757381 [0,1,0,0,0,0|2,0,0]=3 2340 B15R1.1380 CCSCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000757381 [0,1,0,0,0,0|2,0,0]=3 2341 B15R1.1380 CCSCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000757381 [0,1,0,0,0,0|2,0,0]=3 2342 B15R1.1380 CCSCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000757381 [0,1,0,0,0,0|2,0,0]=3 2343 B15R1.1380 CCSCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000757381 [0,1,0,0,0,0|2,0,0]=3 2344 B15R1.1380 COCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000740836 [0,1,0,0,0,0|3,0,0]=4 2345 B15R1.1380 COCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000740836 [0,1,0,0,0,0|3,0,0]=4 2346 B15R1.1380 COCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000740836 [0,1,0,0,0,0|3,0,0]=4 2347 B15R1.1380 COCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000740836 [0,1,0,0,0,0|3,0,0]=4 2348 B15R1.1380 COCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000740836 [0,1,0,0,0,0|3,0,0]=4 2349 B15R1.1380 COCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000740836 [0,1,0,0,0,0|3,0,0]=4 2350 B15R1.1380 COCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000740836 [0,1,0,0,0,0|3,0,0]=4 2351 B15R1.1380 COCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000740836 [0,1,0,0,0,0|3,0,0]=4 2352 B15R1.1380 COCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000740836 [0,1,0,0,0,0|3,0,0]=4 2353 B15R1.1380 COCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000740836 [0,1,0,0,0,0|3,0,0]=4 2354 B15R1.1380 COCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000740836 [0,1,0,0,0,0|3,0,0]=4 2355 B15R1.1380 COCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000740836 [0,1,0,0,0,0|3,0,0]=4 2356 B15R1.1380 COCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000740836 [0,1,0,0,0,0|3,0,0]=4 2357 B15R1.1380 COCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000740836 [0,1,0,0,0,0|3,0,0]=4 2358 B15R1.1380 COCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000740836 [0,1,0,0,0,0|3,0,0]=4 2359 B15R1.1380 COCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000740836 [0,1,0,0,0,0|3,0,0]=4 2360 B15R1.1380 COCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000740836 [0,1,0,0,0,0|3,0,0]=4 2361 B15R1.1380 COCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000740836 [0,1,0,0,0,0|3,0,0]=4 2362 B15R1.1380 COCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000740836 [0,1,0,0,0,0|3,0,0]=4 2363 B15R1.1380 COCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000740836 [0,1,0,0,0,0|3,0,0]=4 2364 B15R1.1380 COCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000740836 [0,1,0,0,0,0|3,0,0]=4 2365 B15R1.1380 COCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000740836 [0,1,0,0,0,0|3,0,0]=4 2366 B15R1.1380 COCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000740836 [0,1,0,0,0,0|3,0,0]=4 2367 B15R1.1380 COCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000740836 [0,1,0,0,0,0|3,0,0]=4 2368 B15R1.1380 COCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000740836 [0,1,0,0,0,0|3,0,0]=4 2369 B15R1.1380 COCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000740836 [0,1,0,0,0,0|3,0,0]=4 2370 B15R1.1380 COCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000740836 [0,1,0,0,0,0|3,0,0]=4 2371 B15R1.1380 COCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000740836 [0,1,0,0,0,0|3,0,0]=4 2372 B15R1.1380 COCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000740836 [0,1,0,0,0,0|3,0,0]=4 2373 B15R1.1380 COCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000740836 [0,1,0,0,0,0|3,0,0]=4 2374 B15R1.1380 COCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000740836 [0,1,0,0,0,0|2,0,0]=3 2375 B15R1.1380 COCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000740836 [0,1,0,0,0,0|2,0,0]=3 2376 B15R1.1380 COCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000740836 [0,1,0,0,0,0|2,0,0]=3 2377 B15R1.1380 COCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000740836 [0,1,0,0,0,0|2,0,0]=3 2378 B15R1.1380 COCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000740836 [0,1,0,0,0,0|2,0,0]=3 2379 B15R1.1380 COCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000740836 [0,1,0,0,0,0|2,0,0]=3 2380 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)Br 1626a_100000209980_100000690610 [0,1,0,0,0,0|3,0,0]=4 2381 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)Br 240690a_100000209980_100000690610 [0,1,0,0,0,0|3,0,0]=4 2382 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)Br 527a_100000209980_100000690610 [0,1,0,0,0,0|3,0,0]=4 2383 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)C 1626a_100000209980_100000689033 [0,1,0,0,0,0|3,0,0]=4 2384 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)C 240690a_100000209980_100000689033 [0,1,0,0,0,0|3,0,0]=4 2385 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)C 527a_100000209980_100000689033 [0,1,0,0,0,0|3,0,0]=4 2386 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)Cl 1626a_100000209980_100000736951 [0,1,0,0,0,0|3,0,0]=4 2387 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)Cl 240690a_100000209980_100000736951 [0,1,0,0,0,0|3,0,0]=4 2388 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)Cl 527a_100000209980_100000736951 [0,1,0,0,0,0|3,0,0]=4 2389 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)F 1626a_100000209980_100000212315 [0,1,0,0,0,0|3,0,0]=4 2390 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)F 240690a_100000209980_100000212315 [0,1,0,0,0,0|3,0,0]=4 2391 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)F 34a_200000206141_200000210301 [0,1,0,0,0,0|3,0,0]=4 2392 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)F 527a_100000209980_100000212315 [0,1,0,0,0,0|3,0,0]=4 2393 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)F 7a_200000206141_200000210301 [0,1,0,0,0,0|3,0,0]=4 2394 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)I 1626a_100000209980_100000698340 [0,1,0,0,0,0|3,0,0]=4 2395 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)I 240690a_100000209980_100000698340 [0,1,0,0,0,0|3,0,0]=4 2396 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)I 527a_100000209980_100000698340 [0,1,0,0,0,0|3,0,0]=4 2397 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)O 240690a_100000209980_100012352043 [0,1,0,0,0,0|3,0,0]=4 2398 B15R1.1380 COCCNC(=O)c1cc(ccc1Br)O 527a_100000209980_100012352043 [0,1,0,0,0,0|3,0,0]=4 2399 B15R1.1380 COCCNC(=O)c1cc(ccc1C)Br 1626a_100000209980_100000759961 [0,1,0,0,0,0|3,0,0]=4 2400 B15R1.1380 COCCNC(=O)c1cc(ccc1C)Br 240690a_100000209980_100000759961 [0,1,0,0,0,0|3,0,0]=4 2401 B15R1.1380 COCCNC(=O)c1cc(ccc1C)Br 527a_100000209980_100000759961 [0,1,0,0,0,0|3,0,0]=4 2402 B15R1.1380 COCCNC(=O)c1cc(ccc1C)C 1626a_100000209980_100000195421 [0,1,0,0,0,0|3,0,0]=4 2403 B15R1.1380 COCCNC(=O)c1cc(ccc1C)C 240690a_100000209980_100000195421 [0,1,0,0,0,0|3,0,0]=4 2404 B15R1.1380 COCCNC(=O)c1cc(ccc1C)C 527a_100000209980_100000195421 [0,1,0,0,0,0|3,0,0]=4 2405 B15R1.1380 COCCNC(=O)c1cc(ccc1C)Cl 1626a_100000209980_100000692595 [0,1,0,0,0,0|3,0,0]=4 2406 B15R1.1380 COCCNC(=O)c1cc(ccc1C)Cl 240690a_100000209980_100000692595 [0,1,0,0,0,0|3,0,0]=4 2407 B15R1.1380 COCCNC(=O)c1cc(ccc1C)Cl 527a_100000209980_100000692595 [0,1,0,0,0,0|3,0,0]=4 2408 B15R1.1380 COCCNC(=O)c1cc(ccc1C)F 1626a_100000209980_100000240043 [0,1,0,0,0,0|3,0,0]=4 2409 B15R1.1380 COCCNC(=O)c1cc(ccc1C)F 240690a_100000209980_100000240043 [0,1,0,0,0,0|3,0,0]=4 2410 B15R1.1380 COCCNC(=O)c1cc(ccc1C)F 527a_100000209980_100000240043 [0,1,0,0,0,0|3,0,0]=4 2411 B15R1.1380 COCCNC(=O)c1cc(ccc1C)I 1626a_100000209980_100000688012 [0,1,0,0,0,0|3,0,0]=4 2412 B15R1.1380 COCCNC(=O)c1cc(ccc1C)I 240690a_100000209980_100000688012 [0,1,0,0,0,0|3,0,0]=4 2413 B15R1.1380 COCCNC(=O)c1cc(ccc1C)I 527a_100000209980_100000688012 [0,1,0,0,0,0|3,0,0]=4 2414 B15R1.1380 COCCNC(=O)c1cc(ccc1C)O 240690a_100000209980_100000687834 [0,1,0,0,0,0|3,0,0]=4 2415 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)Br 1626a_100000209980_100000211212 [0,1,0,0,0,0|3,0,0]=4 2416 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)Br 240690a_100000209980_100000211212 [0,1,0,0,0,0|3,0,0]=4 2417 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)Br 527a_100000209980_100000211212 [0,1,0,0,0,0|3,0,0]=4 2418 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)C 1626a_100000209980_100011290873 [0,1,0,0,0,0|3,0,0]=4 2419 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)C 240690a_100000209980_100011290873 [0,1,0,0,0,0|3,0,0]=4 2420 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)C 527a_100000209980_100011290873 [0,1,0,0,0,0|3,0,0]=4 2421 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100000209980_100000210642 [0,1,0,0,0,0|3,0,0]=4 2422 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000209980_100000210642 [0,1,0,0,0,0|3,0,0]=4 2423 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)Cl 527a_100000209980_100000210642 [0,1,0,0,0,0|3,0,0]=4 2424 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)F 1626a_100000209980_100011219680 [0,1,0,0,0,0|3,0,0]=4 2425 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)F 240690a_100000209980_100011219680 [0,1,0,0,0,0|3,0,0]=4 2426 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)F 527a_100000209980_100011219680 [0,1,0,0,0,0|3,0,0]=4 2427 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)I 1626a_100000209980_100000688013 [0,1,0,0,0,0|3,0,0]=4 2428 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)I 240690a_100000209980_100000688013 [0,1,0,0,0,0|3,0,0]=4 2429 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)I 527a_100000209980_100000688013 [0,1,0,0,0,0|3,0,0]=4 2430 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)O 240690a_100000209980_100000719527 [0,1,0,0,0,0|3,0,0]=4 2431 B15R1.1380 COCCNC(=O)c1cc(ccc1Cl)O 527a_100000209980_100000719527 [0,1,0,0,0,0|3,0,0]=4 2432 B15R1.1380 COCCNC(=O)c1cc(ccc1F)Br 1626a_100000209980_100000212322 [0,1,0,0,0,0|3,0,0]=4 2433 B15R1.1380 COCCNC(=O)c1cc(ccc1F)Br 240690a_100000209980_100000212322 [0,1,0,0,0,0|3,0,0]=4 2434 B15R1.1380 COCCNC(=O)c1cc(ccc1F)Br 527a_100000209980_100000212322 [0,1,0,0,0,0|3,0,0]=4 2435 B15R1.1380 COCCNC(=O)c1cc(ccc1F)C 1626a_100000209980_100000749327 [0,1,0,0,0,0|3,0,0]=4 2436 B15R1.1380 COCCNC(=O)c1cc(ccc1F)C 240690a_100000209980_100000749327 [0,1,0,0,0,0|3,0,0]=4 2437 B15R1.1380 COCCNC(=O)c1cc(ccc1F)C 527a_100000209980_100000749327 [0,1,0,0,0,0|3,0,0]=4 2438 B15R1.1380 COCCNC(=O)c1cc(ccc1F)Cl 1626a_100000209980_100000214954 [0,1,0,0,0,0|3,0,0]=4 2439 B15R1.1380 COCCNC(=O)c1cc(ccc1F)Cl 240690a_100000209980_100000214954 [0,1,0,0,0,0|3,0,0]=4 2440 B15R1.1380 COCCNC(=O)c1cc(ccc1F)Cl 527a_100000209980_100000214954 [0,1,0,0,0,0|3,0,0]=4 2441 B15R1.1380 COCCNC(=O)c1cc(ccc1F)F 1626a_100000209980_100000198512 [0,1,0,0,0,0|3,0,0]=4 2442 B15R1.1380 COCCNC(=O)c1cc(ccc1F)F 240690a_100000209980_100000198512 [0,1,0,0,0,0|3,0,0]=4 2443 B15R1.1380 COCCNC(=O)c1cc(ccc1F)F 527a_100000209980_100000198512 [0,1,0,0,0,0|3,0,0]=4 2444 B15R1.1380 COCCNC(=O)c1cc(ccc1F)I 1626a_100000209980_100000688014 [0,1,0,0,0,0|3,0,0]=4 2445 B15R1.1380 COCCNC(=O)c1cc(ccc1F)I 240690a_100000209980_100000688014 [0,1,0,0,0,0|3,0,0]=4 2446 B15R1.1380 COCCNC(=O)c1cc(ccc1F)I 527a_100000209980_100000688014 [0,1,0,0,0,0|3,0,0]=4 2447 B15R1.1380 COCCNC(=O)c1cc(ccc1F)O 240690a_100000209980_100000037260 [0,1,0,0,0,0|3,0,0]=4 2448 B15R1.1380 COCCNC(=O)c1cc(ccc1F)O 527a_100000209980_100000037260 [0,1,0,0,0,0|3,0,0]=4 2449 B15R1.1380 COCCNC(=O)c1cc(ccc1I)Br 1626a_100000209980_100000183945 [0,1,0,0,0,0|3,0,0]=4 2450 B15R1.1380 COCCNC(=O)c1cc(ccc1I)Br 240690a_100000209980_100000183945 [0,1,0,0,0,0|3,0,0]=4 2451 B15R1.1380 COCCNC(=O)c1cc(ccc1I)C 1626a_100000209980_100000057929 [0,1,0,0,0,0|3,0,0]=4 2452 B15R1.1380 COCCNC(=O)c1cc(ccc1I)C 240690a_100000209980_100000057929 [0,1,0,0,0,0|3,0,0]=4 2453 B15R1.1380 COCCNC(=O)c1cc(ccc1I)C 527a_100000209980_100000057929 [0,1,0,0,0,0|3,0,0]=4 2454 B15R1.1380 COCCNC(=O)c1cc(ccc1I)Cl 1626a_100000209980_100000739379 [0,1,0,0,0,0|3,0,0]=4 2455 B15R1.1380 COCCNC(=O)c1cc(ccc1I)Cl 240690a_100000209980_100000739379 [0,1,0,0,0,0|3,0,0]=4 2456 B15R1.1380 COCCNC(=O)c1cc(ccc1I)Cl 527a_100000209980_100000739379 [0,1,0,0,0,0|3,0,0]=4 2457 B15R1.1380 COCCNC(=O)c1cc(ccc1I)F 1626a_100000209980_100000748905 [0,1,0,0,0,0|3,0,0]=4 2458 B15R1.1380 COCCNC(=O)c1cc(ccc1I)F 240690a_100000209980_100000748905 [0,1,0,0,0,0|3,0,0]=4 2459 B15R1.1380 COCCNC(=O)c1cc(ccc1I)F 527a_100000209980_100000748905 [0,1,0,0,0,0|3,0,0]=4 2460 B15R1.1380 COCCNC(=O)c1cc(ccc1I)I 1626a_100000209980_100000750460 [0,1,0,0,0,0|3,0,0]=4 2461 B15R1.1380 COCCNC(=O)c1cc(ccc1I)I 240690a_100000209980_100000750460 [0,1,0,0,0,0|3,0,0]=4 2462 B15R1.1380 COCCNC(=O)c1cc(ccc1I)I 527a_100000209980_100000750460 [0,1,0,0,0,0|3,0,0]=4 2463 B15R1.1380 COCCNC(=O)c1cc(ccc1I)O 1626a_100000209980_200009995701 [0,1,0,0,0,0|3,0,0]=4 2464 B15R1.1380 COCCNC(=O)c1cc(ccc1I)O 240690a_100000209980_200009995701 [0,1,0,0,0,0|3,0,0]=4 2465 B15R1.1380 COCCNC(=O)c1cc(ccc1I)O 527a_100000209980_200009995701 [0,1,0,0,0,0|3,0,0]=4 2466 B15R1.1380 COCCNC(=O)c1cc(ccc1O)Br 1626a_100000209980_100000212140 [0,1,0,0,0,0|2,0,0]=3 2467 B15R1.1380 COCCNC(=O)c1cc(ccc1O)Br 240690a_100000209980_100000212140 [0,1,0,0,0,0|2,0,0]=3 2468 B15R1.1380 COCCNC(=O)c1cc(ccc1O)Br 527a_100000209980_100000212140 [0,1,0,0,0,0|2,0,0]=3 2469 B15R1.1380 COCCNC(=O)c1cc(ccc1O)C 240690a_100000209980_100000229998 [0,1,0,0,0,0|2,0,0]=3 2470 B15R1.1380 COCCNC(=O)c1cc(ccc1O)C 527a_100000209980_100000229998 [0,1,0,0,0,0|2,0,0]=3 2471 B15R1.1380 COCCNC(=O)c1cc(ccc1O)Cl 1626a_100000209980_100000212143 [0,1,0,0,0,0|2,0,0]=3 2472 B15R1.1380 COCCNC(=O)c1cc(ccc1O)Cl 240690a_100000209980_100000212143 [0,1,0,0,0,0|2,0,0]=3 2473 B15R1.1380 COCCNC(=O)c1cc(ccc1O)Cl 527a_100000209980_100000212143 [0,1,0,0,0,0|2,0,0]=3 2474 B15R1.1380 COCCNC(=O)c1cc(ccc1O)F 240690a_100000209980_100000742286 [0,1,0,0,0,0|2,0,0]=3 2475 B15R1.1380 COCCNC(=O)c1cc(ccc1O)F 527a_100000209980_100000742286 [0,1,0,0,0,0|2,0,0]=3 2476 B15R1.1380 COCCNC(=O)c1cc(ccc1O)I 240690a_100000209980_100000212111 [0,1,0,0,0,0|2,0,0]=3 2477 B15R1.1380 COCCNC(=O)c1cc(ccc1O)I 527a_100000209980_100000212111 [0,1,0,0,0,0|2,0,0]=3 2478 B15R1.1380 COCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000766300 [0,1,0,0,0,0|3,0,0]=4 2479 B15R1.1380 COCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000766300 [0,1,0,0,0,0|3,0,0]=4 2480 B15R1.1380 COCSCC(=O)c1cc(ccc1O)F 62a_100000766300_100009814381 [0,1,0,0,0,0|3,0,0]=4 2481 B15R1.1380 COCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000766300 [0,1,0,0,0,0|3,0,0]=4 2482 B15R1.1380 COCSCC(=O)c1cc(ccc1O)O 62a_100000766300_100009814097 [0,1,0,0,0,0|3,0,0]=4 2483 B15R1.1380 COCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000766300 [0,1,0,0,0,0|3,0,0]=4 2484 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Br 11a_100020590264_100000690610 [0,1,0,0,0,0|3,0,0]=4 2485 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Br 1626a_100020590264_100000690610 [0,1,0,0,0,0|3,0,0]=4 2486 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Br 240690a_100020590264_100000690610 [0,1,0,0,0,0|3,0,0]=4 2487 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Br 527a_100020590264_100000690610 [0,1,0,0,0,0|3,0,0]=4 2488 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)C 11a_100020590264_100000689033 [0,1,0,0,0,0|3,0,0]=4 2489 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)C 1626a_100020590264_100000689033 [0,1,0,0,0,0|3,0,0]=4 2490 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)C 240690a_100020590264_100000689033 [0,1,0,0,0,0|3,0,0]=4 2491 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)C 527a_100020590264_100000689033 [0,1,0,0,0,0|3,0,0]=4 2492 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Cl 11a_100020590264_100000736951 [0,1,0,0,0,0|3,0,0]=4 2493 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Cl 1626a_100020590264_100000736951 [0,1,0,0,0,0|3,0,0]=4 2494 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Cl 240690a_100020590264_100000736951 [0,1,0,0,0,0|3,0,0]=4 2495 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)Cl 527a_100020590264_100000736951 [0,1,0,0,0,0|3,0,0]=4 2496 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)F 11a_100020590264_100000212315 [0,1,0,0,0,0|3,0,0]=4 2497 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)F 1626a_100020590264_100000212315 [0,1,0,0,0,0|3,0,0]=4 2498 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)F 240690a_100020590264_100000212315 [0,1,0,0,0,0|3,0,0]=4 2499 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)F 527a_100020590264_100000212315 [0,1,0,0,0,0|3,0,0]=4 2500 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)I 11a_100020590264_100000698340 [0,1,0,0,0,0|3,0,0]=4 2501 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)I 1626a_100020590264_100000698340 [0,1,0,0,0,0|3,0,0]=4 2502 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)I 240690a_100020590264_100000698340 [0,1,0,0,0,0|3,0,0]=4 2503 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)I 527a_100020590264_100000698340 [0,1,0,0,0,0|3,0,0]=4 2504 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)O 240690a_100020590264_100012352043 [0,1,0,0,0,0|3,0,0]=4 2505 B15R1.1380 CSCCNC(=O)c1cc(ccc1Br)O 527a_100020590264_100012352043 [0,1,0,0,0,0|3,0,0]=4 2506 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Br 11a_100020590264_100000759961 [0,1,0,0,0,0|3,0,0]=4 2507 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Br 1626a_100020590264_100000759961 [0,1,0,0,0,0|3,0,0]=4 2508 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Br 240690a_100020590264_100000759961 [0,1,0,0,0,0|3,0,0]=4 2509 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Br 527a_100020590264_100000759961 [0,1,0,0,0,0|3,0,0]=4 2510 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)C 11a_100020590264_100000195421 [0,1,0,0,0,0|3,0,0]=4 2511 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)C 1626a_100020590264_100000195421 [0,1,0,0,0,0|3,0,0]=4 2512 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)C 240690a_100020590264_100000195421 [0,1,0,0,0,0|3,0,0]=4 2513 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)C 527a_100020590264_100000195421 [0,1,0,0,0,0|3,0,0]=4 2514 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Cl 11a_100020590264_100000692595 [0,1,0,0,0,0|3,0,0]=4 2515 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Cl 1626a_100020590264_100000692595 [0,1,0,0,0,0|3,0,0]=4 2516 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Cl 240690a_100020590264_100000692595 [0,1,0,0,0,0|3,0,0]=4 2517 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)Cl 527a_100020590264_100000692595 [0,1,0,0,0,0|3,0,0]=4 2518 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)F 11a_100020590264_100000240043 [0,1,0,0,0,0|3,0,0]=4 2519 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)F 1626a_100020590264_100000240043 [0,1,0,0,0,0|3,0,0]=4 2520 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)F 240690a_100020590264_100000240043 [0,1,0,0,0,0|3,0,0]=4 2521 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)F 527a_100020590264_100000240043 [0,1,0,0,0,0|3,0,0]=4 2522 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)I 11a_100020590264_100000688012 [0,1,0,0,0,0|3,0,0]=4 2523 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)I 1626a_100020590264_100000688012 [0,1,0,0,0,0|3,0,0]=4 2524 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)I 240690a_100020590264_100000688012 [0,1,0,0,0,0|3,0,0]=4 2525 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)I 527a_100020590264_100000688012 [0,1,0,0,0,0|3,0,0]=4 2526 B15R1.1380 CSCCNC(=O)c1cc(ccc1C)O 240690a_100020590264_100000687834 [0,1,0,0,0,0|3,0,0]=4 2527 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Br 11a_100020590264_100000211212 [0,1,0,0,0,0|3,0,0]=4 2528 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Br 1626a_100020590264_100000211212 [0,1,0,0,0,0|3,0,0]=4 2529 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Br 240690a_100020590264_100000211212 [0,1,0,0,0,0|3,0,0]=4 2530 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Br 527a_100020590264_100000211212 [0,1,0,0,0,0|3,0,0]=4 2531 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)C 11a_100020590264_100011290873 [0,1,0,0,0,0|3,0,0]=4 2532 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)C 1626a_100020590264_100011290873 [0,1,0,0,0,0|3,0,0]=4 2533 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)C 240690a_100020590264_100011290873 [0,1,0,0,0,0|3,0,0]=4 2534 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)C 527a_100020590264_100011290873 [0,1,0,0,0,0|3,0,0]=4 2535 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Cl 11a_100020590264_100000210642 [0,1,0,0,0,0|3,0,0]=4 2536 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100020590264_100000210642 [0,1,0,0,0,0|3,0,0]=4 2537 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100020590264_100000210642 [0,1,0,0,0,0|3,0,0]=4 2538 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)Cl 527a_100020590264_100000210642 [0,1,0,0,0,0|3,0,0]=4 2539 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)F 11a_100020590264_100011219680 [0,1,0,0,0,0|3,0,0]=4 2540 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)F 1626a_100020590264_100011219680 [0,1,0,0,0,0|3,0,0]=4 2541 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)F 240690a_100020590264_100011219680 [0,1,0,0,0,0|3,0,0]=4 2542 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)F 527a_100020590264_100011219680 [0,1,0,0,0,0|3,0,0]=4 2543 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)I 11a_100020590264_100000688013 [0,1,0,0,0,0|3,0,0]=4 2544 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)I 1626a_100020590264_100000688013 [0,1,0,0,0,0|3,0,0]=4 2545 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)I 240690a_100020590264_100000688013 [0,1,0,0,0,0|3,0,0]=4 2546 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)I 527a_100020590264_100000688013 [0,1,0,0,0,0|3,0,0]=4 2547 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)O 240690a_100020590264_100000719527 [0,1,0,0,0,0|3,0,0]=4 2548 B15R1.1380 CSCCNC(=O)c1cc(ccc1Cl)O 527a_100020590264_100000719527 [0,1,0,0,0,0|3,0,0]=4 2549 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Br 11a_100020590264_100000212322 [0,1,0,0,0,0|3,0,0]=4 2550 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Br 1626a_100020590264_100000212322 [0,1,0,0,0,0|3,0,0]=4 2551 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Br 240690a_100020590264_100000212322 [0,1,0,0,0,0|3,0,0]=4 2552 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Br 527a_100020590264_100000212322 [0,1,0,0,0,0|3,0,0]=4 2553 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)C 11a_100020590264_100000749327 [0,1,0,0,0,0|3,0,0]=4 2554 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)C 1626a_100020590264_100000749327 [0,1,0,0,0,0|3,0,0]=4 2555 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)C 240690a_100020590264_100000749327 [0,1,0,0,0,0|3,0,0]=4 2556 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)C 527a_100020590264_100000749327 [0,1,0,0,0,0|3,0,0]=4 2557 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Cl 11a_100020590264_100000214954 [0,1,0,0,0,0|3,0,0]=4 2558 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Cl 1626a_100020590264_100000214954 [0,1,0,0,0,0|3,0,0]=4 2559 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Cl 240690a_100020590264_100000214954 [0,1,0,0,0,0|3,0,0]=4 2560 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)Cl 527a_100020590264_100000214954 [0,1,0,0,0,0|3,0,0]=4 2561 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)F 11a_100020590264_100000198512 [0,1,0,0,0,0|3,0,0]=4 2562 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)F 1626a_100020590264_100000198512 [0,1,0,0,0,0|3,0,0]=4 2563 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)F 240690a_100020590264_100000198512 [0,1,0,0,0,0|3,0,0]=4 2564 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)F 527a_100020590264_100000198512 [0,1,0,0,0,0|3,0,0]=4 2565 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)I 11a_100020590264_100000688014 [0,1,0,0,0,0|3,0,0]=4 2566 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)I 1626a_100020590264_100000688014 [0,1,0,0,0,0|3,0,0]=4 2567 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)I 240690a_100020590264_100000688014 [0,1,0,0,0,0|3,0,0]=4 2568 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)I 527a_100020590264_100000688014 [0,1,0,0,0,0|3,0,0]=4 2569 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)O 240690a_100020590264_100000037260 [0,1,0,0,0,0|3,0,0]=4 2570 B15R1.1380 CSCCNC(=O)c1cc(ccc1F)O 527a_100020590264_100000037260 [0,1,0,0,0,0|3,0,0]=4 2571 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Br 11a_100020590264_100000183945 [0,1,0,0,0,0|3,0,0]=4 2572 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Br 1626a_100020590264_100000183945 [0,1,0,0,0,0|3,0,0]=4 2573 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Br 240690a_100020590264_100000183945 [0,1,0,0,0,0|3,0,0]=4 2574 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)C 11a_100020590264_100000057929 [0,1,0,0,0,0|3,0,0]=4 2575 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)C 1626a_100020590264_100000057929 [0,1,0,0,0,0|3,0,0]=4 2576 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)C 240690a_100020590264_100000057929 [0,1,0,0,0,0|3,0,0]=4 2577 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)C 527a_100020590264_100000057929 [0,1,0,0,0,0|3,0,0]=4 2578 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Cl 11a_100020590264_100000739379 [0,1,0,0,0,0|3,0,0]=4 2579 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Cl 1626a_100020590264_100000739379 [0,1,0,0,0,0|3,0,0]=4 2580 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Cl 240690a_100020590264_100000739379 [0,1,0,0,0,0|3,0,0]=4 2581 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)Cl 527a_100020590264_100000739379 [0,1,0,0,0,0|3,0,0]=4 2582 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)F 11a_100020590264_100000748905 [0,1,0,0,0,0|3,0,0]=4 2583 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)F 1626a_100020590264_100000748905 [0,1,0,0,0,0|3,0,0]=4 2584 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)F 240690a_100020590264_100000748905 [0,1,0,0,0,0|3,0,0]=4 2585 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)F 527a_100020590264_100000748905 [0,1,0,0,0,0|3,0,0]=4 2586 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)I 11a_100020590264_100000750460 [0,1,0,0,0,0|3,0,0]=4 2587 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)I 1626a_100020590264_100000750460 [0,1,0,0,0,0|3,0,0]=4 2588 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)I 240690a_100020590264_100000750460 [0,1,0,0,0,0|3,0,0]=4 2589 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)I 527a_100020590264_100000750460 [0,1,0,0,0,0|3,0,0]=4 2590 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)O 1626a_100020590264_200009995701 [0,1,0,0,0,0|3,0,0]=4 2591 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)O 240690a_100020590264_200009995701 [0,1,0,0,0,0|3,0,0]=4 2592 B15R1.1380 CSCCNC(=O)c1cc(ccc1I)O 527a_100020590264_200009995701 [0,1,0,0,0,0|3,0,0]=4 2593 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Br 1626a_100020590264_100000212140 [0,1,0,0,0,0|2,0,0]=3 2594 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Br 240690a_100020590264_100000212140 [0,1,0,0,0,0|2,0,0]=3 2595 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Br 527a_100020590264_100000212140 [0,1,0,0,0,0|2,0,0]=3 2596 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)C 240690a_100020590264_100000229998 [0,1,0,0,0,0|2,0,0]=3 2597 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)C 527a_100020590264_100000229998 [0,1,0,0,0,0|2,0,0]=3 2598 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Cl 11a_100020590264_100000212143 [0,1,0,0,0,0|2,0,0]=3 2599 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Cl 1626a_100020590264_100000212143 [0,1,0,0,0,0|2,0,0]=3 2600 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Cl 240690a_100020590264_100000212143 [0,1,0,0,0,0|2,0,0]=3 2601 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)Cl 527a_100020590264_100000212143 [0,1,0,0,0,0|2,0,0]=3 2602 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)F 240690a_100020590264_100000742286 [0,1,0,0,0,0|2,0,0]=3 2603 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)F 527a_100020590264_100000742286 [0,1,0,0,0,0|2,0,0]=3 2604 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)I 240690a_100020590264_100000212111 [0,1,0,0,0,0|2,0,0]=3 2605 B15R1.1380 CSCCNC(=O)c1cc(ccc1O)I 527a_100020590264_100000212111 [0,1,0,0,0,0|2,0,0]=3 2606 B15R1.1380 CSCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100011218213 [0,1,0,0,0,0|3,0,0]=4 2607 B15R1.1380 CSCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100011218213 [0,1,0,0,0,0|3,0,0]=4 2608 B15R1.1380 CSCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100011218213 [0,1,0,0,0,0|3,0,0]=4 2609 B15R1.1380 CSCSCC(=O)c1cc(ccc1O)F 62a_100011218213_100009814381 [0,1,0,0,0,0|3,0,0]=4 2610 B15R1.1380 CSCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100011218213 [0,1,0,0,0,0|3,0,0]=4 2611 B15R1.1380 CSCSCC(=O)c1cc(ccc1O)O 62a_100011218213_100009814097 [0,1,0,0,0,0|3,0,0]=4 2612 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCC#N)O 1458a_100000229998_100000211468 [0,1,0,0,0,0|2,0,1]=4 2613 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCF)Br 1458a_100000689033_100000729493 [0,1,0,0,0,0|3,0,0]=4 2614 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCF)C 1458a_100000195421_100000729493 [0,1,0,0,0,0|3,0,0]=4 2615 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCF)Cl 1458a_100011290873_100000729493 [0,1,0,0,0,0|3,0,0]=4 2616 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCF)F 1458a_100000749327_100000729493 [0,1,0,0,0,0|3,0,0]=4 2617 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCF)I 1458a_100000057929_100000729493 [0,1,0,0,0,0|3,0,0]=4 2618 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCF)O 1458a_100000229998_100000729493 [0,1,0,0,0,0|2,0,0]=3 2619 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCO)Br 1458a_100000689033_100000210776 [0,1,0,0,0,0|3,0,0]=4 2620 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCO)C 1458a_100000195421_100000210776 [0,1,0,0,0,0|3,0,0]=4 2621 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCO)Cl 1458a_100011290873_100000210776 [0,1,0,0,0,0|3,0,0]=4 2622 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCO)F 1458a_100000749327_100000210776 [0,1,0,0,0,0|3,0,0]=4 2623 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCO)I 1458a_100000057929_100000210776 [0,1,0,0,0,0|3,0,0]=4 2624 B15R1.1380 Cc1ccc(c(c1)C(=O)CCCCO)O 1458a_100000229998_100000210776 [0,1,0,0,0,0|2,0,0]=3 2625 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCC#N)O 240690a_100000720768_100000229998 [0,1,0,0,0,0|2,0,1]=4 2626 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCC#N)O 527a_100000720768_100000229998 [0,1,0,0,0,0|2,0,1]=4 2627 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Br 11a_100015189416_100000689033 [0,1,0,0,0,0|3,0,0]=4 2628 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Br 1626a_100015189416_100000689033 [0,1,0,0,0,0|3,0,0]=4 2629 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Br 240690a_100015189416_100000689033 [0,1,0,0,0,0|3,0,0]=4 2630 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Br 527a_100015189416_100000689033 [0,1,0,0,0,0|3,0,0]=4 2631 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)C 11a_100015189416_100000195421 [0,1,0,0,0,0|3,0,0]=4 2632 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)C 1626a_100015189416_100000195421 [0,1,0,0,0,0|3,0,0]=4 2633 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)C 240690a_100015189416_100000195421 [0,1,0,0,0,0|3,0,0]=4 2634 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)C 527a_100015189416_100000195421 [0,1,0,0,0,0|3,0,0]=4 2635 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Cl 11a_100015189416_100011290873 [0,1,0,0,0,0|3,0,0]=4 2636 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Cl 1626a_100015189416_100011290873 [0,1,0,0,0,0|3,0,0]=4 2637 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Cl 240690a_100015189416_100011290873 [0,1,0,0,0,0|3,0,0]=4 2638 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)Cl 527a_100015189416_100011290873 [0,1,0,0,0,0|3,0,0]=4 2639 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)F 11a_100015189416_100000749327 [0,1,0,0,0,0|3,0,0]=4 2640 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)F 1626a_100015189416_100000749327 [0,1,0,0,0,0|3,0,0]=4 2641 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)F 240690a_100015189416_100000749327 [0,1,0,0,0,0|3,0,0]=4 2642 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)F 527a_100015189416_100000749327 [0,1,0,0,0,0|3,0,0]=4 2643 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)I 11a_100015189416_100000057929 [0,1,0,0,0,0|3,0,0]=4 2644 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)I 1626a_100015189416_100000057929 [0,1,0,0,0,0|3,0,0]=4 2645 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)I 240690a_100015189416_100000057929 [0,1,0,0,0,0|3,0,0]=4 2646 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)I 527a_100015189416_100000057929 [0,1,0,0,0,0|3,0,0]=4 2647 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)O 240690a_100015189416_100000229998 [0,1,0,0,0,0|2,0,0]=3 2648 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCF)O 527a_100015189416_100000229998 [0,1,0,0,0,0|2,0,0]=3 2649 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)Br 240690a_100000182051_100000689033 [0,1,0,0,0,0|3,0,0]=4 2650 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)Br 527a_100000182051_100000689033 [0,1,0,0,0,0|3,0,0]=4 2651 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)C 240690a_100000182051_100000195421 [0,1,0,0,0,0|3,0,0]=4 2652 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)C 527a_100000182051_100000195421 [0,1,0,0,0,0|3,0,0]=4 2653 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)Cl 240690a_100000182051_100011290873 [0,1,0,0,0,0|3,0,0]=4 2654 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)Cl 527a_100000182051_100011290873 [0,1,0,0,0,0|3,0,0]=4 2655 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)F 240690a_100000182051_100000749327 [0,1,0,0,0,0|3,0,0]=4 2656 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)F 527a_100000182051_100000749327 [0,1,0,0,0,0|3,0,0]=4 2657 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)I 240690a_100000182051_100000057929 [0,1,0,0,0,0|3,0,0]=4 2658 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)I 527a_100000182051_100000057929 [0,1,0,0,0,0|3,0,0]=4 2659 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)O 240690a_100000182051_100000229998 [0,1,0,0,0,0|2,0,0]=3 2660 B15R1.1380 Cc1ccc(c(c1)C(=O)NCCCO)O 527a_100000182051_100000229998 [0,1,0,0,0,0|2,0,0]=3 2661 B15R1.1380 Cc1ccc(c(c1)C(=O)NNCCO)O 22a_100000210001_100000229998 [0,1,0,0,0,0|3,0,0]=4 2662 B15R1.1380 Cc1ccc(cc1C(=O)CCCCF)Br 1458a_100000759961_100000729493 [0,1,0,0,0,0|3,0,0]=4 2663 B15R1.1380 Cc1ccc(cc1C(=O)CCCCF)Cl 1458a_100000692595_100000729493 [0,1,0,0,0,0|3,0,0]=4 2664 B15R1.1380 Cc1ccc(cc1C(=O)CCCCF)F 1458a_100000240043_100000729493 [0,1,0,0,0,0|3,0,0]=4 2665 B15R1.1380 Cc1ccc(cc1C(=O)CCCCF)I 1458a_100000688012_100000729493 [0,1,0,0,0,0|3,0,0]=4 2666 B15R1.1380 Cc1ccc(cc1C(=O)CCCCF)O 1458a_100000687834_100000729493 [0,1,0,0,0,0|3,0,0]=4 2667 B15R1.1380 Cc1ccc(cc1C(=O)CCCCO)Br 1458a_100000759961_100000210776 [0,1,0,0,0,0|3,0,0]=4 2668 B15R1.1380 Cc1ccc(cc1C(=O)CCCCO)Cl 1458a_100000692595_100000210776 [0,1,0,0,0,0|3,0,0]=4 2669 B15R1.1380 Cc1ccc(cc1C(=O)CCCCO)F 1458a_100000240043_100000210776 [0,1,0,0,0,0|3,0,0]=4 2670 B15R1.1380 Cc1ccc(cc1C(=O)CCCCO)I 1458a_100000688012_100000210776 [0,1,0,0,0,0|3,0,0]=4 2671 B15R1.1380 Cc1ccc(cc1C(=O)CCCCO)O 1458a_100000687834_100000210776 [0,1,0,0,0,0|3,0,0]=4 2672 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Br 11a_100015189416_100000759961 [0,1,0,0,0,0|3,0,0]=4 2673 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Br 1626a_100015189416_100000759961 [0,1,0,0,0,0|3,0,0]=4 2674 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Br 240690a_100015189416_100000759961 [0,1,0,0,0,0|3,0,0]=4 2675 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Br 527a_100015189416_100000759961 [0,1,0,0,0,0|3,0,0]=4 2676 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Cl 11a_100015189416_100000692595 [0,1,0,0,0,0|3,0,0]=4 2677 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Cl 1626a_100015189416_100000692595 [0,1,0,0,0,0|3,0,0]=4 2678 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Cl 240690a_100015189416_100000692595 [0,1,0,0,0,0|3,0,0]=4 2679 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)Cl 527a_100015189416_100000692595 [0,1,0,0,0,0|3,0,0]=4 2680 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)F 11a_100015189416_100000240043 [0,1,0,0,0,0|3,0,0]=4 2681 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)F 1626a_100015189416_100000240043 [0,1,0,0,0,0|3,0,0]=4 2682 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)F 240690a_100015189416_100000240043 [0,1,0,0,0,0|3,0,0]=4 2683 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)F 527a_100015189416_100000240043 [0,1,0,0,0,0|3,0,0]=4 2684 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)I 11a_100015189416_100000688012 [0,1,0,0,0,0|3,0,0]=4 2685 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)I 1626a_100015189416_100000688012 [0,1,0,0,0,0|3,0,0]=4 2686 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)I 240690a_100015189416_100000688012 [0,1,0,0,0,0|3,0,0]=4 2687 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)I 527a_100015189416_100000688012 [0,1,0,0,0,0|3,0,0]=4 2688 B15R1.1380 Cc1ccc(cc1C(=O)NCCCF)O 240690a_100015189416_100000687834 [0,1,0,0,0,0|3,0,0]=4 2689 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)Br 240690a_100000182051_100000759961 [0,1,0,0,0,0|3,0,0]=4 2690 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)Br 527a_100000182051_100000759961 [0,1,0,0,0,0|3,0,0]=4 2691 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)Cl 240690a_100000182051_100000692595 [0,1,0,0,0,0|3,0,0]=4 2692 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)Cl 527a_100000182051_100000692595 [0,1,0,0,0,0|3,0,0]=4 2693 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)F 240690a_100000182051_100000240043 [0,1,0,0,0,0|3,0,0]=4 2694 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)F 527a_100000182051_100000240043 [0,1,0,0,0,0|3,0,0]=4 2695 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)I 240690a_100000182051_100000688012 [0,1,0,0,0,0|3,0,0]=4 2696 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)I 527a_100000182051_100000688012 [0,1,0,0,0,0|3,0,0]=4 2697 B15R1.1380 Cc1ccc(cc1C(=O)NCCCO)O 240690a_100000182051_100000687834 [0,1,0,0,0,0|3,0,0]=4 2698 B15R1.1380 N#CCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000211468 [0,1,0,0,0,0|2,0,1]=4 2699 B15R1.1380 N#CCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000211468 [0,1,0,0,0,0|2,0,1]=4 2700 B15R1.1380 N#CCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000211468 [0,1,0,0,0,0|2,0,1]=4 2701 B15R1.1380 N#CCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000211468 [0,1,0,0,0,0|2,0,1]=4 2702 B15R1.1380 N#CCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000211468 [0,1,0,0,0,0|2,0,1]=4 2703 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Br 1626a_100000720768_100000212140 [0,1,0,0,0,0|2,0,1]=4 2704 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Br 240690a_100000720768_100000212140 [0,1,0,0,0,0|2,0,1]=4 2705 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Br 527a_100000720768_100000212140 [0,1,0,0,0,0|2,0,1]=4 2706 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Cl 11a_100000720768_100000212143 [0,1,0,0,0,0|2,0,1]=4 2707 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Cl 1626a_100000720768_100000212143 [0,1,0,0,0,0|2,0,1]=4 2708 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Cl 240690a_100000720768_100000212143 [0,1,0,0,0,0|2,0,1]=4 2709 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)Cl 527a_100000720768_100000212143 [0,1,0,0,0,0|2,0,1]=4 2710 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)F 240690a_100000720768_100000742286 [0,1,0,0,0,0|2,0,1]=4 2711 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)F 527a_100000720768_100000742286 [0,1,0,0,0,0|2,0,1]=4 2712 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)I 240690a_100000720768_100000212111 [0,1,0,0,0,0|2,0,1]=4 2713 B15R1.1380 N#CCCNC(=O)c1cc(ccc1O)I 527a_100000720768_100000212111 [0,1,0,0,0,0|2,0,1]=4 2714 B15R1.1380 NCCOCC(=O)c1cc(ccc1O)Br 34a_100000210304_200009828000 [0,1,0,0,0,0|3,0,0]=4 2715 B15R1.1380 NCCOCC(=O)c1cc(ccc1O)F 34a_100000210304_100009814381 [0,1,0,0,0,0|3,0,0]=4 2716 B15R1.1380 NCCOCC(=O)c1cc(ccc1O)O 34a_100000210304_100009814097 [0,1,0,0,0,0|3,0,0]=4 2717 B15R1.1380 O=C(CCCCF)c1cc(ccc1Br)Br 1458a_100000690610_100000729493 [0,1,0,0,0,0|3,0,0]=4 2718 B15R1.1380 O=C(CCCCF)c1cc(ccc1Br)Cl 1458a_100000736951_100000729493 [0,1,0,0,0,0|3,0,0]=4 2719 B15R1.1380 O=C(CCCCF)c1cc(ccc1Br)F 1458a_100000212315_100000729493 [0,1,0,0,0,0|3,0,0]=4 2720 B15R1.1380 O=C(CCCCF)c1cc(ccc1Br)I 1458a_100000698340_100000729493 [0,1,0,0,0,0|3,0,0]=4 2721 B15R1.1380 O=C(CCCCF)c1cc(ccc1Br)O 1458a_100012352043_100000729493 [0,1,0,0,0,0|3,0,0]=4 2722 B15R1.1380 O=C(CCCCF)c1cc(ccc1Cl)Br 1458a_100000211212_100000729493 [0,1,0,0,0,0|3,0,0]=4 2723 B15R1.1380 O=C(CCCCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100000729493 [0,1,0,0,0,0|3,0,0]=4 2724 B15R1.1380 O=C(CCCCF)c1cc(ccc1Cl)F 1458a_100011219680_100000729493 [0,1,0,0,0,0|3,0,0]=4 2725 B15R1.1380 O=C(CCCCF)c1cc(ccc1Cl)I 1458a_100000688013_100000729493 [0,1,0,0,0,0|3,0,0]=4 2726 B15R1.1380 O=C(CCCCF)c1cc(ccc1Cl)O 1458a_100000719527_100000729493 [0,1,0,0,0,0|3,0,0]=4 2727 B15R1.1380 O=C(CCCCF)c1cc(ccc1F)Br 1458a_100000212322_100000729493 [0,1,0,0,0,0|3,0,0]=4 2728 B15R1.1380 O=C(CCCCF)c1cc(ccc1F)Cl 1458a_100000214954_100000729493 [0,1,0,0,0,0|3,0,0]=4 2729 B15R1.1380 O=C(CCCCF)c1cc(ccc1F)F 1458a_100000198512_100000729493 [0,1,0,0,0,0|3,0,0]=4 2730 B15R1.1380 O=C(CCCCF)c1cc(ccc1F)I 1458a_100000688014_100000729493 [0,1,0,0,0,0|3,0,0]=4 2731 B15R1.1380 O=C(CCCCF)c1cc(ccc1F)O 1458a_100000037260_100000729493 [0,1,0,0,0,0|3,0,0]=4 2732 B15R1.1380 O=C(CCCCF)c1cc(ccc1I)Br 1458a_100000183945_100000729493 [0,1,0,0,0,0|3,0,0]=4 2733 B15R1.1380 O=C(CCCCF)c1cc(ccc1I)Cl 1458a_100000739379_100000729493 [0,1,0,0,0,0|3,0,0]=4 2734 B15R1.1380 O=C(CCCCF)c1cc(ccc1I)F 1458a_100000748905_100000729493 [0,1,0,0,0,0|3,0,0]=4 2735 B15R1.1380 O=C(CCCCF)c1cc(ccc1I)I 1458a_100000750460_100000729493 [0,1,0,0,0,0|3,0,0]=4 2736 B15R1.1380 O=C(CCCCF)c1cc(ccc1I)O 1458a_200009995701_100000729493 [0,1,0,0,0,0|3,0,0]=4 2737 B15R1.1380 O=C(CCCCF)c1cc(ccc1O)Br 1458a_100000212140_100000729493 [0,1,0,0,0,0|2,0,0]=3 2738 B15R1.1380 O=C(CCCCF)c1cc(ccc1O)Cl 1458a_100000212143_100000729493 [0,1,0,0,0,0|2,0,0]=3 2739 B15R1.1380 O=C(CCCCF)c1cc(ccc1O)F 1458a_100000742286_100000729493 [0,1,0,0,0,0|2,0,0]=3 2740 B15R1.1380 O=C(CCCCF)c1cc(ccc1O)I 1458a_100000212111_100000729493 [0,1,0,0,0,0|2,0,0]=3 2741 B15R1.1380 O=C(CCCCF)c1cc(ccc1O)O 1458a_100000758025_100000729493 [0,1,0,0,0,0|2,0,0]=3 2742 B15R1.1380 O=C(CCCCO)c1cc(ccc1Br)Br 1458a_100000690610_100000210776 [0,1,0,0,0,0|3,0,0]=4 2743 B15R1.1380 O=C(CCCCO)c1cc(ccc1Br)Cl 1458a_100000736951_100000210776 [0,1,0,0,0,0|3,0,0]=4 2744 B15R1.1380 O=C(CCCCO)c1cc(ccc1Br)F 1458a_100000212315_100000210776 [0,1,0,0,0,0|3,0,0]=4 2745 B15R1.1380 O=C(CCCCO)c1cc(ccc1Br)I 1458a_100000698340_100000210776 [0,1,0,0,0,0|3,0,0]=4 2746 B15R1.1380 O=C(CCCCO)c1cc(ccc1Br)O 1458a_100012352043_100000210776 [0,1,0,0,0,0|3,0,0]=4 2747 B15R1.1380 O=C(CCCCO)c1cc(ccc1Cl)Br 1458a_100000211212_100000210776 [0,1,0,0,0,0|3,0,0]=4 2748 B15R1.1380 O=C(CCCCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210776 [0,1,0,0,0,0|3,0,0]=4 2749 B15R1.1380 O=C(CCCCO)c1cc(ccc1Cl)F 1458a_100011219680_100000210776 [0,1,0,0,0,0|3,0,0]=4 2750 B15R1.1380 O=C(CCCCO)c1cc(ccc1Cl)I 1458a_100000688013_100000210776 [0,1,0,0,0,0|3,0,0]=4 2751 B15R1.1380 O=C(CCCCO)c1cc(ccc1Cl)O 1458a_100000719527_100000210776 [0,1,0,0,0,0|3,0,0]=4 2752 B15R1.1380 O=C(CCCCO)c1cc(ccc1F)Br 1458a_100000212322_100000210776 [0,1,0,0,0,0|3,0,0]=4 2753 B15R1.1380 O=C(CCCCO)c1cc(ccc1F)Cl 1458a_100000214954_100000210776 [0,1,0,0,0,0|3,0,0]=4 2754 B15R1.1380 O=C(CCCCO)c1cc(ccc1F)F 1458a_100000198512_100000210776 [0,1,0,0,0,0|3,0,0]=4 2755 B15R1.1380 O=C(CCCCO)c1cc(ccc1F)I 1458a_100000688014_100000210776 [0,1,0,0,0,0|3,0,0]=4 2756 B15R1.1380 O=C(CCCCO)c1cc(ccc1F)O 1458a_100000037260_100000210776 [0,1,0,0,0,0|3,0,0]=4 2757 B15R1.1380 O=C(CCCCO)c1cc(ccc1I)Br 1458a_100000183945_100000210776 [0,1,0,0,0,0|3,0,0]=4 2758 B15R1.1380 O=C(CCCCO)c1cc(ccc1I)Cl 1458a_100000739379_100000210776 [0,1,0,0,0,0|3,0,0]=4 2759 B15R1.1380 O=C(CCCCO)c1cc(ccc1I)F 1458a_100000748905_100000210776 [0,1,0,0,0,0|3,0,0]=4 2760 B15R1.1380 O=C(CCCCO)c1cc(ccc1I)I 1458a_100000750460_100000210776 [0,1,0,0,0,0|3,0,0]=4 2761 B15R1.1380 O=C(CCCCO)c1cc(ccc1I)O 1458a_200009995701_100000210776 [0,1,0,0,0,0|3,0,0]=4 2762 B15R1.1380 O=C(CCCCO)c1cc(ccc1O)Br 1458a_100000212140_100000210776 [0,1,0,0,0,0|2,0,0]=3 2763 B15R1.1380 O=C(CCCCO)c1cc(ccc1O)Cl 1458a_100000212143_100000210776 [0,1,0,0,0,0|2,0,0]=3 2764 B15R1.1380 O=C(CCCCO)c1cc(ccc1O)F 1458a_100000742286_100000210776 [0,1,0,0,0,0|2,0,0]=3 2765 B15R1.1380 O=C(CCCCO)c1cc(ccc1O)I 1458a_100000212111_100000210776 [0,1,0,0,0,0|2,0,0]=3 2766 B15R1.1380 O=C(CCCCO)c1cc(ccc1O)O 1458a_100000758025_100000210776 [0,1,0,0,0,0|2,0,0]=3 2767 B15R1.1380 O=C(CNCCF)c1cc(ccc1O)Br 34a_100000724931_200009828000 [0,1,0,0,0,0|3,0,0]=4 2768 B15R1.1380 O=C(CNCCF)c1cc(ccc1O)F 34a_100000724931_100009814381 [0,1,0,0,0,0|3,0,0]=4 2769 B15R1.1380 O=C(CNCCF)c1cc(ccc1O)O 34a_100000724931_100009814097 [0,1,0,0,0,0|3,0,0]=4 2770 B15R1.1380 O=C(CNCCO)c1cc(ccc1O)Br 34a_100016990907_200009828000 [0,1,0,0,0,0|3,0,0]=4 2771 B15R1.1380 O=C(CNCCO)c1cc(ccc1O)F 34a_100016990907_100009814381 [0,1,0,0,0,0|3,0,0]=4 2772 B15R1.1380 O=C(CNCCO)c1cc(ccc1O)O 34a_100016990907_100009814097 [0,1,0,0,0,0|3,0,0]=4 2773 B15R1.1380 O=C(COCCBr)c1cc(ccc1O)Br 34a_100000211926_200009828000 [0,1,0,0,0,0|3,0,0]=4 2774 B15R1.1380 O=C(COCCBr)c1cc(ccc1O)F 34a_100000211926_100009814381 [0,1,0,0,0,0|3,0,0]=4 2775 B15R1.1380 O=C(COCCBr)c1cc(ccc1O)O 34a_100000211926_100009814097 [0,1,0,0,0,0|3,0,0]=4 2776 B15R1.1380 O=C(CSCCF)c1cc(ccc1O)Br 62a_200009828000_100011217306 [0,1,0,0,0,0|3,0,0]=4 2777 B15R1.1380 O=C(CSCCF)c1cc(ccc1O)Cl 62a_200009816716_100011217306 [0,1,0,0,0,0|3,0,0]=4 2778 B15R1.1380 O=C(CSCCF)c1cc(ccc1O)F 62a_100009814381_100011217306 [0,1,0,0,0,0|3,0,0]=4 2779 B15R1.1380 O=C(CSCCF)c1cc(ccc1O)F 62a_100011217306_100009814381 [0,1,0,0,0,0|3,0,0]=4 2780 B15R1.1380 O=C(CSCCF)c1cc(ccc1O)O 62a_100009814097_100011217306 [0,1,0,0,0,0|3,0,0]=4 2781 B15R1.1380 O=C(CSCCF)c1cc(ccc1O)O 62a_100011217306_100009814097 [0,1,0,0,0,0|3,0,0]=4 2782 B15R1.1380 O=C(CSCCO)c1cc(ccc1O)Br 62a_200009828000_100000211926 [0,1,0,0,0,0|3,0,0]=4 2783 B15R1.1380 O=C(CSCCO)c1cc(ccc1O)Cl 62a_200009816716_100000211926 [0,1,0,0,0,0|3,0,0]=4 2784 B15R1.1380 O=C(CSCCO)c1cc(ccc1O)F 62a_100000211926_100009814381 [0,1,0,0,0,0|3,0,0]=4 2785 B15R1.1380 O=C(CSCCO)c1cc(ccc1O)F 62a_100009814381_100000211926 [0,1,0,0,0,0|3,0,0]=4 2786 B15R1.1380 O=C(CSCCO)c1cc(ccc1O)O 62a_100000211926_100009814097 [0,1,0,0,0,0|3,0,0]=4 2787 B15R1.1380 O=C(CSCCO)c1cc(ccc1O)O 62a_100009814097_100000211926 [0,1,0,0,0,0|3,0,0]=4 2788 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Br 11a_100015189416_100000690610 [0,1,0,0,0,0|3,0,0]=4 2789 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Br 1626a_100015189416_100000690610 [0,1,0,0,0,0|3,0,0]=4 2790 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Br 240690a_100015189416_100000690610 [0,1,0,0,0,0|3,0,0]=4 2791 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Br 527a_100015189416_100000690610 [0,1,0,0,0,0|3,0,0]=4 2792 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Cl 11a_100015189416_100000736951 [0,1,0,0,0,0|3,0,0]=4 2793 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Cl 1626a_100015189416_100000736951 [0,1,0,0,0,0|3,0,0]=4 2794 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Cl 240690a_100015189416_100000736951 [0,1,0,0,0,0|3,0,0]=4 2795 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)Cl 527a_100015189416_100000736951 [0,1,0,0,0,0|3,0,0]=4 2796 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)F 11a_100015189416_100000212315 [0,1,0,0,0,0|3,0,0]=4 2797 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)F 1626a_100015189416_100000212315 [0,1,0,0,0,0|3,0,0]=4 2798 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)F 240690a_100015189416_100000212315 [0,1,0,0,0,0|3,0,0]=4 2799 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)F 527a_100015189416_100000212315 [0,1,0,0,0,0|3,0,0]=4 2800 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)I 11a_100015189416_100000698340 [0,1,0,0,0,0|3,0,0]=4 2801 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)I 1626a_100015189416_100000698340 [0,1,0,0,0,0|3,0,0]=4 2802 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)I 240690a_100015189416_100000698340 [0,1,0,0,0,0|3,0,0]=4 2803 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)I 527a_100015189416_100000698340 [0,1,0,0,0,0|3,0,0]=4 2804 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)O 240690a_100015189416_100012352043 [0,1,0,0,0,0|3,0,0]=4 2805 B15R1.1380 O=C(NCCCF)c1cc(ccc1Br)O 527a_100015189416_100012352043 [0,1,0,0,0,0|3,0,0]=4 2806 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Br 11a_100015189416_100000211212 [0,1,0,0,0,0|3,0,0]=4 2807 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Br 1626a_100015189416_100000211212 [0,1,0,0,0,0|3,0,0]=4 2808 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Br 240690a_100015189416_100000211212 [0,1,0,0,0,0|3,0,0]=4 2809 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Br 527a_100015189416_100000211212 [0,1,0,0,0,0|3,0,0]=4 2810 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Cl 11a_100015189416_100000210642 [0,1,0,0,0,0|3,0,0]=4 2811 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Cl 1626a_100015189416_100000210642 [0,1,0,0,0,0|3,0,0]=4 2812 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Cl 240690a_100015189416_100000210642 [0,1,0,0,0,0|3,0,0]=4 2813 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)Cl 527a_100015189416_100000210642 [0,1,0,0,0,0|3,0,0]=4 2814 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)F 11a_100015189416_100011219680 [0,1,0,0,0,0|3,0,0]=4 2815 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)F 1626a_100015189416_100011219680 [0,1,0,0,0,0|3,0,0]=4 2816 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)F 240690a_100015189416_100011219680 [0,1,0,0,0,0|3,0,0]=4 2817 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)F 527a_100015189416_100011219680 [0,1,0,0,0,0|3,0,0]=4 2818 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)I 11a_100015189416_100000688013 [0,1,0,0,0,0|3,0,0]=4 2819 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)I 1626a_100015189416_100000688013 [0,1,0,0,0,0|3,0,0]=4 2820 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)I 240690a_100015189416_100000688013 [0,1,0,0,0,0|3,0,0]=4 2821 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)I 527a_100015189416_100000688013 [0,1,0,0,0,0|3,0,0]=4 2822 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)O 240690a_100015189416_100000719527 [0,1,0,0,0,0|3,0,0]=4 2823 B15R1.1380 O=C(NCCCF)c1cc(ccc1Cl)O 527a_100015189416_100000719527 [0,1,0,0,0,0|3,0,0]=4 2824 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Br 11a_100015189416_100000212322 [0,1,0,0,0,0|3,0,0]=4 2825 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Br 1626a_100015189416_100000212322 [0,1,0,0,0,0|3,0,0]=4 2826 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Br 240690a_100015189416_100000212322 [0,1,0,0,0,0|3,0,0]=4 2827 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Br 527a_100015189416_100000212322 [0,1,0,0,0,0|3,0,0]=4 2828 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Cl 11a_100015189416_100000214954 [0,1,0,0,0,0|3,0,0]=4 2829 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Cl 1626a_100015189416_100000214954 [0,1,0,0,0,0|3,0,0]=4 2830 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Cl 240690a_100015189416_100000214954 [0,1,0,0,0,0|3,0,0]=4 2831 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)Cl 527a_100015189416_100000214954 [0,1,0,0,0,0|3,0,0]=4 2832 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)F 11a_100015189416_100000198512 [0,1,0,0,0,0|3,0,0]=4 2833 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)F 1626a_100015189416_100000198512 [0,1,0,0,0,0|3,0,0]=4 2834 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)F 240690a_100015189416_100000198512 [0,1,0,0,0,0|3,0,0]=4 2835 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)F 527a_100015189416_100000198512 [0,1,0,0,0,0|3,0,0]=4 2836 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)I 11a_100015189416_100000688014 [0,1,0,0,0,0|3,0,0]=4 2837 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)I 1626a_100015189416_100000688014 [0,1,0,0,0,0|3,0,0]=4 2838 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)I 240690a_100015189416_100000688014 [0,1,0,0,0,0|3,0,0]=4 2839 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)I 527a_100015189416_100000688014 [0,1,0,0,0,0|3,0,0]=4 2840 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)O 240690a_100015189416_100000037260 [0,1,0,0,0,0|3,0,0]=4 2841 B15R1.1380 O=C(NCCCF)c1cc(ccc1F)O 527a_100015189416_100000037260 [0,1,0,0,0,0|3,0,0]=4 2842 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Br 11a_100015189416_100000183945 [0,1,0,0,0,0|3,0,0]=4 2843 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Br 1626a_100015189416_100000183945 [0,1,0,0,0,0|3,0,0]=4 2844 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Br 240690a_100015189416_100000183945 [0,1,0,0,0,0|3,0,0]=4 2845 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Cl 11a_100015189416_100000739379 [0,1,0,0,0,0|3,0,0]=4 2846 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Cl 1626a_100015189416_100000739379 [0,1,0,0,0,0|3,0,0]=4 2847 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Cl 240690a_100015189416_100000739379 [0,1,0,0,0,0|3,0,0]=4 2848 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)Cl 527a_100015189416_100000739379 [0,1,0,0,0,0|3,0,0]=4 2849 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)F 11a_100015189416_100000748905 [0,1,0,0,0,0|3,0,0]=4 2850 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)F 1626a_100015189416_100000748905 [0,1,0,0,0,0|3,0,0]=4 2851 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)F 240690a_100015189416_100000748905 [0,1,0,0,0,0|3,0,0]=4 2852 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)F 527a_100015189416_100000748905 [0,1,0,0,0,0|3,0,0]=4 2853 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)I 11a_100015189416_100000750460 [0,1,0,0,0,0|3,0,0]=4 2854 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)I 1626a_100015189416_100000750460 [0,1,0,0,0,0|3,0,0]=4 2855 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)I 240690a_100015189416_100000750460 [0,1,0,0,0,0|3,0,0]=4 2856 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)I 527a_100015189416_100000750460 [0,1,0,0,0,0|3,0,0]=4 2857 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)O 1626a_100015189416_200009995701 [0,1,0,0,0,0|3,0,0]=4 2858 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)O 240690a_100015189416_200009995701 [0,1,0,0,0,0|3,0,0]=4 2859 B15R1.1380 O=C(NCCCF)c1cc(ccc1I)O 527a_100015189416_200009995701 [0,1,0,0,0,0|3,0,0]=4 2860 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Br 1626a_100015189416_100000212140 [0,1,0,0,0,0|2,0,0]=3 2861 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Br 240690a_100015189416_100000212140 [0,1,0,0,0,0|2,0,0]=3 2862 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Br 527a_100015189416_100000212140 [0,1,0,0,0,0|2,0,0]=3 2863 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Cl 11a_100015189416_100000212143 [0,1,0,0,0,0|2,0,0]=3 2864 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Cl 1626a_100015189416_100000212143 [0,1,0,0,0,0|2,0,0]=3 2865 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Cl 240690a_100015189416_100000212143 [0,1,0,0,0,0|2,0,0]=3 2866 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)Cl 527a_100015189416_100000212143 [0,1,0,0,0,0|2,0,0]=3 2867 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)F 240690a_100015189416_100000742286 [0,1,0,0,0,0|2,0,0]=3 2868 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)F 527a_100015189416_100000742286 [0,1,0,0,0,0|2,0,0]=3 2869 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)I 240690a_100015189416_100000212111 [0,1,0,0,0,0|2,0,0]=3 2870 B15R1.1380 O=C(NCCCF)c1cc(ccc1O)I 527a_100015189416_100000212111 [0,1,0,0,0,0|2,0,0]=3 2871 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)Br 240690a_100000182051_100000690610 [0,1,0,0,0,0|3,0,0]=4 2872 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)Br 527a_100000182051_100000690610 [0,1,0,0,0,0|3,0,0]=4 2873 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)Cl 240690a_100000182051_100000736951 [0,1,0,0,0,0|3,0,0]=4 2874 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)Cl 527a_100000182051_100000736951 [0,1,0,0,0,0|3,0,0]=4 2875 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)F 240690a_100000182051_100000212315 [0,1,0,0,0,0|3,0,0]=4 2876 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)F 527a_100000182051_100000212315 [0,1,0,0,0,0|3,0,0]=4 2877 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)I 240690a_100000182051_100000698340 [0,1,0,0,0,0|3,0,0]=4 2878 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)I 527a_100000182051_100000698340 [0,1,0,0,0,0|3,0,0]=4 2879 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)O 240690a_100000182051_100012352043 [0,1,0,0,0,0|3,0,0]=4 2880 B15R1.1380 O=C(NCCCO)c1cc(ccc1Br)O 527a_100000182051_100012352043 [0,1,0,0,0,0|3,0,0]=4 2881 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)Br 240690a_100000182051_100000211212 [0,1,0,0,0,0|3,0,0]=4 2882 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)Br 527a_100000182051_100000211212 [0,1,0,0,0,0|3,0,0]=4 2883 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)Cl 240690a_100000182051_100000210642 [0,1,0,0,0,0|3,0,0]=4 2884 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)Cl 527a_100000182051_100000210642 [0,1,0,0,0,0|3,0,0]=4 2885 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)F 240690a_100000182051_100011219680 [0,1,0,0,0,0|3,0,0]=4 2886 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)F 527a_100000182051_100011219680 [0,1,0,0,0,0|3,0,0]=4 2887 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)I 240690a_100000182051_100000688013 [0,1,0,0,0,0|3,0,0]=4 2888 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)I 527a_100000182051_100000688013 [0,1,0,0,0,0|3,0,0]=4 2889 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)O 240690a_100000182051_100000719527 [0,1,0,0,0,0|3,0,0]=4 2890 B15R1.1380 O=C(NCCCO)c1cc(ccc1Cl)O 527a_100000182051_100000719527 [0,1,0,0,0,0|3,0,0]=4 2891 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)Br 240690a_100000182051_100000212322 [0,1,0,0,0,0|3,0,0]=4 2892 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)Br 527a_100000182051_100000212322 [0,1,0,0,0,0|3,0,0]=4 2893 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)Cl 240690a_100000182051_100000214954 [0,1,0,0,0,0|3,0,0]=4 2894 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)Cl 527a_100000182051_100000214954 [0,1,0,0,0,0|3,0,0]=4 2895 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)F 240690a_100000182051_100000198512 [0,1,0,0,0,0|3,0,0]=4 2896 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)F 527a_100000182051_100000198512 [0,1,0,0,0,0|3,0,0]=4 2897 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)I 240690a_100000182051_100000688014 [0,1,0,0,0,0|3,0,0]=4 2898 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)I 527a_100000182051_100000688014 [0,1,0,0,0,0|3,0,0]=4 2899 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)O 240690a_100000182051_100000037260 [0,1,0,0,0,0|3,0,0]=4 2900 B15R1.1380 O=C(NCCCO)c1cc(ccc1F)O 527a_100000182051_100000037260 [0,1,0,0,0,0|3,0,0]=4 2901 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)Br 240690a_100000182051_100000183945 [0,1,0,0,0,0|3,0,0]=4 2902 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)Cl 240690a_100000182051_100000739379 [0,1,0,0,0,0|3,0,0]=4 2903 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)Cl 527a_100000182051_100000739379 [0,1,0,0,0,0|3,0,0]=4 2904 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)F 240690a_100000182051_100000748905 [0,1,0,0,0,0|3,0,0]=4 2905 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)F 527a_100000182051_100000748905 [0,1,0,0,0,0|3,0,0]=4 2906 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)I 240690a_100000182051_100000750460 [0,1,0,0,0,0|3,0,0]=4 2907 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)I 527a_100000182051_100000750460 [0,1,0,0,0,0|3,0,0]=4 2908 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)O 240690a_100000182051_200009995701 [0,1,0,0,0,0|3,0,0]=4 2909 B15R1.1380 O=C(NCCCO)c1cc(ccc1I)O 527a_100000182051_200009995701 [0,1,0,0,0,0|3,0,0]=4 2910 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)Br 240690a_100000182051_100000212140 [0,1,0,0,0,0|2,0,0]=3 2911 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)Br 527a_100000182051_100000212140 [0,1,0,0,0,0|2,0,0]=3 2912 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)Cl 240690a_100000182051_100000212143 [0,1,0,0,0,0|2,0,0]=3 2913 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)Cl 527a_100000182051_100000212143 [0,1,0,0,0,0|2,0,0]=3 2914 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)F 240690a_100000182051_100000742286 [0,1,0,0,0,0|2,0,0]=3 2915 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)F 527a_100000182051_100000742286 [0,1,0,0,0,0|2,0,0]=3 2916 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)I 240690a_100000182051_100000212111 [0,1,0,0,0,0|2,0,0]=3 2917 B15R1.1380 O=C(NCCCO)c1cc(ccc1O)I 527a_100000182051_100000212111 [0,1,0,0,0,0|2,0,0]=3 2918 B15R1.1380 O=C(NNCCO)c1cc(ccc1O)Br 22a_100000210001_100000212140 [0,1,0,0,0,0|3,0,0]=4 2919 B15R1.1380 O=C(NNCCO)c1cc(ccc1O)Cl 22a_100000210001_100000212143 [0,1,0,0,0,0|3,0,0]=4 2920 B15R1.1380 O=C(NNCCO)c1cc(ccc1O)F 22a_100000210001_100000742286 [0,1,0,0,0,0|3,0,0]=4 2921 B15R1.1380 O=C(NNCCO)c1cc(ccc1O)I 22a_100000210001_100000212111 [0,1,0,0,0,0|3,0,0]=4 2922 B15R1.1380 [13CH3]OCCNC(=O)c1cc(ccc1Br)F 34a_200000206141_200025704644 [0,1,0,0,0,0|3,0,0]=4 2923 B15R1.1380 [13CH3]OCCNC(=O)c1cc(ccc1Br)F 7a_200000206141_200025704644 [0,1,0,0,0,0|3,0,0]=4 2924 B15R1.1402 C#CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000731252 [0,1,0,0,0,0|1,0,2]=4 2925 B15R1.1402 C#CCCCC(=O)c1ccccc1OC 1458a_100000185835_100000731252 [0,1,0,0,0,0|1,0,2]=4 2926 B15R1.1402 C#CCCNC(=O)c1ccccc1OC 11a_100000755551_100000185835 [0,1,0,0,0,0|1,0,2]=4 2927 B15R1.1402 C#CCCNC(=O)c1ccccc1OC 1626a_100000755551_100000185835 [0,1,0,0,0,0|1,0,2]=4 2928 B15R1.1402 C#CCCNC(=O)c1ccccc1OC 240690a_100000755551_100000185835 [0,1,0,0,0,0|1,0,2]=4 2929 B15R1.1402 C#CCCNC(=O)c1ccccc1OC 527a_100000755551_100000185835 [0,1,0,0,0,0|1,0,2]=4 2930 B15R1.1402 C#Cc1ccccc1C(=O)CCCCC 1458a_100011243808_100000210326 [0,1,0,0,0,0|2,0,0]=3 2931 B15R1.1402 C#Cc1ccccc1C(=O)CCCCF 1458a_100011243808_100000729493 [0,1,0,0,0,0|3,0,0]=4 2932 B15R1.1402 C#Cc1ccccc1C(=O)CCCCO 1458a_100011243808_100000210776 [0,1,0,0,0,0|3,0,0]=4 2933 B15R1.1402 C#Cc1ccccc1C(=O)CCCOC 1458a_100011243808_100000740836 [0,1,0,0,0,0|3,0,0]=4 2934 B15R1.1402 C#Cc1ccccc1C(=O)CCOCC 1458a_100011243808_100011215890 [0,1,0,0,0,0|3,0,0]=4 2935 B15R1.1402 C#Cc1ccccc1C(=O)CCSCC 1458a_100011243808_100000757381 [0,1,0,0,0,0|3,0,0]=4 2936 B15R1.1402 C#Cc1ccccc1C(=O)NCCCC 527a_100000102301_100011243808 [0,1,0,0,0,0|2,0,0]=3 2937 B15R1.1402 C#Cc1ccccc1C(=O)NCCCF 527a_100015189416_100011243808 [0,1,0,0,0,0|3,0,0]=4 2938 B15R1.1402 C#Cc1ccccc1C(=O)NCCCO 527a_100000182051_100011243808 [0,1,0,0,0,0|3,0,0]=4 2939 B15R1.1402 C#Cc1ccccc1C(=O)NCCOC 527a_100000209980_100011243808 [0,1,0,0,0,0|3,0,0]=4 2940 B15R1.1402 C#Cc1ccccc1C(=O)NCCSC 527a_100020590264_100011243808 [0,1,0,0,0,0|3,0,0]=4 2941 B15R1.1402 C#Cc1ccccc1C(=O)NNCCC 22a_100000740057_100011243808 [0,1,0,0,0,0|3,0,0]=4 2942 B15R1.1402 C=CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000757094 [0,1,0,0,0,0|1,0,2]=4 2943 B15R1.1402 C=CCCCC(=O)c1ccccc1OC 1458a_100000185835_100000757094 [0,1,0,0,0,0|1,0,2]=4 2944 B15R1.1402 C=CCCNC(=O)c1ccccc1OC 11a_100015191253_100000185835 [0,1,0,0,0,0|1,0,2]=4 2945 B15R1.1402 C=CCCNC(=O)c1ccccc1OC 1626a_100015191253_100000185835 [0,1,0,0,0,0|1,0,2]=4 2946 B15R1.1402 C=CCCNC(=O)c1ccccc1OC 240690a_100015191253_100000185835 [0,1,0,0,0,0|1,0,2]=4 2947 B15R1.1402 C=CCCNC(=O)c1ccccc1OC 527a_100015191253_100000185835 [0,1,0,0,0,0|1,0,2]=4 2948 B15R1.1402 C=Cc1ccccc1C(=O)CCCCC 1458a_100011830265_100000210326 [0,1,0,0,0,0|2,0,0]=3 2949 B15R1.1402 C=Cc1ccccc1C(=O)CCCCF 1458a_100011830265_100000729493 [0,1,0,0,0,0|3,0,0]=4 2950 B15R1.1402 C=Cc1ccccc1C(=O)CCCCO 1458a_100011830265_100000210776 [0,1,0,0,0,0|3,0,0]=4 2951 B15R1.1402 C=Cc1ccccc1C(=O)CCCOC 1458a_100011830265_100000740836 [0,1,0,0,0,0|3,0,0]=4 2952 B15R1.1402 C=Cc1ccccc1C(=O)CCOCC 1458a_100011830265_100011215890 [0,1,0,0,0,0|3,0,0]=4 2953 B15R1.1402 C=Cc1ccccc1C(=O)CCSCC 1458a_100011830265_100000757381 [0,1,0,0,0,0|3,0,0]=4 2954 B15R1.1402 C=Cc1ccccc1C(=O)NCCCC 1626a_100000102301_100011830265 [0,1,0,0,0,0|2,0,0]=3 2955 B15R1.1402 C=Cc1ccccc1C(=O)NCCCC 271570a_100011290941_200000154865 [0,1,0,0,0,0|2,0,0]=3 2956 B15R1.1402 C=Cc1ccccc1C(=O)NCCCF 1626a_100015189416_100011830265 [0,1,0,0,0,0|3,0,0]=4 2957 B15R1.1402 C=Cc1ccccc1C(=O)NCCOC 1626a_100000209980_100011830265 [0,1,0,0,0,0|3,0,0]=4 2958 B15R1.1402 C=Cc1ccccc1C(=O)NCCSC 1626a_100020590264_100011830265 [0,1,0,0,0,0|3,0,0]=4 2959 B15R1.1402 C=Cc1ccccc1C(=O)NNCCC 22a_100000740057_100011830265 [0,1,0,0,0,0|3,0,0]=4 2960 B15R1.1402 CC#CCNC(=O)c1ccccc1OC 11a_100000685387_100000185835 [0,1,0,0,0,0|1,0,2]=4 2961 B15R1.1402 CC#CCNC(=O)c1ccccc1OC 1626a_100000685387_100000185835 [0,1,0,0,0,0|1,0,2]=4 2962 B15R1.1402 CC#CCNC(=O)c1ccccc1OC 527a_100000685387_100000185835 [0,1,0,0,0,0|1,0,2]=4 2963 B15R1.1402 CC/C=C\CC(=O)c1ccccc1CO 1458a_100011301526_100103147603 [0,1,0,0,0,0|1,0,2]=4 2964 B15R1.1402 CC/C=C\CC(=O)c1ccccc1OC 1458a_100000185835_100103147603 [0,1,0,0,0,0|1,0,2]=4 2965 B15R1.1402 CCC#CCC(=O)c1ccccc1CO 1458a_100011301526_100009813939 [0,1,0,0,0,0|1,0,2]=4 2966 B15R1.1402 CCC#CCC(=O)c1ccccc1OC 1458a_100000185835_100009813939 [0,1,0,0,0,0|1,0,2]=4 2967 B15R1.1402 CCC=NNC(=O)c1ccccc1OC 4a_100000189102_100000210100 [0,1,0,0,0,0|2,0,1]=4 2968 B15R1.1402 CCCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210326 [0,1,0,0,0,0|2,0,0]=3 2969 B15R1.1402 CCCCCC(=O)c1ccccc1CC 1458a_100000689120_100000210326 [0,1,0,0,0,0|2,0,0]=3 2970 B15R1.1402 CCCCCC(=O)c1ccccc1CO 1458a_100011301526_100000210326 [0,1,0,0,0,0|1,0,0]=2 2971 B15R1.1402 CCCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210326 [0,1,0,0,0,0|1,0,1]=3 2972 B15R1.1402 CCCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210326 [0,1,0,0,0,0|1,0,0]=2 2973 B15R1.1402 CCCCCC(=O)c1ccccc1SC 1458a_100000183967_100000210326 [0,1,0,0,0,0|1,1,0]=3 2974 B15R1.1402 CCCCCN(C)c1ccccc1OC 2230a_100000219746_100000210326 [0,1,0,0,0,0|3,0,0]=4 2975 B15R1.1402 CCCCCN(C)c1ccccc1OC 269982a_100000219746_100000210215 [0,1,0,0,0,0|3,0,0]=4 2976 B15R1.1402 CCCCCN(C)c1ccccc1OC 34a_100000219746_100000718602 [0,1,0,0,0,0|3,0,0]=4 2977 B15R1.1402 CCCCNC(=O)c1ccccc1C#N 11a_100000102301_100000742908 [0,1,0,0,0,0|2,0,0]=3 2978 B15R1.1402 CCCCNC(=O)c1ccccc1C#N 1626a_100000102301_100000742908 [0,1,0,0,0,0|2,0,0]=3 2979 B15R1.1402 CCCCNC(=O)c1ccccc1C#N 527a_100000102301_100000742908 [0,1,0,0,0,0|2,0,0]=3 2980 B15R1.1402 CCCCNC(=O)c1ccccc1CC 11a_100000102301_100000689120 [0,1,0,0,0,0|2,0,0]=3 2981 B15R1.1402 CCCCNC(=O)c1ccccc1CC 1626a_100000102301_100000689120 [0,1,0,0,0,0|2,0,0]=3 2982 B15R1.1402 CCCCNC(=O)c1ccccc1CC 240690a_100000102301_100000689120 [0,1,0,0,0,0|2,0,0]=3 2983 B15R1.1402 CCCCNC(=O)c1ccccc1CC 527a_100000102301_100000689120 [0,1,0,0,0,0|2,0,0]=3 2984 B15R1.1402 CCCCNC(=O)c1ccccc1I=O 1626a_100000102301_100000032414 [0,1,0,0,0,0|1,0,1]=3 2985 B15R1.1402 CCCCNC(=O)c1ccccc1I=O 240690a_100000102301_100000032414 [0,1,0,0,0,0|1,0,1]=3 2986 B15R1.1402 CCCCNC(=O)c1ccccc1I=O 527a_100000102301_100000032414 [0,1,0,0,0,0|1,0,1]=3 2987 B15R1.1402 CCCCNC(=O)c1ccccc1NC 2230a_100000243867_200000210301 [0,1,0,0,0,0|2,0,0]=3 2988 B15R1.1402 CCCCNC(=O)c1ccccc1NC 27a_100102657272_200000154865 [0,1,0,0,0,0|2,0,0]=3 2989 B15R1.1402 CCCCNC(=O)c1ccccc1NC 34a_100000243867_200000210301 [0,1,0,0,0,0|2,0,0]=3 2990 B15R1.1402 CCCCNC(=O)c1ccccc1N[13CH3] 2230a_100000243867_200025704644 [0,1,0,0,0,0|2,0,0]=3 2991 B15R1.1402 CCCCNC(=O)c1ccccc1N[13CH3] 34a_100000243867_200025704644 [0,1,0,0,0,0|2,0,0]=3 2992 B15R1.1402 CCCCNC(=O)c1ccccc1OC 11a_100000102301_100000185835 [0,1,0,0,0,0|1,0,0]=2 2993 B15R1.1402 CCCCNC(=O)c1ccccc1OC 1626a_100000102301_100000185835 [0,1,0,0,0,0|1,0,0]=2 2994 B15R1.1402 CCCCNC(=O)c1ccccc1OC 240690a_100000102301_100000185835 [0,1,0,0,0,0|1,0,0]=2 2995 B15R1.1402 CCCCNC(=O)c1ccccc1OC 527a_100000102301_100000185835 [0,1,0,0,0,0|1,0,0]=2 2996 B15R1.1402 CCCCNC(=O)c1ccccc1SC 11a_100000102301_100000183967 [0,1,0,0,0,0|1,1,0]=3 2997 B15R1.1402 CCCCNC(=O)c1ccccc1SC 1626a_100000102301_100000183967 [0,1,0,0,0,0|1,1,0]=3 2998 B15R1.1402 CCCCNC(=O)c1ccccc1SC 240690a_100000102301_100000183967 [0,1,0,0,0,0|1,1,0]=3 2999 B15R1.1402 CCCCNC(=O)c1ccccc1SC 527a_100000102301_100000183967 [0,1,0,0,0,0|1,1,0]=3 3000 B15R1.1402 CCCCNC(=O)c1ccccc1SC 62a_200000154865_200000210301 [0,1,0,0,0,0|1,1,0]=3 3001 B15R1.1402 CCCCNC(=O)c1ccccc1SC 62a_200000210301_200000154865 [0,1,0,0,0,0|1,1,0]=3 3002 B15R1.1402 CCCCNC(=O)c1ccccc1S[13CH3] 62a_200000154865_200025704644 [0,1,0,0,0,0|1,1,0]=3 3003 B15R1.1402 CCCCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000154865 [0,1,0,0,0,0|1,1,0]=3 3004 B15R1.1402 CCCCNC(C)c1ccccc1OC 2230a_100000185323_100000210211 [0,1,0,0,0,0|2,0,1]=4 3005 B15R1.1402 CCCCNC(C)c1ccccc1OC 269862a_100000102301_100000173324 [0,1,0,0,0,0|2,0,1]=4 3006 B15R1.1402 CCCCOC(=O)c1ccccc1OC 7a_100011204317_200000210301 [0,1,0,0,0,0|0,0,0]=1 3007 B15R1.1402 CCCCOC(=O)c1ccccc1O[13CH3] 7a_100011204317_200025704644 [0,1,0,0,0,0|0,0,0]=1 3008 B15R1.1402 CCCCOC(C)c1ccccc1OC 7a_100000742714_100000210211 [0,1,0,0,0,0|1,0,1]=3 3009 B15R1.1402 CCCNN=C(C)c1ccccc1OC 4a_100000740057_100000173324 [0,1,0,0,0,0|3,0,0]=4 3010 B15R1.1402 CCCNNC(=O)c1ccccc1C#N 22a_100000740057_100000742908 [0,1,0,0,0,0|3,0,0]=4 3011 B15R1.1402 CCCNNC(=O)c1ccccc1CC 22a_100000740057_100000689120 [0,1,0,0,0,0|3,0,0]=4 3012 B15R1.1402 CCCNNC(=O)c1ccccc1I=O 22a_100000740057_100000032414 [0,1,0,0,0,0|2,0,1]=4 3013 B15R1.1402 CCCNNC(=O)c1ccccc1OC 22a_100000740057_100000185835 [0,1,0,0,0,0|2,0,0]=3 3014 B15R1.1402 CCCNNC(=O)c1ccccc1SC 22a_100000740057_100000183967 [0,1,0,0,0,0|2,1,0]=4 3015 B15R1.1402 CCCOCC(=O)c1ccccc1OC 34a_100000210258_100000195505 [0,1,0,0,0,0|2,0,0]=3 3016 B15R1.1402 CCCSCC(=O)c1ccccc1OC 62a_100000195505_100000210303 [0,1,0,0,0,0|2,0,0]=3 3017 B15R1.1402 CCOCCC(=O)c1ccccc1C#N 1458a_100000742908_100011215890 [0,1,0,0,0,0|3,0,0]=4 3018 B15R1.1402 CCOCCC(=O)c1ccccc1CC 1458a_100000689120_100011215890 [0,1,0,0,0,0|3,0,0]=4 3019 B15R1.1402 CCOCCC(=O)c1ccccc1CO 1458a_100011301526_100011215890 [0,1,0,0,0,0|2,0,0]=3 3020 B15R1.1402 CCOCCC(=O)c1ccccc1I=O 1458a_100000032414_100011215890 [0,1,0,0,0,0|2,0,1]=4 3021 B15R1.1402 CCOCCC(=O)c1ccccc1OC 1458a_100000185835_100011215890 [0,1,0,0,0,0|2,0,0]=3 3022 B15R1.1402 CCOCCC(=O)c1ccccc1SC 1458a_100000183967_100011215890 [0,1,0,0,0,0|2,1,0]=4 3023 B15R1.1402 CCSCCC(=O)c1ccccc1C#N 1458a_100000742908_100000757381 [0,1,0,0,0,0|3,0,0]=4 3024 B15R1.1402 CCSCCC(=O)c1ccccc1CC 1458a_100000689120_100000757381 [0,1,0,0,0,0|3,0,0]=4 3025 B15R1.1402 CCSCCC(=O)c1ccccc1CO 1458a_100011301526_100000757381 [0,1,0,0,0,0|2,0,0]=3 3026 B15R1.1402 CCSCCC(=O)c1ccccc1I=O 1458a_100000032414_100000757381 [0,1,0,0,0,0|2,0,1]=4 3027 B15R1.1402 CCSCCC(=O)c1ccccc1OC 1458a_100000185835_100000757381 [0,1,0,0,0,0|2,0,0]=3 3028 B15R1.1402 CCSCCC(=O)c1ccccc1SC 1458a_100000183967_100000757381 [0,1,0,0,0,0|2,1,0]=4 3029 B15R1.1402 CCc1ccccc1C(=O)CCCCF 1458a_100000689120_100000729493 [0,1,0,0,0,0|3,0,0]=4 3030 B15R1.1402 CCc1ccccc1C(=O)CCCCO 1458a_100000689120_100000210776 [0,1,0,0,0,0|3,0,0]=4 3031 B15R1.1402 CCc1ccccc1C(=O)CCCOC 1458a_100000689120_100000740836 [0,1,0,0,0,0|3,0,0]=4 3032 B15R1.1402 CCc1ccccc1C(=O)NCCCF 11a_100015189416_100000689120 [0,1,0,0,0,0|3,0,0]=4 3033 B15R1.1402 CCc1ccccc1C(=O)NCCCF 1626a_100015189416_100000689120 [0,1,0,0,0,0|3,0,0]=4 3034 B15R1.1402 CCc1ccccc1C(=O)NCCCF 240690a_100015189416_100000689120 [0,1,0,0,0,0|3,0,0]=4 3035 B15R1.1402 CCc1ccccc1C(=O)NCCCF 527a_100015189416_100000689120 [0,1,0,0,0,0|3,0,0]=4 3036 B15R1.1402 CCc1ccccc1C(=O)NCCCO 240690a_100000182051_100000689120 [0,1,0,0,0,0|3,0,0]=4 3037 B15R1.1402 CCc1ccccc1C(=O)NCCCO 527a_100000182051_100000689120 [0,1,0,0,0,0|3,0,0]=4 3038 B15R1.1402 CCc1ccccc1C(=O)NCCOC 1626a_100000209980_100000689120 [0,1,0,0,0,0|3,0,0]=4 3039 B15R1.1402 CCc1ccccc1C(=O)NCCOC 240690a_100000209980_100000689120 [0,1,0,0,0,0|3,0,0]=4 3040 B15R1.1402 CCc1ccccc1C(=O)NCCOC 527a_100000209980_100000689120 [0,1,0,0,0,0|3,0,0]=4 3041 B15R1.1402 CCc1ccccc1C(=O)NCCSC 11a_100020590264_100000689120 [0,1,0,0,0,0|3,0,0]=4 3042 B15R1.1402 CCc1ccccc1C(=O)NCCSC 1626a_100020590264_100000689120 [0,1,0,0,0,0|3,0,0]=4 3043 B15R1.1402 CCc1ccccc1C(=O)NCCSC 240690a_100020590264_100000689120 [0,1,0,0,0,0|3,0,0]=4 3044 B15R1.1402 CCc1ccccc1C(=O)NCCSC 527a_100020590264_100000689120 [0,1,0,0,0,0|3,0,0]=4 3045 B15R1.1402 CNc1ccccc1C(=O)NCCCO 34a_200011191992_200000210301 [0,1,0,0,0,0|3,0,0]=4 3046 B15R1.1402 COCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000740836 [0,1,0,0,0,0|3,0,0]=4 3047 B15R1.1402 COCCCC(=O)c1ccccc1CO 1458a_100011301526_100000740836 [0,1,0,0,0,0|2,0,0]=3 3048 B15R1.1402 COCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000740836 [0,1,0,0,0,0|2,0,1]=4 3049 B15R1.1402 COCCCC(=O)c1ccccc1OC 1458a_100000185835_100000740836 [0,1,0,0,0,0|2,0,0]=3 3050 B15R1.1402 COCCCC(=O)c1ccccc1SC 1458a_100000183967_100000740836 [0,1,0,0,0,0|2,1,0]=4 3051 B15R1.1402 COCCNC(=O)c1ccccc1C#N 1626a_100000209980_100000742908 [0,1,0,0,0,0|3,0,0]=4 3052 B15R1.1402 COCCNC(=O)c1ccccc1C#N 527a_100000209980_100000742908 [0,1,0,0,0,0|3,0,0]=4 3053 B15R1.1402 COCCNC(=O)c1ccccc1I=O 1626a_100000209980_100000032414 [0,1,0,0,0,0|2,0,1]=4 3054 B15R1.1402 COCCNC(=O)c1ccccc1I=O 240690a_100000209980_100000032414 [0,1,0,0,0,0|2,0,1]=4 3055 B15R1.1402 COCCNC(=O)c1ccccc1I=O 527a_100000209980_100000032414 [0,1,0,0,0,0|2,0,1]=4 3056 B15R1.1402 COCCNC(=O)c1ccccc1OC 1626a_100000209980_100000185835 [0,1,0,0,0,0|2,0,0]=3 3057 B15R1.1402 COCCNC(=O)c1ccccc1OC 240690a_100000209980_100000185835 [0,1,0,0,0,0|2,0,0]=3 3058 B15R1.1402 COCCNC(=O)c1ccccc1OC 527a_100000209980_100000185835 [0,1,0,0,0,0|2,0,0]=3 3059 B15R1.1402 COCCNC(=O)c1ccccc1SC 1626a_100000209980_100000183967 [0,1,0,0,0,0|2,1,0]=4 3060 B15R1.1402 COCCNC(=O)c1ccccc1SC 240690a_100000209980_100000183967 [0,1,0,0,0,0|2,1,0]=4 3061 B15R1.1402 COCCNC(=O)c1ccccc1SC 527a_100000209980_100000183967 [0,1,0,0,0,0|2,1,0]=4 3062 B15R1.1402 COCCOC(C)c1ccccc1OC 7a_100000742714_100000233755 [0,1,0,0,0,0|2,0,1]=4 3063 B15R1.1402 COCSCC(=O)c1ccccc1OC 62a_100000195505_100000766300 [0,1,0,0,0,0|3,0,0]=4 3064 B15R1.1402 COc1ccccc1C(=O)CCCC#N 1458a_100000185835_100000211468 [0,1,0,0,0,0|2,0,1]=4 3065 B15R1.1402 COc1ccccc1C(=O)CCCCF 1458a_100000185835_100000729493 [0,1,0,0,0,0|2,0,0]=3 3066 B15R1.1402 COc1ccccc1C(=O)CCCCO 1458a_100000185835_100000210776 [0,1,0,0,0,0|2,0,0]=3 3067 B15R1.1402 COc1ccccc1C(=O)CNCCF 34a_100000724931_100000195505 [0,1,0,0,0,0|3,0,0]=4 3068 B15R1.1402 COc1ccccc1C(=O)CNCCO 34a_100016990907_100000195505 [0,1,0,0,0,0|3,0,0]=4 3069 B15R1.1402 COc1ccccc1C(=O)COCCBr 34a_100000211926_100000195505 [0,1,0,0,0,0|3,0,0]=4 3070 B15R1.1402 COc1ccccc1C(=O)COCCN 34a_100000210304_100000195505 [0,1,0,0,0,0|3,0,0]=4 3071 B15R1.1402 COc1ccccc1C(=O)CSCCF 62a_100000195505_100011217306 [0,1,0,0,0,0|3,0,0]=4 3072 B15R1.1402 COc1ccccc1C(=O)CSCCO 62a_100000195505_100000211926 [0,1,0,0,0,0|3,0,0]=4 3073 B15R1.1402 COc1ccccc1C(=O)CSCSC 62a_100000195505_100011218213 [0,1,0,0,0,0|3,0,0]=4 3074 B15R1.1402 COc1ccccc1C(=O)NCCC#N 11a_100000720768_100000185835 [0,1,0,0,0,0|2,0,1]=4 3075 B15R1.1402 COc1ccccc1C(=O)NCCC#N 1626a_100000720768_100000185835 [0,1,0,0,0,0|2,0,1]=4 3076 B15R1.1402 COc1ccccc1C(=O)NCCC#N 240690a_100000720768_100000185835 [0,1,0,0,0,0|2,0,1]=4 3077 B15R1.1402 COc1ccccc1C(=O)NCCC#N 527a_100000720768_100000185835 [0,1,0,0,0,0|2,0,1]=4 3078 B15R1.1402 COc1ccccc1C(=O)NCCCF 11a_100015189416_100000185835 [0,1,0,0,0,0|2,0,0]=3 3079 B15R1.1402 COc1ccccc1C(=O)NCCCF 1626a_100015189416_100000185835 [0,1,0,0,0,0|2,0,0]=3 3080 B15R1.1402 COc1ccccc1C(=O)NCCCF 240690a_100015189416_100000185835 [0,1,0,0,0,0|2,0,0]=3 3081 B15R1.1402 COc1ccccc1C(=O)NCCCF 527a_100015189416_100000185835 [0,1,0,0,0,0|2,0,0]=3 3082 B15R1.1402 COc1ccccc1C(=O)NCCCO 240690a_100000182051_100000185835 [0,1,0,0,0,0|2,0,0]=3 3083 B15R1.1402 COc1ccccc1C(=O)NCCCO 527a_100000182051_100000185835 [0,1,0,0,0,0|2,0,0]=3 3084 B15R1.1402 COc1ccccc1C(=O)NCCSC 11a_100020590264_100000185835 [0,1,0,0,0,0|2,0,0]=3 3085 B15R1.1402 COc1ccccc1C(=O)NCCSC 1626a_100020590264_100000185835 [0,1,0,0,0,0|2,0,0]=3 3086 B15R1.1402 COc1ccccc1C(=O)NCCSC 240690a_100020590264_100000185835 [0,1,0,0,0,0|2,0,0]=3 3087 B15R1.1402 COc1ccccc1C(=O)NCCSC 527a_100020590264_100000185835 [0,1,0,0,0,0|2,0,0]=3 3088 B15R1.1402 COc1ccccc1C(=O)NNCCO 22a_100000210001_100000185835 [0,1,0,0,0,0|3,0,0]=4 3089 B15R1.1402 COc1ccccc1C(C)OCCCF 7a_100000742714_100011934791 [0,1,0,0,0,0|2,0,1]=4 3090 B15R1.1402 COc1ccccc1C(C)OCCCO 7a_100000742714_100011215043 [0,1,0,0,0,0|2,0,1]=4 3091 B15R1.1402 COc1ccccc1C(C)OCCSC 7a_100000742714_100000212216 [0,1,0,0,0,0|2,0,1]=4 3092 B15R1.1402 CSCCNC(=O)c1ccccc1C#N 11a_100020590264_100000742908 [0,1,0,0,0,0|3,0,0]=4 3093 B15R1.1402 CSCCNC(=O)c1ccccc1C#N 1626a_100020590264_100000742908 [0,1,0,0,0,0|3,0,0]=4 3094 B15R1.1402 CSCCNC(=O)c1ccccc1C#N 527a_100020590264_100000742908 [0,1,0,0,0,0|3,0,0]=4 3095 B15R1.1402 CSCCNC(=O)c1ccccc1I=O 1626a_100020590264_100000032414 [0,1,0,0,0,0|2,0,1]=4 3096 B15R1.1402 CSCCNC(=O)c1ccccc1I=O 240690a_100020590264_100000032414 [0,1,0,0,0,0|2,0,1]=4 3097 B15R1.1402 CSCCNC(=O)c1ccccc1I=O 527a_100020590264_100000032414 [0,1,0,0,0,0|2,0,1]=4 3098 B15R1.1402 CSCCNC(=O)c1ccccc1SC 11a_100020590264_100000183967 [0,1,0,0,0,0|2,1,0]=4 3099 B15R1.1402 CSCCNC(=O)c1ccccc1SC 1626a_100020590264_100000183967 [0,1,0,0,0,0|2,1,0]=4 3100 B15R1.1402 CSCCNC(=O)c1ccccc1SC 240690a_100020590264_100000183967 [0,1,0,0,0,0|2,1,0]=4 3101 B15R1.1402 CSCCNC(=O)c1ccccc1SC 527a_100020590264_100000183967 [0,1,0,0,0,0|2,1,0]=4 3102 B15R1.1402 CSc1ccccc1C(=O)CCCCF 1458a_100000183967_100000729493 [0,1,0,0,0,0|2,1,0]=4 3103 B15R1.1402 CSc1ccccc1C(=O)CCCCO 1458a_100000183967_100000210776 [0,1,0,0,0,0|2,1,0]=4 3104 B15R1.1402 CSc1ccccc1C(=O)NCCCF 11a_100015189416_100000183967 [0,1,0,0,0,0|2,1,0]=4 3105 B15R1.1402 CSc1ccccc1C(=O)NCCCF 1626a_100015189416_100000183967 [0,1,0,0,0,0|2,1,0]=4 3106 B15R1.1402 CSc1ccccc1C(=O)NCCCF 240690a_100015189416_100000183967 [0,1,0,0,0,0|2,1,0]=4 3107 B15R1.1402 CSc1ccccc1C(=O)NCCCF 527a_100015189416_100000183967 [0,1,0,0,0,0|2,1,0]=4 3108 B15R1.1402 CSc1ccccc1C(=O)NCCCO 240690a_100000182051_100000183967 [0,1,0,0,0,0|2,1,0]=4 3109 B15R1.1402 CSc1ccccc1C(=O)NCCCO 527a_100000182051_100000183967 [0,1,0,0,0,0|2,1,0]=4 3110 B15R1.1402 N#CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000211468 [0,1,0,0,0,0|2,0,1]=4 3111 B15R1.1402 N#Cc1ccccc1C(=O)CCCCF 1458a_100000742908_100000729493 [0,1,0,0,0,0|3,0,0]=4 3112 B15R1.1402 N#Cc1ccccc1C(=O)CCCCO 1458a_100000742908_100000210776 [0,1,0,0,0,0|3,0,0]=4 3113 B15R1.1402 N#Cc1ccccc1C(=O)NCCCF 11a_100015189416_100000742908 [0,1,0,0,0,0|3,0,0]=4 3114 B15R1.1402 N#Cc1ccccc1C(=O)NCCCF 1626a_100015189416_100000742908 [0,1,0,0,0,0|3,0,0]=4 3115 B15R1.1402 N#Cc1ccccc1C(=O)NCCCF 527a_100015189416_100000742908 [0,1,0,0,0,0|3,0,0]=4 3116 B15R1.1402 N#Cc1ccccc1C(=O)NCCCO 527a_100000182051_100000742908 [0,1,0,0,0,0|3,0,0]=4 3117 B15R1.1402 O=C(CCCCF)c1ccccc1CO 1458a_100011301526_100000729493 [0,1,0,0,0,0|2,0,0]=3 3118 B15R1.1402 O=C(CCCCO)c1ccccc1CO 1458a_100011301526_100000210776 [0,1,0,0,0,0|2,0,0]=3 3119 B15R1.1402 O=Ic1ccccc1C(=O)CCCCF 1458a_100000032414_100000729493 [0,1,0,0,0,0|2,0,1]=4 3120 B15R1.1402 O=Ic1ccccc1C(=O)CCCCO 1458a_100000032414_100000210776 [0,1,0,0,0,0|2,0,1]=4 3121 B15R1.1402 O=Ic1ccccc1C(=O)NCCCF 1626a_100015189416_100000032414 [0,1,0,0,0,0|2,0,1]=4 3122 B15R1.1402 O=Ic1ccccc1C(=O)NCCCF 240690a_100015189416_100000032414 [0,1,0,0,0,0|2,0,1]=4 3123 B15R1.1402 O=Ic1ccccc1C(=O)NCCCF 527a_100015189416_100000032414 [0,1,0,0,0,0|2,0,1]=4 3124 B15R1.1402 O=Ic1ccccc1C(=O)NCCCO 240690a_100000182051_100000032414 [0,1,0,0,0,0|2,0,1]=4 3125 B15R1.1402 O=Ic1ccccc1C(=O)NCCCO 527a_100000182051_100000032414 [0,1,0,0,0,0|2,0,1]=4 3126 B15R1.1402 [13CH3]Nc1ccccc1C(=O)NCCCO 34a_200011191992_200025704644 [0,1,0,0,0,0|3,0,0]=4 3127 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000731252 [0,1,0,0,0,0|1,0,2]=4 3128 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000731252 [0,1,0,0,0,0|1,0,2]=4 3129 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000731252 [0,1,0,0,0,0|1,0,2]=4 3130 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000731252 [0,1,0,0,0,0|1,0,2]=4 3131 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000731252 [0,1,0,0,0,0|1,0,2]=4 3132 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000731252 [0,1,0,0,0,0|1,0,2]=4 3133 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Br 240690a_100000755551_100000744433 [0,1,0,0,0,0|1,0,2]=4 3134 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Br 527a_100000755551_100000744433 [0,1,0,0,0,0|1,0,2]=4 3135 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)C 1626a_100000755551_100000212137 [0,1,0,0,0,0|1,0,2]=4 3136 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)C 240690a_100000755551_100000212137 [0,1,0,0,0,0|1,0,2]=4 3137 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)C 527a_100000755551_100000212137 [0,1,0,0,0,0|1,0,2]=4 3138 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Cl 11a_100000755551_100000188622 [0,1,0,0,0,0|1,0,2]=4 3139 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Cl 240690a_100000755551_100000188622 [0,1,0,0,0,0|1,0,2]=4 3140 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Cl 527a_100000755551_100000188622 [0,1,0,0,0,0|1,0,2]=4 3141 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)F 240690a_100000755551_100000746061 [0,1,0,0,0,0|1,0,2]=4 3142 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)F 527a_100000755551_100000746061 [0,1,0,0,0,0|1,0,2]=4 3143 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)I 240690a_100000755551_100000091984 [0,1,0,0,0,0|1,0,2]=4 3144 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)I 527a_100000755551_100000091984 [0,1,0,0,0,0|1,0,2]=4 3145 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000757094 [0,1,0,0,0,0|1,0,2]=4 3146 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000757094 [0,1,0,0,0,0|1,0,2]=4 3147 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000757094 [0,1,0,0,0,0|1,0,2]=4 3148 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000757094 [0,1,0,0,0,0|1,0,2]=4 3149 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000757094 [0,1,0,0,0,0|1,0,2]=4 3150 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000757094 [0,1,0,0,0,0|1,0,2]=4 3151 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Br 240690a_100015191253_100000744433 [0,1,0,0,0,0|1,0,2]=4 3152 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Br 527a_100015191253_100000744433 [0,1,0,0,0,0|1,0,2]=4 3153 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)C 1626a_100015191253_100000212137 [0,1,0,0,0,0|1,0,2]=4 3154 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)C 240690a_100015191253_100000212137 [0,1,0,0,0,0|1,0,2]=4 3155 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)C 527a_100015191253_100000212137 [0,1,0,0,0,0|1,0,2]=4 3156 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Cl 11a_100015191253_100000188622 [0,1,0,0,0,0|1,0,2]=4 3157 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Cl 240690a_100015191253_100000188622 [0,1,0,0,0,0|1,0,2]=4 3158 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Cl 527a_100015191253_100000188622 [0,1,0,0,0,0|1,0,2]=4 3159 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)F 240690a_100015191253_100000746061 [0,1,0,0,0,0|1,0,2]=4 3160 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)F 527a_100015191253_100000746061 [0,1,0,0,0,0|1,0,2]=4 3161 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)I 240690a_100015191253_100000091984 [0,1,0,0,0,0|1,0,2]=4 3162 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)I 527a_100015191253_100000091984 [0,1,0,0,0,0|1,0,2]=4 3163 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)Br 527a_100000685387_100000744433 [0,1,0,0,0,0|1,0,2]=4 3164 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)C 1626a_100000685387_100000212137 [0,1,0,0,0,0|1,0,2]=4 3165 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)C 527a_100000685387_100000212137 [0,1,0,0,0,0|1,0,2]=4 3166 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)Cl 11a_100000685387_100000188622 [0,1,0,0,0,0|1,0,2]=4 3167 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)Cl 527a_100000685387_100000188622 [0,1,0,0,0,0|1,0,2]=4 3168 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)F 527a_100000685387_100000746061 [0,1,0,0,0,0|1,0,2]=4 3169 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)I 527a_100000685387_100000091984 [0,1,0,0,0,0|1,0,2]=4 3170 B15R1.3309 CC/C=C\CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100103147603 [0,1,0,0,0,0|1,0,2]=4 3171 B15R1.3309 CC/C=C\CC(=O)c1ccc(cc1O)C 1458a_100000212137_100103147603 [0,1,0,0,0,0|1,0,2]=4 3172 B15R1.3309 CC/C=C\CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100103147603 [0,1,0,0,0,0|1,0,2]=4 3173 B15R1.3309 CC/C=C\CC(=O)c1ccc(cc1O)F 1458a_100000746061_100103147603 [0,1,0,0,0,0|1,0,2]=4 3174 B15R1.3309 CC/C=C\CC(=O)c1ccc(cc1O)I 1458a_100000091984_100103147603 [0,1,0,0,0,0|1,0,2]=4 3175 B15R1.3309 CC/C=C\CC(=O)c1ccc(cc1O)O 1458a_100000212172_100103147603 [0,1,0,0,0,0|1,0,2]=4 3176 B15R1.3309 CCC#CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100009813939 [0,1,0,0,0,0|1,0,2]=4 3177 B15R1.3309 CCC#CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100009813939 [0,1,0,0,0,0|1,0,2]=4 3178 B15R1.3309 CCC#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100009813939 [0,1,0,0,0,0|1,0,2]=4 3179 B15R1.3309 CCC#CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100009813939 [0,1,0,0,0,0|1,0,2]=4 3180 B15R1.3309 CCC#CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100009813939 [0,1,0,0,0,0|1,0,2]=4 3181 B15R1.3309 CCC#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100009813939 [0,1,0,0,0,0|1,0,2]=4 3182 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210326 [0,1,0,0,0,0|2,0,0]=3 3183 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210326 [0,1,0,0,0,0|2,0,0]=3 3184 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210326 [0,1,0,0,0,0|2,0,0]=3 3185 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210326 [0,1,0,0,0,0|2,0,0]=3 3186 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210326 [0,1,0,0,0,0|2,0,0]=3 3187 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210326 [0,1,0,0,0,0|2,0,0]=3 3188 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210326 [0,1,0,0,0,0|2,0,0]=3 3189 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210326 [0,1,0,0,0,0|2,0,0]=3 3190 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210326 [0,1,0,0,0,0|2,0,0]=3 3191 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210326 [0,1,0,0,0,0|2,0,0]=3 3192 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210326 [0,1,0,0,0,0|2,0,0]=3 3193 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210326 [0,1,0,0,0,0|2,0,0]=3 3194 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210326 [0,1,0,0,0,0|2,0,0]=3 3195 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210326 [0,1,0,0,0,0|2,0,0]=3 3196 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210326 [0,1,0,0,0,0|2,0,0]=3 3197 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210326 [0,1,0,0,0,0|2,0,0]=3 3198 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210326 [0,1,0,0,0,0|2,0,0]=3 3199 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210326 [0,1,0,0,0,0|2,0,0]=3 3200 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210326 [0,1,0,0,0,0|2,0,0]=3 3201 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210326 [0,1,0,0,0,0|2,0,0]=3 3202 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210326 [0,1,0,0,0,0|2,0,0]=3 3203 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210326 [0,1,0,0,0,0|2,0,0]=3 3204 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210326 [0,1,0,0,0,0|2,0,0]=3 3205 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210326 [0,1,0,0,0,0|2,0,0]=3 3206 B15R1.3309 CCCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210326 [0,1,0,0,0,0|2,0,0]=3 3207 B15R1.3309 CCCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210326 [0,1,0,0,0,0|2,0,0]=3 3208 B15R1.3309 CCCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210326 [0,1,0,0,0,0|2,0,0]=3 3209 B15R1.3309 CCCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210326 [0,1,0,0,0,0|2,0,0]=3 3210 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210326 [0,1,0,0,0,0|1,0,0]=2 3211 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210326 [0,1,0,0,0,0|1,0,0]=2 3212 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210326 [0,1,0,0,0,0|1,0,0]=2 3213 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210326 [0,1,0,0,0,0|1,0,0]=2 3214 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210326 [0,1,0,0,0,0|1,0,0]=2 3215 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210326 [0,1,0,0,0,0|1,0,0]=2 3216 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 11a_100000102301_100000762965 [0,1,0,0,0,0|2,0,0]=3 3217 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 1626a_100000102301_100000762965 [0,1,0,0,0,0|2,0,0]=3 3218 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 240690a_100000102301_100000762965 [0,1,0,0,0,0|2,0,0]=3 3219 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 527a_100000102301_100000762965 [0,1,0,0,0,0|2,0,0]=3 3220 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 11a_100000102301_100000685072 [0,1,0,0,0,0|2,0,0]=3 3221 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 1626a_100000102301_100000685072 [0,1,0,0,0,0|2,0,0]=3 3222 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 240690a_100000102301_100000685072 [0,1,0,0,0,0|2,0,0]=3 3223 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 527a_100000102301_100000685072 [0,1,0,0,0,0|2,0,0]=3 3224 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 11a_100000102301_100000766353 [0,1,0,0,0,0|2,0,0]=3 3225 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000102301_100000766353 [0,1,0,0,0,0|2,0,0]=3 3226 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000102301_100000766353 [0,1,0,0,0,0|2,0,0]=3 3227 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 527a_100000102301_100000766353 [0,1,0,0,0,0|2,0,0]=3 3228 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 11a_100000102301_100000212304 [0,1,0,0,0,0|2,0,0]=3 3229 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 1626a_100000102301_100000212304 [0,1,0,0,0,0|2,0,0]=3 3230 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 240690a_100000102301_100000212304 [0,1,0,0,0,0|2,0,0]=3 3231 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 527a_100000102301_100000212304 [0,1,0,0,0,0|2,0,0]=3 3232 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 11a_100000102301_100012360512 [0,1,0,0,0,0|2,0,0]=3 3233 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 1626a_100000102301_100012360512 [0,1,0,0,0,0|2,0,0]=3 3234 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 240690a_100000102301_100012360512 [0,1,0,0,0,0|2,0,0]=3 3235 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 527a_100000102301_100012360512 [0,1,0,0,0,0|2,0,0]=3 3236 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)O 240690a_100000102301_100012344906 [0,1,0,0,0,0|2,0,0]=3 3237 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)O 527a_100000102301_100012344906 [0,1,0,0,0,0|2,0,0]=3 3238 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 11a_100000102301_100000741311 [0,1,0,0,0,0|2,0,0]=3 3239 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 1626a_100000102301_100000741311 [0,1,0,0,0,0|2,0,0]=3 3240 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 240690a_100000102301_100000741311 [0,1,0,0,0,0|2,0,0]=3 3241 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 527a_100000102301_100000741311 [0,1,0,0,0,0|2,0,0]=3 3242 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 11a_100000102301_100000211164 [0,1,0,0,0,0|2,0,0]=3 3243 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 1626a_100000102301_100000211164 [0,1,0,0,0,0|2,0,0]=3 3244 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 240690a_100000102301_100000211164 [0,1,0,0,0,0|2,0,0]=3 3245 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 527a_100000102301_100000211164 [0,1,0,0,0,0|2,0,0]=3 3246 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 11a_100000102301_100000688705 [0,1,0,0,0,0|2,0,0]=3 3247 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 1626a_100000102301_100000688705 [0,1,0,0,0,0|2,0,0]=3 3248 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 240690a_100000102301_100000688705 [0,1,0,0,0,0|2,0,0]=3 3249 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 527a_100000102301_100000688705 [0,1,0,0,0,0|2,0,0]=3 3250 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 11a_100000102301_100000686989 [0,1,0,0,0,0|2,0,0]=3 3251 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 1626a_100000102301_100000686989 [0,1,0,0,0,0|2,0,0]=3 3252 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 240690a_100000102301_100000686989 [0,1,0,0,0,0|2,0,0]=3 3253 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 527a_100000102301_100000686989 [0,1,0,0,0,0|2,0,0]=3 3254 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 11a_100000102301_100010189873 [0,1,0,0,0,0|2,0,0]=3 3255 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 1626a_100000102301_100010189873 [0,1,0,0,0,0|2,0,0]=3 3256 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 240690a_100000102301_100010189873 [0,1,0,0,0,0|2,0,0]=3 3257 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 527a_100000102301_100010189873 [0,1,0,0,0,0|2,0,0]=3 3258 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)O 240690a_100000102301_100000692822 [0,1,0,0,0,0|2,0,0]=3 3259 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)O 527a_100000102301_100000692822 [0,1,0,0,0,0|2,0,0]=3 3260 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 11a_100000102301_100000741628 [0,1,0,0,0,0|2,0,0]=3 3261 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000102301_100000741628 [0,1,0,0,0,0|2,0,0]=3 3262 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000102301_100000741628 [0,1,0,0,0,0|2,0,0]=3 3263 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 527a_100000102301_100000741628 [0,1,0,0,0,0|2,0,0]=3 3264 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 11a_100000102301_100000766932 [0,1,0,0,0,0|2,0,0]=3 3265 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 1626a_100000102301_100000766932 [0,1,0,0,0,0|2,0,0]=3 3266 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 240690a_100000102301_100000766932 [0,1,0,0,0,0|2,0,0]=3 3267 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 527a_100000102301_100000766932 [0,1,0,0,0,0|2,0,0]=3 3268 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000102301_100000185840 [0,1,0,0,0,0|2,0,0]=3 3269 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000102301_100000185840 [0,1,0,0,0,0|2,0,0]=3 3270 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000102301_100000185840 [0,1,0,0,0,0|2,0,0]=3 3271 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000102301_100000185840 [0,1,0,0,0,0|2,0,0]=3 3272 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 11a_100000102301_100000211397 [0,1,0,0,0,0|2,0,0]=3 3273 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 1626a_100000102301_100000211397 [0,1,0,0,0,0|2,0,0]=3 3274 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 240690a_100000102301_100000211397 [0,1,0,0,0,0|2,0,0]=3 3275 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 527a_100000102301_100000211397 [0,1,0,0,0,0|2,0,0]=3 3276 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 11a_100000102301_100000751301 [0,1,0,0,0,0|2,0,0]=3 3277 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 1626a_100000102301_100000751301 [0,1,0,0,0,0|2,0,0]=3 3278 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 240690a_100000102301_100000751301 [0,1,0,0,0,0|2,0,0]=3 3279 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 527a_100000102301_100000751301 [0,1,0,0,0,0|2,0,0]=3 3280 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)O 240690a_100000102301_100000702456 [0,1,0,0,0,0|2,0,0]=3 3281 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)O 527a_100000102301_100000702456 [0,1,0,0,0,0|2,0,0]=3 3282 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 11a_100000102301_100000214689 [0,1,0,0,0,0|2,0,0]=3 3283 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 1626a_100000102301_100000214689 [0,1,0,0,0,0|2,0,0]=3 3284 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 240690a_100000102301_100000214689 [0,1,0,0,0,0|2,0,0]=3 3285 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 527a_100000102301_100000214689 [0,1,0,0,0,0|2,0,0]=3 3286 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 11a_100000102301_100000766033 [0,1,0,0,0,0|2,0,0]=3 3287 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 1626a_100000102301_100000766033 [0,1,0,0,0,0|2,0,0]=3 3288 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 240690a_100000102301_100000766033 [0,1,0,0,0,0|2,0,0]=3 3289 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 527a_100000102301_100000766033 [0,1,0,0,0,0|2,0,0]=3 3290 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 11a_100000102301_100000212326 [0,1,0,0,0,0|2,0,0]=3 3291 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 1626a_100000102301_100000212326 [0,1,0,0,0,0|2,0,0]=3 3292 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 240690a_100000102301_100000212326 [0,1,0,0,0,0|2,0,0]=3 3293 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 527a_100000102301_100000212326 [0,1,0,0,0,0|2,0,0]=3 3294 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 11a_100000102301_100000211022 [0,1,0,0,0,0|2,0,0]=3 3295 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 1626a_100000102301_100000211022 [0,1,0,0,0,0|2,0,0]=3 3296 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 240690a_100000102301_100000211022 [0,1,0,0,0,0|2,0,0]=3 3297 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 527a_100000102301_100000211022 [0,1,0,0,0,0|2,0,0]=3 3298 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 11a_100000102301_100000037189 [0,1,0,0,0,0|2,0,0]=3 3299 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 1626a_100000102301_100000037189 [0,1,0,0,0,0|2,0,0]=3 3300 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 240690a_100000102301_100000037189 [0,1,0,0,0,0|2,0,0]=3 3301 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 527a_100000102301_100000037189 [0,1,0,0,0,0|2,0,0]=3 3302 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)O 240690a_100000102301_100000689029 [0,1,0,0,0,0|2,0,0]=3 3303 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)O 527a_100000102301_100000689029 [0,1,0,0,0,0|2,0,0]=3 3304 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 11a_100000102301_100000751167 [0,1,0,0,0,0|2,0,0]=3 3305 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 1626a_100000102301_100000751167 [0,1,0,0,0,0|2,0,0]=3 3306 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 240690a_100000102301_100000751167 [0,1,0,0,0,0|2,0,0]=3 3307 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 527a_100000102301_100000751167 [0,1,0,0,0,0|2,0,0]=3 3308 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 11a_100000102301_100009999607 [0,1,0,0,0,0|2,0,0]=3 3309 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 1626a_100000102301_100009999607 [0,1,0,0,0,0|2,0,0]=3 3310 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 240690a_100000102301_100009999607 [0,1,0,0,0,0|2,0,0]=3 3311 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 527a_100000102301_100009999607 [0,1,0,0,0,0|2,0,0]=3 3312 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 11a_100000102301_100000739380 [0,1,0,0,0,0|2,0,0]=3 3313 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 1626a_100000102301_100000739380 [0,1,0,0,0,0|2,0,0]=3 3314 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 240690a_100000102301_100000739380 [0,1,0,0,0,0|2,0,0]=3 3315 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 527a_100000102301_100000739380 [0,1,0,0,0,0|2,0,0]=3 3316 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 11a_100000102301_100000739341 [0,1,0,0,0,0|2,0,0]=3 3317 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 1626a_100000102301_100000739341 [0,1,0,0,0,0|2,0,0]=3 3318 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 240690a_100000102301_100000739341 [0,1,0,0,0,0|2,0,0]=3 3319 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 527a_100000102301_100000739341 [0,1,0,0,0,0|2,0,0]=3 3320 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Br 240690a_100000102301_100000744433 [0,1,0,0,0,0|1,0,0]=2 3321 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Br 527a_100000102301_100000744433 [0,1,0,0,0,0|1,0,0]=2 3322 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)C 1626a_100000102301_100000212137 [0,1,0,0,0,0|1,0,0]=2 3323 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)C 240690a_100000102301_100000212137 [0,1,0,0,0,0|1,0,0]=2 3324 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)C 527a_100000102301_100000212137 [0,1,0,0,0,0|1,0,0]=2 3325 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Cl 11a_100000102301_100000188622 [0,1,0,0,0,0|1,0,0]=2 3326 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Cl 240690a_100000102301_100000188622 [0,1,0,0,0,0|1,0,0]=2 3327 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Cl 527a_100000102301_100000188622 [0,1,0,0,0,0|1,0,0]=2 3328 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)F 240690a_100000102301_100000746061 [0,1,0,0,0,0|1,0,0]=2 3329 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)F 527a_100000102301_100000746061 [0,1,0,0,0,0|1,0,0]=2 3330 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)I 240690a_100000102301_100000091984 [0,1,0,0,0,0|1,0,0]=2 3331 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)I 527a_100000102301_100000091984 [0,1,0,0,0,0|1,0,0]=2 3332 B15R1.3309 CCCCNC(C)c1ccc(cc1O)Br 269862a_100000102301_100000188348 [0,1,0,0,0,0|2,0,1]=4 3333 B15R1.3309 CCCCNC(C)c1ccc(cc1O)C 269862a_100000102301_100000234885 [0,1,0,0,0,0|2,0,1]=4 3334 B15R1.3309 CCCCNC(C)c1ccc(cc1O)Cl 269862a_100000102301_100000061402 [0,1,0,0,0,0|2,0,1]=4 3335 B15R1.3309 CCCCNC(C)c1ccc(cc1O)F 269862a_100000102301_100011215782 [0,1,0,0,0,0|2,0,1]=4 3336 B15R1.3309 CCCCOC(C)c1ccc(cc1C)C 34a_100000246504_100000210210 [0,1,0,0,0,0|2,0,1]=4 3337 B15R1.3309 CCCCOC(C)c1ccc(cc1C)C 7a_100000246504_100000210211 [0,1,0,0,0,0|2,0,1]=4 3338 B15R1.3309 CCCCOC(C)c1ccc(cc1Cl)Cl 34a_100000743050_100000210210 [0,1,0,0,0,0|2,0,1]=4 3339 B15R1.3309 CCCCOC(C)c1ccc(cc1Cl)Cl 7a_100000743050_100000210211 [0,1,0,0,0,0|2,0,1]=4 3340 B15R1.3309 CCCCOC(C)c1ccc(cc1Cl)F 34a_200011245020_100000210210 [0,1,0,0,0,0|2,0,1]=4 3341 B15R1.3309 CCCCOC(C)c1ccc(cc1Cl)F 7a_200011245020_100000210211 [0,1,0,0,0,0|2,0,1]=4 3342 B15R1.3309 CCCCOC(C)c1ccc(cc1F)Cl 34a_200011805215_100000210210 [0,1,0,0,0,0|2,0,1]=4 3343 B15R1.3309 CCCCOC(C)c1ccc(cc1F)Cl 7a_200011805215_100000210211 [0,1,0,0,0,0|2,0,1]=4 3344 B15R1.3309 CCCCOC(C)c1ccc(cc1F)F 34a_200000246518_100000210210 [0,1,0,0,0,0|2,0,1]=4 3345 B15R1.3309 CCCCOC(C)c1ccc(cc1F)F 7a_200000246518_100000210211 [0,1,0,0,0,0|2,0,1]=4 3346 B15R1.3309 CCCNN=C(C)c1ccc(cc1O)Br 4a_100000740057_100000188348 [0,1,0,0,0,0|3,0,0]=4 3347 B15R1.3309 CCCNN=C(C)c1ccc(cc1O)C 4a_100000740057_100000234885 [0,1,0,0,0,0|3,0,0]=4 3348 B15R1.3309 CCCNN=C(C)c1ccc(cc1O)Cl 4a_100000740057_100000061402 [0,1,0,0,0,0|3,0,0]=4 3349 B15R1.3309 CCCNN=C(C)c1ccc(cc1O)F 4a_100000740057_100011215782 [0,1,0,0,0,0|3,0,0]=4 3350 B15R1.3309 CCCNN=C(C)c1ccc(cc1O)O 4a_100000740057_100000189368 [0,1,0,0,0,0|3,0,0]=4 3351 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)Br 22a_100000740057_100000762965 [0,1,0,0,0,0|3,0,0]=4 3352 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)C 22a_100000740057_100000685072 [0,1,0,0,0,0|3,0,0]=4 3353 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)Cl 22a_100000740057_100000766353 [0,1,0,0,0,0|3,0,0]=4 3354 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)F 22a_100000740057_100000212304 [0,1,0,0,0,0|3,0,0]=4 3355 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)I 22a_100000740057_100012360512 [0,1,0,0,0,0|3,0,0]=4 3356 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)O 22a_100000740057_100012344906 [0,1,0,0,0,0|3,0,0]=4 3357 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)Br 22a_100000740057_100000741311 [0,1,0,0,0,0|3,0,0]=4 3358 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)C 22a_100000740057_100000211164 [0,1,0,0,0,0|3,0,0]=4 3359 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)Cl 22a_100000740057_100000688705 [0,1,0,0,0,0|3,0,0]=4 3360 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)F 22a_100000740057_100000686989 [0,1,0,0,0,0|3,0,0]=4 3361 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)I 22a_100000740057_100010189873 [0,1,0,0,0,0|3,0,0]=4 3362 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)Br 22a_100000740057_100000741628 [0,1,0,0,0,0|3,0,0]=4 3363 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)C 22a_100000740057_100000766932 [0,1,0,0,0,0|3,0,0]=4 3364 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)Cl 22a_100000740057_100000185840 [0,1,0,0,0,0|3,0,0]=4 3365 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)F 22a_100000740057_100000211397 [0,1,0,0,0,0|3,0,0]=4 3366 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)I 22a_100000740057_100000751301 [0,1,0,0,0,0|3,0,0]=4 3367 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)O 22a_100000740057_100000702456 [0,1,0,0,0,0|3,0,0]=4 3368 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)Br 22a_100000740057_100000214689 [0,1,0,0,0,0|3,0,0]=4 3369 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)C 22a_100000740057_100000766033 [0,1,0,0,0,0|3,0,0]=4 3370 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)Cl 22a_100000740057_100000212326 [0,1,0,0,0,0|3,0,0]=4 3371 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)F 22a_100000740057_100000211022 [0,1,0,0,0,0|3,0,0]=4 3372 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)I 22a_100000740057_100000037189 [0,1,0,0,0,0|3,0,0]=4 3373 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)O 22a_100000740057_100000689029 [0,1,0,0,0,0|3,0,0]=4 3374 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)Br 22a_100000740057_100000751167 [0,1,0,0,0,0|3,0,0]=4 3375 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)C 22a_100000740057_100009999607 [0,1,0,0,0,0|3,0,0]=4 3376 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)Cl 22a_100000740057_100000739380 [0,1,0,0,0,0|3,0,0]=4 3377 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)F 22a_100000740057_100000739341 [0,1,0,0,0,0|3,0,0]=4 3378 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)Br 22a_100000740057_100000744433 [0,1,0,0,0,0|2,0,0]=3 3379 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)C 22a_100000740057_100000212137 [0,1,0,0,0,0|2,0,0]=3 3380 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)Cl 22a_100000740057_100000188622 [0,1,0,0,0,0|2,0,0]=3 3381 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)F 22a_100000740057_100000746061 [0,1,0,0,0,0|2,0,0]=3 3382 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)I 22a_100000740057_100000091984 [0,1,0,0,0,0|2,0,0]=3 3383 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)O 22a_100000740057_100000212172 [0,1,0,0,0,0|2,0,0]=3 3384 B15R1.3309 CCCOCC(=O)c1ccc(cc1Br)F 34a_100000210258_100012361341 [0,1,0,0,0,0|3,0,0]=4 3385 B15R1.3309 CCCOCC(=O)c1ccc(cc1C)C 34a_100000210258_100000229959 [0,1,0,0,0,0|3,0,0]=4 3386 B15R1.3309 CCCOCC(=O)c1ccc(cc1Cl)F 34a_100000210258_100012056422 [0,1,0,0,0,0|3,0,0]=4 3387 B15R1.3309 CCCOCC(=O)c1ccc(cc1F)Br 34a_100000210258_200012361339 [0,1,0,0,0,0|3,0,0]=4 3388 B15R1.3309 CCCOCC(=O)c1ccc(cc1F)Cl 34a_100000210258_100012351891 [0,1,0,0,0,0|3,0,0]=4 3389 B15R1.3309 CCCOCC(=O)c1ccc(cc1F)F 34a_100000210258_100000229962 [0,1,0,0,0,0|3,0,0]=4 3390 B15R1.3309 CCCOCC(=O)c1ccc(cc1O)F 34a_100000210258_100009817053 [0,1,0,0,0,0|2,0,0]=3 3391 B15R1.3309 CCCOCC(=O)c1ccc(cc1O)O 34a_100000210258_100009814262 [0,1,0,0,0,0|2,0,0]=3 3392 B15R1.3309 CCCSCC(=O)c1ccc(cc1Br)F 62a_100012361341_100000210303 [0,1,0,0,0,0|3,0,0]=4 3393 B15R1.3309 CCCSCC(=O)c1ccc(cc1C)C 62a_100000210303_100000229959 [0,1,0,0,0,0|3,0,0]=4 3394 B15R1.3309 CCCSCC(=O)c1ccc(cc1C)C 62a_100000229959_100000210303 [0,1,0,0,0,0|3,0,0]=4 3395 B15R1.3309 CCCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210303 [0,1,0,0,0,0|3,0,0]=4 3396 B15R1.3309 CCCSCC(=O)c1ccc(cc1Cl)F 62a_100000210303_100012056422 [0,1,0,0,0,0|3,0,0]=4 3397 B15R1.3309 CCCSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100000210303 [0,1,0,0,0,0|3,0,0]=4 3398 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)Br 62a_200012361339_100000210303 [0,1,0,0,0,0|3,0,0]=4 3399 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)Cl 62a_100000210303_100012351891 [0,1,0,0,0,0|3,0,0]=4 3400 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210303 [0,1,0,0,0,0|3,0,0]=4 3401 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)F 62a_100000210303_100000229962 [0,1,0,0,0,0|3,0,0]=4 3402 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)F 62a_100000229962_100000210303 [0,1,0,0,0,0|3,0,0]=4 3403 B15R1.3309 CCCSCC(=O)c1ccc(cc1O)F 62a_100000210303_100009817053 [0,1,0,0,0,0|2,0,0]=3 3404 B15R1.3309 CCCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000210303 [0,1,0,0,0,0|2,0,0]=3 3405 B15R1.3309 CCCSCC(=O)c1ccc(cc1O)O 62a_100000210303_100009814262 [0,1,0,0,0,0|2,0,0]=3 3406 B15R1.3309 CCCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000210303 [0,1,0,0,0,0|2,0,0]=3 3407 B15R1.3309 CCNCCC(=O)c1ccc(cc1F)Br 2230a_100015525214_100010339771 [0,1,0,0,0,0|3,0,0]=4 3408 B15R1.3309 CCNCOC(=O)c1ccc(cc1Cl)Cl 2230a_100015525214_100010978946 [0,1,0,0,0,0|2,0,0]=3 3409 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011215890 [0,1,0,0,0,0|3,0,0]=4 3410 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100011215890 [0,1,0,0,0,0|3,0,0]=4 3411 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011215890 [0,1,0,0,0,0|3,0,0]=4 3412 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011215890 [0,1,0,0,0,0|3,0,0]=4 3413 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011215890 [0,1,0,0,0,0|3,0,0]=4 3414 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011215890 [0,1,0,0,0,0|3,0,0]=4 3415 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100011215890 [0,1,0,0,0,0|3,0,0]=4 3416 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100011215890 [0,1,0,0,0,0|3,0,0]=4 3417 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011215890 [0,1,0,0,0,0|3,0,0]=4 3418 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100011215890 [0,1,0,0,0,0|3,0,0]=4 3419 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100011215890 [0,1,0,0,0,0|3,0,0]=4 3420 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100011215890 [0,1,0,0,0,0|3,0,0]=4 3421 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011215890 [0,1,0,0,0,0|3,0,0]=4 3422 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100011215890 [0,1,0,0,0,0|3,0,0]=4 3423 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215890 [0,1,0,0,0,0|3,0,0]=4 3424 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011215890 [0,1,0,0,0,0|3,0,0]=4 3425 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011215890 [0,1,0,0,0,0|3,0,0]=4 3426 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011215890 [0,1,0,0,0,0|3,0,0]=4 3427 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011215890 [0,1,0,0,0,0|3,0,0]=4 3428 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)Br 34a_100121572206_100010339771 [0,1,0,0,0,0|3,0,0]=4 3429 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100011215890 [0,1,0,0,0,0|3,0,0]=4 3430 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011215890 [0,1,0,0,0,0|3,0,0]=4 3431 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100011215890 [0,1,0,0,0,0|3,0,0]=4 3432 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100011215890 [0,1,0,0,0,0|3,0,0]=4 3433 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100011215890 [0,1,0,0,0,0|3,0,0]=4 3434 B15R1.3309 CCOCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011215890 [0,1,0,0,0,0|3,0,0]=4 3435 B15R1.3309 CCOCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100011215890 [0,1,0,0,0,0|3,0,0]=4 3436 B15R1.3309 CCOCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011215890 [0,1,0,0,0,0|3,0,0]=4 3437 B15R1.3309 CCOCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100011215890 [0,1,0,0,0,0|3,0,0]=4 3438 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215890 [0,1,0,0,0,0|2,0,0]=3 3439 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100011215890 [0,1,0,0,0,0|2,0,0]=3 3440 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215890 [0,1,0,0,0,0|2,0,0]=3 3441 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215890 [0,1,0,0,0,0|2,0,0]=3 3442 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215890 [0,1,0,0,0,0|2,0,0]=3 3443 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215890 [0,1,0,0,0,0|2,0,0]=3 3444 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000757381 [0,1,0,0,0,0|3,0,0]=4 3445 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000757381 [0,1,0,0,0,0|3,0,0]=4 3446 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000757381 [0,1,0,0,0,0|3,0,0]=4 3447 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000757381 [0,1,0,0,0,0|3,0,0]=4 3448 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000757381 [0,1,0,0,0,0|3,0,0]=4 3449 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000757381 [0,1,0,0,0,0|3,0,0]=4 3450 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000757381 [0,1,0,0,0,0|3,0,0]=4 3451 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000757381 [0,1,0,0,0,0|3,0,0]=4 3452 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000757381 [0,1,0,0,0,0|3,0,0]=4 3453 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000757381 [0,1,0,0,0,0|3,0,0]=4 3454 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000757381 [0,1,0,0,0,0|3,0,0]=4 3455 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000757381 [0,1,0,0,0,0|3,0,0]=4 3456 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000757381 [0,1,0,0,0,0|3,0,0]=4 3457 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000757381 [0,1,0,0,0,0|3,0,0]=4 3458 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000757381 [0,1,0,0,0,0|3,0,0]=4 3459 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000757381 [0,1,0,0,0,0|3,0,0]=4 3460 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000757381 [0,1,0,0,0,0|3,0,0]=4 3461 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000757381 [0,1,0,0,0,0|3,0,0]=4 3462 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000757381 [0,1,0,0,0,0|3,0,0]=4 3463 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)Br 62a_100000210202_100010339771 [0,1,0,0,0,0|3,0,0]=4 3464 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)Br 62a_100010339771_100000210202 [0,1,0,0,0,0|3,0,0]=4 3465 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000757381 [0,1,0,0,0,0|3,0,0]=4 3466 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000757381 [0,1,0,0,0,0|3,0,0]=4 3467 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000757381 [0,1,0,0,0,0|3,0,0]=4 3468 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000757381 [0,1,0,0,0,0|3,0,0]=4 3469 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000757381 [0,1,0,0,0,0|3,0,0]=4 3470 B15R1.3309 CCSCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000757381 [0,1,0,0,0,0|3,0,0]=4 3471 B15R1.3309 CCSCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000757381 [0,1,0,0,0,0|3,0,0]=4 3472 B15R1.3309 CCSCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000757381 [0,1,0,0,0,0|3,0,0]=4 3473 B15R1.3309 CCSCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000757381 [0,1,0,0,0,0|3,0,0]=4 3474 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000757381 [0,1,0,0,0,0|2,0,0]=3 3475 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000757381 [0,1,0,0,0,0|2,0,0]=3 3476 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000757381 [0,1,0,0,0,0|2,0,0]=3 3477 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000757381 [0,1,0,0,0,0|2,0,0]=3 3478 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000757381 [0,1,0,0,0,0|2,0,0]=3 3479 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000757381 [0,1,0,0,0,0|2,0,0]=3 3480 B15R1.3309 CCSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_100000210202 [0,1,0,0,0,0|2,0,0]=3 3481 B15R1.3309 CNCCCC(=O)c1ccc(cc1F)F 34a_100102657272_100012405562 [0,1,0,0,0,0|3,0,0]=4 3482 B15R1.3309 CNCCCC(=O)c1ccc(cc1F)F 7a_106832991635_100012405562 [0,1,0,0,0,0|3,0,0]=4 3483 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000740836 [0,1,0,0,0,0|3,0,0]=4 3484 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000740836 [0,1,0,0,0,0|3,0,0]=4 3485 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000740836 [0,1,0,0,0,0|3,0,0]=4 3486 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000740836 [0,1,0,0,0,0|3,0,0]=4 3487 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000740836 [0,1,0,0,0,0|3,0,0]=4 3488 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000740836 [0,1,0,0,0,0|3,0,0]=4 3489 B15R1.3309 COCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000740836 [0,1,0,0,0,0|3,0,0]=4 3490 B15R1.3309 COCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000740836 [0,1,0,0,0,0|3,0,0]=4 3491 B15R1.3309 COCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000740836 [0,1,0,0,0,0|3,0,0]=4 3492 B15R1.3309 COCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000740836 [0,1,0,0,0,0|3,0,0]=4 3493 B15R1.3309 COCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000740836 [0,1,0,0,0,0|3,0,0]=4 3494 B15R1.3309 COCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000740836 [0,1,0,0,0,0|3,0,0]=4 3495 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000740836 [0,1,0,0,0,0|3,0,0]=4 3496 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000740836 [0,1,0,0,0,0|3,0,0]=4 3497 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000740836 [0,1,0,0,0,0|3,0,0]=4 3498 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000740836 [0,1,0,0,0,0|3,0,0]=4 3499 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000740836 [0,1,0,0,0,0|3,0,0]=4 3500 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000740836 [0,1,0,0,0,0|3,0,0]=4 3501 B15R1.3309 COCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000740836 [0,1,0,0,0,0|3,0,0]=4 3502 B15R1.3309 COCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000740836 [0,1,0,0,0,0|3,0,0]=4 3503 B15R1.3309 COCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000740836 [0,1,0,0,0,0|3,0,0]=4 3504 B15R1.3309 COCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000740836 [0,1,0,0,0,0|3,0,0]=4 3505 B15R1.3309 COCCCC(=O)c1ccc(cc1F)F 34a_100138415774_100012405562 [0,1,0,0,0,0|3,0,0]=4 3506 B15R1.3309 COCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000740836 [0,1,0,0,0,0|3,0,0]=4 3507 B15R1.3309 COCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000740836 [0,1,0,0,0,0|3,0,0]=4 3508 B15R1.3309 COCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000740836 [0,1,0,0,0,0|3,0,0]=4 3509 B15R1.3309 COCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000740836 [0,1,0,0,0,0|3,0,0]=4 3510 B15R1.3309 COCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000740836 [0,1,0,0,0,0|3,0,0]=4 3511 B15R1.3309 COCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000740836 [0,1,0,0,0,0|3,0,0]=4 3512 B15R1.3309 COCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000740836 [0,1,0,0,0,0|2,0,0]=3 3513 B15R1.3309 COCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000740836 [0,1,0,0,0,0|2,0,0]=3 3514 B15R1.3309 COCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000740836 [0,1,0,0,0,0|2,0,0]=3 3515 B15R1.3309 COCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000740836 [0,1,0,0,0,0|2,0,0]=3 3516 B15R1.3309 COCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000740836 [0,1,0,0,0,0|2,0,0]=3 3517 B15R1.3309 COCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000740836 [0,1,0,0,0,0|2,0,0]=3 3518 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Br 1626a_100000209980_100000762965 [0,1,0,0,0,0|3,0,0]=4 3519 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Br 240690a_100000209980_100000762965 [0,1,0,0,0,0|3,0,0]=4 3520 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Br 527a_100000209980_100000762965 [0,1,0,0,0,0|3,0,0]=4 3521 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)C 1626a_100000209980_100000685072 [0,1,0,0,0,0|3,0,0]=4 3522 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)C 240690a_100000209980_100000685072 [0,1,0,0,0,0|3,0,0]=4 3523 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)C 527a_100000209980_100000685072 [0,1,0,0,0,0|3,0,0]=4 3524 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000209980_100000766353 [0,1,0,0,0,0|3,0,0]=4 3525 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000209980_100000766353 [0,1,0,0,0,0|3,0,0]=4 3526 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Cl 527a_100000209980_100000766353 [0,1,0,0,0,0|3,0,0]=4 3527 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)F 1626a_100000209980_100000212304 [0,1,0,0,0,0|3,0,0]=4 3528 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)F 240690a_100000209980_100000212304 [0,1,0,0,0,0|3,0,0]=4 3529 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)F 527a_100000209980_100000212304 [0,1,0,0,0,0|3,0,0]=4 3530 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)I 1626a_100000209980_100012360512 [0,1,0,0,0,0|3,0,0]=4 3531 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)I 240690a_100000209980_100012360512 [0,1,0,0,0,0|3,0,0]=4 3532 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)I 527a_100000209980_100012360512 [0,1,0,0,0,0|3,0,0]=4 3533 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)O 240690a_100000209980_100012344906 [0,1,0,0,0,0|3,0,0]=4 3534 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)O 527a_100000209980_100012344906 [0,1,0,0,0,0|3,0,0]=4 3535 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Br 1626a_100000209980_100000741311 [0,1,0,0,0,0|3,0,0]=4 3536 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Br 240690a_100000209980_100000741311 [0,1,0,0,0,0|3,0,0]=4 3537 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Br 527a_100000209980_100000741311 [0,1,0,0,0,0|3,0,0]=4 3538 B15R1.3309 COCCNC(=O)c1ccc(cc1C)C 1626a_100000209980_100000211164 [0,1,0,0,0,0|3,0,0]=4 3539 B15R1.3309 COCCNC(=O)c1ccc(cc1C)C 240690a_100000209980_100000211164 [0,1,0,0,0,0|3,0,0]=4 3540 B15R1.3309 COCCNC(=O)c1ccc(cc1C)C 527a_100000209980_100000211164 [0,1,0,0,0,0|3,0,0]=4 3541 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Cl 1626a_100000209980_100000688705 [0,1,0,0,0,0|3,0,0]=4 3542 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Cl 240690a_100000209980_100000688705 [0,1,0,0,0,0|3,0,0]=4 3543 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Cl 527a_100000209980_100000688705 [0,1,0,0,0,0|3,0,0]=4 3544 B15R1.3309 COCCNC(=O)c1ccc(cc1C)F 1626a_100000209980_100000686989 [0,1,0,0,0,0|3,0,0]=4 3545 B15R1.3309 COCCNC(=O)c1ccc(cc1C)F 240690a_100000209980_100000686989 [0,1,0,0,0,0|3,0,0]=4 3546 B15R1.3309 COCCNC(=O)c1ccc(cc1C)F 527a_100000209980_100000686989 [0,1,0,0,0,0|3,0,0]=4 3547 B15R1.3309 COCCNC(=O)c1ccc(cc1C)I 1626a_100000209980_100010189873 [0,1,0,0,0,0|3,0,0]=4 3548 B15R1.3309 COCCNC(=O)c1ccc(cc1C)I 240690a_100000209980_100010189873 [0,1,0,0,0,0|3,0,0]=4 3549 B15R1.3309 COCCNC(=O)c1ccc(cc1C)I 527a_100000209980_100010189873 [0,1,0,0,0,0|3,0,0]=4 3550 B15R1.3309 COCCNC(=O)c1ccc(cc1C)O 240690a_100000209980_100000692822 [0,1,0,0,0,0|3,0,0]=4 3551 B15R1.3309 COCCNC(=O)c1ccc(cc1C)O 527a_100000209980_100000692822 [0,1,0,0,0,0|3,0,0]=4 3552 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000209980_100000741628 [0,1,0,0,0,0|3,0,0]=4 3553 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000209980_100000741628 [0,1,0,0,0,0|3,0,0]=4 3554 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Br 527a_100000209980_100000741628 [0,1,0,0,0,0|3,0,0]=4 3555 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)C 1626a_100000209980_100000766932 [0,1,0,0,0,0|3,0,0]=4 3556 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)C 240690a_100000209980_100000766932 [0,1,0,0,0,0|3,0,0]=4 3557 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)C 527a_100000209980_100000766932 [0,1,0,0,0,0|3,0,0]=4 3558 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000209980_100000185840 [0,1,0,0,0,0|3,0,0]=4 3559 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000209980_100000185840 [0,1,0,0,0,0|3,0,0]=4 3560 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000209980_100000185840 [0,1,0,0,0,0|3,0,0]=4 3561 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)F 1626a_100000209980_100000211397 [0,1,0,0,0,0|3,0,0]=4 3562 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)F 240690a_100000209980_100000211397 [0,1,0,0,0,0|3,0,0]=4 3563 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)F 527a_100000209980_100000211397 [0,1,0,0,0,0|3,0,0]=4 3564 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)I 1626a_100000209980_100000751301 [0,1,0,0,0,0|3,0,0]=4 3565 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)I 240690a_100000209980_100000751301 [0,1,0,0,0,0|3,0,0]=4 3566 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)I 527a_100000209980_100000751301 [0,1,0,0,0,0|3,0,0]=4 3567 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)N 34a_100000725507_200000210301 [0,1,0,0,0,0|3,0,0]=4 3568 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)O 240690a_100000209980_100000702456 [0,1,0,0,0,0|3,0,0]=4 3569 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)O 527a_100000209980_100000702456 [0,1,0,0,0,0|3,0,0]=4 3570 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Br 1626a_100000209980_100000214689 [0,1,0,0,0,0|3,0,0]=4 3571 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Br 240690a_100000209980_100000214689 [0,1,0,0,0,0|3,0,0]=4 3572 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Br 527a_100000209980_100000214689 [0,1,0,0,0,0|3,0,0]=4 3573 B15R1.3309 COCCNC(=O)c1ccc(cc1F)C 1626a_100000209980_100000766033 [0,1,0,0,0,0|3,0,0]=4 3574 B15R1.3309 COCCNC(=O)c1ccc(cc1F)C 240690a_100000209980_100000766033 [0,1,0,0,0,0|3,0,0]=4 3575 B15R1.3309 COCCNC(=O)c1ccc(cc1F)C 527a_100000209980_100000766033 [0,1,0,0,0,0|3,0,0]=4 3576 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Cl 1626a_100000209980_100000212326 [0,1,0,0,0,0|3,0,0]=4 3577 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Cl 240690a_100000209980_100000212326 [0,1,0,0,0,0|3,0,0]=4 3578 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Cl 527a_100000209980_100000212326 [0,1,0,0,0,0|3,0,0]=4 3579 B15R1.3309 COCCNC(=O)c1ccc(cc1F)F 1626a_100000209980_100000211022 [0,1,0,0,0,0|3,0,0]=4 3580 B15R1.3309 COCCNC(=O)c1ccc(cc1F)F 240690a_100000209980_100000211022 [0,1,0,0,0,0|3,0,0]=4 3581 B15R1.3309 COCCNC(=O)c1ccc(cc1F)F 527a_100000209980_100000211022 [0,1,0,0,0,0|3,0,0]=4 3582 B15R1.3309 COCCNC(=O)c1ccc(cc1F)I 1626a_100000209980_100000037189 [0,1,0,0,0,0|3,0,0]=4 3583 B15R1.3309 COCCNC(=O)c1ccc(cc1F)I 240690a_100000209980_100000037189 [0,1,0,0,0,0|3,0,0]=4 3584 B15R1.3309 COCCNC(=O)c1ccc(cc1F)I 527a_100000209980_100000037189 [0,1,0,0,0,0|3,0,0]=4 3585 B15R1.3309 COCCNC(=O)c1ccc(cc1F)O 240690a_100000209980_100000689029 [0,1,0,0,0,0|3,0,0]=4 3586 B15R1.3309 COCCNC(=O)c1ccc(cc1F)O 527a_100000209980_100000689029 [0,1,0,0,0,0|3,0,0]=4 3587 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Br 1626a_100000209980_100000751167 [0,1,0,0,0,0|3,0,0]=4 3588 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Br 240690a_100000209980_100000751167 [0,1,0,0,0,0|3,0,0]=4 3589 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Br 527a_100000209980_100000751167 [0,1,0,0,0,0|3,0,0]=4 3590 B15R1.3309 COCCNC(=O)c1ccc(cc1I)C 1626a_100000209980_100009999607 [0,1,0,0,0,0|3,0,0]=4 3591 B15R1.3309 COCCNC(=O)c1ccc(cc1I)C 240690a_100000209980_100009999607 [0,1,0,0,0,0|3,0,0]=4 3592 B15R1.3309 COCCNC(=O)c1ccc(cc1I)C 527a_100000209980_100009999607 [0,1,0,0,0,0|3,0,0]=4 3593 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Cl 1626a_100000209980_100000739380 [0,1,0,0,0,0|3,0,0]=4 3594 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Cl 240690a_100000209980_100000739380 [0,1,0,0,0,0|3,0,0]=4 3595 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Cl 527a_100000209980_100000739380 [0,1,0,0,0,0|3,0,0]=4 3596 B15R1.3309 COCCNC(=O)c1ccc(cc1I)F 1626a_100000209980_100000739341 [0,1,0,0,0,0|3,0,0]=4 3597 B15R1.3309 COCCNC(=O)c1ccc(cc1I)F 240690a_100000209980_100000739341 [0,1,0,0,0,0|3,0,0]=4 3598 B15R1.3309 COCCNC(=O)c1ccc(cc1I)F 527a_100000209980_100000739341 [0,1,0,0,0,0|3,0,0]=4 3599 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Br 240690a_100000209980_100000744433 [0,1,0,0,0,0|2,0,0]=3 3600 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Br 527a_100000209980_100000744433 [0,1,0,0,0,0|2,0,0]=3 3601 B15R1.3309 COCCNC(=O)c1ccc(cc1O)C 1626a_100000209980_100000212137 [0,1,0,0,0,0|2,0,0]=3 3602 B15R1.3309 COCCNC(=O)c1ccc(cc1O)C 240690a_100000209980_100000212137 [0,1,0,0,0,0|2,0,0]=3 3603 B15R1.3309 COCCNC(=O)c1ccc(cc1O)C 527a_100000209980_100000212137 [0,1,0,0,0,0|2,0,0]=3 3604 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Cl 240690a_100000209980_100000188622 [0,1,0,0,0,0|2,0,0]=3 3605 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Cl 527a_100000209980_100000188622 [0,1,0,0,0,0|2,0,0]=3 3606 B15R1.3309 COCCNC(=O)c1ccc(cc1O)F 240690a_100000209980_100000746061 [0,1,0,0,0,0|2,0,0]=3 3607 B15R1.3309 COCCNC(=O)c1ccc(cc1O)F 527a_100000209980_100000746061 [0,1,0,0,0,0|2,0,0]=3 3608 B15R1.3309 COCCNC(=O)c1ccc(cc1O)I 240690a_100000209980_100000091984 [0,1,0,0,0,0|2,0,0]=3 3609 B15R1.3309 COCCNC(=O)c1ccc(cc1O)I 527a_100000209980_100000091984 [0,1,0,0,0,0|2,0,0]=3 3610 B15R1.3309 COCSCC(=O)c1ccc(cc1O)F 62a_100000766300_100009817053 [0,1,0,0,0,0|3,0,0]=4 3611 B15R1.3309 COCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000766300 [0,1,0,0,0,0|3,0,0]=4 3612 B15R1.3309 COCSCC(=O)c1ccc(cc1O)O 62a_100000766300_100009814262 [0,1,0,0,0,0|3,0,0]=4 3613 B15R1.3309 COCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000766300 [0,1,0,0,0,0|3,0,0]=4 3614 B15R1.3309 CSCCCC(=O)c1ccc(cc1F)F 62a_100012405562_200000210301 [0,1,0,0,0,0|3,0,0]=4 3615 B15R1.3309 CSCCCC(=O)c1ccc(cc1F)F 62a_200000210301_100012405562 [0,1,0,0,0,0|3,0,0]=4 3616 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 11a_100020590264_100000762965 [0,1,0,0,0,0|3,0,0]=4 3617 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 1626a_100020590264_100000762965 [0,1,0,0,0,0|3,0,0]=4 3618 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 240690a_100020590264_100000762965 [0,1,0,0,0,0|3,0,0]=4 3619 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 527a_100020590264_100000762965 [0,1,0,0,0,0|3,0,0]=4 3620 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 11a_100020590264_100000685072 [0,1,0,0,0,0|3,0,0]=4 3621 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 1626a_100020590264_100000685072 [0,1,0,0,0,0|3,0,0]=4 3622 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 240690a_100020590264_100000685072 [0,1,0,0,0,0|3,0,0]=4 3623 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 527a_100020590264_100000685072 [0,1,0,0,0,0|3,0,0]=4 3624 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 11a_100020590264_100000766353 [0,1,0,0,0,0|3,0,0]=4 3625 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 1626a_100020590264_100000766353 [0,1,0,0,0,0|3,0,0]=4 3626 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 240690a_100020590264_100000766353 [0,1,0,0,0,0|3,0,0]=4 3627 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 527a_100020590264_100000766353 [0,1,0,0,0,0|3,0,0]=4 3628 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 11a_100020590264_100000212304 [0,1,0,0,0,0|3,0,0]=4 3629 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 1626a_100020590264_100000212304 [0,1,0,0,0,0|3,0,0]=4 3630 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 240690a_100020590264_100000212304 [0,1,0,0,0,0|3,0,0]=4 3631 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 527a_100020590264_100000212304 [0,1,0,0,0,0|3,0,0]=4 3632 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 11a_100020590264_100012360512 [0,1,0,0,0,0|3,0,0]=4 3633 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 1626a_100020590264_100012360512 [0,1,0,0,0,0|3,0,0]=4 3634 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 240690a_100020590264_100012360512 [0,1,0,0,0,0|3,0,0]=4 3635 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 527a_100020590264_100012360512 [0,1,0,0,0,0|3,0,0]=4 3636 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)O 240690a_100020590264_100012344906 [0,1,0,0,0,0|3,0,0]=4 3637 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)O 527a_100020590264_100012344906 [0,1,0,0,0,0|3,0,0]=4 3638 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 11a_100020590264_100000741311 [0,1,0,0,0,0|3,0,0]=4 3639 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 1626a_100020590264_100000741311 [0,1,0,0,0,0|3,0,0]=4 3640 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 240690a_100020590264_100000741311 [0,1,0,0,0,0|3,0,0]=4 3641 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 527a_100020590264_100000741311 [0,1,0,0,0,0|3,0,0]=4 3642 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 11a_100020590264_100000211164 [0,1,0,0,0,0|3,0,0]=4 3643 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 1626a_100020590264_100000211164 [0,1,0,0,0,0|3,0,0]=4 3644 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 240690a_100020590264_100000211164 [0,1,0,0,0,0|3,0,0]=4 3645 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 527a_100020590264_100000211164 [0,1,0,0,0,0|3,0,0]=4 3646 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 11a_100020590264_100000688705 [0,1,0,0,0,0|3,0,0]=4 3647 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 1626a_100020590264_100000688705 [0,1,0,0,0,0|3,0,0]=4 3648 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 240690a_100020590264_100000688705 [0,1,0,0,0,0|3,0,0]=4 3649 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 527a_100020590264_100000688705 [0,1,0,0,0,0|3,0,0]=4 3650 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 11a_100020590264_100000686989 [0,1,0,0,0,0|3,0,0]=4 3651 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 1626a_100020590264_100000686989 [0,1,0,0,0,0|3,0,0]=4 3652 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 240690a_100020590264_100000686989 [0,1,0,0,0,0|3,0,0]=4 3653 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 527a_100020590264_100000686989 [0,1,0,0,0,0|3,0,0]=4 3654 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 11a_100020590264_100010189873 [0,1,0,0,0,0|3,0,0]=4 3655 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 1626a_100020590264_100010189873 [0,1,0,0,0,0|3,0,0]=4 3656 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 240690a_100020590264_100010189873 [0,1,0,0,0,0|3,0,0]=4 3657 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 527a_100020590264_100010189873 [0,1,0,0,0,0|3,0,0]=4 3658 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)O 240690a_100020590264_100000692822 [0,1,0,0,0,0|3,0,0]=4 3659 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)O 527a_100020590264_100000692822 [0,1,0,0,0,0|3,0,0]=4 3660 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 11a_100020590264_100000741628 [0,1,0,0,0,0|3,0,0]=4 3661 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 1626a_100020590264_100000741628 [0,1,0,0,0,0|3,0,0]=4 3662 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 240690a_100020590264_100000741628 [0,1,0,0,0,0|3,0,0]=4 3663 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 527a_100020590264_100000741628 [0,1,0,0,0,0|3,0,0]=4 3664 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 11a_100020590264_100000766932 [0,1,0,0,0,0|3,0,0]=4 3665 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 1626a_100020590264_100000766932 [0,1,0,0,0,0|3,0,0]=4 3666 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 240690a_100020590264_100000766932 [0,1,0,0,0,0|3,0,0]=4 3667 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 527a_100020590264_100000766932 [0,1,0,0,0,0|3,0,0]=4 3668 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 11a_100020590264_100000185840 [0,1,0,0,0,0|3,0,0]=4 3669 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100020590264_100000185840 [0,1,0,0,0,0|3,0,0]=4 3670 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100020590264_100000185840 [0,1,0,0,0,0|3,0,0]=4 3671 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 527a_100020590264_100000185840 [0,1,0,0,0,0|3,0,0]=4 3672 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 11a_100020590264_100000211397 [0,1,0,0,0,0|3,0,0]=4 3673 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 1626a_100020590264_100000211397 [0,1,0,0,0,0|3,0,0]=4 3674 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 240690a_100020590264_100000211397 [0,1,0,0,0,0|3,0,0]=4 3675 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 527a_100020590264_100000211397 [0,1,0,0,0,0|3,0,0]=4 3676 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 11a_100020590264_100000751301 [0,1,0,0,0,0|3,0,0]=4 3677 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 1626a_100020590264_100000751301 [0,1,0,0,0,0|3,0,0]=4 3678 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 240690a_100020590264_100000751301 [0,1,0,0,0,0|3,0,0]=4 3679 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 527a_100020590264_100000751301 [0,1,0,0,0,0|3,0,0]=4 3680 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)O 240690a_100020590264_100000702456 [0,1,0,0,0,0|3,0,0]=4 3681 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)O 527a_100020590264_100000702456 [0,1,0,0,0,0|3,0,0]=4 3682 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 11a_100020590264_100000214689 [0,1,0,0,0,0|3,0,0]=4 3683 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 1626a_100020590264_100000214689 [0,1,0,0,0,0|3,0,0]=4 3684 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 240690a_100020590264_100000214689 [0,1,0,0,0,0|3,0,0]=4 3685 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 527a_100020590264_100000214689 [0,1,0,0,0,0|3,0,0]=4 3686 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 11a_100020590264_100000766033 [0,1,0,0,0,0|3,0,0]=4 3687 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 1626a_100020590264_100000766033 [0,1,0,0,0,0|3,0,0]=4 3688 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 240690a_100020590264_100000766033 [0,1,0,0,0,0|3,0,0]=4 3689 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 527a_100020590264_100000766033 [0,1,0,0,0,0|3,0,0]=4 3690 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 11a_100020590264_100000212326 [0,1,0,0,0,0|3,0,0]=4 3691 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 1626a_100020590264_100000212326 [0,1,0,0,0,0|3,0,0]=4 3692 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 240690a_100020590264_100000212326 [0,1,0,0,0,0|3,0,0]=4 3693 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 527a_100020590264_100000212326 [0,1,0,0,0,0|3,0,0]=4 3694 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 11a_100020590264_100000211022 [0,1,0,0,0,0|3,0,0]=4 3695 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 1626a_100020590264_100000211022 [0,1,0,0,0,0|3,0,0]=4 3696 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 240690a_100020590264_100000211022 [0,1,0,0,0,0|3,0,0]=4 3697 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 527a_100020590264_100000211022 [0,1,0,0,0,0|3,0,0]=4 3698 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 11a_100020590264_100000037189 [0,1,0,0,0,0|3,0,0]=4 3699 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 1626a_100020590264_100000037189 [0,1,0,0,0,0|3,0,0]=4 3700 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 240690a_100020590264_100000037189 [0,1,0,0,0,0|3,0,0]=4 3701 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 527a_100020590264_100000037189 [0,1,0,0,0,0|3,0,0]=4 3702 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)O 240690a_100020590264_100000689029 [0,1,0,0,0,0|3,0,0]=4 3703 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)O 527a_100020590264_100000689029 [0,1,0,0,0,0|3,0,0]=4 3704 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 11a_100020590264_100000751167 [0,1,0,0,0,0|3,0,0]=4 3705 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 1626a_100020590264_100000751167 [0,1,0,0,0,0|3,0,0]=4 3706 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 240690a_100020590264_100000751167 [0,1,0,0,0,0|3,0,0]=4 3707 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 527a_100020590264_100000751167 [0,1,0,0,0,0|3,0,0]=4 3708 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 11a_100020590264_100009999607 [0,1,0,0,0,0|3,0,0]=4 3709 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 1626a_100020590264_100009999607 [0,1,0,0,0,0|3,0,0]=4 3710 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 240690a_100020590264_100009999607 [0,1,0,0,0,0|3,0,0]=4 3711 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 527a_100020590264_100009999607 [0,1,0,0,0,0|3,0,0]=4 3712 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 11a_100020590264_100000739380 [0,1,0,0,0,0|3,0,0]=4 3713 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 1626a_100020590264_100000739380 [0,1,0,0,0,0|3,0,0]=4 3714 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 240690a_100020590264_100000739380 [0,1,0,0,0,0|3,0,0]=4 3715 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 527a_100020590264_100000739380 [0,1,0,0,0,0|3,0,0]=4 3716 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 11a_100020590264_100000739341 [0,1,0,0,0,0|3,0,0]=4 3717 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 1626a_100020590264_100000739341 [0,1,0,0,0,0|3,0,0]=4 3718 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 240690a_100020590264_100000739341 [0,1,0,0,0,0|3,0,0]=4 3719 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 527a_100020590264_100000739341 [0,1,0,0,0,0|3,0,0]=4 3720 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Br 240690a_100020590264_100000744433 [0,1,0,0,0,0|2,0,0]=3 3721 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Br 527a_100020590264_100000744433 [0,1,0,0,0,0|2,0,0]=3 3722 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)C 1626a_100020590264_100000212137 [0,1,0,0,0,0|2,0,0]=3 3723 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)C 240690a_100020590264_100000212137 [0,1,0,0,0,0|2,0,0]=3 3724 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)C 527a_100020590264_100000212137 [0,1,0,0,0,0|2,0,0]=3 3725 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Cl 11a_100020590264_100000188622 [0,1,0,0,0,0|2,0,0]=3 3726 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Cl 240690a_100020590264_100000188622 [0,1,0,0,0,0|2,0,0]=3 3727 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Cl 527a_100020590264_100000188622 [0,1,0,0,0,0|2,0,0]=3 3728 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)F 240690a_100020590264_100000746061 [0,1,0,0,0,0|2,0,0]=3 3729 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)F 527a_100020590264_100000746061 [0,1,0,0,0,0|2,0,0]=3 3730 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)I 240690a_100020590264_100000091984 [0,1,0,0,0,0|2,0,0]=3 3731 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)I 527a_100020590264_100000091984 [0,1,0,0,0,0|2,0,0]=3 3732 B15R1.3309 CSCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100011218213 [0,1,0,0,0,0|3,0,0]=4 3733 B15R1.3309 CSCSCC(=O)c1ccc(cc1O)F 62a_100011218213_100009817053 [0,1,0,0,0,0|3,0,0]=4 3734 B15R1.3309 CSCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100011218213 [0,1,0,0,0,0|3,0,0]=4 3735 B15R1.3309 CSCSCC(=O)c1ccc(cc1O)O 62a_100011218213_100009814262 [0,1,0,0,0,0|3,0,0]=4 3736 B15R1.3309 Cc1cc(ccc1C(=O)CCCCF)Br 1458a_100000741311_100000729493 [0,1,0,0,0,0|3,0,0]=4 3737 B15R1.3309 Cc1cc(ccc1C(=O)CCCCF)Cl 1458a_100000688705_100000729493 [0,1,0,0,0,0|3,0,0]=4 3738 B15R1.3309 Cc1cc(ccc1C(=O)CCCCF)F 1458a_100000686989_100000729493 [0,1,0,0,0,0|3,0,0]=4 3739 B15R1.3309 Cc1cc(ccc1C(=O)CCCCF)I 1458a_100010189873_100000729493 [0,1,0,0,0,0|3,0,0]=4 3740 B15R1.3309 Cc1cc(ccc1C(=O)CCCCF)O 1458a_100000692822_100000729493 [0,1,0,0,0,0|3,0,0]=4 3741 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)Br 1458a_100000741311_100000210776 [0,1,0,0,0,0|3,0,0]=4 3742 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)Cl 1458a_100000688705_100000210776 [0,1,0,0,0,0|3,0,0]=4 3743 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)F 1458a_100000686989_100000210776 [0,1,0,0,0,0|3,0,0]=4 3744 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)I 1458a_100010189873_100000210776 [0,1,0,0,0,0|3,0,0]=4 3745 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)O 1458a_100000692822_100000210776 [0,1,0,0,0,0|3,0,0]=4 3746 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 11a_100015189416_100000741311 [0,1,0,0,0,0|3,0,0]=4 3747 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 1626a_100015189416_100000741311 [0,1,0,0,0,0|3,0,0]=4 3748 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 240690a_100015189416_100000741311 [0,1,0,0,0,0|3,0,0]=4 3749 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 527a_100015189416_100000741311 [0,1,0,0,0,0|3,0,0]=4 3750 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 11a_100015189416_100000688705 [0,1,0,0,0,0|3,0,0]=4 3751 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 1626a_100015189416_100000688705 [0,1,0,0,0,0|3,0,0]=4 3752 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 240690a_100015189416_100000688705 [0,1,0,0,0,0|3,0,0]=4 3753 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 527a_100015189416_100000688705 [0,1,0,0,0,0|3,0,0]=4 3754 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 11a_100015189416_100000686989 [0,1,0,0,0,0|3,0,0]=4 3755 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 1626a_100015189416_100000686989 [0,1,0,0,0,0|3,0,0]=4 3756 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 240690a_100015189416_100000686989 [0,1,0,0,0,0|3,0,0]=4 3757 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 527a_100015189416_100000686989 [0,1,0,0,0,0|3,0,0]=4 3758 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 11a_100015189416_100010189873 [0,1,0,0,0,0|3,0,0]=4 3759 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 1626a_100015189416_100010189873 [0,1,0,0,0,0|3,0,0]=4 3760 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 240690a_100015189416_100010189873 [0,1,0,0,0,0|3,0,0]=4 3761 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 527a_100015189416_100010189873 [0,1,0,0,0,0|3,0,0]=4 3762 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)O 240690a_100015189416_100000692822 [0,1,0,0,0,0|3,0,0]=4 3763 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)O 527a_100015189416_100000692822 [0,1,0,0,0,0|3,0,0]=4 3764 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Br 240690a_100000182051_100000741311 [0,1,0,0,0,0|3,0,0]=4 3765 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Br 527a_100000182051_100000741311 [0,1,0,0,0,0|3,0,0]=4 3766 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Cl 240690a_100000182051_100000688705 [0,1,0,0,0,0|3,0,0]=4 3767 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Cl 527a_100000182051_100000688705 [0,1,0,0,0,0|3,0,0]=4 3768 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)F 240690a_100000182051_100000686989 [0,1,0,0,0,0|3,0,0]=4 3769 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)F 527a_100000182051_100000686989 [0,1,0,0,0,0|3,0,0]=4 3770 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)I 240690a_100000182051_100010189873 [0,1,0,0,0,0|3,0,0]=4 3771 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)I 527a_100000182051_100010189873 [0,1,0,0,0,0|3,0,0]=4 3772 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)O 240690a_100000182051_100000692822 [0,1,0,0,0,0|3,0,0]=4 3773 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)O 527a_100000182051_100000692822 [0,1,0,0,0,0|3,0,0]=4 3774 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)CCCCF 1458a_100000685072_100000729493 [0,1,0,0,0,0|3,0,0]=4 3775 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)CCCCO 1458a_100000685072_100000210776 [0,1,0,0,0,0|3,0,0]=4 3776 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 11a_100015189416_100000685072 [0,1,0,0,0,0|3,0,0]=4 3777 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 1626a_100015189416_100000685072 [0,1,0,0,0,0|3,0,0]=4 3778 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 240690a_100015189416_100000685072 [0,1,0,0,0,0|3,0,0]=4 3779 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 527a_100015189416_100000685072 [0,1,0,0,0,0|3,0,0]=4 3780 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCO 240690a_100000182051_100000685072 [0,1,0,0,0,0|3,0,0]=4 3781 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCO 527a_100000182051_100000685072 [0,1,0,0,0,0|3,0,0]=4 3782 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CCCCF 1458a_100000211164_100000729493 [0,1,0,0,0,0|3,0,0]=4 3783 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CCCCO 1458a_100000211164_100000210776 [0,1,0,0,0,0|3,0,0]=4 3784 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 11a_100015189416_100000211164 [0,1,0,0,0,0|3,0,0]=4 3785 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 1626a_100015189416_100000211164 [0,1,0,0,0,0|3,0,0]=4 3786 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 240690a_100015189416_100000211164 [0,1,0,0,0,0|3,0,0]=4 3787 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 527a_100015189416_100000211164 [0,1,0,0,0,0|3,0,0]=4 3788 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCO 240690a_100000182051_100000211164 [0,1,0,0,0,0|3,0,0]=4 3789 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCO 527a_100000182051_100000211164 [0,1,0,0,0,0|3,0,0]=4 3790 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)CCCCF 1458a_100000766932_100000729493 [0,1,0,0,0,0|3,0,0]=4 3791 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)CCCCO 1458a_100000766932_100000210776 [0,1,0,0,0,0|3,0,0]=4 3792 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 11a_100015189416_100000766932 [0,1,0,0,0,0|3,0,0]=4 3793 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 1626a_100015189416_100000766932 [0,1,0,0,0,0|3,0,0]=4 3794 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 240690a_100015189416_100000766932 [0,1,0,0,0,0|3,0,0]=4 3795 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 527a_100015189416_100000766932 [0,1,0,0,0,0|3,0,0]=4 3796 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCO 240690a_100000182051_100000766932 [0,1,0,0,0,0|3,0,0]=4 3797 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCO 527a_100000182051_100000766932 [0,1,0,0,0,0|3,0,0]=4 3798 B15R1.3309 Cc1ccc(c(c1)F)C(=O)CCCCF 1458a_100000766033_100000729493 [0,1,0,0,0,0|3,0,0]=4 3799 B15R1.3309 Cc1ccc(c(c1)F)C(=O)CCCCO 1458a_100000766033_100000210776 [0,1,0,0,0,0|3,0,0]=4 3800 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 11a_100015189416_100000766033 [0,1,0,0,0,0|3,0,0]=4 3801 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 1626a_100015189416_100000766033 [0,1,0,0,0,0|3,0,0]=4 3802 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 240690a_100015189416_100000766033 [0,1,0,0,0,0|3,0,0]=4 3803 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 527a_100015189416_100000766033 [0,1,0,0,0,0|3,0,0]=4 3804 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCO 240690a_100000182051_100000766033 [0,1,0,0,0,0|3,0,0]=4 3805 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCO 527a_100000182051_100000766033 [0,1,0,0,0,0|3,0,0]=4 3806 B15R1.3309 Cc1ccc(c(c1)I)C(=O)CCCCF 1458a_100009999607_100000729493 [0,1,0,0,0,0|3,0,0]=4 3807 B15R1.3309 Cc1ccc(c(c1)I)C(=O)CCCCO 1458a_100009999607_100000210776 [0,1,0,0,0,0|3,0,0]=4 3808 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 11a_100015189416_100009999607 [0,1,0,0,0,0|3,0,0]=4 3809 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 1626a_100015189416_100009999607 [0,1,0,0,0,0|3,0,0]=4 3810 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 240690a_100015189416_100009999607 [0,1,0,0,0,0|3,0,0]=4 3811 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 527a_100015189416_100009999607 [0,1,0,0,0,0|3,0,0]=4 3812 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCO 240690a_100000182051_100009999607 [0,1,0,0,0,0|3,0,0]=4 3813 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCO 527a_100000182051_100009999607 [0,1,0,0,0,0|3,0,0]=4 3814 B15R1.3309 Cc1ccc(c(c1)O)C(=O)CCCC#N 1458a_100000212137_100000211468 [0,1,0,0,0,0|2,0,1]=4 3815 B15R1.3309 Cc1ccc(c(c1)O)C(=O)CCCCF 1458a_100000212137_100000729493 [0,1,0,0,0,0|2,0,0]=3 3816 B15R1.3309 Cc1ccc(c(c1)O)C(=O)CCCCO 1458a_100000212137_100000210776 [0,1,0,0,0,0|2,0,0]=3 3817 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCC#N 1626a_100000720768_100000212137 [0,1,0,0,0,0|2,0,1]=4 3818 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCC#N 240690a_100000720768_100000212137 [0,1,0,0,0,0|2,0,1]=4 3819 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCC#N 527a_100000720768_100000212137 [0,1,0,0,0,0|2,0,1]=4 3820 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCF 1626a_100015189416_100000212137 [0,1,0,0,0,0|2,0,0]=3 3821 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCF 240690a_100015189416_100000212137 [0,1,0,0,0,0|2,0,0]=3 3822 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCF 527a_100015189416_100000212137 [0,1,0,0,0,0|2,0,0]=3 3823 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCO 240690a_100000182051_100000212137 [0,1,0,0,0,0|2,0,0]=3 3824 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCO 527a_100000182051_100000212137 [0,1,0,0,0,0|2,0,0]=3 3825 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NNCCO 22a_100000210001_100000212137 [0,1,0,0,0,0|3,0,0]=4 3826 B15R1.3309 N#CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000211468 [0,1,0,0,0,0|2,0,1]=4 3827 B15R1.3309 N#CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000211468 [0,1,0,0,0,0|2,0,1]=4 3828 B15R1.3309 N#CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000211468 [0,1,0,0,0,0|2,0,1]=4 3829 B15R1.3309 N#CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000211468 [0,1,0,0,0,0|2,0,1]=4 3830 B15R1.3309 N#CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000211468 [0,1,0,0,0,0|2,0,1]=4 3831 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Br 240690a_100000720768_100000744433 [0,1,0,0,0,0|2,0,1]=4 3832 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Br 527a_100000720768_100000744433 [0,1,0,0,0,0|2,0,1]=4 3833 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Cl 11a_100000720768_100000188622 [0,1,0,0,0,0|2,0,1]=4 3834 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Cl 240690a_100000720768_100000188622 [0,1,0,0,0,0|2,0,1]=4 3835 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Cl 527a_100000720768_100000188622 [0,1,0,0,0,0|2,0,1]=4 3836 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)F 240690a_100000720768_100000746061 [0,1,0,0,0,0|2,0,1]=4 3837 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)F 527a_100000720768_100000746061 [0,1,0,0,0,0|2,0,1]=4 3838 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)I 240690a_100000720768_100000091984 [0,1,0,0,0,0|2,0,1]=4 3839 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)I 527a_100000720768_100000091984 [0,1,0,0,0,0|2,0,1]=4 3840 B15R1.3309 NCCOCC(=O)c1ccc(cc1O)F 34a_100000210304_100009817053 [0,1,0,0,0,0|3,0,0]=4 3841 B15R1.3309 NCCOCC(=O)c1ccc(cc1O)O 34a_100000210304_100009814262 [0,1,0,0,0,0|3,0,0]=4 3842 B15R1.3309 O=C(CCCCF)c1ccc(cc1Br)Br 1458a_100000762965_100000729493 [0,1,0,0,0,0|3,0,0]=4 3843 B15R1.3309 O=C(CCCCF)c1ccc(cc1Br)Cl 1458a_100000766353_100000729493 [0,1,0,0,0,0|3,0,0]=4 3844 B15R1.3309 O=C(CCCCF)c1ccc(cc1Br)F 1458a_100000212304_100000729493 [0,1,0,0,0,0|3,0,0]=4 3845 B15R1.3309 O=C(CCCCF)c1ccc(cc1Br)I 1458a_100012360512_100000729493 [0,1,0,0,0,0|3,0,0]=4 3846 B15R1.3309 O=C(CCCCF)c1ccc(cc1Br)O 1458a_100012344906_100000729493 [0,1,0,0,0,0|3,0,0]=4 3847 B15R1.3309 O=C(CCCCF)c1ccc(cc1Cl)Br 1458a_100000741628_100000729493 [0,1,0,0,0,0|3,0,0]=4 3848 B15R1.3309 O=C(CCCCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100000729493 [0,1,0,0,0,0|3,0,0]=4 3849 B15R1.3309 O=C(CCCCF)c1ccc(cc1Cl)F 1458a_100000211397_100000729493 [0,1,0,0,0,0|3,0,0]=4 3850 B15R1.3309 O=C(CCCCF)c1ccc(cc1Cl)I 1458a_100000751301_100000729493 [0,1,0,0,0,0|3,0,0]=4 3851 B15R1.3309 O=C(CCCCF)c1ccc(cc1Cl)O 1458a_100000702456_100000729493 [0,1,0,0,0,0|3,0,0]=4 3852 B15R1.3309 O=C(CCCCF)c1ccc(cc1F)Br 1458a_100000214689_100000729493 [0,1,0,0,0,0|3,0,0]=4 3853 B15R1.3309 O=C(CCCCF)c1ccc(cc1F)Cl 1458a_100000212326_100000729493 [0,1,0,0,0,0|3,0,0]=4 3854 B15R1.3309 O=C(CCCCF)c1ccc(cc1F)F 1458a_100000211022_100000729493 [0,1,0,0,0,0|3,0,0]=4 3855 B15R1.3309 O=C(CCCCF)c1ccc(cc1F)I 1458a_100000037189_100000729493 [0,1,0,0,0,0|3,0,0]=4 3856 B15R1.3309 O=C(CCCCF)c1ccc(cc1F)O 1458a_100000689029_100000729493 [0,1,0,0,0,0|3,0,0]=4 3857 B15R1.3309 O=C(CCCCF)c1ccc(cc1I)Br 1458a_100000751167_100000729493 [0,1,0,0,0,0|3,0,0]=4 3858 B15R1.3309 O=C(CCCCF)c1ccc(cc1I)Cl 1458a_100000739380_100000729493 [0,1,0,0,0,0|3,0,0]=4 3859 B15R1.3309 O=C(CCCCF)c1ccc(cc1I)F 1458a_100000739341_100000729493 [0,1,0,0,0,0|3,0,0]=4 3860 B15R1.3309 O=C(CCCCF)c1ccc(cc1O)Br 1458a_100000744433_100000729493 [0,1,0,0,0,0|2,0,0]=3 3861 B15R1.3309 O=C(CCCCF)c1ccc(cc1O)Cl 1458a_100000188622_100000729493 [0,1,0,0,0,0|2,0,0]=3 3862 B15R1.3309 O=C(CCCCF)c1ccc(cc1O)F 1458a_100000746061_100000729493 [0,1,0,0,0,0|2,0,0]=3 3863 B15R1.3309 O=C(CCCCF)c1ccc(cc1O)I 1458a_100000091984_100000729493 [0,1,0,0,0,0|2,0,0]=3 3864 B15R1.3309 O=C(CCCCF)c1ccc(cc1O)O 1458a_100000212172_100000729493 [0,1,0,0,0,0|2,0,0]=3 3865 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)Br 1458a_100000762965_100000210776 [0,1,0,0,0,0|3,0,0]=4 3866 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000210776 [0,1,0,0,0,0|3,0,0]=4 3867 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)F 1458a_100000212304_100000210776 [0,1,0,0,0,0|3,0,0]=4 3868 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)I 1458a_100012360512_100000210776 [0,1,0,0,0,0|3,0,0]=4 3869 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)O 1458a_100012344906_100000210776 [0,1,0,0,0,0|3,0,0]=4 3870 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000210776 [0,1,0,0,0,0|3,0,0]=4 3871 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210776 [0,1,0,0,0,0|3,0,0]=4 3872 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)F 1458a_100000211397_100000210776 [0,1,0,0,0,0|3,0,0]=4 3873 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)I 1458a_100000751301_100000210776 [0,1,0,0,0,0|3,0,0]=4 3874 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)O 1458a_100000702456_100000210776 [0,1,0,0,0,0|3,0,0]=4 3875 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)Br 1458a_100000214689_100000210776 [0,1,0,0,0,0|3,0,0]=4 3876 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)Cl 1458a_100000212326_100000210776 [0,1,0,0,0,0|3,0,0]=4 3877 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)F 1458a_100000211022_100000210776 [0,1,0,0,0,0|3,0,0]=4 3878 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)I 1458a_100000037189_100000210776 [0,1,0,0,0,0|3,0,0]=4 3879 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)O 1458a_100000689029_100000210776 [0,1,0,0,0,0|3,0,0]=4 3880 B15R1.3309 O=C(CCCCO)c1ccc(cc1I)Br 1458a_100000751167_100000210776 [0,1,0,0,0,0|3,0,0]=4 3881 B15R1.3309 O=C(CCCCO)c1ccc(cc1I)Cl 1458a_100000739380_100000210776 [0,1,0,0,0,0|3,0,0]=4 3882 B15R1.3309 O=C(CCCCO)c1ccc(cc1I)F 1458a_100000739341_100000210776 [0,1,0,0,0,0|3,0,0]=4 3883 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)Br 1458a_100000744433_100000210776 [0,1,0,0,0,0|2,0,0]=3 3884 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)Cl 1458a_100000188622_100000210776 [0,1,0,0,0,0|2,0,0]=3 3885 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)F 1458a_100000746061_100000210776 [0,1,0,0,0,0|2,0,0]=3 3886 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)I 1458a_100000091984_100000210776 [0,1,0,0,0,0|2,0,0]=3 3887 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)O 1458a_100000212172_100000210776 [0,1,0,0,0,0|2,0,0]=3 3888 B15R1.3309 O=C(CNCCF)c1ccc(cc1O)F 34a_100000724931_100009817053 [0,1,0,0,0,0|3,0,0]=4 3889 B15R1.3309 O=C(CNCCF)c1ccc(cc1O)O 34a_100000724931_100009814262 [0,1,0,0,0,0|3,0,0]=4 3890 B15R1.3309 O=C(CNCCO)c1ccc(cc1O)F 34a_100016990907_100009817053 [0,1,0,0,0,0|3,0,0]=4 3891 B15R1.3309 O=C(CNCCO)c1ccc(cc1O)O 34a_100016990907_100009814262 [0,1,0,0,0,0|3,0,0]=4 3892 B15R1.3309 O=C(COCCBr)c1ccc(cc1O)F 34a_100000211926_100009817053 [0,1,0,0,0,0|3,0,0]=4 3893 B15R1.3309 O=C(COCCBr)c1ccc(cc1O)O 34a_100000211926_100009814262 [0,1,0,0,0,0|3,0,0]=4 3894 B15R1.3309 O=C(CSCCF)c1ccc(cc1O)F 62a_100009817053_100011217306 [0,1,0,0,0,0|3,0,0]=4 3895 B15R1.3309 O=C(CSCCF)c1ccc(cc1O)F 62a_100011217306_100009817053 [0,1,0,0,0,0|3,0,0]=4 3896 B15R1.3309 O=C(CSCCF)c1ccc(cc1O)O 62a_100009814262_100011217306 [0,1,0,0,0,0|3,0,0]=4 3897 B15R1.3309 O=C(CSCCF)c1ccc(cc1O)O 62a_100011217306_100009814262 [0,1,0,0,0,0|3,0,0]=4 3898 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)F 62a_100000211926_100009817053 [0,1,0,0,0,0|3,0,0]=4 3899 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)F 62a_100009817053_100000211926 [0,1,0,0,0,0|3,0,0]=4 3900 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)O 62a_100000211926_100009814262 [0,1,0,0,0,0|3,0,0]=4 3901 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)O 62a_100009814262_100000211926 [0,1,0,0,0,0|3,0,0]=4 3902 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 11a_100015189416_100000762965 [0,1,0,0,0,0|3,0,0]=4 3903 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 1626a_100015189416_100000762965 [0,1,0,0,0,0|3,0,0]=4 3904 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 240690a_100015189416_100000762965 [0,1,0,0,0,0|3,0,0]=4 3905 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 527a_100015189416_100000762965 [0,1,0,0,0,0|3,0,0]=4 3906 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 11a_100015189416_100000766353 [0,1,0,0,0,0|3,0,0]=4 3907 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 1626a_100015189416_100000766353 [0,1,0,0,0,0|3,0,0]=4 3908 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 240690a_100015189416_100000766353 [0,1,0,0,0,0|3,0,0]=4 3909 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 527a_100015189416_100000766353 [0,1,0,0,0,0|3,0,0]=4 3910 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 11a_100015189416_100000212304 [0,1,0,0,0,0|3,0,0]=4 3911 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 1626a_100015189416_100000212304 [0,1,0,0,0,0|3,0,0]=4 3912 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 240690a_100015189416_100000212304 [0,1,0,0,0,0|3,0,0]=4 3913 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 527a_100015189416_100000212304 [0,1,0,0,0,0|3,0,0]=4 3914 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 11a_100015189416_100012360512 [0,1,0,0,0,0|3,0,0]=4 3915 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 1626a_100015189416_100012360512 [0,1,0,0,0,0|3,0,0]=4 3916 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 240690a_100015189416_100012360512 [0,1,0,0,0,0|3,0,0]=4 3917 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 527a_100015189416_100012360512 [0,1,0,0,0,0|3,0,0]=4 3918 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)O 240690a_100015189416_100012344906 [0,1,0,0,0,0|3,0,0]=4 3919 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)O 527a_100015189416_100012344906 [0,1,0,0,0,0|3,0,0]=4 3920 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 11a_100015189416_100000741628 [0,1,0,0,0,0|3,0,0]=4 3921 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 1626a_100015189416_100000741628 [0,1,0,0,0,0|3,0,0]=4 3922 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 240690a_100015189416_100000741628 [0,1,0,0,0,0|3,0,0]=4 3923 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 527a_100015189416_100000741628 [0,1,0,0,0,0|3,0,0]=4 3924 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 11a_100015189416_100000185840 [0,1,0,0,0,0|3,0,0]=4 3925 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 1626a_100015189416_100000185840 [0,1,0,0,0,0|3,0,0]=4 3926 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 240690a_100015189416_100000185840 [0,1,0,0,0,0|3,0,0]=4 3927 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 527a_100015189416_100000185840 [0,1,0,0,0,0|3,0,0]=4 3928 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 11a_100015189416_100000211397 [0,1,0,0,0,0|3,0,0]=4 3929 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 1626a_100015189416_100000211397 [0,1,0,0,0,0|3,0,0]=4 3930 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 240690a_100015189416_100000211397 [0,1,0,0,0,0|3,0,0]=4 3931 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 527a_100015189416_100000211397 [0,1,0,0,0,0|3,0,0]=4 3932 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 11a_100015189416_100000751301 [0,1,0,0,0,0|3,0,0]=4 3933 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 1626a_100015189416_100000751301 [0,1,0,0,0,0|3,0,0]=4 3934 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 240690a_100015189416_100000751301 [0,1,0,0,0,0|3,0,0]=4 3935 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 527a_100015189416_100000751301 [0,1,0,0,0,0|3,0,0]=4 3936 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)O 240690a_100015189416_100000702456 [0,1,0,0,0,0|3,0,0]=4 3937 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)O 527a_100015189416_100000702456 [0,1,0,0,0,0|3,0,0]=4 3938 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 11a_100015189416_100000214689 [0,1,0,0,0,0|3,0,0]=4 3939 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 1626a_100015189416_100000214689 [0,1,0,0,0,0|3,0,0]=4 3940 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 240690a_100015189416_100000214689 [0,1,0,0,0,0|3,0,0]=4 3941 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 527a_100015189416_100000214689 [0,1,0,0,0,0|3,0,0]=4 3942 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 11a_100015189416_100000212326 [0,1,0,0,0,0|3,0,0]=4 3943 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 1626a_100015189416_100000212326 [0,1,0,0,0,0|3,0,0]=4 3944 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 240690a_100015189416_100000212326 [0,1,0,0,0,0|3,0,0]=4 3945 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 527a_100015189416_100000212326 [0,1,0,0,0,0|3,0,0]=4 3946 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 11a_100015189416_100000211022 [0,1,0,0,0,0|3,0,0]=4 3947 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 1626a_100015189416_100000211022 [0,1,0,0,0,0|3,0,0]=4 3948 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 240690a_100015189416_100000211022 [0,1,0,0,0,0|3,0,0]=4 3949 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 527a_100015189416_100000211022 [0,1,0,0,0,0|3,0,0]=4 3950 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 11a_100015189416_100000037189 [0,1,0,0,0,0|3,0,0]=4 3951 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 1626a_100015189416_100000037189 [0,1,0,0,0,0|3,0,0]=4 3952 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 240690a_100015189416_100000037189 [0,1,0,0,0,0|3,0,0]=4 3953 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 527a_100015189416_100000037189 [0,1,0,0,0,0|3,0,0]=4 3954 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)O 240690a_100015189416_100000689029 [0,1,0,0,0,0|3,0,0]=4 3955 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)O 527a_100015189416_100000689029 [0,1,0,0,0,0|3,0,0]=4 3956 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 11a_100015189416_100000751167 [0,1,0,0,0,0|3,0,0]=4 3957 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 1626a_100015189416_100000751167 [0,1,0,0,0,0|3,0,0]=4 3958 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 240690a_100015189416_100000751167 [0,1,0,0,0,0|3,0,0]=4 3959 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 527a_100015189416_100000751167 [0,1,0,0,0,0|3,0,0]=4 3960 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 11a_100015189416_100000739380 [0,1,0,0,0,0|3,0,0]=4 3961 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 1626a_100015189416_100000739380 [0,1,0,0,0,0|3,0,0]=4 3962 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 240690a_100015189416_100000739380 [0,1,0,0,0,0|3,0,0]=4 3963 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 527a_100015189416_100000739380 [0,1,0,0,0,0|3,0,0]=4 3964 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 11a_100015189416_100000739341 [0,1,0,0,0,0|3,0,0]=4 3965 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 1626a_100015189416_100000739341 [0,1,0,0,0,0|3,0,0]=4 3966 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 240690a_100015189416_100000739341 [0,1,0,0,0,0|3,0,0]=4 3967 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 527a_100015189416_100000739341 [0,1,0,0,0,0|3,0,0]=4 3968 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Br 240690a_100015189416_100000744433 [0,1,0,0,0,0|2,0,0]=3 3969 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Br 527a_100015189416_100000744433 [0,1,0,0,0,0|2,0,0]=3 3970 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Cl 11a_100015189416_100000188622 [0,1,0,0,0,0|2,0,0]=3 3971 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Cl 240690a_100015189416_100000188622 [0,1,0,0,0,0|2,0,0]=3 3972 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Cl 527a_100015189416_100000188622 [0,1,0,0,0,0|2,0,0]=3 3973 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)F 240690a_100015189416_100000746061 [0,1,0,0,0,0|2,0,0]=3 3974 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)F 527a_100015189416_100000746061 [0,1,0,0,0,0|2,0,0]=3 3975 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)I 240690a_100015189416_100000091984 [0,1,0,0,0,0|2,0,0]=3 3976 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)I 527a_100015189416_100000091984 [0,1,0,0,0,0|2,0,0]=3 3977 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Br 240690a_100000182051_100000762965 [0,1,0,0,0,0|3,0,0]=4 3978 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Br 527a_100000182051_100000762965 [0,1,0,0,0,0|3,0,0]=4 3979 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Cl 240690a_100000182051_100000766353 [0,1,0,0,0,0|3,0,0]=4 3980 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Cl 527a_100000182051_100000766353 [0,1,0,0,0,0|3,0,0]=4 3981 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)F 240690a_100000182051_100000212304 [0,1,0,0,0,0|3,0,0]=4 3982 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)F 527a_100000182051_100000212304 [0,1,0,0,0,0|3,0,0]=4 3983 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)I 240690a_100000182051_100012360512 [0,1,0,0,0,0|3,0,0]=4 3984 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)I 527a_100000182051_100012360512 [0,1,0,0,0,0|3,0,0]=4 3985 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)O 240690a_100000182051_100012344906 [0,1,0,0,0,0|3,0,0]=4 3986 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)O 527a_100000182051_100012344906 [0,1,0,0,0,0|3,0,0]=4 3987 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Br 240690a_100000182051_100000741628 [0,1,0,0,0,0|3,0,0]=4 3988 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Br 527a_100000182051_100000741628 [0,1,0,0,0,0|3,0,0]=4 3989 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Cl 240690a_100000182051_100000185840 [0,1,0,0,0,0|3,0,0]=4 3990 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Cl 527a_100000182051_100000185840 [0,1,0,0,0,0|3,0,0]=4 3991 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)F 240690a_100000182051_100000211397 [0,1,0,0,0,0|3,0,0]=4 3992 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)F 527a_100000182051_100000211397 [0,1,0,0,0,0|3,0,0]=4 3993 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)I 240690a_100000182051_100000751301 [0,1,0,0,0,0|3,0,0]=4 3994 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)I 527a_100000182051_100000751301 [0,1,0,0,0,0|3,0,0]=4 3995 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)O 240690a_100000182051_100000702456 [0,1,0,0,0,0|3,0,0]=4 3996 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)O 527a_100000182051_100000702456 [0,1,0,0,0,0|3,0,0]=4 3997 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Br 240690a_100000182051_100000214689 [0,1,0,0,0,0|3,0,0]=4 3998 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Br 527a_100000182051_100000214689 [0,1,0,0,0,0|3,0,0]=4 3999 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Cl 240690a_100000182051_100000212326 [0,1,0,0,0,0|3,0,0]=4 4000 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Cl 527a_100000182051_100000212326 [0,1,0,0,0,0|3,0,0]=4 4001 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)F 240690a_100000182051_100000211022 [0,1,0,0,0,0|3,0,0]=4 4002 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)F 527a_100000182051_100000211022 [0,1,0,0,0,0|3,0,0]=4 4003 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)I 240690a_100000182051_100000037189 [0,1,0,0,0,0|3,0,0]=4 4004 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)I 527a_100000182051_100000037189 [0,1,0,0,0,0|3,0,0]=4 4005 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)O 240690a_100000182051_100000689029 [0,1,0,0,0,0|3,0,0]=4 4006 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)O 527a_100000182051_100000689029 [0,1,0,0,0,0|3,0,0]=4 4007 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Br 240690a_100000182051_100000751167 [0,1,0,0,0,0|3,0,0]=4 4008 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Br 527a_100000182051_100000751167 [0,1,0,0,0,0|3,0,0]=4 4009 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Cl 240690a_100000182051_100000739380 [0,1,0,0,0,0|3,0,0]=4 4010 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Cl 527a_100000182051_100000739380 [0,1,0,0,0,0|3,0,0]=4 4011 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)F 240690a_100000182051_100000739341 [0,1,0,0,0,0|3,0,0]=4 4012 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)F 527a_100000182051_100000739341 [0,1,0,0,0,0|3,0,0]=4 4013 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Br 240690a_100000182051_100000744433 [0,1,0,0,0,0|2,0,0]=3 4014 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Br 527a_100000182051_100000744433 [0,1,0,0,0,0|2,0,0]=3 4015 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Cl 240690a_100000182051_100000188622 [0,1,0,0,0,0|2,0,0]=3 4016 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Cl 527a_100000182051_100000188622 [0,1,0,0,0,0|2,0,0]=3 4017 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)F 240690a_100000182051_100000746061 [0,1,0,0,0,0|2,0,0]=3 4018 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)F 527a_100000182051_100000746061 [0,1,0,0,0,0|2,0,0]=3 4019 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)I 240690a_100000182051_100000091984 [0,1,0,0,0,0|2,0,0]=3 4020 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)I 527a_100000182051_100000091984 [0,1,0,0,0,0|2,0,0]=3 4021 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)Br 22a_100000210001_100000744433 [0,1,0,0,0,0|3,0,0]=4 4022 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)Cl 22a_100000210001_100000188622 [0,1,0,0,0,0|3,0,0]=4 4023 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)F 22a_100000210001_100000746061 [0,1,0,0,0,0|3,0,0]=4 4024 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)I 22a_100000210001_100000091984 [0,1,0,0,0,0|3,0,0]=4 4025 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)O 22a_100000210001_100000212172 [0,1,0,0,0,0|3,0,0]=4 4026 B15R1.3309 O=C(OCSCF)c1ccc(cc1Cl)Cl 62a_100010978946_100015361967 [0,1,0,0,0,0|3,0,0]=4 4027 B15R1.3309 [13CH3]OCCNC(=O)c1ccc(cc1Cl)N 34a_100000725507_200025704644 [0,1,0,0,0,0|3,0,0]=4 4028 B15R1.3309 [13CH3]SCCCC(=O)c1ccc(cc1F)F 62a_100012405562_200025704644 [0,1,0,0,0,0|3,0,0]=4 4029 B15R1.3309 [13CH3]SCCCC(=O)c1ccc(cc1F)F 62a_200025704644_100012405562 [0,1,0,0,0,0|3,0,0]=4 4030 B15R1.3402 CCCCCN(CC)c1ccccc1O 269982a_103624766699_100000210215 [0,1,0,0,0,0|3,0,0]=4 4031 B15R1.3402 CCCCOC(C#N)c1ccccc1Cl 7a_200011294979_100000210211 [0,1,0,0,0,0|2,0,1]=4 4032 B15R1.3402 CCCCOC(CC)c1ccccc1F 34a_200011689290_100000210210 [0,1,0,0,0,0|2,0,1]=4 4033 B15R1.3402 CCCCOC(CC)c1ccccc1F 7a_200011689290_100000210211 [0,1,0,0,0,0|2,0,1]=4 4034 B15R1.3402 CCCCOC(CN)c1ccccc1Br 34a_100011236429_100000210210 [0,1,0,0,0,0|2,0,1]=4 4035 B15R1.3402 CCCCOC(CN)c1ccccc1Cl 34a_200000759403_100000210210 [0,1,0,0,0,0|2,0,1]=4 4036 B15R1.3402 CCCNN=C(CC)c1ccccc1O 4a_100000740057_100000184720 [0,1,0,0,0,0|3,0,0]=4 4037 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000747444 [0,1,0,0,0,0|2,0,1]=4 4038 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1Br 1458a_100000211992_100000199116 [0,1,0,0,0,0|2,0,1]=4 4039 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1C 1458a_100000211992_100000741374 [0,1,0,0,0,0|2,0,1]=4 4040 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000747444 [0,1,0,0,0,0|2,0,1]=4 4041 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000747444 [0,1,0,0,0,0|2,0,1]=4 4042 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1Cl 1458a_100000211992_100000211432 [0,1,0,0,0,0|2,0,1]=4 4043 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000747444 [0,1,0,0,0,0|2,0,1]=4 4044 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1F 1458a_100000211992_100000204681 [0,1,0,0,0,0|2,0,1]=4 4045 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000747444 [0,1,0,0,0,0|2,0,1]=4 4046 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1O 1458a_100000211992_100000188908 [0,1,0,0,0,0|1,0,1]=3 4047 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000747444 [0,1,0,0,0,0|1,0,1]=3 4048 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000747444 [0,1,0,0,0,0|1,0,2]=4 4049 B15R1.3722 CCCC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100011216630 [0,1,0,0,0,0|2,0,0]=3 4050 B15R1.3722 CCCC(C)CC(=O)c1ccccc1C 1458a_100000212026_100011216630 [0,1,0,0,0,0|2,0,0]=3 4051 B15R1.3722 CCCC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100011216630 [0,1,0,0,0,0|2,0,0]=3 4052 B15R1.3722 CCCC(C)CC(=O)c1ccccc1F 1458a_100000188656_100011216630 [0,1,0,0,0,0|2,0,0]=3 4053 B15R1.3722 CCCC(C)CC(=O)c1ccccc1I 1458a_100000187884_100011216630 [0,1,0,0,0,0|2,0,0]=3 4054 B15R1.3722 CCCC(C)CC(=O)c1ccccc1O 1458a_100015234032_100011216630 [0,1,0,0,0,0|1,0,0]=2 4055 B15R1.3722 CCCC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011216630 [0,1,0,0,0,0|1,0,1]=3 4056 B15R1.3722 CCCC(C)CN(C)c1ccccc1O 269982a_100000033821_100011216630 [0,1,0,0,0,0|3,0,0]=4 4057 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Br 11a_100000741246_100000188424 [0,1,0,0,0,0|2,0,0]=3 4058 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Br 1626a_100000741246_100000188424 [0,1,0,0,0,0|2,0,0]=3 4059 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Br 240690a_100000741246_100000188424 [0,1,0,0,0,0|2,0,0]=3 4060 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Br 527a_100000741246_100000188424 [0,1,0,0,0,0|2,0,0]=3 4061 B15R1.3722 CCCC(C)NC(=O)c1ccccc1C 11a_100000741246_100000212026 [0,1,0,0,0,0|2,0,0]=3 4062 B15R1.3722 CCCC(C)NC(=O)c1ccccc1C 1626a_100000741246_100000212026 [0,1,0,0,0,0|2,0,0]=3 4063 B15R1.3722 CCCC(C)NC(=O)c1ccccc1C 240690a_100000741246_100000212026 [0,1,0,0,0,0|2,0,0]=3 4064 B15R1.3722 CCCC(C)NC(=O)c1ccccc1C 527a_100000741246_100000212026 [0,1,0,0,0,0|2,0,0]=3 4065 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Cl 11a_100000741246_100000185844 [0,1,0,0,0,0|2,0,0]=3 4066 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Cl 1626a_100000741246_100000185844 [0,1,0,0,0,0|2,0,0]=3 4067 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Cl 240690a_100000741246_100000185844 [0,1,0,0,0,0|2,0,0]=3 4068 B15R1.3722 CCCC(C)NC(=O)c1ccccc1Cl 527a_100000741246_100000185844 [0,1,0,0,0,0|2,0,0]=3 4069 B15R1.3722 CCCC(C)NC(=O)c1ccccc1F 11a_100000741246_100000188656 [0,1,0,0,0,0|2,0,0]=3 4070 B15R1.3722 CCCC(C)NC(=O)c1ccccc1F 1626a_100000741246_100000188656 [0,1,0,0,0,0|2,0,0]=3 4071 B15R1.3722 CCCC(C)NC(=O)c1ccccc1F 240690a_100000741246_100000188656 [0,1,0,0,0,0|2,0,0]=3 4072 B15R1.3722 CCCC(C)NC(=O)c1ccccc1F 527a_100000741246_100000188656 [0,1,0,0,0,0|2,0,0]=3 4073 B15R1.3722 CCCC(C)NC(=O)c1ccccc1I 11a_100000741246_100000187884 [0,1,0,0,0,0|2,0,0]=3 4074 B15R1.3722 CCCC(C)NC(=O)c1ccccc1I 1626a_100000741246_100000187884 [0,1,0,0,0,0|2,0,0]=3 4075 B15R1.3722 CCCC(C)NC(=O)c1ccccc1I 240690a_100000741246_100000187884 [0,1,0,0,0,0|2,0,0]=3 4076 B15R1.3722 CCCC(C)NC(=O)c1ccccc1I 527a_100000741246_100000187884 [0,1,0,0,0,0|2,0,0]=3 4077 B15R1.3722 CCCC(C)NC(=O)c1ccccc1O 240690a_100000741246_100015234032 [0,1,0,0,0,0|1,0,0]=2 4078 B15R1.3722 CCCC(C)NC(=O)c1ccccc1[O-] 1626a_100000741246_100009911694 [0,1,0,0,0,0|1,0,1]=3 4079 B15R1.3722 CCCC(C)NC(=O)c1ccccc1[O-] 240690a_100000741246_100009911694 [0,1,0,0,0,0|1,0,1]=3 4080 B15R1.3722 CCCC(C)NC(=O)c1ccccc1[O-] 527a_100000741246_100009911694 [0,1,0,0,0,0|1,0,1]=3 4081 B15R1.3722 CCCC(C)N[C@H](C)c1ccccc1O 2230a_100025703389_100000766640 [0,1,0,0,0,0|2,0,1]=4 4082 B15R1.3722 CCCC(C)N[C@H](C)c1ccccc1O 270004a_100025703389_100000211909 [0,1,0,0,0,0|2,0,1]=4 4083 B15R1.3722 CCCC(C)OC(C)c1ccccc1Br 34a_100000702211_100000766640 [0,1,0,0,0,0|2,0,1]=4 4084 B15R1.3722 CCCC(C)OC(C)c1ccccc1Br 7a_100000702211_100000766640 [0,1,0,0,0,0|2,0,1]=4 4085 B15R1.3722 CCCC(C)OC(C)c1ccccc1C 34a_100000742021_100000766640 [0,1,0,0,0,0|2,0,1]=4 4086 B15R1.3722 CCCC(C)OC(C)c1ccccc1C 7a_100000742021_100000766640 [0,1,0,0,0,0|2,0,1]=4 4087 B15R1.3722 CCCC(C)OC(C)c1ccccc1Cl 34a_100000740796_100000766640 [0,1,0,0,0,0|2,0,1]=4 4088 B15R1.3722 CCCC(C)OC(C)c1ccccc1Cl 7a_100000740796_100000766640 [0,1,0,0,0,0|2,0,1]=4 4089 B15R1.3722 CCCC(C)OC(C)c1ccccc1Cl 7a_100000764384_100000181259 [0,1,0,0,0,0|2,0,1]=4 4090 B15R1.3722 CCCC(C)OC(C)c1ccccc1F 34a_100000697922_100000766640 [0,1,0,0,0,0|2,0,1]=4 4091 B15R1.3722 CCCC(C)OC(C)c1ccccc1F 34a_100000764384_200000741388 [0,1,0,0,0,0|2,0,1]=4 4092 B15R1.3722 CCCC(C)OC(C)c1ccccc1F 7a_100000697922_100000766640 [0,1,0,0,0,0|2,0,1]=4 4093 B15R1.3722 CCCC(C)OC(C)c1ccccc1F 7a_100000764384_200000741388 [0,1,0,0,0,0|2,0,1]=4 4094 B15R1.3722 CCCC(C)OC(C)c1ccccc1N 7a_100011405641_100000766640 [0,1,0,0,0,0|2,0,1]=4 4095 B15R1.3722 CCCN(C)CC(=O)c1ccccc1Br 269982a_100000747261_100000199116 [0,1,0,0,0,0|3,0,0]=4 4096 B15R1.3722 CCCN(C)CC(=O)c1ccccc1C 2230a_100000747261_100000741374 [0,1,0,0,0,0|3,0,0]=4 4097 B15R1.3722 CCCN(C)CC(=O)c1ccccc1C 269982a_100000747261_100000741374 [0,1,0,0,0,0|3,0,0]=4 4098 B15R1.3722 CCCN(C)CC(=O)c1ccccc1Cl 269982a_100000747261_100000211432 [0,1,0,0,0,0|3,0,0]=4 4099 B15R1.3722 CCCN(C)CC(=O)c1ccccc1F 269982a_100000747261_100000204681 [0,1,0,0,0,0|3,0,0]=4 4100 B15R1.3722 CCCN(C)CC(=O)c1ccccc1O 269982a_100000747261_100000188908 [0,1,0,0,0,0|2,0,0]=3 4101 B15R1.3722 CCNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183381 [0,1,0,0,0,0|2,0,1]=4 4102 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000188475 [0,1,0,0,0,0|2,0,1]=4 4103 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1O 271570a_203496583355_100011248968 [0,1,0,0,0,0|2,0,1]=4 4104 B15R1.3722 CN(CCO)CC(=O)c1ccccc1O 269982a_100000210263_100000188908 [0,1,0,0,0,0|3,0,0]=4 4105 B15R1.3722 COCC(=O)CC(=O)c1ccccc1O 1458a_100000210968_100000188908 [0,1,0,0,0,0|2,0,1]=4 4106 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Br 11a_100000764878_100000188424 [0,1,0,0,0,0|3,0,0]=4 4107 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Br 1626a_100000764878_100000188424 [0,1,0,0,0,0|3,0,0]=4 4108 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Br 240690a_100000764878_100000188424 [0,1,0,0,0,0|3,0,0]=4 4109 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Br 527a_100000764878_100000188424 [0,1,0,0,0,0|3,0,0]=4 4110 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1C 11a_100000764878_100000212026 [0,1,0,0,0,0|3,0,0]=4 4111 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1C 1626a_100000764878_100000212026 [0,1,0,0,0,0|3,0,0]=4 4112 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1C 240690a_100000764878_100000212026 [0,1,0,0,0,0|3,0,0]=4 4113 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1C 527a_100000764878_100000212026 [0,1,0,0,0,0|3,0,0]=4 4114 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Cl 11a_100000764878_100000185844 [0,1,0,0,0,0|3,0,0]=4 4115 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Cl 1626a_100000764878_100000185844 [0,1,0,0,0,0|3,0,0]=4 4116 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Cl 240690a_100000764878_100000185844 [0,1,0,0,0,0|3,0,0]=4 4117 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1Cl 527a_100000764878_100000185844 [0,1,0,0,0,0|3,0,0]=4 4118 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1F 11a_100000764878_100000188656 [0,1,0,0,0,0|3,0,0]=4 4119 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1F 1626a_100000764878_100000188656 [0,1,0,0,0,0|3,0,0]=4 4120 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1F 240690a_100000764878_100000188656 [0,1,0,0,0,0|3,0,0]=4 4121 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1F 527a_100000764878_100000188656 [0,1,0,0,0,0|3,0,0]=4 4122 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1I 11a_100000764878_100000187884 [0,1,0,0,0,0|3,0,0]=4 4123 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1I 1626a_100000764878_100000187884 [0,1,0,0,0,0|3,0,0]=4 4124 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1I 240690a_100000764878_100000187884 [0,1,0,0,0,0|3,0,0]=4 4125 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1I 527a_100000764878_100000187884 [0,1,0,0,0,0|3,0,0]=4 4126 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1O 240690a_100000764878_100015234032 [0,1,0,0,0,0|2,0,0]=3 4127 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1[O-] 1626a_100000764878_100009911694 [0,1,0,0,0,0|2,0,1]=4 4128 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1[O-] 240690a_100000764878_100009911694 [0,1,0,0,0,0|2,0,1]=4 4129 B15R1.3722 COC[C@@H](C)NC(=O)c1ccccc1[O-] 527a_100000764878_100009911694 [0,1,0,0,0,0|2,0,1]=4 4130 B15R1.3722 CSCC(=O)CC(=O)c1ccccc1O 1458a_100000184570_100000188908 [0,1,0,0,0,0|2,0,1]=4 4131 B15R1.3722 C[C@@H](CC#N)NC(=O)c1ccccc1O 240690a_100016994482_100015234032 [0,1,0,0,0,0|2,0,1]=4 4132 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1Br 240690a_100000706166_100000188424 [0,1,0,0,0,0|3,0,0]=4 4133 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1Br 527a_100000706166_100000188424 [0,1,0,0,0,0|3,0,0]=4 4134 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1Cl 240690a_100000706166_100000185844 [0,1,0,0,0,0|3,0,0]=4 4135 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1Cl 527a_100000706166_100000185844 [0,1,0,0,0,0|3,0,0]=4 4136 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1F 240690a_100000706166_100000188656 [0,1,0,0,0,0|3,0,0]=4 4137 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1F 527a_100000706166_100000188656 [0,1,0,0,0,0|3,0,0]=4 4138 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1I 240690a_100000706166_100000187884 [0,1,0,0,0,0|3,0,0]=4 4139 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1I 527a_100000706166_100000187884 [0,1,0,0,0,0|3,0,0]=4 4140 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1O 240690a_100000706166_100015234032 [0,1,0,0,0,0|2,0,0]=3 4141 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1[O-] 240690a_100000706166_100009911694 [0,1,0,0,0,0|2,0,1]=4 4142 B15R1.3722 C[C@H](CCO)NC(=O)c1ccccc1[O-] 527a_100000706166_100009911694 [0,1,0,0,0,0|2,0,1]=4 4143 B15R1.3722 Cc1ccccc1C(=O)N[C@H](C)CCO 240690a_100000706166_100000212026 [0,1,0,0,0,0|3,0,0]=4 4144 B15R1.3722 Cc1ccccc1C(=O)N[C@H](C)CCO 527a_100000706166_100000212026 [0,1,0,0,0,0|3,0,0]=4 4145 B15R1.3722 O=C(CCO)CC(=O)c1ccccc1O 1458a_100011216618_100000188908 [0,1,0,0,0,0|2,0,1]=4 4146 B15R1.3965 C#CCCCCC(=O)c1ccccc1Br 1458a_100000188424_100010269958 [0,1,0,0,0,0|2,0,1]=4 4147 B15R1.3965 C#CCCCCC(=O)c1ccccc1C 1458a_100000212026_100010269958 [0,1,0,0,0,0|2,0,1]=4 4148 B15R1.3965 C#CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100010269958 [0,1,0,0,0,0|2,0,1]=4 4149 B15R1.3965 C#CCCCCC(=O)c1ccccc1F 1458a_100000188656_100010269958 [0,1,0,0,0,0|2,0,1]=4 4150 B15R1.3965 C#CCCCCC(=O)c1ccccc1I 1458a_100000187884_100010269958 [0,1,0,0,0,0|2,0,1]=4 4151 B15R1.3965 C#CCCCCC(=O)c1ccccc1O 1458a_100015234032_100010269958 [0,1,0,0,0,0|1,0,1]=3 4152 B15R1.3965 C#CCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100010269958 [0,1,0,0,0,0|1,0,2]=4 4153 B15R1.3965 C#CCCCNC(=O)c1ccccc1Br 11a_100000718082_100000188424 [0,1,0,0,0,0|2,0,1]=4 4154 B15R1.3965 C#CCCCNC(=O)c1ccccc1Br 1626a_100000718082_100000188424 [0,1,0,0,0,0|2,0,1]=4 4155 B15R1.3965 C#CCCCNC(=O)c1ccccc1Br 240690a_100000718082_100000188424 [0,1,0,0,0,0|2,0,1]=4 4156 B15R1.3965 C#CCCCNC(=O)c1ccccc1Br 527a_100000718082_100000188424 [0,1,0,0,0,0|2,0,1]=4 4157 B15R1.3965 C#CCCCNC(=O)c1ccccc1C 11a_100000718082_100000212026 [0,1,0,0,0,0|2,0,1]=4 4158 B15R1.3965 C#CCCCNC(=O)c1ccccc1C 1626a_100000718082_100000212026 [0,1,0,0,0,0|2,0,1]=4 4159 B15R1.3965 C#CCCCNC(=O)c1ccccc1C 240690a_100000718082_100000212026 [0,1,0,0,0,0|2,0,1]=4 4160 B15R1.3965 C#CCCCNC(=O)c1ccccc1C 527a_100000718082_100000212026 [0,1,0,0,0,0|2,0,1]=4 4161 B15R1.3965 C#CCCCNC(=O)c1ccccc1Cl 11a_100000718082_100000185844 [0,1,0,0,0,0|2,0,1]=4 4162 B15R1.3965 C#CCCCNC(=O)c1ccccc1Cl 1626a_100000718082_100000185844 [0,1,0,0,0,0|2,0,1]=4 4163 B15R1.3965 C#CCCCNC(=O)c1ccccc1Cl 240690a_100000718082_100000185844 [0,1,0,0,0,0|2,0,1]=4 4164 B15R1.3965 C#CCCCNC(=O)c1ccccc1Cl 527a_100000718082_100000185844 [0,1,0,0,0,0|2,0,1]=4 4165 B15R1.3965 C#CCCCNC(=O)c1ccccc1F 11a_100000718082_100000188656 [0,1,0,0,0,0|2,0,1]=4 4166 B15R1.3965 C#CCCCNC(=O)c1ccccc1F 1626a_100000718082_100000188656 [0,1,0,0,0,0|2,0,1]=4 4167 B15R1.3965 C#CCCCNC(=O)c1ccccc1F 240690a_100000718082_100000188656 [0,1,0,0,0,0|2,0,1]=4 4168 B15R1.3965 C#CCCCNC(=O)c1ccccc1F 527a_100000718082_100000188656 [0,1,0,0,0,0|2,0,1]=4 4169 B15R1.3965 C#CCCCNC(=O)c1ccccc1I 11a_100000718082_100000187884 [0,1,0,0,0,0|2,0,1]=4 4170 B15R1.3965 C#CCCCNC(=O)c1ccccc1I 1626a_100000718082_100000187884 [0,1,0,0,0,0|2,0,1]=4 4171 B15R1.3965 C#CCCCNC(=O)c1ccccc1I 240690a_100000718082_100000187884 [0,1,0,0,0,0|2,0,1]=4 4172 B15R1.3965 C#CCCCNC(=O)c1ccccc1I 527a_100000718082_100000187884 [0,1,0,0,0,0|2,0,1]=4 4173 B15R1.3965 C#CCCCNC(=O)c1ccccc1O 240690a_100000718082_100015234032 [0,1,0,0,0,0|1,0,1]=3 4174 B15R1.3965 C#CCCCNC(=O)c1ccccc1[O-] 1626a_100000718082_100009911694 [0,1,0,0,0,0|1,0,2]=4 4175 B15R1.3965 C#CCCCNC(=O)c1ccccc1[O-] 240690a_100000718082_100009911694 [0,1,0,0,0,0|1,0,2]=4 4176 B15R1.3965 C#CCCCNC(=O)c1ccccc1[O-] 527a_100000718082_100009911694 [0,1,0,0,0,0|1,0,2]=4 4177 B15R1.3965 C#CCCOCC(=O)c1ccccc1Br 34a_100011215631_100000199116 [0,1,0,0,0,0|1,0,2]=4 4178 B15R1.3965 C#CCCOCC(=O)c1ccccc1C 34a_100011215631_100000741374 [0,1,0,0,0,0|1,0,2]=4 4179 B15R1.3965 C#CCCOCC(=O)c1ccccc1Cl 34a_100011215631_100000211432 [0,1,0,0,0,0|1,0,2]=4 4180 B15R1.3965 C#CCCOCC(=O)c1ccccc1F 34a_100011215631_100000204681 [0,1,0,0,0,0|1,0,2]=4 4181 B15R1.3965 C#CCCSCC(=O)c1ccccc1O 62a_100000188908_100000688953 [0,1,0,0,0,0|0,1,2]=4 4182 B15R1.3965 C#CCCSCC(=O)c1ccccc1O 62a_100000688953_100000188908 [0,1,0,0,0,0|0,1,2]=4 4183 B15R1.3965 C#CCOCCC(=O)c1ccccc1O 1458a_100015234032_100010402529 [0,1,0,0,0,0|1,0,2]=4 4184 B15R1.3965 C#CCSCCC(=O)c1ccccc1O 62a_100000038162_100009873196 [0,1,0,0,0,0|1,0,2]=4 4185 B15R1.3965 C/C=C/COCC(=O)c1ccccc1Br 34a_100016270725_100000199116 [0,1,0,0,0,0|1,0,2]=4 4186 B15R1.3965 C/C=C/COCC(=O)c1ccccc1C 34a_100016270725_100000741374 [0,1,0,0,0,0|1,0,2]=4 4187 B15R1.3965 C/C=C/COCC(=O)c1ccccc1Cl 34a_100016270725_100000211432 [0,1,0,0,0,0|1,0,2]=4 4188 B15R1.3965 C/C=C/COCC(=O)c1ccccc1F 34a_100016270725_100000204681 [0,1,0,0,0,0|1,0,2]=4 4189 B15R1.3965 C/C=C/CSCC(=O)c1ccccc1O 62a_100000188908_100102629194 [0,1,0,0,0,0|0,1,2]=4 4190 B15R1.3965 C/C=C/CSCC(=O)c1ccccc1O 62a_100102629194_100000188908 [0,1,0,0,0,0|0,1,2]=4 4191 B15R1.3965 C=CCCCCC(=O)c1ccccc1Br 1458a_100000188424_100011215482 [0,1,0,0,0,0|2,0,1]=4 4192 B15R1.3965 C=CCCCCC(=O)c1ccccc1C 1458a_100000212026_100011215482 [0,1,0,0,0,0|2,0,1]=4 4193 B15R1.3965 C=CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215482 [0,1,0,0,0,0|2,0,1]=4 4194 B15R1.3965 C=CCCCCC(=O)c1ccccc1F 1458a_100000188656_100011215482 [0,1,0,0,0,0|2,0,1]=4 4195 B15R1.3965 C=CCCCCC(=O)c1ccccc1I 1458a_100000187884_100011215482 [0,1,0,0,0,0|2,0,1]=4 4196 B15R1.3965 C=CCCCCC(=O)c1ccccc1O 1458a_100015234032_100011215482 [0,1,0,0,0,0|1,0,1]=3 4197 B15R1.3965 C=CCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215482 [0,1,0,0,0,0|1,0,2]=4 4198 B15R1.3965 C=CCCCNC(=O)c1ccccc1Br 11a_100000700776_100000188424 [0,1,0,0,0,0|2,0,1]=4 4199 B15R1.3965 C=CCCCNC(=O)c1ccccc1Br 1626a_100000700776_100000188424 [0,1,0,0,0,0|2,0,1]=4 4200 B15R1.3965 C=CCCCNC(=O)c1ccccc1Br 240690a_100000700776_100000188424 [0,1,0,0,0,0|2,0,1]=4 4201 B15R1.3965 C=CCCCNC(=O)c1ccccc1Br 527a_100000700776_100000188424 [0,1,0,0,0,0|2,0,1]=4 4202 B15R1.3965 C=CCCCNC(=O)c1ccccc1C 11a_100000700776_100000212026 [0,1,0,0,0,0|2,0,1]=4 4203 B15R1.3965 C=CCCCNC(=O)c1ccccc1C 1626a_100000700776_100000212026 [0,1,0,0,0,0|2,0,1]=4 4204 B15R1.3965 C=CCCCNC(=O)c1ccccc1C 240690a_100000700776_100000212026 [0,1,0,0,0,0|2,0,1]=4 4205 B15R1.3965 C=CCCCNC(=O)c1ccccc1C 527a_100000700776_100000212026 [0,1,0,0,0,0|2,0,1]=4 4206 B15R1.3965 C=CCCCNC(=O)c1ccccc1Cl 11a_100000700776_100000185844 [0,1,0,0,0,0|2,0,1]=4 4207 B15R1.3965 C=CCCCNC(=O)c1ccccc1Cl 1626a_100000700776_100000185844 [0,1,0,0,0,0|2,0,1]=4 4208 B15R1.3965 C=CCCCNC(=O)c1ccccc1Cl 240690a_100000700776_100000185844 [0,1,0,0,0,0|2,0,1]=4 4209 B15R1.3965 C=CCCCNC(=O)c1ccccc1Cl 527a_100000700776_100000185844 [0,1,0,0,0,0|2,0,1]=4 4210 B15R1.3965 C=CCCCNC(=O)c1ccccc1F 11a_100000700776_100000188656 [0,1,0,0,0,0|2,0,1]=4 4211 B15R1.3965 C=CCCCNC(=O)c1ccccc1F 1626a_100000700776_100000188656 [0,1,0,0,0,0|2,0,1]=4 4212 B15R1.3965 C=CCCCNC(=O)c1ccccc1F 240690a_100000700776_100000188656 [0,1,0,0,0,0|2,0,1]=4 4213 B15R1.3965 C=CCCCNC(=O)c1ccccc1F 527a_100000700776_100000188656 [0,1,0,0,0,0|2,0,1]=4 4214 B15R1.3965 C=CCCCNC(=O)c1ccccc1I 11a_100000700776_100000187884 [0,1,0,0,0,0|2,0,1]=4 4215 B15R1.3965 C=CCCCNC(=O)c1ccccc1I 1626a_100000700776_100000187884 [0,1,0,0,0,0|2,0,1]=4 4216 B15R1.3965 C=CCCCNC(=O)c1ccccc1I 240690a_100000700776_100000187884 [0,1,0,0,0,0|2,0,1]=4 4217 B15R1.3965 C=CCCCNC(=O)c1ccccc1I 527a_100000700776_100000187884 [0,1,0,0,0,0|2,0,1]=4 4218 B15R1.3965 C=CCCCNC(=O)c1ccccc1O 240690a_100000700776_100015234032 [0,1,0,0,0,0|1,0,1]=3 4219 B15R1.3965 C=CCCCNC(=O)c1ccccc1[O-] 1626a_100000700776_100009911694 [0,1,0,0,0,0|1,0,2]=4 4220 B15R1.3965 C=CCCCNC(=O)c1ccccc1[O-] 240690a_100000700776_100009911694 [0,1,0,0,0,0|1,0,2]=4 4221 B15R1.3965 C=CCCCNC(=O)c1ccccc1[O-] 527a_100000700776_100009911694 [0,1,0,0,0,0|1,0,2]=4 4222 B15R1.3965 C=CCCOCC(=O)c1ccccc1Br 34a_100011205117_100000199116 [0,1,0,0,0,0|1,0,2]=4 4223 B15R1.3965 C=CCCOCC(=O)c1ccccc1C 34a_100011205117_100000741374 [0,1,0,0,0,0|1,0,2]=4 4224 B15R1.3965 C=CCCOCC(=O)c1ccccc1Cl 34a_100011205117_100000211432 [0,1,0,0,0,0|1,0,2]=4 4225 B15R1.3965 C=CCCOCC(=O)c1ccccc1F 34a_100011205117_100000204681 [0,1,0,0,0,0|1,0,2]=4 4226 B15R1.3965 C=CCCSCC(=O)c1ccccc1O 62a_100000188908_100000754431 [0,1,0,0,0,0|0,1,2]=4 4227 B15R1.3965 C=CCCSCC(=O)c1ccccc1O 62a_100000754431_100000188908 [0,1,0,0,0,0|0,1,2]=4 4228 B15R1.3965 C=CCSCCC(=O)c1ccccc1O 62a_100000210623_100009873196 [0,1,0,0,0,0|1,0,2]=4 4229 B15R1.3965 CC#CCOCC(=O)c1ccccc1Br 34a_100000761923_100000199116 [0,1,0,0,0,0|1,0,2]=4 4230 B15R1.3965 CC#CCOCC(=O)c1ccccc1C 34a_100000761923_100000741374 [0,1,0,0,0,0|1,0,2]=4 4231 B15R1.3965 CC#CCOCC(=O)c1ccccc1Cl 34a_100000761923_100000211432 [0,1,0,0,0,0|1,0,2]=4 4232 B15R1.3965 CC#CCOCC(=O)c1ccccc1F 34a_100000761923_100000204681 [0,1,0,0,0,0|1,0,2]=4 4233 B15R1.3965 CC#CCSCC(=O)c1ccccc1O 62a_100000188908_100000748600 [0,1,0,0,0,0|0,1,2]=4 4234 B15R1.3965 CC#CCSCC(=O)c1ccccc1O 62a_100000748600_100000188908 [0,1,0,0,0,0|0,1,2]=4 4235 B15R1.3965 CC(OCCCCBr)c1ccccc1F 34a_100011216708_200000741388 [0,1,0,0,0,0|2,0,1]=4 4236 B15R1.3965 CC(OCCCCCl)c1ccccc1Cl 7a_100000210776_100000181259 [0,1,0,0,0,0|2,0,1]=4 4237 B15R1.3965 CC(OCCCCCl)c1ccccc1F 34a_100000210776_200000741388 [0,1,0,0,0,0|2,0,1]=4 4238 B15R1.3965 CC(OCCCCCl)c1ccccc1F 7a_100000210776_200000741388 [0,1,0,0,0,0|2,0,1]=4 4239 B15R1.3965 CC(OCCCCF)c1ccccc1Br 34a_100000702211_100000729493 [0,1,0,0,0,0|2,0,1]=4 4240 B15R1.3965 CC(OCCCCF)c1ccccc1Br 7a_100000702211_100000729493 [0,1,0,0,0,0|2,0,1]=4 4241 B15R1.3965 CC(OCCCCF)c1ccccc1Cl 34a_100000740796_100000729493 [0,1,0,0,0,0|2,0,1]=4 4242 B15R1.3965 CC(OCCCCF)c1ccccc1Cl 7a_100000740796_100000729493 [0,1,0,0,0,0|2,0,1]=4 4243 B15R1.3965 CC(OCCCCF)c1ccccc1Cl 7a_100011995726_100000181259 [0,1,0,0,0,0|2,0,1]=4 4244 B15R1.3965 CC(OCCCCF)c1ccccc1F 34a_100000697922_100000729493 [0,1,0,0,0,0|2,0,1]=4 4245 B15R1.3965 CC(OCCCCF)c1ccccc1F 34a_100011995726_200000741388 [0,1,0,0,0,0|2,0,1]=4 4246 B15R1.3965 CC(OCCCCF)c1ccccc1F 7a_100000697922_100000729493 [0,1,0,0,0,0|2,0,1]=4 4247 B15R1.3965 CC(OCCCCF)c1ccccc1F 7a_100011995726_200000741388 [0,1,0,0,0,0|2,0,1]=4 4248 B15R1.3965 CC(OCCCCF)c1ccccc1N 7a_100011405641_100000729493 [0,1,0,0,0,0|2,0,1]=4 4249 B15R1.3965 CC(OCCCCI)c1ccccc1F 34a_200012148704_200000741388 [0,1,0,0,0,0|2,0,1]=4 4250 B15R1.3965 CC(OCCCCN)c1ccccc1F 34a_100000750430_200000741388 [0,1,0,0,0,0|2,0,1]=4 4251 B15R1.3965 CC(OCCCCO)c1ccccc1Br 34a_100000702211_100011216708 [0,1,0,0,0,0|2,0,1]=4 4252 B15R1.3965 CC(OCCCCO)c1ccccc1Br 7a_100000702211_100000210776 [0,1,0,0,0,0|2,0,1]=4 4253 B15R1.3965 CC(OCCCCO)c1ccccc1Cl 34a_100000740796_100011216708 [0,1,0,0,0,0|2,0,1]=4 4254 B15R1.3965 CC(OCCCCO)c1ccccc1Cl 7a_100000740796_100000210776 [0,1,0,0,0,0|2,0,1]=4 4255 B15R1.3965 CC(OCCCCO)c1ccccc1F 34a_100000697922_100011216708 [0,1,0,0,0,0|2,0,1]=4 4256 B15R1.3965 CC(OCCCCO)c1ccccc1F 7a_100000697922_100000210776 [0,1,0,0,0,0|2,0,1]=4 4257 B15R1.3965 CC(OCCCCO)c1ccccc1N 7a_100011405641_100000210776 [0,1,0,0,0,0|2,0,1]=4 4258 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1Br 1458a_100000188424_100015370543 [0,1,0,0,0,0|2,0,1]=4 4259 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1C 1458a_100000212026_100015370543 [0,1,0,0,0,0|2,0,1]=4 4260 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1Cl 1458a_100000185844_100015370543 [0,1,0,0,0,0|2,0,1]=4 4261 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1F 1458a_100000188656_100015370543 [0,1,0,0,0,0|2,0,1]=4 4262 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1I 1458a_100000187884_100015370543 [0,1,0,0,0,0|2,0,1]=4 4263 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1O 1458a_100015234032_100015370543 [0,1,0,0,0,0|1,0,1]=3 4264 B15R1.3965 CC/C=C\CCC(=O)c1ccccc1[O-] 1458a_100009911694_100015370543 [0,1,0,0,0,0|1,0,2]=4 4265 B15R1.3965 CC=CCSCC(=O)c1ccccc1O 62a_100000070051_100000188908 [0,1,0,0,0,0|0,1,2]=4 4266 B15R1.3965 CC=CCSCC(=O)c1ccccc1O 62a_100000188908_100000070051 [0,1,0,0,0,0|0,1,2]=4 4267 B15R1.3965 CCCC=NNC(=O)c1ccccc1Br 4a_100000183644_100000185831 [0,1,0,0,0,0|2,0,1]=4 4268 B15R1.3965 CCCC=NNC(=O)c1ccccc1C 4a_100000181371_100000185831 [0,1,0,0,0,0|2,0,1]=4 4269 B15R1.3965 CCCC=NNC(=O)c1ccccc1Cl 4a_100000186534_100000185831 [0,1,0,0,0,0|2,0,1]=4 4270 B15R1.3965 CCCC=NNC(=O)c1ccccc1F 4a_100000183521_100000185831 [0,1,0,0,0,0|2,0,1]=4 4271 B15R1.3965 CCCC=NNC(=O)c1ccccc1I 4a_100000190081_100000185831 [0,1,0,0,0,0|2,0,1]=4 4272 B15R1.3965 CCCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210757 [0,1,0,0,0,0|2,0,0]=3 4273 B15R1.3965 CCCCCCC(=O)c1ccccc1C 1458a_100000212026_100000210757 [0,1,0,0,0,0|2,0,0]=3 4274 B15R1.3965 CCCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210757 [0,1,0,0,0,0|2,0,0]=3 4275 B15R1.3965 CCCCCCC(=O)c1ccccc1F 1458a_100000188656_100000210757 [0,1,0,0,0,0|2,0,0]=3 4276 B15R1.3965 CCCCCCC(=O)c1ccccc1I 1458a_100000187884_100000210757 [0,1,0,0,0,0|2,0,0]=3 4277 B15R1.3965 CCCCCCC(=O)c1ccccc1O 1458a_100015234032_100000210757 [0,1,0,0,0,0|1,0,0]=2 4278 B15R1.3965 CCCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210757 [0,1,0,0,0,0|1,0,1]=3 4279 B15R1.3965 CCCCCCN(C)c1ccccc1O 269982a_100000033821_100000210757 [0,1,0,0,0,0|3,0,0]=4 4280 B15R1.3965 CCCCCNC(=O)c1ccccc1Br 11a_100000209983_100000188424 [0,1,0,0,0,0|2,0,0]=3 4281 B15R1.3965 CCCCCNC(=O)c1ccccc1Br 1626a_100000209983_100000188424 [0,1,0,0,0,0|2,0,0]=3 4282 B15R1.3965 CCCCCNC(=O)c1ccccc1Br 240690a_100000209983_100000188424 [0,1,0,0,0,0|2,0,0]=3 4283 B15R1.3965 CCCCCNC(=O)c1ccccc1Br 527a_100000209983_100000188424 [0,1,0,0,0,0|2,0,0]=3 4284 B15R1.3965 CCCCCNC(=O)c1ccccc1C 11a_100000209983_100000212026 [0,1,0,0,0,0|2,0,0]=3 4285 B15R1.3965 CCCCCNC(=O)c1ccccc1C 1626a_100000209983_100000212026 [0,1,0,0,0,0|2,0,0]=3 4286 B15R1.3965 CCCCCNC(=O)c1ccccc1C 240690a_100000209983_100000212026 [0,1,0,0,0,0|2,0,0]=3 4287 B15R1.3965 CCCCCNC(=O)c1ccccc1C 527a_100000209983_100000212026 [0,1,0,0,0,0|2,0,0]=3 4288 B15R1.3965 CCCCCNC(=O)c1ccccc1Cl 11a_100000209983_100000185844 [0,1,0,0,0,0|2,0,0]=3 4289 B15R1.3965 CCCCCNC(=O)c1ccccc1Cl 1626a_100000209983_100000185844 [0,1,0,0,0,0|2,0,0]=3 4290 B15R1.3965 CCCCCNC(=O)c1ccccc1Cl 240690a_100000209983_100000185844 [0,1,0,0,0,0|2,0,0]=3 4291 B15R1.3965 CCCCCNC(=O)c1ccccc1Cl 527a_100000209983_100000185844 [0,1,0,0,0,0|2,0,0]=3 4292 B15R1.3965 CCCCCNC(=O)c1ccccc1F 11a_100000209983_100000188656 [0,1,0,0,0,0|2,0,0]=3 4293 B15R1.3965 CCCCCNC(=O)c1ccccc1F 1626a_100000209983_100000188656 [0,1,0,0,0,0|2,0,0]=3 4294 B15R1.3965 CCCCCNC(=O)c1ccccc1F 240690a_100000209983_100000188656 [0,1,0,0,0,0|2,0,0]=3 4295 B15R1.3965 CCCCCNC(=O)c1ccccc1F 527a_100000209983_100000188656 [0,1,0,0,0,0|2,0,0]=3 4296 B15R1.3965 CCCCCNC(=O)c1ccccc1I 11a_100000209983_100000187884 [0,1,0,0,0,0|2,0,0]=3 4297 B15R1.3965 CCCCCNC(=O)c1ccccc1I 1626a_100000209983_100000187884 [0,1,0,0,0,0|2,0,0]=3 4298 B15R1.3965 CCCCCNC(=O)c1ccccc1I 240690a_100000209983_100000187884 [0,1,0,0,0,0|2,0,0]=3 4299 B15R1.3965 CCCCCNC(=O)c1ccccc1I 527a_100000209983_100000187884 [0,1,0,0,0,0|2,0,0]=3 4300 B15R1.3965 CCCCCNC(=O)c1ccccc1O 240690a_100000209983_100015234032 [0,1,0,0,0,0|1,0,0]=2 4301 B15R1.3965 CCCCCNC(=O)c1ccccc1O 271570a_203496583355_200000152840 [0,1,0,0,0,0|1,0,0]=2 4302 B15R1.3965 CCCCCNC(=O)c1ccccc1[O-] 1626a_100000209983_100009911694 [0,1,0,0,0,0|1,0,1]=3 4303 B15R1.3965 CCCCCNC(=O)c1ccccc1[O-] 240690a_100000209983_100009911694 [0,1,0,0,0,0|1,0,1]=3 4304 B15R1.3965 CCCCCNC(=O)c1ccccc1[O-] 527a_100000209983_100009911694 [0,1,0,0,0,0|1,0,1]=3 4305 B15R1.3965 CCCCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210326 [0,1,0,0,0,0|2,0,1]=4 4306 B15R1.3965 CCCCCOC(C)c1ccccc1Br 34a_100000702211_100000718602 [0,1,0,0,0,0|2,0,1]=4 4307 B15R1.3965 CCCCCOC(C)c1ccccc1Br 7a_100000702211_100000210326 [0,1,0,0,0,0|2,0,1]=4 4308 B15R1.3965 CCCCCOC(C)c1ccccc1C 34a_100000742021_100000718602 [0,1,0,0,0,0|2,0,1]=4 4309 B15R1.3965 CCCCCOC(C)c1ccccc1C 7a_100000742021_100000210326 [0,1,0,0,0,0|2,0,1]=4 4310 B15R1.3965 CCCCCOC(C)c1ccccc1Cl 34a_100000740796_100000718602 [0,1,0,0,0,0|2,0,1]=4 4311 B15R1.3965 CCCCCOC(C)c1ccccc1Cl 7a_100000210253_100000181259 [0,1,0,0,0,0|2,0,1]=4 4312 B15R1.3965 CCCCCOC(C)c1ccccc1Cl 7a_100000740796_100000210326 [0,1,0,0,0,0|2,0,1]=4 4313 B15R1.3965 CCCCCOC(C)c1ccccc1F 34a_100000210253_200000741388 [0,1,0,0,0,0|2,0,1]=4 4314 B15R1.3965 CCCCCOC(C)c1ccccc1F 34a_100000697922_100000718602 [0,1,0,0,0,0|2,0,1]=4 4315 B15R1.3965 CCCCCOC(C)c1ccccc1F 7a_100000210253_200000741388 [0,1,0,0,0,0|2,0,1]=4 4316 B15R1.3965 CCCCCOC(C)c1ccccc1F 7a_100000697922_100000210326 [0,1,0,0,0,0|2,0,1]=4 4317 B15R1.3965 CCCCCOC(C)c1ccccc1N 7a_100011405641_100000210326 [0,1,0,0,0,0|2,0,1]=4 4318 B15R1.3965 CCCCNCC(=O)c1ccccc1C 2230a_100000102301_100000741374 [0,1,0,0,0,0|2,0,0]=3 4319 B15R1.3965 CCCCNCC(=O)c1ccccc1C 7a_106832991798_100000741374 [0,1,0,0,0,0|2,0,0]=3 4320 B15R1.3965 CCCCNCC(=O)c1ccccc1F 7a_106832991798_100000204681 [0,1,0,0,0,0|2,0,0]=3 4321 B15R1.3965 CCCCNCC(=O)c1ccccc1O 7a_106832991798_100000188908 [0,1,0,0,0,0|1,0,0]=2 4322 B15R1.3965 CCCCNN=C(C)c1ccccc1Br 4a_100025702795_100000187085 [0,1,0,0,0,0|3,0,0]=4 4323 B15R1.3965 CCCCNN=C(C)c1ccccc1C 4a_100025702795_100000211656 [0,1,0,0,0,0|3,0,0]=4 4324 B15R1.3965 CCCCNN=C(C)c1ccccc1Cl 4a_100025702795_100000210134 [0,1,0,0,0,0|3,0,0]=4 4325 B15R1.3965 CCCCNN=C(C)c1ccccc1F 4a_100025702795_100000210632 [0,1,0,0,0,0|3,0,0]=4 4326 B15R1.3965 CCCCNN=C(C)c1ccccc1I 4a_100025702795_100000751169 [0,1,0,0,0,0|3,0,0]=4 4327 B15R1.3965 CCCCNN=C(C)c1ccccc1O 4a_100025702795_100000188907 [0,1,0,0,0,0|2,0,0]=3 4328 B15R1.3965 CCCCNN=C(C)c1cccnc1O 4a_100025702795_100012024847 [0,1,0,0,0,0|3,0,0]=4 4329 B15R1.3965 CCCCNN=C(C)c1ccncc1O 4a_100025702795_100009872882 [0,1,0,0,0,0|3,0,0]=4 4330 B15R1.3965 CCCCNN=C(C)c1ncccc1O 4a_100025702795_100000087166 [0,1,0,0,0,0|3,0,0]=4 4331 B15R1.3965 CCCCNNC(=O)c1ccccc1Br 22a_100025702795_100000188424 [0,1,0,0,0,0|2,0,0]=3 4332 B15R1.3965 CCCCNNC(=O)c1ccccc1C 22a_100025702795_100000212026 [0,1,0,0,0,0|2,0,0]=3 4333 B15R1.3965 CCCCNNC(=O)c1ccccc1Cl 22a_100025702795_100000185844 [0,1,0,0,0,0|2,0,0]=3 4334 B15R1.3965 CCCCNNC(=O)c1ccccc1F 22a_100025702795_100000188656 [0,1,0,0,0,0|2,0,0]=3 4335 B15R1.3965 CCCCNNC(=O)c1ccccc1I 22a_100025702795_100000187884 [0,1,0,0,0,0|2,0,0]=3 4336 B15R1.3965 CCCCNNC(=O)c1ccccc1O 22a_100025702795_100015234032 [0,1,0,0,0,0|1,0,0]=2 4337 B15R1.3965 CCCCNNC(=O)c1ccccc1[O-] 22a_100025702795_100009911694 [0,1,0,0,0,0|1,0,1]=3 4338 B15R1.3965 CCCCOCC(=O)c1ccccc1Br 1458a_100000188424_100011995733 [0,1,0,0,0,0|1,0,0]=2 4339 B15R1.3965 CCCCOCC(=O)c1ccccc1Br 34a_100000210227_100000199116 [0,1,0,0,0,0|1,0,0]=2 4340 B15R1.3965 CCCCOCC(=O)c1ccccc1C 1458a_100000212026_100011995733 [0,1,0,0,0,0|1,0,0]=2 4341 B15R1.3965 CCCCOCC(=O)c1ccccc1C 34a_100000210227_100000741374 [0,1,0,0,0,0|1,0,0]=2 4342 B15R1.3965 CCCCOCC(=O)c1ccccc1C 7a_100000210227_100000741374 [0,1,0,0,0,0|1,0,0]=2 4343 B15R1.3965 CCCCOCC(=O)c1ccccc1Cl 1458a_100000185844_100011995733 [0,1,0,0,0,0|1,0,0]=2 4344 B15R1.3965 CCCCOCC(=O)c1ccccc1Cl 34a_100000210227_100000211432 [0,1,0,0,0,0|1,0,0]=2 4345 B15R1.3965 CCCCOCC(=O)c1ccccc1F 1458a_100000188656_100011995733 [0,1,0,0,0,0|1,0,0]=2 4346 B15R1.3965 CCCCOCC(=O)c1ccccc1F 34a_100000210227_100000204681 [0,1,0,0,0,0|1,0,0]=2 4347 B15R1.3965 CCCCOCC(=O)c1ccccc1F 7a_100000210227_100000204681 [0,1,0,0,0,0|1,0,0]=2 4348 B15R1.3965 CCCCOCC(=O)c1ccccc1I 1458a_100000187884_100011995733 [0,1,0,0,0,0|1,0,0]=2 4349 B15R1.3965 CCCCOCC(=O)c1ccccc1O 1458a_100015234032_100011995733 [0,1,0,0,0,0|0,0,0]=1 4350 B15R1.3965 CCCCOCC(=O)c1ccccc1O 7a_100000210227_100000188908 [0,1,0,0,0,0|0,0,0]=1 4351 B15R1.3965 CCCCOCC(=O)c1ccccc1[O-] 1458a_100009911694_100011995733 [0,1,0,0,0,0|0,0,1]=2 4352 B15R1.3965 CCCCOCC(N)c1ccccc1Cl 34a_100138412506_100000210210 [0,1,0,0,0,0|2,0,1]=4 4353 B15R1.3965 CCCCOCN(C)c1ccccc1Br 2230a_100020606079_100011995733 [0,1,0,0,0,0|3,0,0]=4 4354 B15R1.3965 CCCCOCN(C)c1ccccc1Br 269982a_100020606079_100011995733 [0,1,0,0,0,0|3,0,0]=4 4355 B15R1.3965 CCCCOCN(C)c1ccccc1Br 34a_100020606079_100011995733 [0,1,0,0,0,0|3,0,0]=4 4356 B15R1.3965 CCCCOCN(C)c1ccccc1C 2230a_100000219699_100011995733 [0,1,0,0,0,0|3,0,0]=4 4357 B15R1.3965 CCCCOCN(C)c1ccccc1C 269982a_100000219699_100011995733 [0,1,0,0,0,0|3,0,0]=4 4358 B15R1.3965 CCCCOCN(C)c1ccccc1C 34a_100000219699_100011995733 [0,1,0,0,0,0|3,0,0]=4 4359 B15R1.3965 CCCCOCN(C)c1ccccc1Cl 2230a_100000219374_100011995733 [0,1,0,0,0,0|3,0,0]=4 4360 B15R1.3965 CCCCOCN(C)c1ccccc1Cl 269982a_100000219374_100011995733 [0,1,0,0,0,0|3,0,0]=4 4361 B15R1.3965 CCCCOCN(C)c1ccccc1Cl 34a_100000219374_100011995733 [0,1,0,0,0,0|3,0,0]=4 4362 B15R1.3965 CCCCOCN(C)c1ccccc1F 2230a_100000220357_100011995733 [0,1,0,0,0,0|3,0,0]=4 4363 B15R1.3965 CCCCOCN(C)c1ccccc1F 269982a_100000220357_100011995733 [0,1,0,0,0,0|3,0,0]=4 4364 B15R1.3965 CCCCOCN(C)c1ccccc1F 34a_100000220357_100011995733 [0,1,0,0,0,0|3,0,0]=4 4365 B15R1.3965 CCCCOCN(C)c1ccccc1O 269982a_100000033821_100011995733 [0,1,0,0,0,0|2,0,0]=3 4366 B15R1.3965 CCCCOC[C@@H](N)c1ccccc1Br 34a_100161155918_100000210210 [0,1,0,0,0,0|2,0,1]=4 4367 B15R1.3965 CCCCOC[C@H](N)c1ccccc1F 34a_100009818778_100000210210 [0,1,0,0,0,0|2,0,1]=4 4368 B15R1.3965 CCCCSCC(=O)c1ccccc1Br 62a_100000199116_100000210210 [0,1,0,0,0,0|1,1,0]=3 4369 B15R1.3965 CCCCSCC(=O)c1ccccc1C 62a_100000210211_100000741374 [0,1,0,0,0,0|1,1,0]=3 4370 B15R1.3965 CCCCSCC(=O)c1ccccc1C 62a_100000741374_100000210210 [0,1,0,0,0,0|1,1,0]=3 4371 B15R1.3965 CCCCSCC(=O)c1ccccc1Cl 62a_100000210211_100000211432 [0,1,0,0,0,0|1,1,0]=3 4372 B15R1.3965 CCCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210210 [0,1,0,0,0,0|1,1,0]=3 4373 B15R1.3965 CCCCSCC(=O)c1ccccc1F 62a_100000204681_100000210210 [0,1,0,0,0,0|1,1,0]=3 4374 B15R1.3965 CCCCSCC(=O)c1ccccc1F 62a_100000210211_100000204681 [0,1,0,0,0,0|1,1,0]=3 4375 B15R1.3965 CCCCSCC(=O)c1ccccc1O 62a_100000188908_100000210210 [0,1,0,0,0,0|0,1,0]=2 4376 B15R1.3965 CCCCSCC(=O)c1ccccc1O 62a_100000210211_100000188908 [0,1,0,0,0,0|0,1,0]=2 4377 B15R1.3965 CCCOCCC(=O)c1ccccc1Br 1458a_100000188424_100011215938 [0,1,0,0,0,0|2,0,0]=3 4378 B15R1.3965 CCCOCCC(=O)c1ccccc1C 1458a_100000212026_100011215938 [0,1,0,0,0,0|2,0,0]=3 4379 B15R1.3965 CCCOCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215938 [0,1,0,0,0,0|2,0,0]=3 4380 B15R1.3965 CCCOCCC(=O)c1ccccc1F 1458a_100000188656_100011215938 [0,1,0,0,0,0|2,0,0]=3 4381 B15R1.3965 CCCOCCC(=O)c1ccccc1I 1458a_100000187884_100011215938 [0,1,0,0,0,0|2,0,0]=3 4382 B15R1.3965 CCCOCCC(=O)c1ccccc1O 1458a_100015234032_100011215938 [0,1,0,0,0,0|1,0,0]=2 4383 B15R1.3965 CCCOCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215938 [0,1,0,0,0,0|1,0,1]=3 4384 B15R1.3965 CCCOCCN(C)c1ccccc1O 269982a_100000033821_100011215938 [0,1,0,0,0,0|3,0,0]=4 4385 B15R1.3965 CCCSCCC(=O)c1ccccc1F 62a_100000086012_100000210303 [0,1,0,0,0,0|2,0,0]=3 4386 B15R1.3965 CCCSCCC(=O)c1ccccc1F 62a_100000210303_100000086012 [0,1,0,0,0,0|2,0,0]=3 4387 B15R1.3965 CCCSCCC(=O)c1ccccc1O 62a_100000210303_100009873196 [0,1,0,0,0,0|1,0,0]=2 4388 B15R1.3965 CCNCCNC(=O)c1ccccc1Cl 2230a_100000737833_100000210202 [0,1,0,0,0,0|2,0,0]=3 4389 B15R1.3965 CCNCCNC(=O)c1ccccc1Cl 34a_100000737833_100000210202 [0,1,0,0,0,0|2,0,0]=3 4390 B15R1.3965 CCOCCCC(=O)c1ccccc1Br 1458a_100000188424_100012232248 [0,1,0,0,0,0|2,0,0]=3 4391 B15R1.3965 CCOCCCC(=O)c1ccccc1C 1458a_100000212026_100012232248 [0,1,0,0,0,0|2,0,0]=3 4392 B15R1.3965 CCOCCCC(=O)c1ccccc1Cl 1458a_100000185844_100012232248 [0,1,0,0,0,0|2,0,0]=3 4393 B15R1.3965 CCOCCCC(=O)c1ccccc1F 1458a_100000188656_100012232248 [0,1,0,0,0,0|2,0,0]=3 4394 B15R1.3965 CCOCCCC(=O)c1ccccc1I 1458a_100000187884_100012232248 [0,1,0,0,0,0|2,0,0]=3 4395 B15R1.3965 CCOCCCC(=O)c1ccccc1O 1458a_100015234032_100012232248 [0,1,0,0,0,0|1,0,0]=2 4396 B15R1.3965 CCOCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100012232248 [0,1,0,0,0,0|1,0,1]=3 4397 B15R1.3965 CCOCCCN(C)c1ccccc1O 269982a_100000033821_100012232248 [0,1,0,0,0,0|3,0,0]=4 4398 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 11a_100011200944_100000188424 [0,1,0,0,0,0|2,0,0]=3 4399 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 1626a_102516460346_100000188424 [0,1,0,0,0,0|2,0,0]=3 4400 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 240690a_100011200944_100000188424 [0,1,0,0,0,0|2,0,0]=3 4401 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 34a_200000158863_100000210202 [0,1,0,0,0,0|2,0,0]=3 4402 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 527a_100011200944_100000188424 [0,1,0,0,0,0|2,0,0]=3 4403 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 7a_200000158863_100000210202 [0,1,0,0,0,0|2,0,0]=3 4404 B15R1.3965 CCOCCNC(=O)c1ccccc1C 11a_100011200944_100000212026 [0,1,0,0,0,0|2,0,0]=3 4405 B15R1.3965 CCOCCNC(=O)c1ccccc1C 1626a_102516460346_100000212026 [0,1,0,0,0,0|2,0,0]=3 4406 B15R1.3965 CCOCCNC(=O)c1ccccc1C 240690a_100011200944_100000212026 [0,1,0,0,0,0|2,0,0]=3 4407 B15R1.3965 CCOCCNC(=O)c1ccccc1C 527a_100011200944_100000212026 [0,1,0,0,0,0|2,0,0]=3 4408 B15R1.3965 CCOCCNC(=O)c1ccccc1Cl 11a_100011200944_100000185844 [0,1,0,0,0,0|2,0,0]=3 4409 B15R1.3965 CCOCCNC(=O)c1ccccc1Cl 1626a_102516460346_100000185844 [0,1,0,0,0,0|2,0,0]=3 4410 B15R1.3965 CCOCCNC(=O)c1ccccc1Cl 240690a_100011200944_100000185844 [0,1,0,0,0,0|2,0,0]=3 4411 B15R1.3965 CCOCCNC(=O)c1ccccc1Cl 527a_100011200944_100000185844 [0,1,0,0,0,0|2,0,0]=3 4412 B15R1.3965 CCOCCNC(=O)c1ccccc1F 11a_100011200944_100000188656 [0,1,0,0,0,0|2,0,0]=3 4413 B15R1.3965 CCOCCNC(=O)c1ccccc1F 1626a_102516460346_100000188656 [0,1,0,0,0,0|2,0,0]=3 4414 B15R1.3965 CCOCCNC(=O)c1ccccc1F 240690a_100011200944_100000188656 [0,1,0,0,0,0|2,0,0]=3 4415 B15R1.3965 CCOCCNC(=O)c1ccccc1F 527a_100011200944_100000188656 [0,1,0,0,0,0|2,0,0]=3 4416 B15R1.3965 CCOCCNC(=O)c1ccccc1I 11a_100011200944_100000187884 [0,1,0,0,0,0|2,0,0]=3 4417 B15R1.3965 CCOCCNC(=O)c1ccccc1I 1626a_102516460346_100000187884 [0,1,0,0,0,0|2,0,0]=3 4418 B15R1.3965 CCOCCNC(=O)c1ccccc1I 240690a_100011200944_100000187884 [0,1,0,0,0,0|2,0,0]=3 4419 B15R1.3965 CCOCCNC(=O)c1ccccc1I 527a_100011200944_100000187884 [0,1,0,0,0,0|2,0,0]=3 4420 B15R1.3965 CCOCCNC(=O)c1ccccc1O 240690a_100011200944_100015234032 [0,1,0,0,0,0|1,0,0]=2 4421 B15R1.3965 CCOCCNC(=O)c1ccccc1[O-] 1626a_102516460346_100009911694 [0,1,0,0,0,0|1,0,1]=3 4422 B15R1.3965 CCOCCNC(=O)c1ccccc1[O-] 240690a_100011200944_100009911694 [0,1,0,0,0,0|1,0,1]=3 4423 B15R1.3965 CCOCCNC(=O)c1ccccc1[O-] 527a_100011200944_100009911694 [0,1,0,0,0,0|1,0,1]=3 4424 B15R1.3965 CCOCCN[C@H](C)c1ccccc1O 2230a_100025703389_100011215890 [0,1,0,0,0,0|2,0,1]=4 4425 B15R1.3965 CCOCCOC(C)c1ccccc1Br 34a_100000702211_100000210147 [0,1,0,0,0,0|2,0,1]=4 4426 B15R1.3965 CCOCCOC(C)c1ccccc1Br 7a_100000702211_100011215890 [0,1,0,0,0,0|2,0,1]=4 4427 B15R1.3965 CCOCCOC(C)c1ccccc1C 34a_100000742021_100000210147 [0,1,0,0,0,0|2,0,1]=4 4428 B15R1.3965 CCOCCOC(C)c1ccccc1C 7a_100000742021_100011215890 [0,1,0,0,0,0|2,0,1]=4 4429 B15R1.3965 CCOCCOC(C)c1ccccc1Cl 34a_100000740796_100000210147 [0,1,0,0,0,0|2,0,1]=4 4430 B15R1.3965 CCOCCOC(C)c1ccccc1Cl 7a_100000210136_100000181259 [0,1,0,0,0,0|2,0,1]=4 4431 B15R1.3965 CCOCCOC(C)c1ccccc1Cl 7a_100000740796_100011215890 [0,1,0,0,0,0|2,0,1]=4 4432 B15R1.3965 CCOCCOC(C)c1ccccc1F 34a_100000210136_200000741388 [0,1,0,0,0,0|2,0,1]=4 4433 B15R1.3965 CCOCCOC(C)c1ccccc1F 34a_100000697922_100000210147 [0,1,0,0,0,0|2,0,1]=4 4434 B15R1.3965 CCOCCOC(C)c1ccccc1F 7a_100000210136_200000741388 [0,1,0,0,0,0|2,0,1]=4 4435 B15R1.3965 CCOCCOC(C)c1ccccc1F 7a_100000697922_100011215890 [0,1,0,0,0,0|2,0,1]=4 4436 B15R1.3965 CCOCCOC(C)c1ccccc1N 7a_100011405641_100011215890 [0,1,0,0,0,0|2,0,1]=4 4437 B15R1.3965 CCOCSCC(=O)c1ccccc1Br 62a_100000199116_100000739092 [0,1,0,0,0,0|2,1,0]=4 4438 B15R1.3965 CCOCSCC(=O)c1ccccc1C 62a_100000739092_100000741374 [0,1,0,0,0,0|2,1,0]=4 4439 B15R1.3965 CCOCSCC(=O)c1ccccc1C 62a_100000741374_100000739092 [0,1,0,0,0,0|2,1,0]=4 4440 B15R1.3965 CCOCSCC(=O)c1ccccc1Cl 62a_100000211432_100000739092 [0,1,0,0,0,0|2,1,0]=4 4441 B15R1.3965 CCOCSCC(=O)c1ccccc1Cl 62a_100000739092_100000211432 [0,1,0,0,0,0|2,1,0]=4 4442 B15R1.3965 CCOCSCC(=O)c1ccccc1F 62a_100000204681_100000739092 [0,1,0,0,0,0|2,1,0]=4 4443 B15R1.3965 CCOCSCC(=O)c1ccccc1F 62a_100000739092_100000204681 [0,1,0,0,0,0|2,1,0]=4 4444 B15R1.3965 CCOCSCC(=O)c1ccccc1O 62a_100000188908_100000739092 [0,1,0,0,0,0|1,1,0]=3 4445 B15R1.3965 CCOCSCC(=O)c1ccccc1O 62a_100000739092_100000188908 [0,1,0,0,0,0|1,1,0]=3 4446 B15R1.3965 CCSCCNC(=O)c1ccccc1Br 11a_100000106463_100000188424 [0,1,0,0,0,0|2,0,0]=3 4447 B15R1.3965 CCSCCNC(=O)c1ccccc1Br 1626a_100000106463_100000188424 [0,1,0,0,0,0|2,0,0]=3 4448 B15R1.3965 CCSCCNC(=O)c1ccccc1Br 240690a_100000106463_100000188424 [0,1,0,0,0,0|2,0,0]=3 4449 B15R1.3965 CCSCCNC(=O)c1ccccc1Br 527a_100000106463_100000188424 [0,1,0,0,0,0|2,0,0]=3 4450 B15R1.3965 CCSCCNC(=O)c1ccccc1C 11a_100000106463_100000212026 [0,1,0,0,0,0|2,0,0]=3 4451 B15R1.3965 CCSCCNC(=O)c1ccccc1C 1626a_100000106463_100000212026 [0,1,0,0,0,0|2,0,0]=3 4452 B15R1.3965 CCSCCNC(=O)c1ccccc1C 240690a_100000106463_100000212026 [0,1,0,0,0,0|2,0,0]=3 4453 B15R1.3965 CCSCCNC(=O)c1ccccc1C 527a_100000106463_100000212026 [0,1,0,0,0,0|2,0,0]=3 4454 B15R1.3965 CCSCCNC(=O)c1ccccc1Cl 11a_100000106463_100000185844 [0,1,0,0,0,0|2,0,0]=3 4455 B15R1.3965 CCSCCNC(=O)c1ccccc1Cl 1626a_100000106463_100000185844 [0,1,0,0,0,0|2,0,0]=3 4456 B15R1.3965 CCSCCNC(=O)c1ccccc1Cl 240690a_100000106463_100000185844 [0,1,0,0,0,0|2,0,0]=3 4457 B15R1.3965 CCSCCNC(=O)c1ccccc1Cl 527a_100000106463_100000185844 [0,1,0,0,0,0|2,0,0]=3 4458 B15R1.3965 CCSCCNC(=O)c1ccccc1F 11a_100000106463_100000188656 [0,1,0,0,0,0|2,0,0]=3 4459 B15R1.3965 CCSCCNC(=O)c1ccccc1F 1626a_100000106463_100000188656 [0,1,0,0,0,0|2,0,0]=3 4460 B15R1.3965 CCSCCNC(=O)c1ccccc1F 240690a_100000106463_100000188656 [0,1,0,0,0,0|2,0,0]=3 4461 B15R1.3965 CCSCCNC(=O)c1ccccc1F 527a_100000106463_100000188656 [0,1,0,0,0,0|2,0,0]=3 4462 B15R1.3965 CCSCCNC(=O)c1ccccc1I 11a_100000106463_100000187884 [0,1,0,0,0,0|2,0,0]=3 4463 B15R1.3965 CCSCCNC(=O)c1ccccc1I 1626a_100000106463_100000187884 [0,1,0,0,0,0|2,0,0]=3 4464 B15R1.3965 CCSCCNC(=O)c1ccccc1I 240690a_100000106463_100000187884 [0,1,0,0,0,0|2,0,0]=3 4465 B15R1.3965 CCSCCNC(=O)c1ccccc1I 527a_100000106463_100000187884 [0,1,0,0,0,0|2,0,0]=3 4466 B15R1.3965 CCSCCNC(=O)c1ccccc1O 240690a_100000106463_100015234032 [0,1,0,0,0,0|1,0,0]=2 4467 B15R1.3965 CCSCCNC(=O)c1ccccc1[O-] 1626a_100000106463_100009911694 [0,1,0,0,0,0|1,0,1]=3 4468 B15R1.3965 CCSCCNC(=O)c1ccccc1[O-] 240690a_100000106463_100009911694 [0,1,0,0,0,0|1,0,1]=3 4469 B15R1.3965 CCSCCNC(=O)c1ccccc1[O-] 527a_100000106463_100009911694 [0,1,0,0,0,0|1,0,1]=3 4470 B15R1.3965 CCSCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000757381 [0,1,0,0,0,0|2,0,1]=4 4471 B15R1.3965 CCSCCOC(C)c1ccccc1Br 34a_100000702211_100000757381 [0,1,0,0,0,0|2,0,1]=4 4472 B15R1.3965 CCSCCOC(C)c1ccccc1Br 7a_100000702211_100000757381 [0,1,0,0,0,0|2,0,1]=4 4473 B15R1.3965 CCSCCOC(C)c1ccccc1C 34a_100000742021_100000757381 [0,1,0,0,0,0|2,0,1]=4 4474 B15R1.3965 CCSCCOC(C)c1ccccc1C 7a_100000742021_100000757381 [0,1,0,0,0,0|2,0,1]=4 4475 B15R1.3965 CCSCCOC(C)c1ccccc1Cl 34a_100000740796_100000757381 [0,1,0,0,0,0|2,0,1]=4 4476 B15R1.3965 CCSCCOC(C)c1ccccc1Cl 7a_100000212035_100000181259 [0,1,0,0,0,0|2,0,1]=4 4477 B15R1.3965 CCSCCOC(C)c1ccccc1Cl 7a_100000740796_100000757381 [0,1,0,0,0,0|2,0,1]=4 4478 B15R1.3965 CCSCCOC(C)c1ccccc1F 34a_100000212035_200000741388 [0,1,0,0,0,0|2,0,1]=4 4479 B15R1.3965 CCSCCOC(C)c1ccccc1F 34a_100000697922_100000757381 [0,1,0,0,0,0|2,0,1]=4 4480 B15R1.3965 CCSCCOC(C)c1ccccc1F 7a_100000212035_200000741388 [0,1,0,0,0,0|2,0,1]=4 4481 B15R1.3965 CCSCCOC(C)c1ccccc1F 7a_100000697922_100000757381 [0,1,0,0,0,0|2,0,1]=4 4482 B15R1.3965 CCSCCOC(C)c1ccccc1N 7a_100011405641_100000757381 [0,1,0,0,0,0|2,0,1]=4 4483 B15R1.3965 CN(CCCCCF)c1ccccc1O 269982a_100000033821_100000729378 [0,1,0,0,0,0|3,0,0]=4 4484 B15R1.3965 CN(CCCCCO)c1ccccc1O 269982a_100000033821_100000746330 [0,1,0,0,0,0|3,0,0]=4 4485 B15R1.3965 CNCCCOC(C)c1ccccc1F 34a_100000213112_200000741388 [0,1,0,0,0,0|2,0,1]=4 4486 B15R1.3965 COCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000755781 [0,1,0,0,0,0|2,0,0]=3 4487 B15R1.3965 COCCCCC(=O)c1ccccc1C 1458a_100000212026_100000755781 [0,1,0,0,0,0|2,0,0]=3 4488 B15R1.3965 COCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000755781 [0,1,0,0,0,0|2,0,0]=3 4489 B15R1.3965 COCCCCC(=O)c1ccccc1F 1458a_100000188656_100000755781 [0,1,0,0,0,0|2,0,0]=3 4490 B15R1.3965 COCCCCC(=O)c1ccccc1I 1458a_100000187884_100000755781 [0,1,0,0,0,0|2,0,0]=3 4491 B15R1.3965 COCCCCC(=O)c1ccccc1O 1458a_100015234032_100000755781 [0,1,0,0,0,0|1,0,0]=2 4492 B15R1.3965 COCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000755781 [0,1,0,0,0,0|1,0,1]=3 4493 B15R1.3965 COCCCCN(C)c1ccccc1O 269982a_100000033821_100000730899 [0,1,0,0,0,0|3,0,0]=4 4494 B15R1.3965 COCCCNC(=O)c1ccccc1Br 1626a_100150723488_100000188424 [0,1,0,0,0,0|2,0,0]=3 4495 B15R1.3965 COCCCNC(=O)c1ccccc1Br 240690a_100150723488_100000188424 [0,1,0,0,0,0|2,0,0]=3 4496 B15R1.3965 COCCCNC(=O)c1ccccc1Br 527a_100150723488_100000188424 [0,1,0,0,0,0|2,0,0]=3 4497 B15R1.3965 COCCCNC(=O)c1ccccc1C 1626a_100150723488_100000212026 [0,1,0,0,0,0|2,0,0]=3 4498 B15R1.3965 COCCCNC(=O)c1ccccc1C 240690a_100150723488_100000212026 [0,1,0,0,0,0|2,0,0]=3 4499 B15R1.3965 COCCCNC(=O)c1ccccc1C 527a_100150723488_100000212026 [0,1,0,0,0,0|2,0,0]=3 4500 B15R1.3965 COCCCNC(=O)c1ccccc1Cl 1626a_100150723488_100000185844 [0,1,0,0,0,0|2,0,0]=3 4501 B15R1.3965 COCCCNC(=O)c1ccccc1Cl 240690a_100150723488_100000185844 [0,1,0,0,0,0|2,0,0]=3 4502 B15R1.3965 COCCCNC(=O)c1ccccc1Cl 527a_100150723488_100000185844 [0,1,0,0,0,0|2,0,0]=3 4503 B15R1.3965 COCCCNC(=O)c1ccccc1F 1626a_100150723488_100000188656 [0,1,0,0,0,0|2,0,0]=3 4504 B15R1.3965 COCCCNC(=O)c1ccccc1F 240690a_100150723488_100000188656 [0,1,0,0,0,0|2,0,0]=3 4505 B15R1.3965 COCCCNC(=O)c1ccccc1F 527a_100150723488_100000188656 [0,1,0,0,0,0|2,0,0]=3 4506 B15R1.3965 COCCCNC(=O)c1ccccc1I 1626a_100150723488_100000187884 [0,1,0,0,0,0|2,0,0]=3 4507 B15R1.3965 COCCCNC(=O)c1ccccc1I 240690a_100150723488_100000187884 [0,1,0,0,0,0|2,0,0]=3 4508 B15R1.3965 COCCCNC(=O)c1ccccc1I 527a_100150723488_100000187884 [0,1,0,0,0,0|2,0,0]=3 4509 B15R1.3965 COCCCNC(=O)c1ccccc1N 34a_200011191992_200000210301 [0,1,0,0,0,0|2,0,0]=3 4510 B15R1.3965 COCCCNC(=O)c1ccccc1O 240690a_100150723488_100015234032 [0,1,0,0,0,0|1,0,0]=2 4511 B15R1.3965 COCCCNC(=O)c1ccccc1[O-] 1626a_100150723488_100009911694 [0,1,0,0,0,0|1,0,1]=3 4512 B15R1.3965 COCCCNC(=O)c1ccccc1[O-] 240690a_100150723488_100009911694 [0,1,0,0,0,0|1,0,1]=3 4513 B15R1.3965 COCCCNC(=O)c1ccccc1[O-] 527a_100150723488_100009911694 [0,1,0,0,0,0|1,0,1]=3 4514 B15R1.3965 COCCCN[C@H](C)c1ccccc1O 2230a_100025703389_100000740836 [0,1,0,0,0,0|2,0,1]=4 4515 B15R1.3965 COCCCOC(C)c1ccccc1Br 34a_100000702211_100000740836 [0,1,0,0,0,0|2,0,1]=4 4516 B15R1.3965 COCCCOC(C)c1ccccc1Br 7a_100000702211_100000740836 [0,1,0,0,0,0|2,0,1]=4 4517 B15R1.3965 COCCCOC(C)c1ccccc1C 34a_100000742021_100000740836 [0,1,0,0,0,0|2,0,1]=4 4518 B15R1.3965 COCCCOC(C)c1ccccc1C 7a_100000742021_100000740836 [0,1,0,0,0,0|2,0,1]=4 4519 B15R1.3965 COCCCOC(C)c1ccccc1Cl 34a_100000740796_100000740836 [0,1,0,0,0,0|2,0,1]=4 4520 B15R1.3965 COCCCOC(C)c1ccccc1Cl 7a_100000740796_100000740836 [0,1,0,0,0,0|2,0,1]=4 4521 B15R1.3965 COCCCOC(C)c1ccccc1F 34a_100000697922_100000740836 [0,1,0,0,0,0|2,0,1]=4 4522 B15R1.3965 COCCCOC(C)c1ccccc1F 34a_100000740835_200000741388 [0,1,0,0,0,0|2,0,1]=4 4523 B15R1.3965 COCCCOC(C)c1ccccc1F 7a_100000697922_100000740836 [0,1,0,0,0,0|2,0,1]=4 4524 B15R1.3965 COCCCOC(C)c1ccccc1N 7a_100011405641_100000740836 [0,1,0,0,0,0|2,0,1]=4 4525 B15R1.3965 COCCNCC(=O)c1ccccc1C 2230a_100000209980_100000741374 [0,1,0,0,0,0|3,0,0]=4 4526 B15R1.3965 COCCNNC(=O)c1ccccc1Br 22a_100000741390_100000188424 [0,1,0,0,0,0|3,0,0]=4 4527 B15R1.3965 COCCNNC(=O)c1ccccc1C 22a_100000741390_100000212026 [0,1,0,0,0,0|3,0,0]=4 4528 B15R1.3965 COCCNNC(=O)c1ccccc1Cl 22a_100000741390_100000185844 [0,1,0,0,0,0|3,0,0]=4 4529 B15R1.3965 COCCNNC(=O)c1ccccc1F 22a_100000741390_100000188656 [0,1,0,0,0,0|3,0,0]=4 4530 B15R1.3965 COCCNNC(=O)c1ccccc1I 22a_100000741390_100000187884 [0,1,0,0,0,0|3,0,0]=4 4531 B15R1.3965 COCCNNC(=O)c1ccccc1O 22a_100000741390_100015234032 [0,1,0,0,0,0|2,0,0]=3 4532 B15R1.3965 COCCNNC(=O)c1ccccc1[O-] 22a_100000741390_100009911694 [0,1,0,0,0,0|2,0,1]=4 4533 B15R1.3965 COCCOCC(=O)c1ccccc1Br 34a_100000210237_100000199116 [0,1,0,0,0,0|2,0,0]=3 4534 B15R1.3965 COCCOCC(=O)c1ccccc1C 34a_100000210237_100000741374 [0,1,0,0,0,0|2,0,0]=3 4535 B15R1.3965 COCCOCC(=O)c1ccccc1Cl 34a_100000210237_100000211432 [0,1,0,0,0,0|2,0,0]=3 4536 B15R1.3965 COCCOCC(=O)c1ccccc1F 34a_100000210237_100000204681 [0,1,0,0,0,0|2,0,0]=3 4537 B15R1.3965 COCCOCN(C)c1ccccc1O 269982a_100000033821_100000231047 [0,1,0,0,0,0|3,0,0]=4 4538 B15R1.3965 COCCSCC(=O)c1ccccc1Br 62a_100000199116_100000233755 [0,1,0,0,0,0|2,1,0]=4 4539 B15R1.3965 COCCSCC(=O)c1ccccc1C 62a_100000233755_100000741374 [0,1,0,0,0,0|2,1,0]=4 4540 B15R1.3965 COCCSCC(=O)c1ccccc1C 62a_100000741374_100000233755 [0,1,0,0,0,0|2,1,0]=4 4541 B15R1.3965 COCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000233755 [0,1,0,0,0,0|2,1,0]=4 4542 B15R1.3965 COCCSCC(=O)c1ccccc1Cl 62a_100000233755_100000211432 [0,1,0,0,0,0|2,1,0]=4 4543 B15R1.3965 COCCSCC(=O)c1ccccc1F 62a_100000204681_100000233755 [0,1,0,0,0,0|2,1,0]=4 4544 B15R1.3965 COCCSCC(=O)c1ccccc1F 62a_100000233755_100000204681 [0,1,0,0,0,0|2,1,0]=4 4545 B15R1.3965 COCCSCC(=O)c1ccccc1O 62a_100000188908_100000233755 [0,1,0,0,0,0|1,1,0]=3 4546 B15R1.3965 COCCSCC(=O)c1ccccc1O 62a_100000233755_100000188908 [0,1,0,0,0,0|1,1,0]=3 4547 B15R1.3965 COCSCCC(=O)c1ccccc1F 62a_100000086012_100000766300 [0,1,0,0,0,0|3,0,0]=4 4548 B15R1.3965 COCSCCC(=O)c1ccccc1F 62a_100000766300_100000086012 [0,1,0,0,0,0|3,0,0]=4 4549 B15R1.3965 COCSCCC(=O)c1ccccc1O 62a_100000766300_100009873196 [0,1,0,0,0,0|2,0,0]=3 4550 B15R1.3965 CSCCCNC(=O)c1ccccc1Br 11a_100000749238_100000188424 [0,1,0,0,0,0|2,0,0]=3 4551 B15R1.3965 CSCCCNC(=O)c1ccccc1Br 1626a_100000749238_100000188424 [0,1,0,0,0,0|2,0,0]=3 4552 B15R1.3965 CSCCCNC(=O)c1ccccc1Br 240690a_100000749238_100000188424 [0,1,0,0,0,0|2,0,0]=3 4553 B15R1.3965 CSCCCNC(=O)c1ccccc1Br 527a_100000749238_100000188424 [0,1,0,0,0,0|2,0,0]=3 4554 B15R1.3965 CSCCCNC(=O)c1ccccc1C 11a_100000749238_100000212026 [0,1,0,0,0,0|2,0,0]=3 4555 B15R1.3965 CSCCCNC(=O)c1ccccc1C 1626a_100000749238_100000212026 [0,1,0,0,0,0|2,0,0]=3 4556 B15R1.3965 CSCCCNC(=O)c1ccccc1C 240690a_100000749238_100000212026 [0,1,0,0,0,0|2,0,0]=3 4557 B15R1.3965 CSCCCNC(=O)c1ccccc1C 527a_100000749238_100000212026 [0,1,0,0,0,0|2,0,0]=3 4558 B15R1.3965 CSCCCNC(=O)c1ccccc1Cl 11a_100000749238_100000185844 [0,1,0,0,0,0|2,0,0]=3 4559 B15R1.3965 CSCCCNC(=O)c1ccccc1Cl 1626a_100000749238_100000185844 [0,1,0,0,0,0|2,0,0]=3 4560 B15R1.3965 CSCCCNC(=O)c1ccccc1Cl 240690a_100000749238_100000185844 [0,1,0,0,0,0|2,0,0]=3 4561 B15R1.3965 CSCCCNC(=O)c1ccccc1Cl 527a_100000749238_100000185844 [0,1,0,0,0,0|2,0,0]=3 4562 B15R1.3965 CSCCCNC(=O)c1ccccc1F 11a_100000749238_100000188656 [0,1,0,0,0,0|2,0,0]=3 4563 B15R1.3965 CSCCCNC(=O)c1ccccc1F 1626a_100000749238_100000188656 [0,1,0,0,0,0|2,0,0]=3 4564 B15R1.3965 CSCCCNC(=O)c1ccccc1F 240690a_100000749238_100000188656 [0,1,0,0,0,0|2,0,0]=3 4565 B15R1.3965 CSCCCNC(=O)c1ccccc1F 527a_100000749238_100000188656 [0,1,0,0,0,0|2,0,0]=3 4566 B15R1.3965 CSCCCNC(=O)c1ccccc1I 11a_100000749238_100000187884 [0,1,0,0,0,0|2,0,0]=3 4567 B15R1.3965 CSCCCNC(=O)c1ccccc1I 1626a_100000749238_100000187884 [0,1,0,0,0,0|2,0,0]=3 4568 B15R1.3965 CSCCCNC(=O)c1ccccc1I 240690a_100000749238_100000187884 [0,1,0,0,0,0|2,0,0]=3 4569 B15R1.3965 CSCCCNC(=O)c1ccccc1I 527a_100000749238_100000187884 [0,1,0,0,0,0|2,0,0]=3 4570 B15R1.3965 CSCCCNC(=O)c1ccccc1O 240690a_100000749238_100015234032 [0,1,0,0,0,0|1,0,0]=2 4571 B15R1.3965 CSCCCNC(=O)c1ccccc1[O-] 1626a_100000749238_100009911694 [0,1,0,0,0,0|1,0,1]=3 4572 B15R1.3965 CSCCCNC(=O)c1ccccc1[O-] 240690a_100000749238_100009911694 [0,1,0,0,0,0|1,0,1]=3 4573 B15R1.3965 CSCCCNC(=O)c1ccccc1[O-] 527a_100000749238_100009911694 [0,1,0,0,0,0|1,0,1]=3 4574 B15R1.3965 CSCCCOC(C)c1ccccc1Cl 7a_100000690336_100000181259 [0,1,0,0,0,0|2,0,1]=4 4575 B15R1.3965 CSCCCOC(C)c1ccccc1F 34a_100000690336_200000741388 [0,1,0,0,0,0|2,0,1]=4 4576 B15R1.3965 CSCCCOC(C)c1ccccc1F 7a_100000690336_200000741388 [0,1,0,0,0,0|2,0,1]=4 4577 B15R1.3965 CSCCNCC(=O)c1ccccc1C 2230a_100020590264_100000741374 [0,1,0,0,0,0|3,0,0]=4 4578 B15R1.3965 CSCCOCC(=O)c1ccccc1Br 34a_100000230434_100000199116 [0,1,0,0,0,0|2,0,0]=3 4579 B15R1.3965 CSCCOCC(=O)c1ccccc1C 34a_100000230434_100000741374 [0,1,0,0,0,0|2,0,0]=3 4580 B15R1.3965 CSCCOCC(=O)c1ccccc1C 7a_100000230434_100000741374 [0,1,0,0,0,0|2,0,0]=3 4581 B15R1.3965 CSCCOCC(=O)c1ccccc1Cl 34a_100000230434_100000211432 [0,1,0,0,0,0|2,0,0]=3 4582 B15R1.3965 CSCCOCC(=O)c1ccccc1F 34a_100000230434_100000204681 [0,1,0,0,0,0|2,0,0]=3 4583 B15R1.3965 CSCCOCC(=O)c1ccccc1F 7a_100000230434_100000204681 [0,1,0,0,0,0|2,0,0]=3 4584 B15R1.3965 CSCCOCC(=O)c1ccccc1O 7a_100000230434_100000188908 [0,1,0,0,0,0|1,0,0]=2 4585 B15R1.3965 CSCCSCC(=O)c1ccccc1Br 62a_100000199116_100000751147 [0,1,0,0,0,0|2,1,0]=4 4586 B15R1.3965 CSCCSCC(=O)c1ccccc1C 62a_100000212216_100000741374 [0,1,0,0,0,0|2,1,0]=4 4587 B15R1.3965 CSCCSCC(=O)c1ccccc1C 62a_100000741374_100000751147 [0,1,0,0,0,0|2,1,0]=4 4588 B15R1.3965 CSCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000751147 [0,1,0,0,0,0|2,1,0]=4 4589 B15R1.3965 CSCCSCC(=O)c1ccccc1Cl 62a_100000212216_100000211432 [0,1,0,0,0,0|2,1,0]=4 4590 B15R1.3965 CSCCSCC(=O)c1ccccc1F 62a_100000204681_100000751147 [0,1,0,0,0,0|2,1,0]=4 4591 B15R1.3965 CSCCSCC(=O)c1ccccc1F 62a_100000212216_100000204681 [0,1,0,0,0,0|2,1,0]=4 4592 B15R1.3965 CSCCSCC(=O)c1ccccc1O 62a_100000188908_100000751147 [0,1,0,0,0,0|1,1,0]=3 4593 B15R1.3965 CSCCSCC(=O)c1ccccc1O 62a_100000212216_100000188908 [0,1,0,0,0,0|1,1,0]=3 4594 B15R1.3965 CSCSCCC(=O)c1ccccc1F 62a_100000086012_100011218213 [0,1,0,0,0,0|3,0,0]=4 4595 B15R1.3965 CSCSCCC(=O)c1ccccc1F 62a_100011218213_100000086012 [0,1,0,0,0,0|3,0,0]=4 4596 B15R1.3965 CSCSCCC(=O)c1ccccc1O 62a_100011218213_100009873196 [0,1,0,0,0,0|2,0,0]=3 4597 B15R1.3965 C[C@@H](NCCCCF)c1ccccc1O 2230a_100025703389_100000729493 [0,1,0,0,0,0|2,0,1]=4 4598 B15R1.3965 C[C@@H](NCCCCO)c1ccccc1O 2230a_100025703389_100000210776 [0,1,0,0,0,0|2,0,1]=4 4599 B15R1.3965 Cc1ccccc1C(=O)CCCCC#N 1458a_100000212026_100000211819 [0,1,0,0,0,0|2,0,1]=4 4600 B15R1.3965 Cc1ccccc1C(=O)CCCCCF 1458a_100000212026_100000729378 [0,1,0,0,0,0|2,0,0]=3 4601 B15R1.3965 Cc1ccccc1C(=O)CCCCCO 1458a_100000212026_100000746330 [0,1,0,0,0,0|2,0,0]=3 4602 B15R1.3965 Cc1ccccc1C(=O)CCOCCO 1458a_100000212026_100011215305 [0,1,0,0,0,0|3,0,0]=4 4603 B15R1.3965 Cc1ccccc1C(=O)CNCCCF 2230a_100015189416_100000741374 [0,1,0,0,0,0|3,0,0]=4 4604 B15R1.3965 Cc1ccccc1C(=O)CNCCCF 34a_100015189416_100000741374 [0,1,0,0,0,0|3,0,0]=4 4605 B15R1.3965 Cc1ccccc1C(=O)COCCCBr 34a_100011217188_100000741374 [0,1,0,0,0,0|2,0,0]=3 4606 B15R1.3965 Cc1ccccc1C(=O)COCCCCl 34a_100000230001_100000741374 [0,1,0,0,0,0|2,0,0]=3 4607 B15R1.3965 Cc1ccccc1C(=O)COCCCF 34a_100000759539_100000741374 [0,1,0,0,0,0|2,0,0]=3 4608 B15R1.3965 Cc1ccccc1C(=O)COCCCN 34a_100000182051_100000741374 [0,1,0,0,0,0|2,0,0]=3 4609 B15R1.3965 Cc1ccccc1C(=O)COCCON 34a_100000700252_100000741374 [0,1,0,0,0,0|3,0,0]=4 4610 B15R1.3965 Cc1ccccc1C(=O)CSCCCF 62a_100000741374_100011934791 [0,1,0,0,0,0|2,1,0]=4 4611 B15R1.3965 Cc1ccccc1C(=O)CSCCCF 62a_100011934791_100000741374 [0,1,0,0,0,0|2,1,0]=4 4612 B15R1.3965 Cc1ccccc1C(=O)CSCCCO 62a_100000741374_100011215043 [0,1,0,0,0,0|2,1,0]=4 4613 B15R1.3965 Cc1ccccc1C(=O)CSCCCO 62a_100011215043_100000741374 [0,1,0,0,0,0|2,1,0]=4 4614 B15R1.3965 Cc1ccccc1C(=O)NCCCCO 240690a_100000750430_100000212026 [0,1,0,0,0,0|2,0,0]=3 4615 B15R1.3965 Cc1ccccc1C(=O)NCCCCO 527a_100000750430_100000212026 [0,1,0,0,0,0|2,0,0]=3 4616 B15R1.3965 Cc1ccccc1C(C)OCCCCF 34a_100000742021_100000729493 [0,1,0,0,0,0|2,0,1]=4 4617 B15R1.3965 Cc1ccccc1C(C)OCCCCF 7a_100000742021_100000729493 [0,1,0,0,0,0|2,0,1]=4 4618 B15R1.3965 Cc1ccccc1C(C)OCCCCO 34a_100000742021_100011216708 [0,1,0,0,0,0|2,0,1]=4 4619 B15R1.3965 Cc1ccccc1C(C)OCCCCO 7a_100000742021_100000210776 [0,1,0,0,0,0|2,0,1]=4 4620 B15R1.3965 N#CCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000211819 [0,1,0,0,0,0|2,0,1]=4 4621 B15R1.3965 N#CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000211819 [0,1,0,0,0,0|2,0,1]=4 4622 B15R1.3965 N#CCCCCC(=O)c1ccccc1F 1458a_100000188656_100000211819 [0,1,0,0,0,0|2,0,1]=4 4623 B15R1.3965 N#CCCCCC(=O)c1ccccc1I 1458a_100000187884_100000211819 [0,1,0,0,0,0|2,0,1]=4 4624 B15R1.3965 N#CCCCCC(=O)c1ccccc1O 1458a_100015234032_100000211819 [0,1,0,0,0,0|1,0,1]=3 4625 B15R1.3965 N#CCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000211819 [0,1,0,0,0,0|1,0,2]=4 4626 B15R1.3965 N#CCCNNC(=O)c1ccccc1O 22a_100000229987_100015234032 [0,1,0,0,0,0|2,0,1]=4 4627 B15R1.3965 N#CCCSCC(=O)c1ccccc1O 62a_100000188908_100011215226 [0,1,0,0,0,0|1,1,1]=4 4628 B15R1.3965 N#CCCSCC(=O)c1ccccc1O 62a_100011215226_100000188908 [0,1,0,0,0,0|1,1,1]=4 4629 B15R1.3965 N#CCOCCC(=O)c1ccccc1O 1458a_100015234032_200000047693 [0,1,0,0,0,0|2,0,1]=4 4630 B15R1.3965 N#CCSCCC(=O)c1ccccc1O 62a_100011215382_100009873196 [0,1,0,0,0,0|2,0,1]=4 4631 B15R1.3965 NCCCOCC(=O)c1ccccc1Br 34a_100000182051_100000199116 [0,1,0,0,0,0|2,0,0]=3 4632 B15R1.3965 NCCCOCC(=O)c1ccccc1Cl 34a_100000182051_100000211432 [0,1,0,0,0,0|2,0,0]=3 4633 B15R1.3965 NCCCOCC(=O)c1ccccc1F 34a_100000182051_100000204681 [0,1,0,0,0,0|2,0,0]=3 4634 B15R1.3965 NOCCOCC(=O)c1ccccc1Br 34a_100000700252_100000199116 [0,1,0,0,0,0|3,0,0]=4 4635 B15R1.3965 NOCCOCC(=O)c1ccccc1Cl 34a_100000700252_100000211432 [0,1,0,0,0,0|3,0,0]=4 4636 B15R1.3965 NOCCOCC(=O)c1ccccc1F 34a_100000700252_100000204681 [0,1,0,0,0,0|3,0,0]=4 4637 B15R1.3965 O=C(CCCCCF)c1ccccc1Br 1458a_100000188424_100000729378 [0,1,0,0,0,0|2,0,0]=3 4638 B15R1.3965 O=C(CCCCCF)c1ccccc1Cl 1458a_100000185844_100000729378 [0,1,0,0,0,0|2,0,0]=3 4639 B15R1.3965 O=C(CCCCCF)c1ccccc1F 1458a_100000188656_100000729378 [0,1,0,0,0,0|2,0,0]=3 4640 B15R1.3965 O=C(CCCCCF)c1ccccc1I 1458a_100000187884_100000729378 [0,1,0,0,0,0|2,0,0]=3 4641 B15R1.3965 O=C(CCCCCF)c1ccccc1O 1458a_100015234032_100000729378 [0,1,0,0,0,0|1,0,0]=2 4642 B15R1.3965 O=C(CCCCCF)c1ccccc1[O-] 1458a_100009911694_100000729378 [0,1,0,0,0,0|1,0,1]=3 4643 B15R1.3965 O=C(CCCCCO)c1ccccc1Br 1458a_100000188424_100000746330 [0,1,0,0,0,0|2,0,0]=3 4644 B15R1.3965 O=C(CCCCCO)c1ccccc1Cl 1458a_100000185844_100000746330 [0,1,0,0,0,0|2,0,0]=3 4645 B15R1.3965 O=C(CCCCCO)c1ccccc1F 1458a_100000188656_100000746330 [0,1,0,0,0,0|2,0,0]=3 4646 B15R1.3965 O=C(CCCCCO)c1ccccc1I 1458a_100000187884_100000746330 [0,1,0,0,0,0|2,0,0]=3 4647 B15R1.3965 O=C(CCCCCO)c1ccccc1O 1458a_100015234032_100000746330 [0,1,0,0,0,0|1,0,0]=2 4648 B15R1.3965 O=C(CCCCCO)c1ccccc1[O-] 1458a_100009911694_100000746330 [0,1,0,0,0,0|1,0,1]=3 4649 B15R1.3965 O=C(CCNCCO)c1ccccc1F 2230a_100016997473_100000086012 [0,1,0,0,0,0|3,0,0]=4 4650 B15R1.3965 O=C(CCOCCO)c1ccccc1Br 1458a_100000188424_100011215305 [0,1,0,0,0,0|3,0,0]=4 4651 B15R1.3965 O=C(CCOCCO)c1ccccc1Cl 1458a_100000185844_100011215305 [0,1,0,0,0,0|3,0,0]=4 4652 B15R1.3965 O=C(CCOCCO)c1ccccc1F 1458a_100000188656_100011215305 [0,1,0,0,0,0|3,0,0]=4 4653 B15R1.3965 O=C(CCOCCO)c1ccccc1I 1458a_100000187884_100011215305 [0,1,0,0,0,0|3,0,0]=4 4654 B15R1.3965 O=C(CCOCCO)c1ccccc1O 1458a_100015234032_100011215305 [0,1,0,0,0,0|2,0,0]=3 4655 B15R1.3965 O=C(CCOCCO)c1ccccc1[O-] 1458a_100009911694_100011215305 [0,1,0,0,0,0|2,0,1]=4 4656 B15R1.3965 O=C(CCSCCF)c1ccccc1F 62a_100000086012_100011217306 [0,1,0,0,0,0|3,0,0]=4 4657 B15R1.3965 O=C(CCSCCF)c1ccccc1F 62a_100011217306_100000086012 [0,1,0,0,0,0|3,0,0]=4 4658 B15R1.3965 O=C(CCSCCF)c1ccccc1O 62a_100011217306_100009873196 [0,1,0,0,0,0|2,0,0]=3 4659 B15R1.3965 O=C(CCSCCO)c1ccccc1F 62a_100000086012_100000211926 [0,1,0,0,0,0|3,0,0]=4 4660 B15R1.3965 O=C(CCSCCO)c1ccccc1F 62a_100000211926_100000086012 [0,1,0,0,0,0|3,0,0]=4 4661 B15R1.3965 O=C(CCSCCO)c1ccccc1O 62a_100000211926_100009873196 [0,1,0,0,0,0|2,0,0]=3 4662 B15R1.3965 O=C(CNCCCF)c1ccccc1Br 34a_100015189416_100000199116 [0,1,0,0,0,0|3,0,0]=4 4663 B15R1.3965 O=C(CNCCCF)c1ccccc1Cl 34a_100015189416_100000211432 [0,1,0,0,0,0|3,0,0]=4 4664 B15R1.3965 O=C(CNCCCF)c1ccccc1F 34a_100015189416_100000204681 [0,1,0,0,0,0|3,0,0]=4 4665 B15R1.3965 O=C(COCCCBr)c1ccccc1Br 34a_100011217188_100000199116 [0,1,0,0,0,0|2,0,0]=3 4666 B15R1.3965 O=C(COCCCBr)c1ccccc1Cl 34a_100011217188_100000211432 [0,1,0,0,0,0|2,0,0]=3 4667 B15R1.3965 O=C(COCCCBr)c1ccccc1F 34a_100011217188_100000204681 [0,1,0,0,0,0|2,0,0]=3 4668 B15R1.3965 O=C(COCCCCl)c1ccccc1Br 34a_100000230001_100000199116 [0,1,0,0,0,0|2,0,0]=3 4669 B15R1.3965 O=C(COCCCCl)c1ccccc1Cl 34a_100000230001_100000211432 [0,1,0,0,0,0|2,0,0]=3 4670 B15R1.3965 O=C(COCCCCl)c1ccccc1F 34a_100000230001_100000204681 [0,1,0,0,0,0|2,0,0]=3 4671 B15R1.3965 O=C(COCCCF)c1ccccc1Br 34a_100000759539_100000199116 [0,1,0,0,0,0|2,0,0]=3 4672 B15R1.3965 O=C(COCCCF)c1ccccc1Cl 34a_100000759539_100000211432 [0,1,0,0,0,0|2,0,0]=3 4673 B15R1.3965 O=C(COCCCF)c1ccccc1F 34a_100000759539_100000204681 [0,1,0,0,0,0|2,0,0]=3 4674 B15R1.3965 O=C(CSCCCF)c1ccccc1Br 62a_100000199116_100011934791 [0,1,0,0,0,0|2,1,0]=4 4675 B15R1.3965 O=C(CSCCCF)c1ccccc1Cl 62a_100000211432_100011934791 [0,1,0,0,0,0|2,1,0]=4 4676 B15R1.3965 O=C(CSCCCF)c1ccccc1Cl 62a_100011934791_100000211432 [0,1,0,0,0,0|2,1,0]=4 4677 B15R1.3965 O=C(CSCCCF)c1ccccc1F 62a_100000204681_100011934791 [0,1,0,0,0,0|2,1,0]=4 4678 B15R1.3965 O=C(CSCCCF)c1ccccc1F 62a_100011934791_100000204681 [0,1,0,0,0,0|2,1,0]=4 4679 B15R1.3965 O=C(CSCCCF)c1ccccc1O 62a_100000188908_100011934791 [0,1,0,0,0,0|1,1,0]=3 4680 B15R1.3965 O=C(CSCCCF)c1ccccc1O 62a_100011934791_100000188908 [0,1,0,0,0,0|1,1,0]=3 4681 B15R1.3965 O=C(CSCCCO)c1ccccc1Br 62a_100000199116_100011215043 [0,1,0,0,0,0|2,1,0]=4 4682 B15R1.3965 O=C(CSCCCO)c1ccccc1Cl 62a_100000211432_100011215043 [0,1,0,0,0,0|2,1,0]=4 4683 B15R1.3965 O=C(CSCCCO)c1ccccc1Cl 62a_100011215043_100000211432 [0,1,0,0,0,0|2,1,0]=4 4684 B15R1.3965 O=C(CSCCCO)c1ccccc1F 62a_100000204681_100011215043 [0,1,0,0,0,0|2,1,0]=4 4685 B15R1.3965 O=C(CSCCCO)c1ccccc1F 62a_100011215043_100000204681 [0,1,0,0,0,0|2,1,0]=4 4686 B15R1.3965 O=C(CSCCCO)c1ccccc1O 62a_100000188908_100011215043 [0,1,0,0,0,0|1,1,0]=3 4687 B15R1.3965 O=C(CSCCCO)c1ccccc1O 62a_100011215043_100000188908 [0,1,0,0,0,0|1,1,0]=3 4688 B15R1.3965 O=C(NCCCCO)c1ccccc1Br 240690a_100000750430_100000188424 [0,1,0,0,0,0|2,0,0]=3 4689 B15R1.3965 O=C(NCCCCO)c1ccccc1Br 527a_100000750430_100000188424 [0,1,0,0,0,0|2,0,0]=3 4690 B15R1.3965 O=C(NCCCCO)c1ccccc1Cl 240690a_100000750430_100000185844 [0,1,0,0,0,0|2,0,0]=3 4691 B15R1.3965 O=C(NCCCCO)c1ccccc1Cl 527a_100000750430_100000185844 [0,1,0,0,0,0|2,0,0]=3 4692 B15R1.3965 O=C(NCCCCO)c1ccccc1F 240690a_100000750430_100000188656 [0,1,0,0,0,0|2,0,0]=3 4693 B15R1.3965 O=C(NCCCCO)c1ccccc1F 527a_100000750430_100000188656 [0,1,0,0,0,0|2,0,0]=3 4694 B15R1.3965 O=C(NCCCCO)c1ccccc1I 240690a_100000750430_100000187884 [0,1,0,0,0,0|2,0,0]=3 4695 B15R1.3965 O=C(NCCCCO)c1ccccc1I 527a_100000750430_100000187884 [0,1,0,0,0,0|2,0,0]=3 4696 B15R1.3965 O=C(NCCCCO)c1ccccc1O 240690a_100000750430_100015234032 [0,1,0,0,0,0|1,0,0]=2 4697 B15R1.3965 O=C(NCCCCO)c1ccccc1[O-] 240690a_100000750430_100009911694 [0,1,0,0,0,0|1,0,1]=3 4698 B15R1.3965 O=C(NCCCCO)c1ccccc1[O-] 527a_100000750430_100009911694 [0,1,0,0,0,0|1,0,1]=3 4699 B15R1.3965 O=C(NCCNCF)c1ccccc1Cl 34a_100000737833_100015361967 [0,1,0,0,0,0|3,0,0]=4 4700 B15R1.3965 O=C(NCCOCF)c1ccccc1Br 34a_200000158863_100015361967 [0,1,0,0,0,0|3,0,0]=4 4701 B15R1.3965 O=C(NCCOCF)c1ccccc1Br 7a_200000158863_100015361967 [0,1,0,0,0,0|3,0,0]=4 4702 B15R1.3965 O=CCSCCC(=O)c1ccccc1O 62a_200015260668_100009873196 [0,1,0,0,0,0|2,0,1]=4 4703 B15R1.3965 [13CH3]OCCCNC(=O)c1ccccc1N 34a_200011191992_200025704644 [0,1,0,0,0,0|2,0,0]=3 4704 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1Br 270084a_100000102301_100000184729 [0,1,0,0,0,0|3,0,0]=4 4705 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1Br 274078a_100000102301_100000184729 [0,1,0,0,0,0|3,0,0]=4 4706 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1Br 40a_100000102301_100010380725 [0,1,0,0,0,0|3,0,0]=4 4707 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1C 270084a_100000102301_100000750907 [0,1,0,0,0,0|3,0,0]=4 4708 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1C 274078a_100000102301_100000750907 [0,1,0,0,0,0|3,0,0]=4 4709 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1C 40a_100000102301_100010269479 [0,1,0,0,0,0|3,0,0]=4 4710 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1Cl 270084a_100000102301_100000184199 [0,1,0,0,0,0|3,0,0]=4 4711 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1Cl 274078a_100000102301_100000184199 [0,1,0,0,0,0|3,0,0]=4 4712 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1F 270084a_100000102301_100000184916 [0,1,0,0,0,0|3,0,0]=4 4713 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1F 274078a_100000102301_100000184916 [0,1,0,0,0,0|3,0,0]=4 4714 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1I 270084a_100000102301_100011191325 [0,1,0,0,0,0|3,0,0]=4 4715 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1I 274078a_100000102301_100011191325 [0,1,0,0,0,0|3,0,0]=4 4716 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1N 40a_100000102301_100000703237 [0,1,0,0,0,0|3,0,0]=4 4717 B15R1.4060 CCCCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000164993 [0,1,0,0,0,0|2,0,0]=3 4718 B15R1.4060 CCCCOC(C)(C)c1ccccc1Br 34a_100011346021_100000210210 [0,1,0,0,0,0|2,0,1]=4 4719 B15R1.4060 CCCCOC(C)(C)c1ccccc1Br 7a_100011346021_100000210211 [0,1,0,0,0,0|2,0,1]=4 4720 B15R1.4060 CCCCOC(C)(C)c1ccccc1Cl 34a_100000690508_100000210210 [0,1,0,0,0,0|2,0,1]=4 4721 B15R1.4060 CCCCOC(C)(C)c1ccccc1Cl 7a_100000690508_100000210211 [0,1,0,0,0,0|2,0,1]=4 4722 B15R1.4060 CCCCOC(C)(C)c1ccccc1F 34a_100011345963_100000210210 [0,1,0,0,0,0|2,0,1]=4 4723 B15R1.4060 CCCCOC(C)(C)c1ccccc1F 7a_100011345963_100000210211 [0,1,0,0,0,0|2,0,1]=4 4724 B15R1.4060 CCCCOC(C)(C)c1ccccc1I 34a_100010296449_100000210210 [0,1,0,0,0,0|2,0,1]=4 4725 B15R1.4060 CCCCOC(C)(C)c1ccccc1I 7a_100010296449_100000210211 [0,1,0,0,0,0|2,0,1]=4 4726 B15R1.4060 CCCCOC(C)(C)c1ccccc1N 7a_100000081495_100000210211 [0,1,0,0,0,0|2,0,1]=4 4727 B15R1.4060 CCCCOC(F)(F)c1ccccc1F 34a_100000210227_100000070671 [0,1,0,0,0,0|2,0,1]=4 4728 B15R1.4060 CCCCOC(F)(F)c1ccccc1F 7a_100000210227_100000070671 [0,1,0,0,0,0|2,0,1]=4 4729 B15R1.5815 CC(CF)OCC(=O)c1ccccc1O 7a_100016041109_100000188908 [0,1,0,0,0,0|3,0,0]=4 4730 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Br 240690a_100000744482_100000188424 [0,1,0,0,0,0|3,0,0]=4 4731 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Br 527a_100000744482_100000188424 [0,1,0,0,0,0|3,0,0]=4 4732 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Cl 240690a_100000744482_100000185844 [0,1,0,0,0,0|3,0,0]=4 4733 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Cl 527a_100000744482_100000185844 [0,1,0,0,0,0|3,0,0]=4 4734 B15R1.5815 CC(CO)CNC(=O)c1ccccc1F 240690a_100000744482_100000188656 [0,1,0,0,0,0|3,0,0]=4 4735 B15R1.5815 CC(CO)CNC(=O)c1ccccc1F 527a_100000744482_100000188656 [0,1,0,0,0,0|3,0,0]=4 4736 B15R1.5815 CC(CO)CNC(=O)c1ccccc1I 240690a_100000744482_100000187884 [0,1,0,0,0,0|3,0,0]=4 4737 B15R1.5815 CC(CO)CNC(=O)c1ccccc1I 527a_100000744482_100000187884 [0,1,0,0,0,0|3,0,0]=4 4738 B15R1.5815 CC(CO)CNC(=O)c1ccccc1O 240690a_100000744482_100015234032 [0,1,0,0,0,0|2,0,0]=3 4739 B15R1.5815 CC(CO)CNC(=O)c1ccccc1[O-] 240690a_100000744482_100009911694 [0,1,0,0,0,0|2,0,1]=4 4740 B15R1.5815 CC(CO)CNC(=O)c1ccccc1[O-] 527a_100000744482_100009911694 [0,1,0,0,0,0|2,0,1]=4 4741 B15R1.5815 CC(CO)SCC(=O)c1ccccc1O 62a_100012180447_100000188908 [0,1,0,0,0,0|3,0,0]=4 4742 B15R1.5815 CCC(=O)CCC(=O)c1ccccc1F 1458a_100000210414_100000086012 [0,1,0,0,0,0|2,0,1]=4 4743 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_100000210202 [0,1,0,0,0,0|2,0,1]=4 4744 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_100000210202 [0,1,0,0,0,0|2,0,1]=4 4745 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1F 1458a_100000182453_100000210202 [0,1,0,0,0,0|2,0,1]=4 4746 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1I 1458a_100000194700_100000210202 [0,1,0,0,0,0|2,0,1]=4 4747 B15R1.5815 CCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000210202 [0,1,0,0,0,0|1,0,1]=3 4748 B15R1.5815 CCC(=O)NNC(=O)c1ccccc1O 22a_100000183195_100015234032 [0,1,0,0,0,0|2,0,1]=4 4749 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 11a_100020588543_100000188424 [0,1,0,0,0,0|2,0,0]=3 4750 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 1626a_100020588543_100000188424 [0,1,0,0,0,0|2,0,0]=3 4751 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 240690a_100020588543_100000188424 [0,1,0,0,0,0|2,0,0]=3 4752 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 527a_100020588543_100000188424 [0,1,0,0,0,0|2,0,0]=3 4753 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 11a_100020588543_100000212026 [0,1,0,0,0,0|2,0,0]=3 4754 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 1626a_100020588543_100000212026 [0,1,0,0,0,0|2,0,0]=3 4755 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 240690a_100020588543_100000212026 [0,1,0,0,0,0|2,0,0]=3 4756 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 527a_100020588543_100000212026 [0,1,0,0,0,0|2,0,0]=3 4757 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 11a_100020588543_100000185844 [0,1,0,0,0,0|2,0,0]=3 4758 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 1626a_100020588543_100000185844 [0,1,0,0,0,0|2,0,0]=3 4759 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 240690a_100020588543_100000185844 [0,1,0,0,0,0|2,0,0]=3 4760 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 527a_100020588543_100000185844 [0,1,0,0,0,0|2,0,0]=3 4761 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 11a_100020588543_100000188656 [0,1,0,0,0,0|2,0,0]=3 4762 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 1626a_100020588543_100000188656 [0,1,0,0,0,0|2,0,0]=3 4763 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 240690a_100020588543_100000188656 [0,1,0,0,0,0|2,0,0]=3 4764 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 527a_100020588543_100000188656 [0,1,0,0,0,0|2,0,0]=3 4765 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 11a_100020588543_100000187884 [0,1,0,0,0,0|2,0,0]=3 4766 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 1626a_100020588543_100000187884 [0,1,0,0,0,0|2,0,0]=3 4767 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 240690a_100020588543_100000187884 [0,1,0,0,0,0|2,0,0]=3 4768 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 527a_100020588543_100000187884 [0,1,0,0,0,0|2,0,0]=3 4769 B15R1.5815 CCC(C)CNC(=O)c1ccccc1O 240690a_100020588543_100015234032 [0,1,0,0,0,0|1,0,0]=2 4770 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 1626a_100020588543_100009911694 [0,1,0,0,0,0|1,0,1]=3 4771 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 240690a_100020588543_100009911694 [0,1,0,0,0,0|1,0,1]=3 4772 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 527a_100020588543_100009911694 [0,1,0,0,0,0|1,0,1]=3 4773 B15R1.5815 CCC(C)CN[C@H](C)c1ccccc1O 2230a_100025703389_100000748023 [0,1,0,0,0,0|2,0,1]=4 4774 B15R1.5815 CCC(C)CN[C@H](C)c1ccccc1O 270004a_100025703389_100000243153 [0,1,0,0,0,0|2,0,1]=4 4775 B15R1.5815 CCC(C)COC(C)c1ccccc1Br 34a_100000702211_100000748023 [0,1,0,0,0,0|2,0,1]=4 4776 B15R1.5815 CCC(C)COC(C)c1ccccc1Br 7a_100000702211_100000748023 [0,1,0,0,0,0|2,0,1]=4 4777 B15R1.5815 CCC(C)COC(C)c1ccccc1C 34a_100000742021_100000748023 [0,1,0,0,0,0|2,0,1]=4 4778 B15R1.5815 CCC(C)COC(C)c1ccccc1C 7a_100000742021_100000748023 [0,1,0,0,0,0|2,0,1]=4 4779 B15R1.5815 CCC(C)COC(C)c1ccccc1Cl 34a_100000740796_100000748023 [0,1,0,0,0,0|2,0,1]=4 4780 B15R1.5815 CCC(C)COC(C)c1ccccc1Cl 7a_100000740796_100000748023 [0,1,0,0,0,0|2,0,1]=4 4781 B15R1.5815 CCC(C)COC(C)c1ccccc1F 34a_100000697922_100000748023 [0,1,0,0,0,0|2,0,1]=4 4782 B15R1.5815 CCC(C)COC(C)c1ccccc1F 7a_100000697922_100000748023 [0,1,0,0,0,0|2,0,1]=4 4783 B15R1.5815 CCC(C)COC(C)c1ccccc1N 7a_100011405641_100000748023 [0,1,0,0,0,0|2,0,1]=4 4784 B15R1.5815 CCC(C)NCC(=O)c1ccccc1C 2230a_100000209981_100000741374 [0,1,0,0,0,0|3,0,0]=4 4785 B15R1.5815 CCC(C)NN=C(C)c1ccccc1O 4a_100000718999_100000188907 [0,1,0,0,0,0|3,0,0]=4 4786 B15R1.5815 CCC(C)NNC(=O)c1ccccc1Br 22a_100000718999_100000188424 [0,1,0,0,0,0|3,0,0]=4 4787 B15R1.5815 CCC(C)NNC(=O)c1ccccc1C 22a_100000718999_100000212026 [0,1,0,0,0,0|3,0,0]=4 4788 B15R1.5815 CCC(C)NNC(=O)c1ccccc1Cl 22a_100000718999_100000185844 [0,1,0,0,0,0|3,0,0]=4 4789 B15R1.5815 CCC(C)NNC(=O)c1ccccc1F 22a_100000718999_100000188656 [0,1,0,0,0,0|3,0,0]=4 4790 B15R1.5815 CCC(C)NNC(=O)c1ccccc1I 22a_100000718999_100000187884 [0,1,0,0,0,0|3,0,0]=4 4791 B15R1.5815 CCC(C)NNC(=O)c1ccccc1O 22a_100000718999_100015234032 [0,1,0,0,0,0|2,0,0]=3 4792 B15R1.5815 CCC(C)NNC(=O)c1ccccc1[O-] 22a_100000718999_100009911694 [0,1,0,0,0,0|2,0,1]=4 4793 B15R1.5815 CCC(C)OCC(=O)c1ccccc1C 7a_100000210228_100000741374 [0,1,0,0,0,0|3,0,0]=4 4794 B15R1.5815 CCC(C)OCC(=O)c1ccccc1F 7a_100000210228_100000204681 [0,1,0,0,0,0|3,0,0]=4 4795 B15R1.5815 CCC(C)OCC(=O)c1ccccc1O 7a_100000210228_100000188908 [0,1,0,0,0,0|2,0,0]=3 4796 B15R1.5815 CCC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000758301 [0,1,0,0,0,0|3,0,0]=4 4797 B15R1.5815 CCC(C)SCC(=O)c1ccccc1C 62a_100000741374_100000758301 [0,1,0,0,0,0|3,0,0]=4 4798 B15R1.5815 CCC(C)SCC(=O)c1ccccc1C 62a_100000758301_100000741374 [0,1,0,0,0,0|3,0,0]=4 4799 B15R1.5815 CCC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000758301 [0,1,0,0,0,0|3,0,0]=4 4800 B15R1.5815 CCC(C)SCC(=O)c1ccccc1Cl 62a_100000758301_100000211432 [0,1,0,0,0,0|3,0,0]=4 4801 B15R1.5815 CCC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000758301 [0,1,0,0,0,0|3,0,0]=4 4802 B15R1.5815 CCC(C)SCC(=O)c1ccccc1F 62a_100000758301_100000204681 [0,1,0,0,0,0|3,0,0]=4 4803 B15R1.5815 CCC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000758301 [0,1,0,0,0,0|2,0,0]=3 4804 B15R1.5815 CCC(C)SCC(=O)c1ccccc1O 62a_100000758301_100000188908 [0,1,0,0,0,0|2,0,0]=3 4805 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Br 11a_100011218483_100000188424 [0,1,0,0,0,0|2,0,0]=3 4806 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Br 240690a_100011218483_100000188424 [0,1,0,0,0,0|2,0,0]=3 4807 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Br 527a_100011218483_100000188424 [0,1,0,0,0,0|2,0,0]=3 4808 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 11a_100011218483_100000212026 [0,1,0,0,0,0|2,0,0]=3 4809 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 240690a_100011218483_100000212026 [0,1,0,0,0,0|2,0,0]=3 4810 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 527a_100011218483_100000212026 [0,1,0,0,0,0|2,0,0]=3 4811 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Cl 11a_100011218483_100000185844 [0,1,0,0,0,0|2,0,0]=3 4812 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Cl 240690a_100011218483_100000185844 [0,1,0,0,0,0|2,0,0]=3 4813 B15R1.5815 CCC(O)CNC(=O)c1ccccc1Cl 527a_100011218483_100000185844 [0,1,0,0,0,0|2,0,0]=3 4814 B15R1.5815 CCC(O)CNC(=O)c1ccccc1F 11a_100011218483_100000188656 [0,1,0,0,0,0|2,0,0]=3 4815 B15R1.5815 CCC(O)CNC(=O)c1ccccc1F 240690a_100011218483_100000188656 [0,1,0,0,0,0|2,0,0]=3 4816 B15R1.5815 CCC(O)CNC(=O)c1ccccc1F 527a_100011218483_100000188656 [0,1,0,0,0,0|2,0,0]=3 4817 B15R1.5815 CCC(O)CNC(=O)c1ccccc1I 11a_100011218483_100000187884 [0,1,0,0,0,0|2,0,0]=3 4818 B15R1.5815 CCC(O)CNC(=O)c1ccccc1I 240690a_100011218483_100000187884 [0,1,0,0,0,0|2,0,0]=3 4819 B15R1.5815 CCC(O)CNC(=O)c1ccccc1I 527a_100011218483_100000187884 [0,1,0,0,0,0|2,0,0]=3 4820 B15R1.5815 CCC(O)CNC(=O)c1ccccc1O 240690a_100011218483_100015234032 [0,1,0,0,0,0|1,0,0]=2 4821 B15R1.5815 CCC(O)CNC(=O)c1ccccc1[O-] 240690a_100011218483_100009911694 [0,1,0,0,0,0|1,0,1]=3 4822 B15R1.5815 CCC(O)CNC(=O)c1ccccc1[O-] 527a_100011218483_100009911694 [0,1,0,0,0,0|1,0,1]=3 4823 B15R1.5815 CCC(O)CN[C@H](C)c1ccccc1O 2230a_100025703389_100011218378 [0,1,0,0,0,0|2,0,1]=4 4824 B15R1.5815 CCC(O)COC(C)c1ccccc1Br 34a_100000702211_100011218378 [0,1,0,0,0,0|2,0,1]=4 4825 B15R1.5815 CCC(O)COC(C)c1ccccc1Br 7a_100000702211_100011218378 [0,1,0,0,0,0|2,0,1]=4 4826 B15R1.5815 CCC(O)COC(C)c1ccccc1C 34a_100000742021_100011218378 [0,1,0,0,0,0|2,0,1]=4 4827 B15R1.5815 CCC(O)COC(C)c1ccccc1C 7a_100000742021_100011218378 [0,1,0,0,0,0|2,0,1]=4 4828 B15R1.5815 CCC(O)COC(C)c1ccccc1Cl 34a_100000740796_100011218378 [0,1,0,0,0,0|2,0,1]=4 4829 B15R1.5815 CCC(O)COC(C)c1ccccc1Cl 7a_100000740796_100011218378 [0,1,0,0,0,0|2,0,1]=4 4830 B15R1.5815 CCC(O)COC(C)c1ccccc1F 34a_100000697922_100011218378 [0,1,0,0,0,0|2,0,1]=4 4831 B15R1.5815 CCC(O)COC(C)c1ccccc1F 7a_100000697922_100011218378 [0,1,0,0,0,0|2,0,1]=4 4832 B15R1.5815 CCC(O)COC(C)c1ccccc1N 7a_100011405641_100011218378 [0,1,0,0,0,0|2,0,1]=4 4833 B15R1.5815 CCN(C)CCC(=O)c1ccccc1F 2230a_100000225621_100000086012 [0,1,0,0,0,0|3,0,0]=4 4834 B15R1.5815 CCN(C)CCC(=O)c1ccccc1F 269982a_100000225621_100000086012 [0,1,0,0,0,0|3,0,0]=4 4835 B15R1.5815 CCN(C)CCC(=O)c1ccccc1O 269982a_100000225621_100009873196 [0,1,0,0,0,0|2,0,0]=3 4836 B15R1.5815 CC[C@H](C)CN[C@H](C)c1ccccc1O 2230a_100025703389_100009816398 [0,1,0,0,0,0|2,0,1]=4 4837 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Br 34a_100000702211_100009816398 [0,1,0,0,0,0|2,0,1]=4 4838 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Br 7a_100000702211_100009816398 [0,1,0,0,0,0|2,0,1]=4 4839 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1C 34a_100000742021_100009816398 [0,1,0,0,0,0|2,0,1]=4 4840 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1C 7a_100000742021_100009816398 [0,1,0,0,0,0|2,0,1]=4 4841 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Cl 34a_100000740796_100009816398 [0,1,0,0,0,0|2,0,1]=4 4842 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Cl 7a_100000740796_100009816398 [0,1,0,0,0,0|2,0,1]=4 4843 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1Cl 7a_100009816381_100000181259 [0,1,0,0,0,0|2,0,1]=4 4844 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1F 34a_100000697922_100009816398 [0,1,0,0,0,0|2,0,1]=4 4845 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1F 7a_100000697922_100009816398 [0,1,0,0,0,0|2,0,1]=4 4846 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1F 7a_100009816381_200000741388 [0,1,0,0,0,0|2,0,1]=4 4847 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1N 7a_100011405641_100009816398 [0,1,0,0,0,0|2,0,1]=4 4848 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1O 240690a_100000693194_100015234032 [0,1,0,0,0,0|2,0,1]=4 4849 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1O 240690a_100102657272_100011193979 [0,1,0,0,0,0|2,0,1]=4 4850 B15R1.5815 CNC(=O)CNC(=O)c1ccccc1O 527a_100102657272_100011193979 [0,1,0,0,0,0|2,0,1]=4 4851 B15R1.5815 CNC(C)COC(=O)c1ccccc1Br 270004a_106832991635_201991511838 [0,1,0,0,0,0|2,0,0]=3 4852 B15R1.5815 COC(=O)CNC(=O)c1ccccc1O 188690a_100000185156_100015234032 [0,1,0,0,0,0|2,0,1]=4 4853 B15R1.5815 COC(C)SCC(=O)c1ccccc1O 62a_100000188908_100009879195 [0,1,0,0,0,0|3,0,0]=4 4854 B15R1.5815 COC(C)SCC(=O)c1ccccc1O 62a_100009879195_100000188908 [0,1,0,0,0,0|3,0,0]=4 4855 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 11a_100020591295_100000188424 [0,1,0,0,0,0|3,0,0]=4 4856 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 1626a_100020591295_100000188424 [0,1,0,0,0,0|3,0,0]=4 4857 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 240690a_100020591295_100000188424 [0,1,0,0,0,0|3,0,0]=4 4858 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 527a_100020591295_100000188424 [0,1,0,0,0,0|3,0,0]=4 4859 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 11a_100020591295_100000212026 [0,1,0,0,0,0|3,0,0]=4 4860 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 1626a_100020591295_100000212026 [0,1,0,0,0,0|3,0,0]=4 4861 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 240690a_100020591295_100000212026 [0,1,0,0,0,0|3,0,0]=4 4862 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 527a_100020591295_100000212026 [0,1,0,0,0,0|3,0,0]=4 4863 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 11a_100020591295_100000185844 [0,1,0,0,0,0|3,0,0]=4 4864 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 1626a_100020591295_100000185844 [0,1,0,0,0,0|3,0,0]=4 4865 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 240690a_100020591295_100000185844 [0,1,0,0,0,0|3,0,0]=4 4866 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 527a_100020591295_100000185844 [0,1,0,0,0,0|3,0,0]=4 4867 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 11a_100020591295_100000188656 [0,1,0,0,0,0|3,0,0]=4 4868 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 1626a_100020591295_100000188656 [0,1,0,0,0,0|3,0,0]=4 4869 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 240690a_100020591295_100000188656 [0,1,0,0,0,0|3,0,0]=4 4870 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 527a_100020591295_100000188656 [0,1,0,0,0,0|3,0,0]=4 4871 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 11a_100020591295_100000187884 [0,1,0,0,0,0|3,0,0]=4 4872 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 1626a_100020591295_100000187884 [0,1,0,0,0,0|3,0,0]=4 4873 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 240690a_100020591295_100000187884 [0,1,0,0,0,0|3,0,0]=4 4874 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 527a_100020591295_100000187884 [0,1,0,0,0,0|3,0,0]=4 4875 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1O 240690a_100020591295_100015234032 [0,1,0,0,0,0|2,0,0]=3 4876 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 1626a_100020591295_100009911694 [0,1,0,0,0,0|2,0,1]=4 4877 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 240690a_100020591295_100009911694 [0,1,0,0,0,0|2,0,1]=4 4878 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 527a_100020591295_100009911694 [0,1,0,0,0,0|2,0,1]=4 4879 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1O 62a_100000188908_100016084084 [0,1,0,0,0,0|3,0,0]=4 4880 B15R1.5815 C[C@H](CO)SCC(=O)c1ccccc1O 62a_100016084084_100000188908 [0,1,0,0,0,0|3,0,0]=4 4881 B15R1.5815 Cc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000212026 [0,1,0,0,0,0|3,0,0]=4 4882 B15R1.5815 Cc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000212026 [0,1,0,0,0,0|3,0,0]=4 4883 B15R1.5815 Cc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000212026 [0,1,0,0,0,0|3,0,0]=4 4884 B15R1.5815 Cc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000212026 [0,1,0,0,0,0|3,0,0]=4 4885 B15R1.5815 Cc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000212026 [0,1,0,0,0,0|3,0,0]=4 4886 B15R1.5815 Cc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000212026 [0,1,0,0,0,0|3,0,0]=4 4887 B15R1.5815 O=C(CF)CNC(=O)c1ccccc1O 1458a_100011193979_100015361967 [0,1,0,0,0,0|2,0,1]=4 4888 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Br 240690a_100015665980_100000188424 [0,1,0,0,0,0|3,0,0]=4 4889 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Br 527a_100015665980_100000188424 [0,1,0,0,0,0|3,0,0]=4 4890 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Cl 240690a_100015665980_100000185844 [0,1,0,0,0,0|3,0,0]=4 4891 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1Cl 527a_100015665980_100000185844 [0,1,0,0,0,0|3,0,0]=4 4892 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1F 240690a_100015665980_100000188656 [0,1,0,0,0,0|3,0,0]=4 4893 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1F 527a_100015665980_100000188656 [0,1,0,0,0,0|3,0,0]=4 4894 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1I 240690a_100015665980_100000187884 [0,1,0,0,0,0|3,0,0]=4 4895 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1I 527a_100015665980_100000187884 [0,1,0,0,0,0|3,0,0]=4 4896 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1O 240690a_100015665980_100015234032 [0,1,0,0,0,0|2,0,0]=3 4897 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1[O-] 240690a_100015665980_100009911694 [0,1,0,0,0,0|2,0,1]=4 4898 B15R1.5815 O=C(NC[C@@H](F)CO)c1ccccc1[O-] 527a_100015665980_100009911694 [0,1,0,0,0,0|2,0,1]=4 4899 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Br 240690a_100020644852_100000188424 [0,1,0,0,0,0|3,0,0]=4 4900 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Br 527a_100020644852_100000188424 [0,1,0,0,0,0|3,0,0]=4 4901 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Cl 240690a_100020644852_100000185844 [0,1,0,0,0,0|3,0,0]=4 4902 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1Cl 527a_100020644852_100000185844 [0,1,0,0,0,0|3,0,0]=4 4903 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1F 240690a_100020644852_100000188656 [0,1,0,0,0,0|3,0,0]=4 4904 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1F 527a_100020644852_100000188656 [0,1,0,0,0,0|3,0,0]=4 4905 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1I 240690a_100020644852_100000187884 [0,1,0,0,0,0|3,0,0]=4 4906 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1I 527a_100020644852_100000187884 [0,1,0,0,0,0|3,0,0]=4 4907 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1O 240690a_100020644852_100015234032 [0,1,0,0,0,0|2,0,0]=3 4908 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1[O-] 240690a_100020644852_100009911694 [0,1,0,0,0,0|2,0,1]=4 4909 B15R1.5815 O=C(NC[C@H](O)CO)c1ccccc1[O-] 527a_100020644852_100009911694 [0,1,0,0,0,0|2,0,1]=4 4910 B15R1.5837 C=CCCN(C)C(=O)c1ccccc1O 240690a_100020639649_100015234032 [0,1,0,0,0,0|1,0,2]=4 4911 B15R1.5837 CCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210183 [0,1,0,0,0,0|3,0,0]=4 4912 B15R1.5837 CCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210183 [0,1,0,0,0,0|3,0,0]=4 4913 B15R1.5837 CCCCC(C)C(=O)c1ccccc1Br 1458a_100000188424_200011215066 [0,1,0,0,0,0|2,0,0]=3 4914 B15R1.5837 CCCCC(C)C(=O)c1ccccc1C 1458a_100000212026_200011215066 [0,1,0,0,0,0|2,0,0]=3 4915 B15R1.5837 CCCCC(C)C(=O)c1ccccc1Cl 1458a_100000185844_200011215066 [0,1,0,0,0,0|2,0,0]=3 4916 B15R1.5837 CCCCC(C)C(=O)c1ccccc1F 1458a_100000188656_200011215066 [0,1,0,0,0,0|2,0,0]=3 4917 B15R1.5837 CCCCC(C)C(=O)c1ccccc1I 1458a_100000187884_200011215066 [0,1,0,0,0,0|2,0,0]=3 4918 B15R1.5837 CCCCC(C)C(=O)c1ccccc1O 1458a_100015234032_200011215066 [0,1,0,0,0,0|1,0,0]=2 4919 B15R1.5837 CCCCC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_200011215066 [0,1,0,0,0,0|1,0,1]=3 4920 B15R1.5837 CCCCC(C)N(C)c1ccccc1O 269982a_100000033821_200011215066 [0,1,0,0,0,0|3,0,0]=4 4921 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Br 11a_100000207549_100000188424 [0,1,0,0,0,0|2,0,0]=3 4922 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Br 1626a_100000207549_100000188424 [0,1,0,0,0,0|2,0,0]=3 4923 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Br 240690a_100000207549_100000188424 [0,1,0,0,0,0|2,0,0]=3 4924 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Br 527a_100000207549_100000188424 [0,1,0,0,0,0|2,0,0]=3 4925 B15R1.5837 CCCCN(C)C(=O)c1ccccc1C 11a_100000207549_100000212026 [0,1,0,0,0,0|2,0,0]=3 4926 B15R1.5837 CCCCN(C)C(=O)c1ccccc1C 1626a_100000207549_100000212026 [0,1,0,0,0,0|2,0,0]=3 4927 B15R1.5837 CCCCN(C)C(=O)c1ccccc1C 240690a_100000207549_100000212026 [0,1,0,0,0,0|2,0,0]=3 4928 B15R1.5837 CCCCN(C)C(=O)c1ccccc1C 527a_100000207549_100000212026 [0,1,0,0,0,0|2,0,0]=3 4929 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Cl 11a_100000207549_100000185844 [0,1,0,0,0,0|2,0,0]=3 4930 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Cl 1626a_100000207549_100000185844 [0,1,0,0,0,0|2,0,0]=3 4931 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Cl 240690a_100000207549_100000185844 [0,1,0,0,0,0|2,0,0]=3 4932 B15R1.5837 CCCCN(C)C(=O)c1ccccc1Cl 527a_100000207549_100000185844 [0,1,0,0,0,0|2,0,0]=3 4933 B15R1.5837 CCCCN(C)C(=O)c1ccccc1F 11a_100000207549_100000188656 [0,1,0,0,0,0|2,0,0]=3 4934 B15R1.5837 CCCCN(C)C(=O)c1ccccc1F 1626a_100000207549_100000188656 [0,1,0,0,0,0|2,0,0]=3 4935 B15R1.5837 CCCCN(C)C(=O)c1ccccc1F 240690a_100000207549_100000188656 [0,1,0,0,0,0|2,0,0]=3 4936 B15R1.5837 CCCCN(C)C(=O)c1ccccc1F 527a_100000207549_100000188656 [0,1,0,0,0,0|2,0,0]=3 4937 B15R1.5837 CCCCN(C)C(=O)c1ccccc1I 11a_100000207549_100000187884 [0,1,0,0,0,0|2,0,0]=3 4938 B15R1.5837 CCCCN(C)C(=O)c1ccccc1I 1626a_100000207549_100000187884 [0,1,0,0,0,0|2,0,0]=3 4939 B15R1.5837 CCCCN(C)C(=O)c1ccccc1I 240690a_100000207549_100000187884 [0,1,0,0,0,0|2,0,0]=3 4940 B15R1.5837 CCCCN(C)C(=O)c1ccccc1I 527a_100000207549_100000187884 [0,1,0,0,0,0|2,0,0]=3 4941 B15R1.5837 CCCCN(C)C(=O)c1ccccc1O 240690a_100000207549_100015234032 [0,1,0,0,0,0|1,0,0]=2 4942 B15R1.5837 CCCCN(C)C(=O)c1ccccc1[O-] 1626a_100000207549_100009911694 [0,1,0,0,0,0|1,0,1]=3 4943 B15R1.5837 CCCCN(C)C(=O)c1ccccc1[O-] 240690a_100000207549_100009911694 [0,1,0,0,0,0|1,0,1]=3 4944 B15R1.5837 CCCCN(C)C(=O)c1ccccc1[O-] 527a_100000207549_100009911694 [0,1,0,0,0,0|1,0,1]=3 4945 B15R1.5837 CCCSC(C)C(=O)c1ccccc1Cl 62a_100000210303_100010255250 [0,1,0,0,0,0|3,0,0]=4 4946 B15R1.5837 CCCSC(C)C(=O)c1ccccc1Cl 62a_100010255250_100000210303 [0,1,0,0,0,0|3,0,0]=4 4947 B15R1.5837 CN(CCC#N)C(=O)c1ccccc1O 240690a_100000184479_100015234032 [0,1,0,0,0,0|2,0,1]=4 4948 B15R1.5837 CN(CCCO)C(=O)c1ccccc1Br 240690a_100000213112_100000188424 [0,1,0,0,0,0|3,0,0]=4 4949 B15R1.5837 CN(CCCO)C(=O)c1ccccc1Br 527a_100000213112_100000188424 [0,1,0,0,0,0|3,0,0]=4 4950 B15R1.5837 CN(CCCO)C(=O)c1ccccc1Cl 240690a_100000213112_100000185844 [0,1,0,0,0,0|3,0,0]=4 4951 B15R1.5837 CN(CCCO)C(=O)c1ccccc1Cl 527a_100000213112_100000185844 [0,1,0,0,0,0|3,0,0]=4 4952 B15R1.5837 CN(CCCO)C(=O)c1ccccc1F 240690a_100000213112_100000188656 [0,1,0,0,0,0|3,0,0]=4 4953 B15R1.5837 CN(CCCO)C(=O)c1ccccc1F 527a_100000213112_100000188656 [0,1,0,0,0,0|3,0,0]=4 4954 B15R1.5837 CN(CCCO)C(=O)c1ccccc1I 240690a_100000213112_100000187884 [0,1,0,0,0,0|3,0,0]=4 4955 B15R1.5837 CN(CCCO)C(=O)c1ccccc1I 527a_100000213112_100000187884 [0,1,0,0,0,0|3,0,0]=4 4956 B15R1.5837 CN(CCCO)C(=O)c1ccccc1O 240690a_100000213112_100015234032 [0,1,0,0,0,0|2,0,0]=3 4957 B15R1.5837 CN(CCCO)C(=O)c1ccccc1[O-] 240690a_100000213112_100009911694 [0,1,0,0,0,0|2,0,1]=4 4958 B15R1.5837 CN(CCCO)C(=O)c1ccccc1[O-] 527a_100000213112_100009911694 [0,1,0,0,0,0|2,0,1]=4 4959 B15R1.5837 COCCN(C)C(=O)c1ccccc1Br 11a_100000743101_100000188424 [0,1,0,0,0,0|3,0,0]=4 4960 B15R1.5837 COCCN(C)C(=O)c1ccccc1Br 1626a_100000743101_100000188424 [0,1,0,0,0,0|3,0,0]=4 4961 B15R1.5837 COCCN(C)C(=O)c1ccccc1Br 240690a_100000743101_100000188424 [0,1,0,0,0,0|3,0,0]=4 4962 B15R1.5837 COCCN(C)C(=O)c1ccccc1Br 527a_100000743101_100000188424 [0,1,0,0,0,0|3,0,0]=4 4963 B15R1.5837 COCCN(C)C(=O)c1ccccc1C 11a_100000743101_100000212026 [0,1,0,0,0,0|3,0,0]=4 4964 B15R1.5837 COCCN(C)C(=O)c1ccccc1C 1626a_100000743101_100000212026 [0,1,0,0,0,0|3,0,0]=4 4965 B15R1.5837 COCCN(C)C(=O)c1ccccc1C 240690a_100000743101_100000212026 [0,1,0,0,0,0|3,0,0]=4 4966 B15R1.5837 COCCN(C)C(=O)c1ccccc1C 527a_100000743101_100000212026 [0,1,0,0,0,0|3,0,0]=4 4967 B15R1.5837 COCCN(C)C(=O)c1ccccc1Cl 11a_100000743101_100000185844 [0,1,0,0,0,0|3,0,0]=4 4968 B15R1.5837 COCCN(C)C(=O)c1ccccc1Cl 1626a_100000743101_100000185844 [0,1,0,0,0,0|3,0,0]=4 4969 B15R1.5837 COCCN(C)C(=O)c1ccccc1Cl 240690a_100000743101_100000185844 [0,1,0,0,0,0|3,0,0]=4 4970 B15R1.5837 COCCN(C)C(=O)c1ccccc1Cl 527a_100000743101_100000185844 [0,1,0,0,0,0|3,0,0]=4 4971 B15R1.5837 COCCN(C)C(=O)c1ccccc1F 11a_100000743101_100000188656 [0,1,0,0,0,0|3,0,0]=4 4972 B15R1.5837 COCCN(C)C(=O)c1ccccc1F 1626a_100000743101_100000188656 [0,1,0,0,0,0|3,0,0]=4 4973 B15R1.5837 COCCN(C)C(=O)c1ccccc1F 240690a_100000743101_100000188656 [0,1,0,0,0,0|3,0,0]=4 4974 B15R1.5837 COCCN(C)C(=O)c1ccccc1F 527a_100000743101_100000188656 [0,1,0,0,0,0|3,0,0]=4 4975 B15R1.5837 COCCN(C)C(=O)c1ccccc1I 11a_100000743101_100000187884 [0,1,0,0,0,0|3,0,0]=4 4976 B15R1.5837 COCCN(C)C(=O)c1ccccc1I 1626a_100000743101_100000187884 [0,1,0,0,0,0|3,0,0]=4 4977 B15R1.5837 COCCN(C)C(=O)c1ccccc1I 240690a_100000743101_100000187884 [0,1,0,0,0,0|3,0,0]=4 4978 B15R1.5837 COCCN(C)C(=O)c1ccccc1I 527a_100000743101_100000187884 [0,1,0,0,0,0|3,0,0]=4 4979 B15R1.5837 COCCN(C)C(=O)c1ccccc1O 240690a_100000743101_100015234032 [0,1,0,0,0,0|2,0,0]=3 4980 B15R1.5837 COCCN(C)C(=O)c1ccccc1[O-] 1626a_100000743101_100009911694 [0,1,0,0,0,0|2,0,1]=4 4981 B15R1.5837 COCCN(C)C(=O)c1ccccc1[O-] 240690a_100000743101_100009911694 [0,1,0,0,0,0|2,0,1]=4 4982 B15R1.5837 COCCN(C)C(=O)c1ccccc1[O-] 527a_100000743101_100009911694 [0,1,0,0,0,0|2,0,1]=4 4983 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Br 11a_100000686725_100000188424 [0,1,0,0,0,0|3,0,0]=4 4984 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Br 1626a_100000686725_100000188424 [0,1,0,0,0,0|3,0,0]=4 4985 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Br 240690a_100000686725_100000188424 [0,1,0,0,0,0|3,0,0]=4 4986 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Br 527a_100000686725_100000188424 [0,1,0,0,0,0|3,0,0]=4 4987 B15R1.5837 CSCCN(C)C(=O)c1ccccc1C 11a_100000686725_100000212026 [0,1,0,0,0,0|3,0,0]=4 4988 B15R1.5837 CSCCN(C)C(=O)c1ccccc1C 1626a_100000686725_100000212026 [0,1,0,0,0,0|3,0,0]=4 4989 B15R1.5837 CSCCN(C)C(=O)c1ccccc1C 240690a_100000686725_100000212026 [0,1,0,0,0,0|3,0,0]=4 4990 B15R1.5837 CSCCN(C)C(=O)c1ccccc1C 527a_100000686725_100000212026 [0,1,0,0,0,0|3,0,0]=4 4991 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Cl 11a_100000686725_100000185844 [0,1,0,0,0,0|3,0,0]=4 4992 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Cl 1626a_100000686725_100000185844 [0,1,0,0,0,0|3,0,0]=4 4993 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Cl 240690a_100000686725_100000185844 [0,1,0,0,0,0|3,0,0]=4 4994 B15R1.5837 CSCCN(C)C(=O)c1ccccc1Cl 527a_100000686725_100000185844 [0,1,0,0,0,0|3,0,0]=4 4995 B15R1.5837 CSCCN(C)C(=O)c1ccccc1F 11a_100000686725_100000188656 [0,1,0,0,0,0|3,0,0]=4 4996 B15R1.5837 CSCCN(C)C(=O)c1ccccc1F 1626a_100000686725_100000188656 [0,1,0,0,0,0|3,0,0]=4 4997 B15R1.5837 CSCCN(C)C(=O)c1ccccc1F 240690a_100000686725_100000188656 [0,1,0,0,0,0|3,0,0]=4 4998 B15R1.5837 CSCCN(C)C(=O)c1ccccc1F 527a_100000686725_100000188656 [0,1,0,0,0,0|3,0,0]=4 4999 B15R1.5837 CSCCN(C)C(=O)c1ccccc1I 11a_100000686725_100000187884 [0,1,0,0,0,0|3,0,0]=4 5000 B15R1.5837 CSCCN(C)C(=O)c1ccccc1I 1626a_100000686725_100000187884 [0,1,0,0,0,0|3,0,0]=4 5001 B15R1.5837 CSCCN(C)C(=O)c1ccccc1I 240690a_100000686725_100000187884 [0,1,0,0,0,0|3,0,0]=4 5002 B15R1.5837 CSCCN(C)C(=O)c1ccccc1I 527a_100000686725_100000187884 [0,1,0,0,0,0|3,0,0]=4 5003 B15R1.5837 CSCCN(C)C(=O)c1ccccc1O 240690a_100000686725_100015234032 [0,1,0,0,0,0|2,0,0]=3 5004 B15R1.5837 CSCCN(C)C(=O)c1ccccc1[O-] 1626a_100000686725_100009911694 [0,1,0,0,0,0|2,0,1]=4 5005 B15R1.5837 CSCCN(C)C(=O)c1ccccc1[O-] 240690a_100000686725_100009911694 [0,1,0,0,0,0|2,0,1]=4 5006 B15R1.5837 CSCCN(C)C(=O)c1ccccc1[O-] 527a_100000686725_100009911694 [0,1,0,0,0,0|2,0,1]=4 5007 B15R1.5837 Cc1ccccc1C(=O)N(C)CCCO 240690a_100000213112_100000212026 [0,1,0,0,0,0|3,0,0]=4 5008 B15R1.5837 Cc1ccccc1C(=O)N(C)CCCO 527a_100000213112_100000212026 [0,1,0,0,0,0|3,0,0]=4 5009 B15R1.8019 C=C(C)CNNC(=O)c1ccccc1O 22a_100000729518_100015234032 [0,1,0,0,0,0|2,0,1]=4 5010 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000211660 [0,1,0,0,0,0|2,0,1]=4 5011 B15R1.8019 C=C(C)CSCC(=O)c1ccccc1O 62a_100000748629_100000188908 [0,1,0,0,0,0|2,0,1]=4 5012 B15R1.8019 CC(=CCCC(=O)c1ccccc1O)C 1458a_100015234032_100011217483 [0,1,0,0,0,0|1,0,2]=4 5013 B15R1.8019 CC(=NNCC(C)O)c1ccccc1O 4a_200000730056_100000188907 [0,1,0,0,0,0|3,0,0]=4 5014 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215641 [0,1,0,0,0,0|2,0,1]=4 5015 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1C 1458a_100000212026_100011215641 [0,1,0,0,0,0|2,0,1]=4 5016 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215641 [0,1,0,0,0,0|2,0,1]=4 5017 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100011215641 [0,1,0,0,0,0|2,0,1]=4 5018 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100011215641 [0,1,0,0,0,0|2,0,1]=4 5019 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100011215641 [0,1,0,0,0,0|1,0,1]=3 5020 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215641 [0,1,0,0,0,0|1,0,2]=4 5021 B15R1.8019 CC(=O)CCNC(=O)c1ccccc1C 1458a_100000195313_200000210301 [0,1,0,0,0,0|2,0,1]=4 5022 B15R1.8019 CC(=O)CCNC(=O)c1ccccc1Cl 1458a_100000182440_200000210301 [0,1,0,0,0,0|2,0,1]=4 5023 B15R1.8019 CC(=O)NCCC(=O)c1ccccc1O 1458a_100015234032_100000189650 [0,1,0,0,0,0|2,0,1]=4 5024 B15R1.8019 CC(=O)OCCC(=O)c1ccccc1O 1458a_100015234032_100009814007 [0,1,0,0,0,0|2,0,1]=4 5025 B15R1.8019 CC(Br)CCOC(C)c1ccccc1F 34a_100009893172_200000741388 [0,1,0,0,0,0|2,0,1]=4 5026 B15R1.8019 CC(Br)COCC(=O)c1ccccc1Br 34a_100012180447_100000199116 [0,1,0,0,0,0|3,0,0]=4 5027 B15R1.8019 CC(Br)COCC(=O)c1ccccc1Cl 34a_100012180447_100000211432 [0,1,0,0,0,0|3,0,0]=4 5028 B15R1.8019 CC(Br)COCC(=O)c1ccccc1F 34a_100012180447_100000204681 [0,1,0,0,0,0|3,0,0]=4 5029 B15R1.8019 CC(C)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011214892 [0,1,0,0,0,0|2,0,0]=3 5030 B15R1.8019 CC(C)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011214892 [0,1,0,0,0,0|2,0,0]=3 5031 B15R1.8019 CC(C)CCCC(=O)c1ccccc1F 1458a_100000188656_100011214892 [0,1,0,0,0,0|2,0,0]=3 5032 B15R1.8019 CC(C)CCCC(=O)c1ccccc1I 1458a_100000187884_100011214892 [0,1,0,0,0,0|2,0,0]=3 5033 B15R1.8019 CC(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100011214892 [0,1,0,0,0,0|1,0,0]=2 5034 B15R1.8019 CC(C)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011214892 [0,1,0,0,0,0|1,0,1]=3 5035 B15R1.8019 CC(C)CCCN(C)c1ccccc1O 269982a_100000033821_100011214892 [0,1,0,0,0,0|3,0,0]=4 5036 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 11a_100000210545_100000188424 [0,1,0,0,0,0|2,0,0]=3 5037 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 1626a_100000210545_100000188424 [0,1,0,0,0,0|2,0,0]=3 5038 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 240690a_100000210545_100000188424 [0,1,0,0,0,0|2,0,0]=3 5039 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 527a_100000210545_100000188424 [0,1,0,0,0,0|2,0,0]=3 5040 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 11a_100000210545_100000185844 [0,1,0,0,0,0|2,0,0]=3 5041 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 1626a_100000210545_100000185844 [0,1,0,0,0,0|2,0,0]=3 5042 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 240690a_100000210545_100000185844 [0,1,0,0,0,0|2,0,0]=3 5043 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 527a_100000210545_100000185844 [0,1,0,0,0,0|2,0,0]=3 5044 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 11a_100000210545_100000188656 [0,1,0,0,0,0|2,0,0]=3 5045 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 1626a_100000210545_100000188656 [0,1,0,0,0,0|2,0,0]=3 5046 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 240690a_100000210545_100000188656 [0,1,0,0,0,0|2,0,0]=3 5047 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 527a_100000210545_100000188656 [0,1,0,0,0,0|2,0,0]=3 5048 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 11a_100000210545_100000187884 [0,1,0,0,0,0|2,0,0]=3 5049 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 1626a_100000210545_100000187884 [0,1,0,0,0,0|2,0,0]=3 5050 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 240690a_100000210545_100000187884 [0,1,0,0,0,0|2,0,0]=3 5051 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 527a_100000210545_100000187884 [0,1,0,0,0,0|2,0,0]=3 5052 B15R1.8019 CC(C)CCNC(=O)c1ccccc1O 240690a_100000210545_100015234032 [0,1,0,0,0,0|1,0,0]=2 5053 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 1626a_100000210545_100009911694 [0,1,0,0,0,0|1,0,1]=3 5054 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 240690a_100000210545_100009911694 [0,1,0,0,0,0|1,0,1]=3 5055 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 527a_100000210545_100009911694 [0,1,0,0,0,0|1,0,1]=3 5056 B15R1.8019 CC(C)CCN[C@H](C)c1ccccc1O 2230a_100025703389_100000210312 [0,1,0,0,0,0|2,0,1]=4 5057 B15R1.8019 CC(C)CCN[C@H](C)c1ccccc1O 269862a_100025703389_100000185833 [0,1,0,0,0,0|2,0,1]=4 5058 B15R1.8019 CC(C)CCOC(C)c1ccccc1Br 34a_100000702211_100000210312 [0,1,0,0,0,0|2,0,1]=4 5059 B15R1.8019 CC(C)CCOC(C)c1ccccc1Br 7a_100000702211_100000210626 [0,1,0,0,0,0|2,0,1]=4 5060 B15R1.8019 CC(C)CCOC(C)c1ccccc1Cl 34a_100000740796_100000210312 [0,1,0,0,0,0|2,0,1]=4 5061 B15R1.8019 CC(C)CCOC(C)c1ccccc1Cl 7a_100000210254_100000181259 [0,1,0,0,0,0|2,0,1]=4 5062 B15R1.8019 CC(C)CCOC(C)c1ccccc1Cl 7a_100000740796_100000210626 [0,1,0,0,0,0|2,0,1]=4 5063 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 34a_100000210254_200000741388 [0,1,0,0,0,0|2,0,1]=4 5064 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 34a_100000697922_100000210312 [0,1,0,0,0,0|2,0,1]=4 5065 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 7a_100000210254_200000741388 [0,1,0,0,0,0|2,0,1]=4 5066 B15R1.8019 CC(C)CCOC(C)c1ccccc1F 7a_100000697922_100000210626 [0,1,0,0,0,0|2,0,1]=4 5067 B15R1.8019 CC(C)CCOC(C)c1ccccc1N 7a_100011405641_100000210626 [0,1,0,0,0,0|2,0,1]=4 5068 B15R1.8019 CC(C)CNCC(=O)c1ccccc1Br 34a_100000210953_100000199116 [0,1,0,0,0,0|3,0,0]=4 5069 B15R1.8019 CC(C)CNCC(=O)c1ccccc1Cl 34a_100000210953_100000211432 [0,1,0,0,0,0|3,0,0]=4 5070 B15R1.8019 CC(C)CNCC(=O)c1ccccc1F 34a_100000210953_100000204681 [0,1,0,0,0,0|3,0,0]=4 5071 B15R1.8019 CC(C)CNNC(=O)c1ccccc1Br 22a_100000696102_100000188424 [0,1,0,0,0,0|3,0,0]=4 5072 B15R1.8019 CC(C)CNNC(=O)c1ccccc1Cl 22a_100000696102_100000185844 [0,1,0,0,0,0|3,0,0]=4 5073 B15R1.8019 CC(C)CNNC(=O)c1ccccc1F 22a_100000696102_100000188656 [0,1,0,0,0,0|3,0,0]=4 5074 B15R1.8019 CC(C)CNNC(=O)c1ccccc1I 22a_100000696102_100000187884 [0,1,0,0,0,0|3,0,0]=4 5075 B15R1.8019 CC(C)CNNC(=O)c1ccccc1O 22a_100000696102_100015234032 [0,1,0,0,0,0|2,0,0]=3 5076 B15R1.8019 CC(C)CNNC(=O)c1ccccc1[O-] 22a_100000696102_100009911694 [0,1,0,0,0,0|2,0,1]=4 5077 B15R1.8019 CC(C)COCC(=O)c1ccccc1Br 34a_100000210257_100000199116 [0,1,0,0,0,0|3,0,0]=4 5078 B15R1.8019 CC(C)COCC(=O)c1ccccc1Cl 34a_100000210257_100000211432 [0,1,0,0,0,0|3,0,0]=4 5079 B15R1.8019 CC(C)COCC(=O)c1ccccc1F 34a_100000210257_100000204681 [0,1,0,0,0,0|3,0,0]=4 5080 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Br 62a_100000199116_100000210760 [0,1,0,0,0,0|3,0,0]=4 5081 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Cl 62a_100000210624_100000211432 [0,1,0,0,0,0|3,0,0]=4 5082 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000210760 [0,1,0,0,0,0|3,0,0]=4 5083 B15R1.8019 CC(C)CSCC(=O)c1ccccc1F 62a_100000204681_100000210760 [0,1,0,0,0,0|3,0,0]=4 5084 B15R1.8019 CC(C)CSCC(=O)c1ccccc1F 62a_100000210624_100000204681 [0,1,0,0,0,0|3,0,0]=4 5085 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000210760 [0,1,0,0,0,0|2,0,0]=3 5086 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000210624_100000188908 [0,1,0,0,0,0|2,0,0]=3 5087 B15R1.8019 CC(C)NCCC(=O)c1ccccc1F 2230a_100138425928_100000086012 [0,1,0,0,0,0|3,0,0]=4 5088 B15R1.8019 CC(C)OCCC(=O)c1ccccc1Br 1458a_100000188424_100000211751 [0,1,0,0,0,0|3,0,0]=4 5089 B15R1.8019 CC(C)OCCC(=O)c1ccccc1Cl 1458a_100000185844_100000211751 [0,1,0,0,0,0|3,0,0]=4 5090 B15R1.8019 CC(C)OCCC(=O)c1ccccc1F 1458a_100000188656_100000211751 [0,1,0,0,0,0|3,0,0]=4 5091 B15R1.8019 CC(C)OCCC(=O)c1ccccc1I 1458a_100000187884_100000211751 [0,1,0,0,0,0|3,0,0]=4 5092 B15R1.8019 CC(C)OCCC(=O)c1ccccc1O 1458a_100015234032_100000211751 [0,1,0,0,0,0|2,0,0]=3 5093 B15R1.8019 CC(C)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000211751 [0,1,0,0,0,0|2,0,1]=4 5094 B15R1.8019 CC(C)SCCC(=O)c1ccccc1Br 1458a_100000188424_100000730970 [0,1,0,0,0,0|3,0,0]=4 5095 B15R1.8019 CC(C)SCCC(=O)c1ccccc1Cl 1458a_100000185844_100000730970 [0,1,0,0,0,0|3,0,0]=4 5096 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 1458a_100000188656_100000730970 [0,1,0,0,0,0|3,0,0]=4 5097 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 62a_100000086012_100000210206 [0,1,0,0,0,0|3,0,0]=4 5098 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 62a_100000210206_100000086012 [0,1,0,0,0,0|3,0,0]=4 5099 B15R1.8019 CC(C)SCCC(=O)c1ccccc1I 1458a_100000187884_100000730970 [0,1,0,0,0,0|3,0,0]=4 5100 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 1458a_100015234032_100000730970 [0,1,0,0,0,0|2,0,0]=3 5101 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 62a_100000210206_100009873196 [0,1,0,0,0,0|2,0,0]=3 5102 B15R1.8019 CC(C)SCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730970 [0,1,0,0,0,0|2,0,1]=4 5103 B15R1.8019 CC(F)COCC(=O)c1ccccc1Br 34a_100015925927_100000199116 [0,1,0,0,0,0|3,0,0]=4 5104 B15R1.8019 CC(F)COCC(=O)c1ccccc1Cl 34a_100015925927_100000211432 [0,1,0,0,0,0|3,0,0]=4 5105 B15R1.8019 CC(F)COCC(=O)c1ccccc1F 34a_100015925927_100000204681 [0,1,0,0,0,0|3,0,0]=4 5106 B15R1.8019 CC(O)CCCC(=O)c1ccccc1Br 1458a_100000188424_200000718107 [0,1,0,0,0,0|2,0,0]=3 5107 B15R1.8019 CC(O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_200000718107 [0,1,0,0,0,0|2,0,0]=3 5108 B15R1.8019 CC(O)CCCC(=O)c1ccccc1F 1458a_100000188656_200000718107 [0,1,0,0,0,0|2,0,0]=3 5109 B15R1.8019 CC(O)CCCC(=O)c1ccccc1I 1458a_100000187884_200000718107 [0,1,0,0,0,0|2,0,0]=3 5110 B15R1.8019 CC(O)CCCC(=O)c1ccccc1O 1458a_100015234032_200000718107 [0,1,0,0,0,0|1,0,0]=2 5111 B15R1.8019 CC(O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_200000718107 [0,1,0,0,0,0|1,0,1]=3 5112 B15R1.8019 CC(O)CCCN(C)c1ccccc1O 269982a_100000033821_200000718107 [0,1,0,0,0,0|3,0,0]=4 5113 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Br 240690a_200000755665_100000188424 [0,1,0,0,0,0|2,0,0]=3 5114 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Br 527a_200000755665_100000188424 [0,1,0,0,0,0|2,0,0]=3 5115 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Cl 240690a_200000755665_100000185844 [0,1,0,0,0,0|2,0,0]=3 5116 B15R1.8019 CC(O)CCNC(=O)c1ccccc1Cl 527a_200000755665_100000185844 [0,1,0,0,0,0|2,0,0]=3 5117 B15R1.8019 CC(O)CCNC(=O)c1ccccc1F 240690a_200000755665_100000188656 [0,1,0,0,0,0|2,0,0]=3 5118 B15R1.8019 CC(O)CCNC(=O)c1ccccc1F 527a_200000755665_100000188656 [0,1,0,0,0,0|2,0,0]=3 5119 B15R1.8019 CC(O)CCNC(=O)c1ccccc1I 240690a_200000755665_100000187884 [0,1,0,0,0,0|2,0,0]=3 5120 B15R1.8019 CC(O)CCNC(=O)c1ccccc1I 527a_200000755665_100000187884 [0,1,0,0,0,0|2,0,0]=3 5121 B15R1.8019 CC(O)CCNC(=O)c1ccccc1O 240690a_200000755665_100015234032 [0,1,0,0,0,0|1,0,0]=2 5122 B15R1.8019 CC(O)CCNC(=O)c1ccccc1[O-] 240690a_200000755665_100009911694 [0,1,0,0,0,0|1,0,1]=3 5123 B15R1.8019 CC(O)CCNC(=O)c1ccccc1[O-] 527a_200000755665_100009911694 [0,1,0,0,0,0|1,0,1]=3 5124 B15R1.8019 CC(O)CCN[C@H](C)c1ccccc1O 2230a_100025703389_100012276601 [0,1,0,0,0,0|2,0,1]=4 5125 B15R1.8019 CC(O)CCOC(C)c1ccccc1Br 34a_100000702211_100012276601 [0,1,0,0,0,0|2,0,1]=4 5126 B15R1.8019 CC(O)CCOC(C)c1ccccc1Br 7a_100000702211_100012276601 [0,1,0,0,0,0|2,0,1]=4 5127 B15R1.8019 CC(O)CCOC(C)c1ccccc1Cl 34a_100000740796_100012276601 [0,1,0,0,0,0|2,0,1]=4 5128 B15R1.8019 CC(O)CCOC(C)c1ccccc1Cl 7a_100000740796_100012276601 [0,1,0,0,0,0|2,0,1]=4 5129 B15R1.8019 CC(O)CCOC(C)c1ccccc1F 34a_100000697922_100012276601 [0,1,0,0,0,0|2,0,1]=4 5130 B15R1.8019 CC(O)CCOC(C)c1ccccc1F 7a_100000697922_100012276601 [0,1,0,0,0,0|2,0,1]=4 5131 B15R1.8019 CC(O)CCOC(C)c1ccccc1N 7a_100011405641_100012276601 [0,1,0,0,0,0|2,0,1]=4 5132 B15R1.8019 CC(O)CNCC(=O)c1ccccc1Br 34a_100000210904_100000199116 [0,1,0,0,0,0|3,0,0]=4 5133 B15R1.8019 CC(O)CNCC(=O)c1ccccc1Cl 34a_100000210904_100000211432 [0,1,0,0,0,0|3,0,0]=4 5134 B15R1.8019 CC(O)CNCC(=O)c1ccccc1F 34a_100000210904_100000204681 [0,1,0,0,0,0|3,0,0]=4 5135 B15R1.8019 CC(O)CNNC(=O)c1ccccc1Br 22a_200000730056_100000188424 [0,1,0,0,0,0|3,0,0]=4 5136 B15R1.8019 CC(O)CNNC(=O)c1ccccc1Cl 22a_200000730056_100000185844 [0,1,0,0,0,0|3,0,0]=4 5137 B15R1.8019 CC(O)CNNC(=O)c1ccccc1F 22a_200000730056_100000188656 [0,1,0,0,0,0|3,0,0]=4 5138 B15R1.8019 CC(O)CNNC(=O)c1ccccc1I 22a_200000730056_100000187884 [0,1,0,0,0,0|3,0,0]=4 5139 B15R1.8019 CC(O)CNNC(=O)c1ccccc1O 22a_200000730056_100015234032 [0,1,0,0,0,0|2,0,0]=3 5140 B15R1.8019 CC(O)CNNC(=O)c1ccccc1[O-] 22a_200000730056_100009911694 [0,1,0,0,0,0|2,0,1]=4 5141 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Br 62a_100000199116_100011218427 [0,1,0,0,0,0|3,0,0]=4 5142 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100011218427 [0,1,0,0,0,0|3,0,0]=4 5143 B15R1.8019 CC(O)CSCC(=O)c1ccccc1Cl 62a_100011218427_100000211432 [0,1,0,0,0,0|3,0,0]=4 5144 B15R1.8019 CC(O)CSCC(=O)c1ccccc1F 62a_100000204681_100011218427 [0,1,0,0,0,0|3,0,0]=4 5145 B15R1.8019 CC(O)CSCC(=O)c1ccccc1F 62a_100011218427_100000204681 [0,1,0,0,0,0|3,0,0]=4 5146 B15R1.8019 CC(O)CSCC(=O)c1ccccc1O 62a_100000188908_100011218427 [0,1,0,0,0,0|2,0,0]=3 5147 B15R1.8019 CC(O)CSCC(=O)c1ccccc1O 62a_100011218427_100000188908 [0,1,0,0,0,0|2,0,0]=3 5148 B15R1.8019 CC(OCC[C@@H](C)N)c1ccccc1F 34a_100000706166_200000741388 [0,1,0,0,0,0|2,0,1]=4 5149 B15R1.8019 CN(C)CCCC(=O)c1ccccc1Br 1458a_100000188424_100000695564 [0,1,0,0,0,0|3,0,0]=4 5150 B15R1.8019 CN(C)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000695564 [0,1,0,0,0,0|3,0,0]=4 5151 B15R1.8019 CN(C)CCCC(=O)c1ccccc1F 1458a_100000188656_100000695564 [0,1,0,0,0,0|3,0,0]=4 5152 B15R1.8019 CN(C)CCCC(=O)c1ccccc1I 1458a_100000187884_100000695564 [0,1,0,0,0,0|3,0,0]=4 5153 B15R1.8019 CN(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100000695564 [0,1,0,0,0,0|2,0,0]=3 5154 B15R1.8019 CN(C)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000695564 [0,1,0,0,0,0|2,0,1]=4 5155 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Br 240690a_100000210585_100000188424 [0,1,0,0,0,0|3,0,0]=4 5156 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Br 527a_100000210585_100000188424 [0,1,0,0,0,0|3,0,0]=4 5157 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Cl 240690a_100000210585_100000185844 [0,1,0,0,0,0|3,0,0]=4 5158 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Cl 527a_100000210585_100000185844 [0,1,0,0,0,0|3,0,0]=4 5159 B15R1.8019 CN(C)CCNC(=O)c1ccccc1F 240690a_100000210585_100000188656 [0,1,0,0,0,0|3,0,0]=4 5160 B15R1.8019 CN(C)CCNC(=O)c1ccccc1F 527a_100000210585_100000188656 [0,1,0,0,0,0|3,0,0]=4 5161 B15R1.8019 CN(C)CCNC(=O)c1ccccc1I 240690a_100000210585_100000187884 [0,1,0,0,0,0|3,0,0]=4 5162 B15R1.8019 CN(C)CCNC(=O)c1ccccc1I 527a_100000210585_100000187884 [0,1,0,0,0,0|3,0,0]=4 5163 B15R1.8019 CN(C)CCNC(=O)c1ccccc1O 240690a_100000210585_100015234032 [0,1,0,0,0,0|2,0,0]=3 5164 B15R1.8019 CN(C)CCNC(=O)c1ccccc1[O-] 240690a_100000210585_100009911694 [0,1,0,0,0,0|2,0,1]=4 5165 B15R1.8019 CN(C)CCNC(=O)c1ccccc1[O-] 527a_100000210585_100009911694 [0,1,0,0,0,0|2,0,1]=4 5166 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1Br 34a_100016084084_100000199116 [0,1,0,0,0,0|3,0,0]=4 5167 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1Cl 34a_100016084084_100000211432 [0,1,0,0,0,0|3,0,0]=4 5168 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1F 34a_100016084084_100000204681 [0,1,0,0,0,0|3,0,0]=4 5169 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1Br 34a_100000737577_100000199116 [0,1,0,0,0,0|3,0,0]=4 5170 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1Cl 34a_100000737577_100000211432 [0,1,0,0,0,0|3,0,0]=4 5171 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1F 34a_100000737577_100000204681 [0,1,0,0,0,0|3,0,0]=4 5172 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Br 62a_100000199116_100009817552 [0,1,0,0,0,0|3,0,0]=4 5173 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100009817552 [0,1,0,0,0,0|3,0,0]=4 5174 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1Cl 62a_100009817552_100000211432 [0,1,0,0,0,0|3,0,0]=4 5175 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1F 62a_100000204681_100009817552 [0,1,0,0,0,0|3,0,0]=4 5176 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1F 62a_100009817552_100000204681 [0,1,0,0,0,0|3,0,0]=4 5177 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1O 62a_100000188908_100009817552 [0,1,0,0,0,0|2,0,0]=3 5178 B15R1.8019 C[C@@H](O)CSCC(=O)c1ccccc1O 62a_100009817552_100000188908 [0,1,0,0,0,0|2,0,0]=3 5179 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)C 1458a_100000212026_100011214892 [0,1,0,0,0,0|2,0,0]=3 5180 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)O 1458a_100000212026_200000718107 [0,1,0,0,0,0|2,0,0]=3 5181 B15R1.8019 Cc1ccccc1C(=O)CCCN(C)C 1458a_100000212026_100000695564 [0,1,0,0,0,0|3,0,0]=4 5182 B15R1.8019 Cc1ccccc1C(=O)CCOC(C)C 1458a_100000212026_100000211751 [0,1,0,0,0,0|3,0,0]=4 5183 B15R1.8019 Cc1ccccc1C(=O)CCSC(C)C 1458a_100000212026_100000730970 [0,1,0,0,0,0|3,0,0]=4 5184 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)C 2230a_100000210953_100000741374 [0,1,0,0,0,0|3,0,0]=4 5185 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)C 34a_100000210953_100000741374 [0,1,0,0,0,0|3,0,0]=4 5186 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 2230a_100000210904_100000741374 [0,1,0,0,0,0|3,0,0]=4 5187 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000741374 [0,1,0,0,0,0|3,0,0]=4 5188 B15R1.8019 Cc1ccccc1C(=O)COCC(C)Br 34a_100012180447_100000741374 [0,1,0,0,0,0|3,0,0]=4 5189 B15R1.8019 Cc1ccccc1C(=O)COCC(C)C 34a_100000210257_100000741374 [0,1,0,0,0,0|3,0,0]=4 5190 B15R1.8019 Cc1ccccc1C(=O)COCC(C)F 34a_100015925927_100000741374 [0,1,0,0,0,0|3,0,0]=4 5191 B15R1.8019 Cc1ccccc1C(=O)COC[C@@H](C)Cl 34a_100016084084_100000741374 [0,1,0,0,0,0|3,0,0]=4 5192 B15R1.8019 Cc1ccccc1C(=O)COC[C@@H](C)N 34a_100000737577_100000741374 [0,1,0,0,0,0|3,0,0]=4 5193 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)C 62a_100000210624_100000741374 [0,1,0,0,0,0|3,0,0]=4 5194 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)C 62a_100000741374_100000210760 [0,1,0,0,0,0|3,0,0]=4 5195 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100000741374_100011218427 [0,1,0,0,0,0|3,0,0]=4 5196 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100011218427_100000741374 [0,1,0,0,0,0|3,0,0]=4 5197 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000741374_100009817552 [0,1,0,0,0,0|3,0,0]=4 5198 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100009817552_100000741374 [0,1,0,0,0,0|3,0,0]=4 5199 B15R1.8019 Cc1ccccc1C(=O)NCCC(=O)[13CH3] 1458a_100000195313_200025704644 [0,1,0,0,0,0|2,0,1]=4 5200 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000212026 [0,1,0,0,0,0|2,0,0]=3 5201 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000212026 [0,1,0,0,0,0|2,0,0]=3 5202 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000212026 [0,1,0,0,0,0|2,0,0]=3 5203 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000212026 [0,1,0,0,0,0|2,0,0]=3 5204 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000212026 [0,1,0,0,0,0|2,0,0]=3 5205 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000212026 [0,1,0,0,0,0|2,0,0]=3 5206 B15R1.8019 Cc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000212026 [0,1,0,0,0,0|3,0,0]=4 5207 B15R1.8019 Cc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000212026 [0,1,0,0,0,0|3,0,0]=4 5208 B15R1.8019 Cc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000212026 [0,1,0,0,0,0|3,0,0]=4 5209 B15R1.8019 Cc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000212026 [0,1,0,0,0,0|3,0,0]=4 5210 B15R1.8019 Cc1ccccc1C(C)OCCC(C)C 34a_100000742021_100000210312 [0,1,0,0,0,0|2,0,1]=4 5211 B15R1.8019 Cc1ccccc1C(C)OCCC(C)C 7a_100000742021_100000210626 [0,1,0,0,0,0|2,0,1]=4 5212 B15R1.8019 Cc1ccccc1C(C)OCCC(C)O 34a_100000742021_100012276601 [0,1,0,0,0,0|2,0,1]=4 5213 B15R1.8019 Cc1ccccc1C(C)OCCC(C)O 7a_100000742021_100012276601 [0,1,0,0,0,0|2,0,1]=4 5214 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100102525003 [0,1,0,0,0,0|2,0,1]=4 5215 B15R1.8019 NC(=O)CCNC(=O)c1ccccc1O 240690a_100000740010_100015234032 [0,1,0,0,0,0|2,0,1]=4 5216 B15R1.8019 O=C(CSCC(F)F)c1ccccc1O 62a_100000188908_100011934356 [0,1,0,0,0,0|3,0,0]=4 5217 B15R1.8019 O=C(CSCC(F)F)c1ccccc1O 62a_100011934356_100000188908 [0,1,0,0,0,0|3,0,0]=4 5218 B15R1.8019 [13CH3]C(=O)CCNC(=O)c1ccccc1Cl 1458a_100000182440_200025704644 [0,1,0,0,0,0|2,0,1]=4 5219 B15R1.14566 C#CCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000731252 [0,1,0,0,0,0|1,0,2]=4 5220 B15R1.14566 C#CCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000731252 [0,1,0,0,0,0|1,0,2]=4 5221 B15R1.14566 C#CCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000731252 [0,1,0,0,0,0|1,0,2]=4 5222 B15R1.14566 C#CCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000731252 [0,1,0,0,0,0|1,0,2]=4 5223 B15R1.14566 C#CCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000731252 [0,1,0,0,0,0|1,0,2]=4 5224 B15R1.14566 C#CCCNC(=O)c1c(cccc1Br)O 240690a_100000755551_100011935254 [0,1,0,0,0,0|1,0,2]=4 5225 B15R1.14566 C#CCCNC(=O)c1c(cccc1Br)O 527a_100000755551_100011935254 [0,1,0,0,0,0|1,0,2]=4 5226 B15R1.14566 C#CCCNC(=O)c1c(cccc1Cl)O 240690a_100000755551_100000745519 [0,1,0,0,0,0|1,0,2]=4 5227 B15R1.14566 C#CCCNC(=O)c1c(cccc1Cl)O 527a_100000755551_100000745519 [0,1,0,0,0,0|1,0,2]=4 5228 B15R1.14566 C#CCCNC(=O)c1c(cccc1F)O 527a_100000755551_100000763259 [0,1,0,0,0,0|1,0,2]=4 5229 B15R1.14566 C#CCCNC(=O)c1c(cccc1O)O 527a_100000755551_100000755285 [0,1,0,0,0,0|1,0,2]=4 5230 B15R1.14566 C=CCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000757094 [0,1,0,0,0,0|1,0,2]=4 5231 B15R1.14566 C=CCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000757094 [0,1,0,0,0,0|1,0,2]=4 5232 B15R1.14566 C=CCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000757094 [0,1,0,0,0,0|1,0,2]=4 5233 B15R1.14566 C=CCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000757094 [0,1,0,0,0,0|1,0,2]=4 5234 B15R1.14566 C=CCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000757094 [0,1,0,0,0,0|1,0,2]=4 5235 B15R1.14566 C=CCCNC(=O)c1c(cccc1Br)O 240690a_100015191253_100011935254 [0,1,0,0,0,0|1,0,2]=4 5236 B15R1.14566 C=CCCNC(=O)c1c(cccc1Br)O 527a_100015191253_100011935254 [0,1,0,0,0,0|1,0,2]=4 5237 B15R1.14566 C=CCCNC(=O)c1c(cccc1Cl)O 240690a_100015191253_100000745519 [0,1,0,0,0,0|1,0,2]=4 5238 B15R1.14566 C=CCCNC(=O)c1c(cccc1Cl)O 527a_100015191253_100000745519 [0,1,0,0,0,0|1,0,2]=4 5239 B15R1.14566 C=CCCNC(=O)c1c(cccc1F)O 527a_100015191253_100000763259 [0,1,0,0,0,0|1,0,2]=4 5240 B15R1.14566 C=CCCNC(=O)c1c(cccc1O)O 527a_100015191253_100000755285 [0,1,0,0,0,0|1,0,2]=4 5241 B15R1.14566 CC#CCNC(=O)c1c(cccc1Br)O 527a_100000685387_100011935254 [0,1,0,0,0,0|1,0,2]=4 5242 B15R1.14566 CC#CCNC(=O)c1c(cccc1Cl)O 527a_100000685387_100000745519 [0,1,0,0,0,0|1,0,2]=4 5243 B15R1.14566 CC#CCNC(=O)c1c(cccc1F)O 527a_100000685387_100000763259 [0,1,0,0,0,0|1,0,2]=4 5244 B15R1.14566 CC#CCNC(=O)c1c(cccc1O)O 527a_100000685387_100000755285 [0,1,0,0,0,0|1,0,2]=4 5245 B15R1.14566 CC/C=C\CC(=O)c1c(cccc1Br)O 1458a_100011935254_100103147603 [0,1,0,0,0,0|1,0,2]=4 5246 B15R1.14566 CC/C=C\CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100103147603 [0,1,0,0,0,0|1,0,2]=4 5247 B15R1.14566 CC/C=C\CC(=O)c1c(cccc1F)O 1458a_100000763259_100103147603 [0,1,0,0,0,0|1,0,2]=4 5248 B15R1.14566 CC/C=C\CC(=O)c1c(cccc1O)C 1458a_100011934116_100103147603 [0,1,0,0,0,0|1,0,2]=4 5249 B15R1.14566 CC/C=C\CC(=O)c1c(cccc1O)O 1458a_100000755285_100103147603 [0,1,0,0,0,0|1,0,2]=4 5250 B15R1.14566 CCC#CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100009813939 [0,1,0,0,0,0|1,0,2]=4 5251 B15R1.14566 CCC#CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100009813939 [0,1,0,0,0,0|1,0,2]=4 5252 B15R1.14566 CCC#CCC(=O)c1c(cccc1F)O 1458a_100000763259_100009813939 [0,1,0,0,0,0|1,0,2]=4 5253 B15R1.14566 CCC#CCC(=O)c1c(cccc1O)C 1458a_100011934116_100009813939 [0,1,0,0,0,0|1,0,2]=4 5254 B15R1.14566 CCC#CCC(=O)c1c(cccc1O)O 1458a_100000755285_100009813939 [0,1,0,0,0,0|1,0,2]=4 5255 B15R1.14566 CCCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210326 [0,1,0,0,0,0|2,0,0]=3 5256 B15R1.14566 CCCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210326 [0,1,0,0,0,0|2,0,0]=3 5257 B15R1.14566 CCCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210326 [0,1,0,0,0,0|2,0,0]=3 5258 B15R1.14566 CCCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210326 [0,1,0,0,0,0|2,0,0]=3 5259 B15R1.14566 CCCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210326 [0,1,0,0,0,0|1,0,0]=2 5260 B15R1.14566 CCCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210326 [0,1,0,0,0,0|2,0,0]=3 5261 B15R1.14566 CCCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210326 [0,1,0,0,0,0|2,0,0]=3 5262 B15R1.14566 CCCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210326 [0,1,0,0,0,0|2,0,0]=3 5263 B15R1.14566 CCCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210326 [0,1,0,0,0,0|2,0,0]=3 5264 B15R1.14566 CCCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210326 [0,1,0,0,0,0|1,0,0]=2 5265 B15R1.14566 CCCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210326 [0,1,0,0,0,0|2,0,0]=3 5266 B15R1.14566 CCCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210326 [0,1,0,0,0,0|2,0,0]=3 5267 B15R1.14566 CCCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210326 [0,1,0,0,0,0|1,0,0]=2 5268 B15R1.14566 CCCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210326 [0,1,0,0,0,0|2,0,0]=3 5269 B15R1.14566 CCCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210326 [0,1,0,0,0,0|2,0,0]=3 5270 B15R1.14566 CCCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210326 [0,1,0,0,0,0|2,0,0]=3 5271 B15R1.14566 CCCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210326 [0,1,0,0,0,0|2,0,0]=3 5272 B15R1.14566 CCCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210326 [0,1,0,0,0,0|1,0,0]=2 5273 B15R1.14566 CCCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210326 [0,1,0,0,0,0|1,0,0]=2 5274 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Br 11a_100000102301_100000690891 [0,1,0,0,0,0|2,0,0]=3 5275 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Br 1626a_100000102301_100000690891 [0,1,0,0,0,0|2,0,0]=3 5276 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Br 240690a_100000102301_100000690891 [0,1,0,0,0,0|2,0,0]=3 5277 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Br 527a_100000102301_100000690891 [0,1,0,0,0,0|2,0,0]=3 5278 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)C 11a_100000102301_100000701904 [0,1,0,0,0,0|2,0,0]=3 5279 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)C 1626a_100000102301_100000701904 [0,1,0,0,0,0|2,0,0]=3 5280 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)C 240690a_100000102301_100000701904 [0,1,0,0,0,0|2,0,0]=3 5281 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)C 527a_100000102301_100000701904 [0,1,0,0,0,0|2,0,0]=3 5282 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Cl 11a_100000102301_100011253703 [0,1,0,0,0,0|2,0,0]=3 5283 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Cl 1626a_100000102301_100011253703 [0,1,0,0,0,0|2,0,0]=3 5284 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Cl 240690a_100000102301_100011253703 [0,1,0,0,0,0|2,0,0]=3 5285 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)Cl 527a_100000102301_100011253703 [0,1,0,0,0,0|2,0,0]=3 5286 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)F 11a_100000102301_100000752694 [0,1,0,0,0,0|2,0,0]=3 5287 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)F 1626a_100000102301_100000752694 [0,1,0,0,0,0|2,0,0]=3 5288 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)F 240690a_100000102301_100000752694 [0,1,0,0,0,0|2,0,0]=3 5289 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)F 527a_100000102301_100000752694 [0,1,0,0,0,0|2,0,0]=3 5290 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)O 240690a_100000102301_100011935254 [0,1,0,0,0,0|1,0,0]=2 5291 B15R1.14566 CCCCNC(=O)c1c(cccc1Br)O 527a_100000102301_100011935254 [0,1,0,0,0,0|1,0,0]=2 5292 B15R1.14566 CCCCNC(=O)c1c(cccc1C)C 11a_100000102301_100000758298 [0,1,0,0,0,0|2,0,0]=3 5293 B15R1.14566 CCCCNC(=O)c1c(cccc1C)C 1626a_100000102301_100000758298 [0,1,0,0,0,0|2,0,0]=3 5294 B15R1.14566 CCCCNC(=O)c1c(cccc1C)C 240690a_100000102301_100000758298 [0,1,0,0,0,0|2,0,0]=3 5295 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)C 11a_100000102301_100000692601 [0,1,0,0,0,0|2,0,0]=3 5296 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)C 1626a_100000102301_100000692601 [0,1,0,0,0,0|2,0,0]=3 5297 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)C 240690a_100000102301_100000692601 [0,1,0,0,0,0|2,0,0]=3 5298 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)Cl 11a_100000102301_100000210656 [0,1,0,0,0,0|2,0,0]=3 5299 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)Cl 1626a_100000102301_100000210656 [0,1,0,0,0,0|2,0,0]=3 5300 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)Cl 240690a_100000102301_100000210656 [0,1,0,0,0,0|2,0,0]=3 5301 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)F 11a_100000102301_100000210369 [0,1,0,0,0,0|2,0,0]=3 5302 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)F 1626a_100000102301_100000210369 [0,1,0,0,0,0|2,0,0]=3 5303 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)F 240690a_100000102301_100000210369 [0,1,0,0,0,0|2,0,0]=3 5304 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)F 527a_100000102301_100000210369 [0,1,0,0,0,0|2,0,0]=3 5305 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)O 240690a_100000102301_100000745519 [0,1,0,0,0,0|1,0,0]=2 5306 B15R1.14566 CCCCNC(=O)c1c(cccc1Cl)O 527a_100000102301_100000745519 [0,1,0,0,0,0|1,0,0]=2 5307 B15R1.14566 CCCCNC(=O)c1c(cccc1F)C 11a_100000102301_100000762013 [0,1,0,0,0,0|2,0,0]=3 5308 B15R1.14566 CCCCNC(=O)c1c(cccc1F)C 1626a_100000102301_100000762013 [0,1,0,0,0,0|2,0,0]=3 5309 B15R1.14566 CCCCNC(=O)c1c(cccc1F)C 240690a_100000102301_100000762013 [0,1,0,0,0,0|2,0,0]=3 5310 B15R1.14566 CCCCNC(=O)c1c(cccc1F)C 527a_100000102301_100000762013 [0,1,0,0,0,0|2,0,0]=3 5311 B15R1.14566 CCCCNC(=O)c1c(cccc1F)F 11a_100000102301_100000210804 [0,1,0,0,0,0|2,0,0]=3 5312 B15R1.14566 CCCCNC(=O)c1c(cccc1F)F 1626a_100000102301_100000210804 [0,1,0,0,0,0|2,0,0]=3 5313 B15R1.14566 CCCCNC(=O)c1c(cccc1F)F 240690a_100000102301_100000210804 [0,1,0,0,0,0|2,0,0]=3 5314 B15R1.14566 CCCCNC(=O)c1c(cccc1F)F 527a_100000102301_100000210804 [0,1,0,0,0,0|2,0,0]=3 5315 B15R1.14566 CCCCNC(=O)c1c(cccc1F)O 527a_100000102301_100000763259 [0,1,0,0,0,0|1,0,0]=2 5316 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Br 11a_100000102301_100010232521 [0,1,0,0,0,0|2,0,0]=3 5317 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Br 1626a_100000102301_100010232521 [0,1,0,0,0,0|2,0,0]=3 5318 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Br 240690a_100000102301_100010232521 [0,1,0,0,0,0|2,0,0]=3 5319 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Br 527a_100000102301_100010232521 [0,1,0,0,0,0|2,0,0]=3 5320 B15R1.14566 CCCCNC(=O)c1c(cccc1I)C 11a_100000102301_100000688020 [0,1,0,0,0,0|2,0,0]=3 5321 B15R1.14566 CCCCNC(=O)c1c(cccc1I)C 1626a_100000102301_100000688020 [0,1,0,0,0,0|2,0,0]=3 5322 B15R1.14566 CCCCNC(=O)c1c(cccc1I)C 240690a_100000102301_100000688020 [0,1,0,0,0,0|2,0,0]=3 5323 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Cl 11a_100000102301_100000702859 [0,1,0,0,0,0|2,0,0]=3 5324 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Cl 1626a_100000102301_100000702859 [0,1,0,0,0,0|2,0,0]=3 5325 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Cl 240690a_100000102301_100000702859 [0,1,0,0,0,0|2,0,0]=3 5326 B15R1.14566 CCCCNC(=O)c1c(cccc1I)Cl 527a_100000102301_100000702859 [0,1,0,0,0,0|2,0,0]=3 5327 B15R1.14566 CCCCNC(=O)c1c(cccc1I)F 11a_100000102301_100000023732 [0,1,0,0,0,0|2,0,0]=3 5328 B15R1.14566 CCCCNC(=O)c1c(cccc1I)F 1626a_100000102301_100000023732 [0,1,0,0,0,0|2,0,0]=3 5329 B15R1.14566 CCCCNC(=O)c1c(cccc1I)F 240690a_100000102301_100000023732 [0,1,0,0,0,0|2,0,0]=3 5330 B15R1.14566 CCCCNC(=O)c1c(cccc1O)O 527a_100000102301_100000755285 [0,1,0,0,0,0|1,0,0]=2 5331 B15R1.14566 CCCCOC(C)c1c(cccc1Br)F 34a_100013085324_100000210210 [0,1,0,0,0,0|2,0,1]=4 5332 B15R1.14566 CCCCOC(C)c1c(cccc1Br)F 7a_100013085324_100000210211 [0,1,0,0,0,0|2,0,1]=4 5333 B15R1.14566 CCCCOC(C)c1c(cccc1C)C 34a_200000695261_100000210210 [0,1,0,0,0,0|2,0,1]=4 5334 B15R1.14566 CCCCOC(C)c1c(cccc1C)C 7a_200000695261_100000210211 [0,1,0,0,0,0|2,0,1]=4 5335 B15R1.14566 CCCCOC(C)c1c(cccc1Cl)Cl 34a_100011215154_100000210210 [0,1,0,0,0,0|2,0,1]=4 5336 B15R1.14566 CCCCOC(C)c1c(cccc1Cl)Cl 7a_100011215154_100000210211 [0,1,0,0,0,0|2,0,1]=4 5337 B15R1.14566 CCCCOC(C)c1c(cccc1F)F 34a_100000742607_100000210210 [0,1,0,0,0,0|2,0,1]=4 5338 B15R1.14566 CCCCOC(C)c1c(cccc1F)F 7a_100000742607_100000210211 [0,1,0,0,0,0|2,0,1]=4 5339 B15R1.14566 CCCCO[C@H](C)c1c(cccc1Cl)F 34a_200012136785_100000210210 [0,1,0,0,0,0|2,0,1]=4 5340 B15R1.14566 CCCCO[C@H](C)c1c(cccc1Cl)F 7a_200012136785_100000210211 [0,1,0,0,0,0|2,0,1]=4 5341 B15R1.14566 CCCNN=C(C)c1c(cccc1Br)O 4a_100000740057_100010174959 [0,1,0,0,0,0|3,0,0]=4 5342 B15R1.14566 CCCNN=C(C)c1c(cccc1Cl)O 4a_100000740057_100000730630 [0,1,0,0,0,0|3,0,0]=4 5343 B15R1.14566 CCCNN=C(C)c1c(cccc1F)O 4a_100000740057_100011216272 [0,1,0,0,0,0|3,0,0]=4 5344 B15R1.14566 CCCNN=C(C)c1c(cccc1O)C 4a_100000740057_100009860897 [0,1,0,0,0,0|3,0,0]=4 5345 B15R1.14566 CCCNN=C(C)c1c(cccc1O)O 4a_100000740057_100000691522 [0,1,0,0,0,0|3,0,0]=4 5346 B15R1.14566 CCCNNC(=O)c1c(cccc1Br)Br 22a_100000740057_100000690891 [0,1,0,0,0,0|3,0,0]=4 5347 B15R1.14566 CCCNNC(=O)c1c(cccc1Br)C 22a_100000740057_100000701904 [0,1,0,0,0,0|3,0,0]=4 5348 B15R1.14566 CCCNNC(=O)c1c(cccc1Br)Cl 22a_100000740057_100011253703 [0,1,0,0,0,0|3,0,0]=4 5349 B15R1.14566 CCCNNC(=O)c1c(cccc1Br)F 22a_100000740057_100000752694 [0,1,0,0,0,0|3,0,0]=4 5350 B15R1.14566 CCCNNC(=O)c1c(cccc1Br)O 22a_100000740057_100011935254 [0,1,0,0,0,0|2,0,0]=3 5351 B15R1.14566 CCCNNC(=O)c1c(cccc1C)C 22a_100000740057_100000758298 [0,1,0,0,0,0|3,0,0]=4 5352 B15R1.14566 CCCNNC(=O)c1c(cccc1Cl)C 22a_100000740057_100000692601 [0,1,0,0,0,0|3,0,0]=4 5353 B15R1.14566 CCCNNC(=O)c1c(cccc1Cl)Cl 22a_100000740057_100000210656 [0,1,0,0,0,0|3,0,0]=4 5354 B15R1.14566 CCCNNC(=O)c1c(cccc1Cl)F 22a_100000740057_100000210369 [0,1,0,0,0,0|3,0,0]=4 5355 B15R1.14566 CCCNNC(=O)c1c(cccc1Cl)O 22a_100000740057_100000745519 [0,1,0,0,0,0|2,0,0]=3 5356 B15R1.14566 CCCNNC(=O)c1c(cccc1F)C 22a_100000740057_100000762013 [0,1,0,0,0,0|3,0,0]=4 5357 B15R1.14566 CCCNNC(=O)c1c(cccc1F)F 22a_100000740057_100000210804 [0,1,0,0,0,0|3,0,0]=4 5358 B15R1.14566 CCCNNC(=O)c1c(cccc1F)O 22a_100000740057_100000763259 [0,1,0,0,0,0|2,0,0]=3 5359 B15R1.14566 CCCNNC(=O)c1c(cccc1I)Br 22a_100000740057_100010232521 [0,1,0,0,0,0|3,0,0]=4 5360 B15R1.14566 CCCNNC(=O)c1c(cccc1I)C 22a_100000740057_100000688020 [0,1,0,0,0,0|3,0,0]=4 5361 B15R1.14566 CCCNNC(=O)c1c(cccc1I)Cl 22a_100000740057_100000702859 [0,1,0,0,0,0|3,0,0]=4 5362 B15R1.14566 CCCNNC(=O)c1c(cccc1I)F 22a_100000740057_100000023732 [0,1,0,0,0,0|3,0,0]=4 5363 B15R1.14566 CCCNNC(=O)c1c(cccc1O)C 22a_100000740057_100011934116 [0,1,0,0,0,0|2,0,0]=3 5364 B15R1.14566 CCCOCC(=O)c1c(cccc1Cl)Cl 34a_100000210258_100012340516 [0,1,0,0,0,0|3,0,0]=4 5365 B15R1.14566 CCCOCC(=O)c1c(cccc1Cl)F 34a_100000210258_100011219195 [0,1,0,0,0,0|3,0,0]=4 5366 B15R1.14566 CCCOCC(=O)c1c(cccc1F)F 34a_100000210258_100000199083 [0,1,0,0,0,0|3,0,0]=4 5367 B15R1.14566 CCCSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100000210303 [0,1,0,0,0,0|3,0,0]=4 5368 B15R1.14566 CCCSCC(=O)c1c(cccc1Cl)F 62a_100000210303_100011219195 [0,1,0,0,0,0|3,0,0]=4 5369 B15R1.14566 CCCSCC(=O)c1c(cccc1Cl)F 62a_100011219195_100000210303 [0,1,0,0,0,0|3,0,0]=4 5370 B15R1.14566 CCCSCC(=O)c1c(cccc1F)F 62a_100000199083_100000210303 [0,1,0,0,0,0|3,0,0]=4 5371 B15R1.14566 CCCSCC(=O)c1c(cccc1F)F 62a_100000210303_100000199083 [0,1,0,0,0,0|3,0,0]=4 5372 B15R1.14566 CCOCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011215890 [0,1,0,0,0,0|3,0,0]=4 5373 B15R1.14566 CCOCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100011215890 [0,1,0,0,0,0|3,0,0]=4 5374 B15R1.14566 CCOCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011215890 [0,1,0,0,0,0|3,0,0]=4 5375 B15R1.14566 CCOCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100011215890 [0,1,0,0,0,0|3,0,0]=4 5376 B15R1.14566 CCOCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215890 [0,1,0,0,0,0|2,0,0]=3 5377 B15R1.14566 CCOCCC(=O)c1c(cccc1C)C 1458a_100000758298_100011215890 [0,1,0,0,0,0|3,0,0]=4 5378 B15R1.14566 CCOCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100011215890 [0,1,0,0,0,0|3,0,0]=4 5379 B15R1.14566 CCOCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011215890 [0,1,0,0,0,0|3,0,0]=4 5380 B15R1.14566 CCOCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011215890 [0,1,0,0,0,0|3,0,0]=4 5381 B15R1.14566 CCOCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215890 [0,1,0,0,0,0|2,0,0]=3 5382 B15R1.14566 CCOCCC(=O)c1c(cccc1F)C 1458a_100000762013_100011215890 [0,1,0,0,0,0|3,0,0]=4 5383 B15R1.14566 CCOCCC(=O)c1c(cccc1F)F 1458a_100000210804_100011215890 [0,1,0,0,0,0|3,0,0]=4 5384 B15R1.14566 CCOCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215890 [0,1,0,0,0,0|2,0,0]=3 5385 B15R1.14566 CCOCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100011215890 [0,1,0,0,0,0|3,0,0]=4 5386 B15R1.14566 CCOCCC(=O)c1c(cccc1I)C 1458a_100000688020_100011215890 [0,1,0,0,0,0|3,0,0]=4 5387 B15R1.14566 CCOCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011215890 [0,1,0,0,0,0|3,0,0]=4 5388 B15R1.14566 CCOCCC(=O)c1c(cccc1I)F 1458a_100000023732_100011215890 [0,1,0,0,0,0|3,0,0]=4 5389 B15R1.14566 CCOCCC(=O)c1c(cccc1O)C 1458a_100011934116_100011215890 [0,1,0,0,0,0|2,0,0]=3 5390 B15R1.14566 CCOCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215890 [0,1,0,0,0,0|2,0,0]=3 5391 B15R1.14566 CCSCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000757381 [0,1,0,0,0,0|3,0,0]=4 5392 B15R1.14566 CCSCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000757381 [0,1,0,0,0,0|3,0,0]=4 5393 B15R1.14566 CCSCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000757381 [0,1,0,0,0,0|3,0,0]=4 5394 B15R1.14566 CCSCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000757381 [0,1,0,0,0,0|3,0,0]=4 5395 B15R1.14566 CCSCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000757381 [0,1,0,0,0,0|2,0,0]=3 5396 B15R1.14566 CCSCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000757381 [0,1,0,0,0,0|3,0,0]=4 5397 B15R1.14566 CCSCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000757381 [0,1,0,0,0,0|3,0,0]=4 5398 B15R1.14566 CCSCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000757381 [0,1,0,0,0,0|3,0,0]=4 5399 B15R1.14566 CCSCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000757381 [0,1,0,0,0,0|3,0,0]=4 5400 B15R1.14566 CCSCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000757381 [0,1,0,0,0,0|2,0,0]=3 5401 B15R1.14566 CCSCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000757381 [0,1,0,0,0,0|3,0,0]=4 5402 B15R1.14566 CCSCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000757381 [0,1,0,0,0,0|3,0,0]=4 5403 B15R1.14566 CCSCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000757381 [0,1,0,0,0,0|2,0,0]=3 5404 B15R1.14566 CCSCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000757381 [0,1,0,0,0,0|3,0,0]=4 5405 B15R1.14566 CCSCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000757381 [0,1,0,0,0,0|3,0,0]=4 5406 B15R1.14566 CCSCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000757381 [0,1,0,0,0,0|3,0,0]=4 5407 B15R1.14566 CCSCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000757381 [0,1,0,0,0,0|3,0,0]=4 5408 B15R1.14566 CCSCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000757381 [0,1,0,0,0,0|2,0,0]=3 5409 B15R1.14566 CCSCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000757381 [0,1,0,0,0,0|2,0,0]=3 5410 B15R1.14566 COCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000740836 [0,1,0,0,0,0|3,0,0]=4 5411 B15R1.14566 COCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000740836 [0,1,0,0,0,0|3,0,0]=4 5412 B15R1.14566 COCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000740836 [0,1,0,0,0,0|3,0,0]=4 5413 B15R1.14566 COCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000740836 [0,1,0,0,0,0|3,0,0]=4 5414 B15R1.14566 COCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000740836 [0,1,0,0,0,0|2,0,0]=3 5415 B15R1.14566 COCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000740836 [0,1,0,0,0,0|3,0,0]=4 5416 B15R1.14566 COCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000740836 [0,1,0,0,0,0|3,0,0]=4 5417 B15R1.14566 COCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000740836 [0,1,0,0,0,0|3,0,0]=4 5418 B15R1.14566 COCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000740836 [0,1,0,0,0,0|3,0,0]=4 5419 B15R1.14566 COCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000740836 [0,1,0,0,0,0|2,0,0]=3 5420 B15R1.14566 COCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000740836 [0,1,0,0,0,0|3,0,0]=4 5421 B15R1.14566 COCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000740836 [0,1,0,0,0,0|3,0,0]=4 5422 B15R1.14566 COCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000740836 [0,1,0,0,0,0|2,0,0]=3 5423 B15R1.14566 COCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000740836 [0,1,0,0,0,0|3,0,0]=4 5424 B15R1.14566 COCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000740836 [0,1,0,0,0,0|3,0,0]=4 5425 B15R1.14566 COCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000740836 [0,1,0,0,0,0|3,0,0]=4 5426 B15R1.14566 COCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000740836 [0,1,0,0,0,0|3,0,0]=4 5427 B15R1.14566 COCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000740836 [0,1,0,0,0,0|2,0,0]=3 5428 B15R1.14566 COCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000740836 [0,1,0,0,0,0|2,0,0]=3 5429 B15R1.14566 COCCNC(=O)c1c(cccc1Br)Br 1626a_100000209980_100000690891 [0,1,0,0,0,0|3,0,0]=4 5430 B15R1.14566 COCCNC(=O)c1c(cccc1Br)Br 240690a_100000209980_100000690891 [0,1,0,0,0,0|3,0,0]=4 5431 B15R1.14566 COCCNC(=O)c1c(cccc1Br)Br 527a_100000209980_100000690891 [0,1,0,0,0,0|3,0,0]=4 5432 B15R1.14566 COCCNC(=O)c1c(cccc1Br)C 1626a_100000209980_100000701904 [0,1,0,0,0,0|3,0,0]=4 5433 B15R1.14566 COCCNC(=O)c1c(cccc1Br)C 240690a_100000209980_100000701904 [0,1,0,0,0,0|3,0,0]=4 5434 B15R1.14566 COCCNC(=O)c1c(cccc1Br)C 527a_100000209980_100000701904 [0,1,0,0,0,0|3,0,0]=4 5435 B15R1.14566 COCCNC(=O)c1c(cccc1Br)Cl 1626a_100000209980_100011253703 [0,1,0,0,0,0|3,0,0]=4 5436 B15R1.14566 COCCNC(=O)c1c(cccc1Br)Cl 240690a_100000209980_100011253703 [0,1,0,0,0,0|3,0,0]=4 5437 B15R1.14566 COCCNC(=O)c1c(cccc1Br)Cl 527a_100000209980_100011253703 [0,1,0,0,0,0|3,0,0]=4 5438 B15R1.14566 COCCNC(=O)c1c(cccc1Br)F 1626a_100000209980_100000752694 [0,1,0,0,0,0|3,0,0]=4 5439 B15R1.14566 COCCNC(=O)c1c(cccc1Br)F 240690a_100000209980_100000752694 [0,1,0,0,0,0|3,0,0]=4 5440 B15R1.14566 COCCNC(=O)c1c(cccc1Br)F 527a_100000209980_100000752694 [0,1,0,0,0,0|3,0,0]=4 5441 B15R1.14566 COCCNC(=O)c1c(cccc1Br)O 240690a_100000209980_100011935254 [0,1,0,0,0,0|2,0,0]=3 5442 B15R1.14566 COCCNC(=O)c1c(cccc1Br)O 527a_100000209980_100011935254 [0,1,0,0,0,0|2,0,0]=3 5443 B15R1.14566 COCCNC(=O)c1c(cccc1C)C 1626a_100000209980_100000758298 [0,1,0,0,0,0|3,0,0]=4 5444 B15R1.14566 COCCNC(=O)c1c(cccc1C)C 240690a_100000209980_100000758298 [0,1,0,0,0,0|3,0,0]=4 5445 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)C 1626a_100000209980_100000692601 [0,1,0,0,0,0|3,0,0]=4 5446 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)C 240690a_100000209980_100000692601 [0,1,0,0,0,0|3,0,0]=4 5447 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)Cl 1626a_100000209980_100000210656 [0,1,0,0,0,0|3,0,0]=4 5448 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)Cl 240690a_100000209980_100000210656 [0,1,0,0,0,0|3,0,0]=4 5449 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)F 1626a_100000209980_100000210369 [0,1,0,0,0,0|3,0,0]=4 5450 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)F 240690a_100000209980_100000210369 [0,1,0,0,0,0|3,0,0]=4 5451 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)F 527a_100000209980_100000210369 [0,1,0,0,0,0|3,0,0]=4 5452 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)O 240690a_100000209980_100000745519 [0,1,0,0,0,0|2,0,0]=3 5453 B15R1.14566 COCCNC(=O)c1c(cccc1Cl)O 527a_100000209980_100000745519 [0,1,0,0,0,0|2,0,0]=3 5454 B15R1.14566 COCCNC(=O)c1c(cccc1F)C 1626a_100000209980_100000762013 [0,1,0,0,0,0|3,0,0]=4 5455 B15R1.14566 COCCNC(=O)c1c(cccc1F)C 240690a_100000209980_100000762013 [0,1,0,0,0,0|3,0,0]=4 5456 B15R1.14566 COCCNC(=O)c1c(cccc1F)C 527a_100000209980_100000762013 [0,1,0,0,0,0|3,0,0]=4 5457 B15R1.14566 COCCNC(=O)c1c(cccc1F)F 1626a_100000209980_100000210804 [0,1,0,0,0,0|3,0,0]=4 5458 B15R1.14566 COCCNC(=O)c1c(cccc1F)F 240690a_100000209980_100000210804 [0,1,0,0,0,0|3,0,0]=4 5459 B15R1.14566 COCCNC(=O)c1c(cccc1F)F 527a_100000209980_100000210804 [0,1,0,0,0,0|3,0,0]=4 5460 B15R1.14566 COCCNC(=O)c1c(cccc1F)O 527a_100000209980_100000763259 [0,1,0,0,0,0|2,0,0]=3 5461 B15R1.14566 COCCNC(=O)c1c(cccc1I)Br 1626a_100000209980_100010232521 [0,1,0,0,0,0|3,0,0]=4 5462 B15R1.14566 COCCNC(=O)c1c(cccc1I)Br 240690a_100000209980_100010232521 [0,1,0,0,0,0|3,0,0]=4 5463 B15R1.14566 COCCNC(=O)c1c(cccc1I)Br 527a_100000209980_100010232521 [0,1,0,0,0,0|3,0,0]=4 5464 B15R1.14566 COCCNC(=O)c1c(cccc1I)C 1626a_100000209980_100000688020 [0,1,0,0,0,0|3,0,0]=4 5465 B15R1.14566 COCCNC(=O)c1c(cccc1I)C 240690a_100000209980_100000688020 [0,1,0,0,0,0|3,0,0]=4 5466 B15R1.14566 COCCNC(=O)c1c(cccc1I)Cl 1626a_100000209980_100000702859 [0,1,0,0,0,0|3,0,0]=4 5467 B15R1.14566 COCCNC(=O)c1c(cccc1I)Cl 240690a_100000209980_100000702859 [0,1,0,0,0,0|3,0,0]=4 5468 B15R1.14566 COCCNC(=O)c1c(cccc1I)Cl 527a_100000209980_100000702859 [0,1,0,0,0,0|3,0,0]=4 5469 B15R1.14566 COCCNC(=O)c1c(cccc1I)F 1626a_100000209980_100000023732 [0,1,0,0,0,0|3,0,0]=4 5470 B15R1.14566 COCCNC(=O)c1c(cccc1I)F 240690a_100000209980_100000023732 [0,1,0,0,0,0|3,0,0]=4 5471 B15R1.14566 COCCNC(=O)c1c(cccc1O)O 527a_100000209980_100000755285 [0,1,0,0,0,0|2,0,0]=3 5472 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Br 11a_100020590264_100000690891 [0,1,0,0,0,0|3,0,0]=4 5473 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Br 1626a_100020590264_100000690891 [0,1,0,0,0,0|3,0,0]=4 5474 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Br 240690a_100020590264_100000690891 [0,1,0,0,0,0|3,0,0]=4 5475 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Br 527a_100020590264_100000690891 [0,1,0,0,0,0|3,0,0]=4 5476 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)C 11a_100020590264_100000701904 [0,1,0,0,0,0|3,0,0]=4 5477 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)C 1626a_100020590264_100000701904 [0,1,0,0,0,0|3,0,0]=4 5478 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)C 240690a_100020590264_100000701904 [0,1,0,0,0,0|3,0,0]=4 5479 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)C 527a_100020590264_100000701904 [0,1,0,0,0,0|3,0,0]=4 5480 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Cl 11a_100020590264_100011253703 [0,1,0,0,0,0|3,0,0]=4 5481 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Cl 1626a_100020590264_100011253703 [0,1,0,0,0,0|3,0,0]=4 5482 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Cl 240690a_100020590264_100011253703 [0,1,0,0,0,0|3,0,0]=4 5483 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)Cl 527a_100020590264_100011253703 [0,1,0,0,0,0|3,0,0]=4 5484 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)F 11a_100020590264_100000752694 [0,1,0,0,0,0|3,0,0]=4 5485 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)F 1626a_100020590264_100000752694 [0,1,0,0,0,0|3,0,0]=4 5486 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)F 240690a_100020590264_100000752694 [0,1,0,0,0,0|3,0,0]=4 5487 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)F 527a_100020590264_100000752694 [0,1,0,0,0,0|3,0,0]=4 5488 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)O 240690a_100020590264_100011935254 [0,1,0,0,0,0|2,0,0]=3 5489 B15R1.14566 CSCCNC(=O)c1c(cccc1Br)O 527a_100020590264_100011935254 [0,1,0,0,0,0|2,0,0]=3 5490 B15R1.14566 CSCCNC(=O)c1c(cccc1C)C 11a_100020590264_100000758298 [0,1,0,0,0,0|3,0,0]=4 5491 B15R1.14566 CSCCNC(=O)c1c(cccc1C)C 1626a_100020590264_100000758298 [0,1,0,0,0,0|3,0,0]=4 5492 B15R1.14566 CSCCNC(=O)c1c(cccc1C)C 240690a_100020590264_100000758298 [0,1,0,0,0,0|3,0,0]=4 5493 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)C 11a_100020590264_100000692601 [0,1,0,0,0,0|3,0,0]=4 5494 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)C 1626a_100020590264_100000692601 [0,1,0,0,0,0|3,0,0]=4 5495 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)C 240690a_100020590264_100000692601 [0,1,0,0,0,0|3,0,0]=4 5496 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)Cl 11a_100020590264_100000210656 [0,1,0,0,0,0|3,0,0]=4 5497 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)Cl 1626a_100020590264_100000210656 [0,1,0,0,0,0|3,0,0]=4 5498 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)Cl 240690a_100020590264_100000210656 [0,1,0,0,0,0|3,0,0]=4 5499 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)F 11a_100020590264_100000210369 [0,1,0,0,0,0|3,0,0]=4 5500 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)F 1626a_100020590264_100000210369 [0,1,0,0,0,0|3,0,0]=4 5501 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)F 240690a_100020590264_100000210369 [0,1,0,0,0,0|3,0,0]=4 5502 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)F 527a_100020590264_100000210369 [0,1,0,0,0,0|3,0,0]=4 5503 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)O 240690a_100020590264_100000745519 [0,1,0,0,0,0|2,0,0]=3 5504 B15R1.14566 CSCCNC(=O)c1c(cccc1Cl)O 527a_100020590264_100000745519 [0,1,0,0,0,0|2,0,0]=3 5505 B15R1.14566 CSCCNC(=O)c1c(cccc1F)C 11a_100020590264_100000762013 [0,1,0,0,0,0|3,0,0]=4 5506 B15R1.14566 CSCCNC(=O)c1c(cccc1F)C 1626a_100020590264_100000762013 [0,1,0,0,0,0|3,0,0]=4 5507 B15R1.14566 CSCCNC(=O)c1c(cccc1F)C 240690a_100020590264_100000762013 [0,1,0,0,0,0|3,0,0]=4 5508 B15R1.14566 CSCCNC(=O)c1c(cccc1F)C 527a_100020590264_100000762013 [0,1,0,0,0,0|3,0,0]=4 5509 B15R1.14566 CSCCNC(=O)c1c(cccc1F)F 11a_100020590264_100000210804 [0,1,0,0,0,0|3,0,0]=4 5510 B15R1.14566 CSCCNC(=O)c1c(cccc1F)F 1626a_100020590264_100000210804 [0,1,0,0,0,0|3,0,0]=4 5511 B15R1.14566 CSCCNC(=O)c1c(cccc1F)F 240690a_100020590264_100000210804 [0,1,0,0,0,0|3,0,0]=4 5512 B15R1.14566 CSCCNC(=O)c1c(cccc1F)F 527a_100020590264_100000210804 [0,1,0,0,0,0|3,0,0]=4 5513 B15R1.14566 CSCCNC(=O)c1c(cccc1F)O 527a_100020590264_100000763259 [0,1,0,0,0,0|2,0,0]=3 5514 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Br 11a_100020590264_100010232521 [0,1,0,0,0,0|3,0,0]=4 5515 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Br 1626a_100020590264_100010232521 [0,1,0,0,0,0|3,0,0]=4 5516 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Br 240690a_100020590264_100010232521 [0,1,0,0,0,0|3,0,0]=4 5517 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Br 527a_100020590264_100010232521 [0,1,0,0,0,0|3,0,0]=4 5518 B15R1.14566 CSCCNC(=O)c1c(cccc1I)C 11a_100020590264_100000688020 [0,1,0,0,0,0|3,0,0]=4 5519 B15R1.14566 CSCCNC(=O)c1c(cccc1I)C 1626a_100020590264_100000688020 [0,1,0,0,0,0|3,0,0]=4 5520 B15R1.14566 CSCCNC(=O)c1c(cccc1I)C 240690a_100020590264_100000688020 [0,1,0,0,0,0|3,0,0]=4 5521 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Cl 11a_100020590264_100000702859 [0,1,0,0,0,0|3,0,0]=4 5522 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Cl 1626a_100020590264_100000702859 [0,1,0,0,0,0|3,0,0]=4 5523 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Cl 240690a_100020590264_100000702859 [0,1,0,0,0,0|3,0,0]=4 5524 B15R1.14566 CSCCNC(=O)c1c(cccc1I)Cl 527a_100020590264_100000702859 [0,1,0,0,0,0|3,0,0]=4 5525 B15R1.14566 CSCCNC(=O)c1c(cccc1I)F 11a_100020590264_100000023732 [0,1,0,0,0,0|3,0,0]=4 5526 B15R1.14566 CSCCNC(=O)c1c(cccc1I)F 1626a_100020590264_100000023732 [0,1,0,0,0,0|3,0,0]=4 5527 B15R1.14566 CSCCNC(=O)c1c(cccc1I)F 240690a_100020590264_100000023732 [0,1,0,0,0,0|3,0,0]=4 5528 B15R1.14566 CSCCNC(=O)c1c(cccc1O)O 527a_100020590264_100000755285 [0,1,0,0,0,0|2,0,0]=3 5529 B15R1.14566 Cc1cccc(c1C(=O)CCCC#N)O 1458a_100011934116_100000211468 [0,1,0,0,0,0|2,0,1]=4 5530 B15R1.14566 Cc1cccc(c1C(=O)CCCCF)Br 1458a_100000701904_100000729493 [0,1,0,0,0,0|3,0,0]=4 5531 B15R1.14566 Cc1cccc(c1C(=O)CCCCF)C 1458a_100000758298_100000729493 [0,1,0,0,0,0|3,0,0]=4 5532 B15R1.14566 Cc1cccc(c1C(=O)CCCCF)Cl 1458a_100000692601_100000729493 [0,1,0,0,0,0|3,0,0]=4 5533 B15R1.14566 Cc1cccc(c1C(=O)CCCCF)F 1458a_100000762013_100000729493 [0,1,0,0,0,0|3,0,0]=4 5534 B15R1.14566 Cc1cccc(c1C(=O)CCCCF)I 1458a_100000688020_100000729493 [0,1,0,0,0,0|3,0,0]=4 5535 B15R1.14566 Cc1cccc(c1C(=O)CCCCF)O 1458a_100011934116_100000729493 [0,1,0,0,0,0|2,0,0]=3 5536 B15R1.14566 Cc1cccc(c1C(=O)CCCCO)Br 1458a_100000701904_100000210776 [0,1,0,0,0,0|3,0,0]=4 5537 B15R1.14566 Cc1cccc(c1C(=O)CCCCO)C 1458a_100000758298_100000210776 [0,1,0,0,0,0|3,0,0]=4 5538 B15R1.14566 Cc1cccc(c1C(=O)CCCCO)Cl 1458a_100000692601_100000210776 [0,1,0,0,0,0|3,0,0]=4 5539 B15R1.14566 Cc1cccc(c1C(=O)CCCCO)F 1458a_100000762013_100000210776 [0,1,0,0,0,0|3,0,0]=4 5540 B15R1.14566 Cc1cccc(c1C(=O)CCCCO)I 1458a_100000688020_100000210776 [0,1,0,0,0,0|3,0,0]=4 5541 B15R1.14566 Cc1cccc(c1C(=O)CCCCO)O 1458a_100011934116_100000210776 [0,1,0,0,0,0|2,0,0]=3 5542 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Br 11a_100015189416_100000701904 [0,1,0,0,0,0|3,0,0]=4 5543 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Br 1626a_100015189416_100000701904 [0,1,0,0,0,0|3,0,0]=4 5544 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Br 240690a_100015189416_100000701904 [0,1,0,0,0,0|3,0,0]=4 5545 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Br 527a_100015189416_100000701904 [0,1,0,0,0,0|3,0,0]=4 5546 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)C 11a_100015189416_100000758298 [0,1,0,0,0,0|3,0,0]=4 5547 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)C 1626a_100015189416_100000758298 [0,1,0,0,0,0|3,0,0]=4 5548 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)C 240690a_100015189416_100000758298 [0,1,0,0,0,0|3,0,0]=4 5549 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Cl 11a_100015189416_100000692601 [0,1,0,0,0,0|3,0,0]=4 5550 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Cl 1626a_100015189416_100000692601 [0,1,0,0,0,0|3,0,0]=4 5551 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)Cl 240690a_100015189416_100000692601 [0,1,0,0,0,0|3,0,0]=4 5552 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)F 11a_100015189416_100000762013 [0,1,0,0,0,0|3,0,0]=4 5553 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)F 1626a_100015189416_100000762013 [0,1,0,0,0,0|3,0,0]=4 5554 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)F 240690a_100015189416_100000762013 [0,1,0,0,0,0|3,0,0]=4 5555 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)F 527a_100015189416_100000762013 [0,1,0,0,0,0|3,0,0]=4 5556 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)I 11a_100015189416_100000688020 [0,1,0,0,0,0|3,0,0]=4 5557 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)I 1626a_100015189416_100000688020 [0,1,0,0,0,0|3,0,0]=4 5558 B15R1.14566 Cc1cccc(c1C(=O)NCCCF)I 240690a_100015189416_100000688020 [0,1,0,0,0,0|3,0,0]=4 5559 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)Br 240690a_100000182051_100000701904 [0,1,0,0,0,0|3,0,0]=4 5560 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)Br 527a_100000182051_100000701904 [0,1,0,0,0,0|3,0,0]=4 5561 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)C 240690a_100000182051_100000758298 [0,1,0,0,0,0|3,0,0]=4 5562 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)Cl 240690a_100000182051_100000692601 [0,1,0,0,0,0|3,0,0]=4 5563 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)F 240690a_100000182051_100000762013 [0,1,0,0,0,0|3,0,0]=4 5564 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)F 527a_100000182051_100000762013 [0,1,0,0,0,0|3,0,0]=4 5565 B15R1.14566 Cc1cccc(c1C(=O)NCCCO)I 240690a_100000182051_100000688020 [0,1,0,0,0,0|3,0,0]=4 5566 B15R1.14566 Cc1cccc(c1C(=O)NNCCO)O 22a_100000210001_100011934116 [0,1,0,0,0,0|3,0,0]=4 5567 B15R1.14566 N#CCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000211468 [0,1,0,0,0,0|2,0,1]=4 5568 B15R1.14566 N#CCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000211468 [0,1,0,0,0,0|2,0,1]=4 5569 B15R1.14566 N#CCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000211468 [0,1,0,0,0,0|2,0,1]=4 5570 B15R1.14566 N#CCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000211468 [0,1,0,0,0,0|2,0,1]=4 5571 B15R1.14566 N#CCCNC(=O)c1c(cccc1Br)O 240690a_100000720768_100011935254 [0,1,0,0,0,0|2,0,1]=4 5572 B15R1.14566 N#CCCNC(=O)c1c(cccc1Br)O 527a_100000720768_100011935254 [0,1,0,0,0,0|2,0,1]=4 5573 B15R1.14566 N#CCCNC(=O)c1c(cccc1Cl)O 240690a_100000720768_100000745519 [0,1,0,0,0,0|2,0,1]=4 5574 B15R1.14566 N#CCCNC(=O)c1c(cccc1Cl)O 527a_100000720768_100000745519 [0,1,0,0,0,0|2,0,1]=4 5575 B15R1.14566 N#CCCNC(=O)c1c(cccc1F)O 527a_100000720768_100000763259 [0,1,0,0,0,0|2,0,1]=4 5576 B15R1.14566 N#CCCNC(=O)c1c(cccc1O)O 527a_100000720768_100000755285 [0,1,0,0,0,0|2,0,1]=4 5577 B15R1.14566 O=C(CCCCF)c1c(cccc1Br)Br 1458a_100000690891_100000729493 [0,1,0,0,0,0|3,0,0]=4 5578 B15R1.14566 O=C(CCCCF)c1c(cccc1Br)Cl 1458a_100011253703_100000729493 [0,1,0,0,0,0|3,0,0]=4 5579 B15R1.14566 O=C(CCCCF)c1c(cccc1Br)F 1458a_100000752694_100000729493 [0,1,0,0,0,0|3,0,0]=4 5580 B15R1.14566 O=C(CCCCF)c1c(cccc1Br)O 1458a_100011935254_100000729493 [0,1,0,0,0,0|2,0,0]=3 5581 B15R1.14566 O=C(CCCCF)c1c(cccc1Cl)Cl 1458a_100000210656_100000729493 [0,1,0,0,0,0|3,0,0]=4 5582 B15R1.14566 O=C(CCCCF)c1c(cccc1Cl)F 1458a_100000210369_100000729493 [0,1,0,0,0,0|3,0,0]=4 5583 B15R1.14566 O=C(CCCCF)c1c(cccc1Cl)O 1458a_100000745519_100000729493 [0,1,0,0,0,0|2,0,0]=3 5584 B15R1.14566 O=C(CCCCF)c1c(cccc1F)F 1458a_100000210804_100000729493 [0,1,0,0,0,0|3,0,0]=4 5585 B15R1.14566 O=C(CCCCF)c1c(cccc1F)O 1458a_100000763259_100000729493 [0,1,0,0,0,0|2,0,0]=3 5586 B15R1.14566 O=C(CCCCF)c1c(cccc1I)Br 1458a_100010232521_100000729493 [0,1,0,0,0,0|3,0,0]=4 5587 B15R1.14566 O=C(CCCCF)c1c(cccc1I)Cl 1458a_100000702859_100000729493 [0,1,0,0,0,0|3,0,0]=4 5588 B15R1.14566 O=C(CCCCF)c1c(cccc1I)F 1458a_100000023732_100000729493 [0,1,0,0,0,0|3,0,0]=4 5589 B15R1.14566 O=C(CCCCF)c1c(cccc1O)O 1458a_100000755285_100000729493 [0,1,0,0,0,0|2,0,0]=3 5590 B15R1.14566 O=C(CCCCO)c1c(cccc1Br)Br 1458a_100000690891_100000210776 [0,1,0,0,0,0|3,0,0]=4 5591 B15R1.14566 O=C(CCCCO)c1c(cccc1Br)Cl 1458a_100011253703_100000210776 [0,1,0,0,0,0|3,0,0]=4 5592 B15R1.14566 O=C(CCCCO)c1c(cccc1Br)F 1458a_100000752694_100000210776 [0,1,0,0,0,0|3,0,0]=4 5593 B15R1.14566 O=C(CCCCO)c1c(cccc1Br)O 1458a_100011935254_100000210776 [0,1,0,0,0,0|2,0,0]=3 5594 B15R1.14566 O=C(CCCCO)c1c(cccc1Cl)Cl 1458a_100000210656_100000210776 [0,1,0,0,0,0|3,0,0]=4 5595 B15R1.14566 O=C(CCCCO)c1c(cccc1Cl)F 1458a_100000210369_100000210776 [0,1,0,0,0,0|3,0,0]=4 5596 B15R1.14566 O=C(CCCCO)c1c(cccc1Cl)O 1458a_100000745519_100000210776 [0,1,0,0,0,0|2,0,0]=3 5597 B15R1.14566 O=C(CCCCO)c1c(cccc1F)F 1458a_100000210804_100000210776 [0,1,0,0,0,0|3,0,0]=4 5598 B15R1.14566 O=C(CCCCO)c1c(cccc1F)O 1458a_100000763259_100000210776 [0,1,0,0,0,0|2,0,0]=3 5599 B15R1.14566 O=C(CCCCO)c1c(cccc1I)Br 1458a_100010232521_100000210776 [0,1,0,0,0,0|3,0,0]=4 5600 B15R1.14566 O=C(CCCCO)c1c(cccc1I)Cl 1458a_100000702859_100000210776 [0,1,0,0,0,0|3,0,0]=4 5601 B15R1.14566 O=C(CCCCO)c1c(cccc1I)F 1458a_100000023732_100000210776 [0,1,0,0,0,0|3,0,0]=4 5602 B15R1.14566 O=C(CCCCO)c1c(cccc1O)O 1458a_100000755285_100000210776 [0,1,0,0,0,0|2,0,0]=3 5603 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Br 11a_100015189416_100000690891 [0,1,0,0,0,0|3,0,0]=4 5604 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Br 1626a_100015189416_100000690891 [0,1,0,0,0,0|3,0,0]=4 5605 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Br 240690a_100015189416_100000690891 [0,1,0,0,0,0|3,0,0]=4 5606 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Br 527a_100015189416_100000690891 [0,1,0,0,0,0|3,0,0]=4 5607 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Cl 11a_100015189416_100011253703 [0,1,0,0,0,0|3,0,0]=4 5608 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Cl 1626a_100015189416_100011253703 [0,1,0,0,0,0|3,0,0]=4 5609 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Cl 240690a_100015189416_100011253703 [0,1,0,0,0,0|3,0,0]=4 5610 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)Cl 527a_100015189416_100011253703 [0,1,0,0,0,0|3,0,0]=4 5611 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)F 11a_100015189416_100000752694 [0,1,0,0,0,0|3,0,0]=4 5612 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)F 1626a_100015189416_100000752694 [0,1,0,0,0,0|3,0,0]=4 5613 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)F 240690a_100015189416_100000752694 [0,1,0,0,0,0|3,0,0]=4 5614 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)F 527a_100015189416_100000752694 [0,1,0,0,0,0|3,0,0]=4 5615 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)O 240690a_100015189416_100011935254 [0,1,0,0,0,0|2,0,0]=3 5616 B15R1.14566 O=C(NCCCF)c1c(cccc1Br)O 527a_100015189416_100011935254 [0,1,0,0,0,0|2,0,0]=3 5617 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)Cl 11a_100015189416_100000210656 [0,1,0,0,0,0|3,0,0]=4 5618 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)Cl 1626a_100015189416_100000210656 [0,1,0,0,0,0|3,0,0]=4 5619 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)Cl 240690a_100015189416_100000210656 [0,1,0,0,0,0|3,0,0]=4 5620 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)F 11a_100015189416_100000210369 [0,1,0,0,0,0|3,0,0]=4 5621 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)F 1626a_100015189416_100000210369 [0,1,0,0,0,0|3,0,0]=4 5622 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)F 240690a_100015189416_100000210369 [0,1,0,0,0,0|3,0,0]=4 5623 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)F 527a_100015189416_100000210369 [0,1,0,0,0,0|3,0,0]=4 5624 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)O 240690a_100015189416_100000745519 [0,1,0,0,0,0|2,0,0]=3 5625 B15R1.14566 O=C(NCCCF)c1c(cccc1Cl)O 527a_100015189416_100000745519 [0,1,0,0,0,0|2,0,0]=3 5626 B15R1.14566 O=C(NCCCF)c1c(cccc1F)F 11a_100015189416_100000210804 [0,1,0,0,0,0|3,0,0]=4 5627 B15R1.14566 O=C(NCCCF)c1c(cccc1F)F 1626a_100015189416_100000210804 [0,1,0,0,0,0|3,0,0]=4 5628 B15R1.14566 O=C(NCCCF)c1c(cccc1F)F 240690a_100015189416_100000210804 [0,1,0,0,0,0|3,0,0]=4 5629 B15R1.14566 O=C(NCCCF)c1c(cccc1F)F 527a_100015189416_100000210804 [0,1,0,0,0,0|3,0,0]=4 5630 B15R1.14566 O=C(NCCCF)c1c(cccc1F)O 527a_100015189416_100000763259 [0,1,0,0,0,0|2,0,0]=3 5631 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Br 11a_100015189416_100010232521 [0,1,0,0,0,0|3,0,0]=4 5632 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Br 1626a_100015189416_100010232521 [0,1,0,0,0,0|3,0,0]=4 5633 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Br 240690a_100015189416_100010232521 [0,1,0,0,0,0|3,0,0]=4 5634 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Br 527a_100015189416_100010232521 [0,1,0,0,0,0|3,0,0]=4 5635 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Cl 11a_100015189416_100000702859 [0,1,0,0,0,0|3,0,0]=4 5636 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Cl 1626a_100015189416_100000702859 [0,1,0,0,0,0|3,0,0]=4 5637 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Cl 240690a_100015189416_100000702859 [0,1,0,0,0,0|3,0,0]=4 5638 B15R1.14566 O=C(NCCCF)c1c(cccc1I)Cl 527a_100015189416_100000702859 [0,1,0,0,0,0|3,0,0]=4 5639 B15R1.14566 O=C(NCCCF)c1c(cccc1I)F 11a_100015189416_100000023732 [0,1,0,0,0,0|3,0,0]=4 5640 B15R1.14566 O=C(NCCCF)c1c(cccc1I)F 1626a_100015189416_100000023732 [0,1,0,0,0,0|3,0,0]=4 5641 B15R1.14566 O=C(NCCCF)c1c(cccc1I)F 240690a_100015189416_100000023732 [0,1,0,0,0,0|3,0,0]=4 5642 B15R1.14566 O=C(NCCCF)c1c(cccc1O)O 527a_100015189416_100000755285 [0,1,0,0,0,0|2,0,0]=3 5643 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)Br 240690a_100000182051_100000690891 [0,1,0,0,0,0|3,0,0]=4 5644 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)Br 527a_100000182051_100000690891 [0,1,0,0,0,0|3,0,0]=4 5645 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)Cl 240690a_100000182051_100011253703 [0,1,0,0,0,0|3,0,0]=4 5646 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)Cl 527a_100000182051_100011253703 [0,1,0,0,0,0|3,0,0]=4 5647 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)F 240690a_100000182051_100000752694 [0,1,0,0,0,0|3,0,0]=4 5648 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)F 527a_100000182051_100000752694 [0,1,0,0,0,0|3,0,0]=4 5649 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)O 240690a_100000182051_100011935254 [0,1,0,0,0,0|2,0,0]=3 5650 B15R1.14566 O=C(NCCCO)c1c(cccc1Br)O 527a_100000182051_100011935254 [0,1,0,0,0,0|2,0,0]=3 5651 B15R1.14566 O=C(NCCCO)c1c(cccc1Cl)Cl 240690a_100000182051_100000210656 [0,1,0,0,0,0|3,0,0]=4 5652 B15R1.14566 O=C(NCCCO)c1c(cccc1Cl)F 240690a_100000182051_100000210369 [0,1,0,0,0,0|3,0,0]=4 5653 B15R1.14566 O=C(NCCCO)c1c(cccc1Cl)F 527a_100000182051_100000210369 [0,1,0,0,0,0|3,0,0]=4 5654 B15R1.14566 O=C(NCCCO)c1c(cccc1Cl)O 240690a_100000182051_100000745519 [0,1,0,0,0,0|2,0,0]=3 5655 B15R1.14566 O=C(NCCCO)c1c(cccc1Cl)O 527a_100000182051_100000745519 [0,1,0,0,0,0|2,0,0]=3 5656 B15R1.14566 O=C(NCCCO)c1c(cccc1F)F 240690a_100000182051_100000210804 [0,1,0,0,0,0|3,0,0]=4 5657 B15R1.14566 O=C(NCCCO)c1c(cccc1F)F 527a_100000182051_100000210804 [0,1,0,0,0,0|3,0,0]=4 5658 B15R1.14566 O=C(NCCCO)c1c(cccc1F)O 527a_100000182051_100000763259 [0,1,0,0,0,0|2,0,0]=3 5659 B15R1.14566 O=C(NCCCO)c1c(cccc1I)Br 240690a_100000182051_100010232521 [0,1,0,0,0,0|3,0,0]=4 5660 B15R1.14566 O=C(NCCCO)c1c(cccc1I)Br 527a_100000182051_100010232521 [0,1,0,0,0,0|3,0,0]=4 5661 B15R1.14566 O=C(NCCCO)c1c(cccc1I)Cl 240690a_100000182051_100000702859 [0,1,0,0,0,0|3,0,0]=4 5662 B15R1.14566 O=C(NCCCO)c1c(cccc1I)Cl 527a_100000182051_100000702859 [0,1,0,0,0,0|3,0,0]=4 5663 B15R1.14566 O=C(NCCCO)c1c(cccc1I)F 240690a_100000182051_100000023732 [0,1,0,0,0,0|3,0,0]=4 5664 B15R1.14566 O=C(NCCCO)c1c(cccc1O)O 527a_100000182051_100000755285 [0,1,0,0,0,0|2,0,0]=3 5665 B15R1.14566 O=C(NNCCO)c1c(cccc1Br)O 22a_100000210001_100011935254 [0,1,0,0,0,0|3,0,0]=4 5666 B15R1.14566 O=C(NNCCO)c1c(cccc1Cl)O 22a_100000210001_100000745519 [0,1,0,0,0,0|3,0,0]=4 5667 B15R1.14566 O=C(NNCCO)c1c(cccc1F)O 22a_100000210001_100000763259 [0,1,0,0,0,0|3,0,0]=4 5668 B13R0.195 C=CC=CC(=O)CC(=O)CCCCC 1458a_100016291481_200012276598 [0,0,1,0,0,0|1,0,2]=4 5669 B13R0.195 C=CC=CC(=O)CC(=O)NCCCC 1458a_100016291481_100000182744 [0,0,1,0,0,0|1,0,2]=4 5670 B13R0.195 C=CC=CC(=O)CC(=O)OCCCC 1458a_100016291481_100000211628 [0,0,1,0,0,0|0,0,2]=3 5671 B13R0.195 C=CC=CC(=O)CC(=O)OCCOC 1458a_100016291481_200000040189 [0,0,1,0,0,0|1,0,2]=4 5672 B15R2.5 CCCC=Cc1coc2c1cccc2 271570a_100016258520_100009812202 [0,0,0,1,0,0|2,0,1]=4 5673 B15R2.5 CCCCNC1COc2c1cccc2 2230a_100000747519_100000210211 [0,0,0,1,0,0|2,0,1]=4 5674 B15R2.5 CCCCOC1CCc2c1cccc2 34a_100000212247_100000210210 [0,0,0,1,0,0|2,0,1]=4 5675 B15R2.5 CCCCOC1CCc2c1cccc2 7a_100000212247_100000210211 [0,0,0,1,0,0|2,0,1]=4 5676 B15R2.5 CCCCOc1csc2c1cccc2 34a_100000077758_100000210210 [0,0,0,1,0,0|1,1,0]=3 5677 B15R2.5 CCCCOc1csc2c1cccc2 7a_100000077758_100000210211 [0,0,0,1,0,0|1,1,0]=3 5678 B15R2.5 CCCCSc1coc2c1cccc2 62a_100000210211_100009812202 [0,0,0,1,0,0|1,1,0]=3 5679 B15R2.5 CCCCSc1coc2c1nccc2 62a_100000210211_100009889148 [0,0,0,1,0,0|2,1,0]=4 5680 B15R2.5 CCCCSc1csc2c1cccc2 62a_100000210211_100009813928 [0,0,0,1,0,0|1,2,0]=4 5681 B15R2.5 CCCCSc1n[nH]c2c1cccc2 62a_100000210211_100000050141 [0,0,0,1,0,0|2,1,0]=4 5682 B15R2.5 CCCCSc1noc2c1cccc2 62a_100000210211_200000703156 [0,0,0,1,0,0|1,1,0]=3 5683 B15R2.5 CCCCSc1noc2c1cccc2 62a_200000703156_100000210210 [0,0,0,1,0,0|1,1,0]=3 5684 B15R2.5 CCCNCc1coc2c1cccc2 207a_100020643023_100000688544 [0,0,0,1,0,0|3,0,0]=4 5685 B15R2.5 CCCNCc1coc2c1cccc2 270004a_100020643023_100000688544 [0,0,0,1,0,0|3,0,0]=4 5686 B15R2.5 CCCNN=C1COc2c1cccc2 4a_100000740057_100000185568 [0,0,0,1,0,0|3,0,0]=4 5687 B15R2.5 CCCOCc1noc2c1cccc2 34a_100000210258_100009813815 [0,0,0,1,0,0|3,0,0]=4 5688 B15R2.5 CCCSCc1noc2c1cccc2 62a_100000210303_100009813815 [0,0,0,1,0,0|3,0,0]=4 5689 B15R2.5 CCCSCc1noc2c1cccc2 62a_100009813815_100000210303 [0,0,0,1,0,0|3,0,0]=4 5690 B15R2.5 CCNCCc1coc2c1cccc2 2230a_100011934666_100000210202 [0,0,0,1,0,0|3,0,0]=4 5691 B15R2.5 CCNCCc1coc2c1cccc2 34a_100011934666_100000210202 [0,0,0,1,0,0|3,0,0]=4 5692 B15R2.5 CCOCSc1coc2c1cccc2 62a_100000739092_100009812202 [0,0,0,1,0,0|2,1,0]=4 5693 B15R2.5 CCOCSc1noc2c1cccc2 62a_100000739092_200000703156 [0,0,0,1,0,0|2,1,0]=4 5694 B15R2.5 CCOCSc1noc2c1cccc2 62a_200000703156_100000739092 [0,0,0,1,0,0|2,1,0]=4 5695 B15R2.5 COCCOc1csc2c1cccc2 34a_100000077758_100011201679 [0,0,0,1,0,0|2,1,0]=4 5696 B15R2.5 COCCOc1csc2c1cccc2 7a_100000077758_100000233755 [0,0,0,1,0,0|2,1,0]=4 5697 B15R2.5 COCCSc1coc2c1cccc2 62a_100000233755_100009812202 [0,0,0,1,0,0|2,1,0]=4 5698 B15R2.5 COCCSc1noc2c1cccc2 62a_100000233755_200000703156 [0,0,0,1,0,0|2,1,0]=4 5699 B15R2.5 COCCSc1noc2c1cccc2 62a_200000703156_100000233755 [0,0,0,1,0,0|2,1,0]=4 5700 B15R2.5 CSCCOc1csc2c1cccc2 34a_100000077758_100000212216 [0,0,0,1,0,0|2,1,0]=4 5701 B15R2.5 CSCCOc1csc2c1cccc2 7a_100000077758_100000212216 [0,0,0,1,0,0|2,1,0]=4 5702 B15R2.5 CSCCSc1coc2c1cccc2 62a_100000212216_100009812202 [0,0,0,1,0,0|2,1,0]=4 5703 B15R2.5 CSCCSc1noc2c1cccc2 62a_100000212216_200000703156 [0,0,0,1,0,0|2,1,0]=4 5704 B15R2.5 CSCCSc1noc2c1cccc2 62a_200000703156_100000751147 [0,0,0,1,0,0|2,1,0]=4 5705 B15R2.5 FCCCOc1csc2c1cccc2 34a_100000077758_100011934791 [0,0,0,1,0,0|2,1,0]=4 5706 B15R2.5 FCCCOc1csc2c1cccc2 7a_100000077758_100011934791 [0,0,0,1,0,0|2,1,0]=4 5707 B15R2.5 FCCCSc1coc2c1cccc2 62a_100011934791_100009812202 [0,0,0,1,0,0|2,1,0]=4 5708 B15R2.5 FCCCSc1noc2c1cccc2 62a_100011934791_200000703156 [0,0,0,1,0,0|2,1,0]=4 5709 B15R2.5 FCCCSc1noc2c1cccc2 62a_200000703156_100011934791 [0,0,0,1,0,0|2,1,0]=4 5710 B15R2.5 OCCCOc1csc2c1cccc2 34a_100000077758_100000230001 [0,0,0,1,0,0|2,1,0]=4 5711 B15R2.5 OCCCOc1csc2c1cccc2 7a_100000077758_100011215043 [0,0,0,1,0,0|2,1,0]=4 5712 B15R2.5 OCCCSc1coc2c1cccc2 62a_100011215043_100009812202 [0,0,0,1,0,0|2,1,0]=4 5713 B15R2.5 OCCCSc1noc2c1cccc2 62a_100011215043_200000703156 [0,0,0,1,0,0|2,1,0]=4 5714 B15R2.5 OCCCSc1noc2c1cccc2 62a_200000703156_100011215043 [0,0,0,1,0,0|2,1,0]=4 5715 B15R2.89 CCCCc1sc2ccccc2c1C 271570a_100020621405_200010198769 [0,0,0,1,0,0|2,1,0]=4 5716 B15R2.89 CCCSC1Cc2ccccc2C1=O 62a_100000210303_100011218503 [0,0,0,1,0,0|3,0,0]=4 5717 B15R2.89 CCCSC1Cc2ccccc2C1=O 62a_100011218503_100000210303 [0,0,0,1,0,0|3,0,0]=4 5718 B15R2.89 CCNCc1oc2ccccc2c1C 207a_100015525214_100000077534 [0,0,0,1,0,0|3,0,0]=4 5719 B15R2.89 CCNCc1oc2ccccc2c1C 2230a_100153394726_100000210202 [0,0,0,1,0,0|3,0,0]=4 5720 B15R2.89 CCNCc1oc2ccccc2c1C 270004a_100015525214_100000077534 [0,0,0,1,0,0|3,0,0]=4 5721 B15R2.89 CCNCc1oc2ccccc2c1C 34a_100153394726_100000210202 [0,0,0,1,0,0|3,0,0]=4 5722 B15R2.358 CN(c1ccccc1O)C2CCCC2 269982a_100000033821_100000179811 [0,0,0,1,0,0|3,0,0]=4 5723 B15R2.358 Cc1ccccc1C(=O)C2CCCC2 1458a_100000212026_100000179811 [0,0,0,1,0,0|2,0,0]=3 5724 B15R2.358 Cc1ccccc1C(=O)C2CCOC2 1458a_100000212026_100000690089 [0,0,0,1,0,0|3,0,0]=4 5725 B15R2.358 Cc1ccccc1C(=O)N2CCCC2 240690a_100000188435_100000212026 [0,0,0,1,0,0|2,0,0]=3 5726 B15R2.358 Cc1ccccc1C(=O)N2CCCC2 527a_100000188435_100000212026 [0,0,0,1,0,0|2,0,0]=3 5727 B15R2.358 Cc1ccccc1C(=O)N2CCSC2 11a_100011215254_100000212026 [0,0,0,1,0,0|3,0,0]=4 5728 B15R2.358 Cc1ccccc1C(=O)N2CCSC2 240690a_100011215254_100000212026 [0,0,0,1,0,0|3,0,0]=4 5729 B15R2.358 Cc1ccccc1C(=O)N2CCSC2 527a_100011215254_100000212026 [0,0,0,1,0,0|3,0,0]=4 5730 B15R2.358 O=C(c1ccccc1Br)C2CCCC2 1458a_100000188424_100000179811 [0,0,0,1,0,0|2,0,0]=3 5731 B15R2.358 O=C(c1ccccc1Br)C2CCOC2 1458a_100000188424_100000690089 [0,0,0,1,0,0|3,0,0]=4 5732 B15R2.358 O=C(c1ccccc1Br)N2CCCC2 240690a_100000188435_100000188424 [0,0,0,1,0,0|2,0,0]=3 5733 B15R2.358 O=C(c1ccccc1Br)N2CCCC2 527a_100000188435_100000188424 [0,0,0,1,0,0|2,0,0]=3 5734 B15R2.358 O=C(c1ccccc1Br)N2CCSC2 11a_100011215254_100000188424 [0,0,0,1,0,0|3,0,0]=4 5735 B15R2.358 O=C(c1ccccc1Br)N2CCSC2 240690a_100011215254_100000188424 [0,0,0,1,0,0|3,0,0]=4 5736 B15R2.358 O=C(c1ccccc1Br)N2CCSC2 527a_100011215254_100000188424 [0,0,0,1,0,0|3,0,0]=4 5737 B15R2.358 O=C(c1ccccc1Cl)C2CCCC2 1458a_100000185844_100000179811 [0,0,0,1,0,0|2,0,0]=3 5738 B15R2.358 O=C(c1ccccc1Cl)C2CCOC2 1458a_100000185844_100000690089 [0,0,0,1,0,0|3,0,0]=4 5739 B15R2.358 O=C(c1ccccc1Cl)N2CCCC2 240690a_100000188435_100000185844 [0,0,0,1,0,0|2,0,0]=3 5740 B15R2.358 O=C(c1ccccc1Cl)N2CCCC2 527a_100000188435_100000185844 [0,0,0,1,0,0|2,0,0]=3 5741 B15R2.358 O=C(c1ccccc1Cl)N2CCSC2 11a_100011215254_100000185844 [0,0,0,1,0,0|3,0,0]=4 5742 B15R2.358 O=C(c1ccccc1Cl)N2CCSC2 240690a_100011215254_100000185844 [0,0,0,1,0,0|3,0,0]=4 5743 B15R2.358 O=C(c1ccccc1Cl)N2CCSC2 527a_100011215254_100000185844 [0,0,0,1,0,0|3,0,0]=4 5744 B15R2.358 O=C(c1ccccc1F)C2CCCC2 1458a_100000188656_100000179811 [0,0,0,1,0,0|2,0,0]=3 5745 B15R2.358 O=C(c1ccccc1F)C2CCOC2 1458a_100000188656_100000690089 [0,0,0,1,0,0|3,0,0]=4 5746 B15R2.358 O=C(c1ccccc1F)N2CCCC2 240690a_100000188435_100000188656 [0,0,0,1,0,0|2,0,0]=3 5747 B15R2.358 O=C(c1ccccc1F)N2CCCC2 527a_100000188435_100000188656 [0,0,0,1,0,0|2,0,0]=3 5748 B15R2.358 O=C(c1ccccc1F)N2CCSC2 11a_100011215254_100000188656 [0,0,0,1,0,0|3,0,0]=4 5749 B15R2.358 O=C(c1ccccc1F)N2CCSC2 240690a_100011215254_100000188656 [0,0,0,1,0,0|3,0,0]=4 5750 B15R2.358 O=C(c1ccccc1F)N2CCSC2 527a_100011215254_100000188656 [0,0,0,1,0,0|3,0,0]=4 5751 B15R2.358 O=C(c1ccccc1I)C2CCCC2 1458a_100000187884_100000179811 [0,0,0,1,0,0|2,0,0]=3 5752 B15R2.358 O=C(c1ccccc1I)C2CCOC2 1458a_100000187884_100000690089 [0,0,0,1,0,0|3,0,0]=4 5753 B15R2.358 O=C(c1ccccc1I)N2CCCC2 240690a_100000188435_100000187884 [0,0,0,1,0,0|2,0,0]=3 5754 B15R2.358 O=C(c1ccccc1I)N2CCCC2 527a_100000188435_100000187884 [0,0,0,1,0,0|2,0,0]=3 5755 B15R2.358 O=C(c1ccccc1I)N2CCSC2 11a_100011215254_100000187884 [0,0,0,1,0,0|3,0,0]=4 5756 B15R2.358 O=C(c1ccccc1I)N2CCSC2 240690a_100011215254_100000187884 [0,0,0,1,0,0|3,0,0]=4 5757 B15R2.358 O=C(c1ccccc1I)N2CCSC2 527a_100011215254_100000187884 [0,0,0,1,0,0|3,0,0]=4 5758 B15R2.358 O=C(c1ccccc1O)C2CCCC2 1458a_100015234032_100000179811 [0,0,0,1,0,0|1,0,0]=2 5759 B15R2.358 O=C(c1ccccc1O)C2CCOC2 1458a_100015234032_100000690089 [0,0,0,1,0,0|2,0,0]=3 5760 B15R2.358 O=C(c1ccccc1O)N2CC=CC2 240690a_100015195280_100015234032 [0,0,0,1,0,0|1,0,2]=4 5761 B15R2.358 O=C(c1ccccc1O)N2CCCC2 240690a_100000188435_100015234032 [0,0,0,1,0,0|1,0,0]=2 5762 B15R2.358 O=C(c1ccccc1O)N2CCCC2 271570a_203496583355_200000153373 [0,0,0,1,0,0|1,0,0]=2 5763 B15R2.358 O=C(c1ccccc1O)N2CCSC2 240690a_100011215254_100015234032 [0,0,0,1,0,0|2,0,0]=3 5764 B15R2.358 O=C(c1ccccc1[O-])C2CCCC2 1458a_100009911694_100000179811 [0,0,0,1,0,0|1,0,1]=3 5765 B15R2.358 O=C(c1ccccc1[O-])C2CCOC2 1458a_100009911694_100000690089 [0,0,0,1,0,0|2,0,1]=4 5766 B15R2.358 O=C(c1ccccc1[O-])N2CCCC2 240690a_100000188435_100009911694 [0,0,0,1,0,0|1,0,1]=3 5767 B15R2.358 O=C(c1ccccc1[O-])N2CCCC2 527a_100000188435_100009911694 [0,0,0,1,0,0|1,0,1]=3 5768 B15R2.358 O=C(c1ccccc1[O-])N2CCSC2 240690a_100011215254_100009911694 [0,0,0,1,0,0|2,0,1]=4 5769 B15R2.358 O=C(c1ccccc1[O-])N2CCSC2 527a_100011215254_100009911694 [0,0,0,1,0,0|2,0,1]=4 5770 B15R2.358 O=C(c1cccnc1O)N2CCCC2 271570a_203496583355_100000158159 [0,0,0,1,0,0|2,0,0]=3 5771 B15R2.2243 CCc1noc(n1)c2ccccc2O 270196a_200000212204_100015234032 [0,0,0,1,0,0|2,0,1]=4 5772 B15R2.7431 CC1CCN1C(=O)c2ccccc2Br 11a_100000755817_100000188424 [0,0,0,1,0,0|2,0,0]=3 5773 B15R2.7431 CC1CCN1C(=O)c2ccccc2Br 240690a_100000755817_100000188424 [0,0,0,1,0,0|2,0,0]=3 5774 B15R2.7431 CC1CCN1C(=O)c2ccccc2Br 527a_100000755817_100000188424 [0,0,0,1,0,0|2,0,0]=3 5775 B15R2.7431 CC1CCN1C(=O)c2ccccc2Cl 11a_100000755817_100000185844 [0,0,0,1,0,0|2,0,0]=3 5776 B15R2.7431 CC1CCN1C(=O)c2ccccc2Cl 240690a_100000755817_100000185844 [0,0,0,1,0,0|2,0,0]=3 5777 B15R2.7431 CC1CCN1C(=O)c2ccccc2Cl 527a_100000755817_100000185844 [0,0,0,1,0,0|2,0,0]=3 5778 B15R2.7431 CC1CCN1C(=O)c2ccccc2F 11a_100000755817_100000188656 [0,0,0,1,0,0|2,0,0]=3 5779 B15R2.7431 CC1CCN1C(=O)c2ccccc2F 240690a_100000755817_100000188656 [0,0,0,1,0,0|2,0,0]=3 5780 B15R2.7431 CC1CCN1C(=O)c2ccccc2F 527a_100000755817_100000188656 [0,0,0,1,0,0|2,0,0]=3 5781 B15R2.7431 CC1CCN1C(=O)c2ccccc2I 11a_100000755817_100000187884 [0,0,0,1,0,0|2,0,0]=3 5782 B15R2.7431 CC1CCN1C(=O)c2ccccc2I 240690a_100000755817_100000187884 [0,0,0,1,0,0|2,0,0]=3 5783 B15R2.7431 CC1CCN1C(=O)c2ccccc2I 527a_100000755817_100000187884 [0,0,0,1,0,0|2,0,0]=3 5784 B15R2.7431 CC1CCN1C(=O)c2ccccc2O 240690a_100000755817_100015234032 [0,0,0,1,0,0|1,0,0]=2 5785 B15R2.7431 CC1CCN1C(=O)c2ccccc2[O-] 240690a_100000755817_100009911694 [0,0,0,1,0,0|1,0,1]=3 5786 B15R2.7431 CC1CCN1C(=O)c2ccccc2[O-] 527a_100000755817_100009911694 [0,0,0,1,0,0|1,0,1]=3 5787 B15R2.7431 Cc1ccccc1C(=O)N2CCC2C 11a_100000755817_100000212026 [0,0,0,1,0,0|2,0,0]=3 5788 B15R2.7431 Cc1ccccc1C(=O)N2CCC2C 240690a_100000755817_100000212026 [0,0,0,1,0,0|2,0,0]=3 5789 B15R2.7431 Cc1ccccc1C(=O)N2CCC2C 527a_100000755817_100000212026 [0,0,0,1,0,0|2,0,0]=3 5790 B15R2.7431 O=C1CCC1C(=O)c2ccccc2O 1458a_100015234032_100009892977 [0,0,0,1,0,0|2,0,1]=4 5791 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212026 [0,0,0,1,0,0|3,0,0]=4 5792 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212026 [0,0,0,1,0,0|3,0,0]=4 5793 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000212026 [0,0,0,1,0,0|3,0,0]=4 5794 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000212026 [0,0,0,1,0,0|3,0,0]=4 5795 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212026 [0,0,0,1,0,0|3,0,0]=4 5796 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000212026 [0,0,0,1,0,0|3,0,0]=4 5797 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Br 240690a_100015190264_100000188424 [0,0,0,1,0,0|3,0,0]=4 5798 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Br 527a_100015190264_100000188424 [0,0,0,1,0,0|3,0,0]=4 5799 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Cl 240690a_100015190264_100000185844 [0,0,0,1,0,0|3,0,0]=4 5800 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2Cl 527a_100015190264_100000185844 [0,0,0,1,0,0|3,0,0]=4 5801 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2F 240690a_100015190264_100000188656 [0,0,0,1,0,0|3,0,0]=4 5802 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2F 527a_100015190264_100000188656 [0,0,0,1,0,0|3,0,0]=4 5803 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2I 240690a_100015190264_100000187884 [0,0,0,1,0,0|3,0,0]=4 5804 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2I 527a_100015190264_100000187884 [0,0,0,1,0,0|3,0,0]=4 5805 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2O 240690a_100015190264_100015234032 [0,0,0,1,0,0|2,0,0]=3 5806 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2[O-] 240690a_100015190264_100009911694 [0,0,0,1,0,0|2,0,1]=4 5807 B15R2.7464 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2[O-] 527a_100015190264_100009911694 [0,0,0,1,0,0|2,0,1]=4 5808 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 11a_100025746932_100000188424 [0,0,0,1,0,0|3,0,0]=4 5809 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 1626a_100025746932_100000188424 [0,0,0,1,0,0|3,0,0]=4 5810 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 240690a_100025746932_100000188424 [0,0,0,1,0,0|3,0,0]=4 5811 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Br 527a_100025746932_100000188424 [0,0,0,1,0,0|3,0,0]=4 5812 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 11a_100025746932_100000185844 [0,0,0,1,0,0|3,0,0]=4 5813 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 1626a_100025746932_100000185844 [0,0,0,1,0,0|3,0,0]=4 5814 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 240690a_100025746932_100000185844 [0,0,0,1,0,0|3,0,0]=4 5815 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2Cl 527a_100025746932_100000185844 [0,0,0,1,0,0|3,0,0]=4 5816 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 11a_100025746932_100000188656 [0,0,0,1,0,0|3,0,0]=4 5817 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 1626a_100025746932_100000188656 [0,0,0,1,0,0|3,0,0]=4 5818 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 240690a_100025746932_100000188656 [0,0,0,1,0,0|3,0,0]=4 5819 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2F 527a_100025746932_100000188656 [0,0,0,1,0,0|3,0,0]=4 5820 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 11a_100025746932_100000187884 [0,0,0,1,0,0|3,0,0]=4 5821 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 1626a_100025746932_100000187884 [0,0,0,1,0,0|3,0,0]=4 5822 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 240690a_100025746932_100000187884 [0,0,0,1,0,0|3,0,0]=4 5823 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2I 527a_100025746932_100000187884 [0,0,0,1,0,0|3,0,0]=4 5824 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2O 240690a_100025746932_100015234032 [0,0,0,1,0,0|2,0,0]=3 5825 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2[O-] 1626a_100025746932_100009911694 [0,0,0,1,0,0|2,0,1]=4 5826 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2[O-] 240690a_100025746932_100009911694 [0,0,0,1,0,0|2,0,1]=4 5827 B15R2.7464 O=C(N[C@@H]1C[C@H]1F)c2ccccc2[O-] 527a_100025746932_100009911694 [0,0,0,1,0,0|2,0,1]=4 5828 B15R2.8789 Brc1ccccc1C2=CCCCCC2 271570a_200009888920_100000695589 [0,0,0,1,0,0|3,0,0]=4 5829 B15R2.8789 Cc1ccccc1C2=CCCCCC2 271570a_200009888920_100000210755 [0,0,0,1,0,0|3,0,0]=4 5830 B15R2.8789 Clc1ccccc1C2=CCCCCC2 271570a_200009888920_100000764095 [0,0,0,1,0,0|3,0,0]=4 5831 B15R2.8789 Fc1ccccc1C2=CCCCCC2 271570a_200009888920_100011215700 [0,0,0,1,0,0|3,0,0]=4 5832 B15R2.8789 Nc1ccccc1C2=CCCCCC2 271570a_200009888920_100000210017 [0,0,0,1,0,0|3,0,0]=4 5833 B15R2.8789 Oc1ccccc1C2=CCCCCC2 271570a_200009888920_100000739446 [0,0,0,1,0,0|2,0,0]=3 5834 B15R2.8789 Oc1cccnc1C2=CCCCCC2 271570a_200009888920_100000034122 [0,0,0,1,0,0|3,0,0]=4 5835 B15R2.8789 Oc1cnccc1C2=CCCCCC2 271570a_200009888920_100009817591 [0,0,0,1,0,0|3,0,0]=4 5836 B15R2.8805 CC(=NNC1CC1)c2ccccc2O 4a_100000701032_100000188907 [0,0,0,1,0,0|3,0,0]=4 5837 B15R2.8805 CC(OCC1CC1)c2ccccc2Br 34a_100000702211_100000742324 [0,0,0,1,0,0|2,0,1]=4 5838 B15R2.8805 CC(OCC1CC1)c2ccccc2Br 7a_100000702211_100000742324 [0,0,0,1,0,0|2,0,1]=4 5839 B15R2.8805 CC(OCC1CC1)c2ccccc2Cl 34a_100000740796_100000742324 [0,0,0,1,0,0|2,0,1]=4 5840 B15R2.8805 CC(OCC1CC1)c2ccccc2Cl 7a_100000740796_100000742324 [0,0,0,1,0,0|2,0,1]=4 5841 B15R2.8805 CC(OCC1CC1)c2ccccc2F 34a_100000211283_200000741388 [0,0,0,1,0,0|2,0,1]=4 5842 B15R2.8805 CC(OCC1CC1)c2ccccc2F 34a_100000697922_100000742324 [0,0,0,1,0,0|2,0,1]=4 5843 B15R2.8805 CC(OCC1CC1)c2ccccc2F 7a_100000697922_100000742324 [0,0,0,1,0,0|2,0,1]=4 5844 B15R2.8805 CC(OCC1CC1)c2ccccc2N 7a_100011405641_100000742324 [0,0,0,1,0,0|2,0,1]=4 5845 B15R2.8805 CN(CCC1CC1)c2ccccc2O 269982a_100000033821_100000694398 [0,0,0,1,0,0|3,0,0]=4 5846 B15R2.8805 C[C@@H](NCC1CC1)c2ccccc2O 2230a_100025703389_100000742324 [0,0,0,1,0,0|2,0,1]=4 5847 B15R2.8805 C[C@@H](NCC1CC1)c2ccccc2O 269862a_100025703389_100000741477 [0,0,0,1,0,0|2,0,1]=4 5848 B15R2.8805 Cc1ccccc1C(=O)CCC2CC2 1458a_100000212026_100000694398 [0,0,0,1,0,0|2,0,0]=3 5849 B15R2.8805 Cc1ccccc1C(=O)CCC2CO2 1458a_100000212026_100000732470 [0,0,0,1,0,0|3,0,0]=4 5850 B15R2.8805 Cc1ccccc1C(=O)CNC2CC2 34a_100000212008_100000741374 [0,0,0,1,0,0|3,0,0]=4 5851 B15R2.8805 Cc1ccccc1C(=O)CSC2CC2 62a_100000741374_100000211595 [0,0,0,1,0,0|3,0,0]=4 5852 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000212026 [0,0,0,1,0,0|2,0,0]=3 5853 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000212026 [0,0,0,1,0,0|2,0,0]=3 5854 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000212026 [0,0,0,1,0,0|2,0,0]=3 5855 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000212026 [0,0,0,1,0,0|2,0,0]=3 5856 B15R2.8805 Cc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000212026 [0,0,0,1,0,0|3,0,0]=4 5857 B15R2.8805 Cc1ccccc1C(C)OCC2CC2 34a_100000742021_100000742324 [0,0,0,1,0,0|2,0,1]=4 5858 B15R2.8805 Cc1ccccc1C(C)OCC2CC2 7a_100000742021_100000742324 [0,0,0,1,0,0|2,0,1]=4 5859 B15R2.8805 O=C(CCC1CC1)c2ccccc2Br 1458a_100000188424_100000694398 [0,0,0,1,0,0|2,0,0]=3 5860 B15R2.8805 O=C(CCC1CC1)c2ccccc2Cl 1458a_100000185844_100000694398 [0,0,0,1,0,0|2,0,0]=3 5861 B15R2.8805 O=C(CCC1CC1)c2ccccc2F 1458a_100000188656_100000694398 [0,0,0,1,0,0|2,0,0]=3 5862 B15R2.8805 O=C(CCC1CC1)c2ccccc2I 1458a_100000187884_100000694398 [0,0,0,1,0,0|2,0,0]=3 5863 B15R2.8805 O=C(CCC1CC1)c2ccccc2O 1458a_100015234032_100000694398 [0,0,0,1,0,0|1,0,0]=2 5864 B15R2.8805 O=C(CCC1CC1)c2ccccc2[O-] 1458a_100009911694_100000694398 [0,0,0,1,0,0|1,0,1]=3 5865 B15R2.8805 O=C(CCC1CO1)c2ccccc2Br 1458a_100000188424_100000732470 [0,0,0,1,0,0|3,0,0]=4 5866 B15R2.8805 O=C(CCC1CO1)c2ccccc2Cl 1458a_100000185844_100000732470 [0,0,0,1,0,0|3,0,0]=4 5867 B15R2.8805 O=C(CCC1CO1)c2ccccc2F 1458a_100000188656_100000732470 [0,0,0,1,0,0|3,0,0]=4 5868 B15R2.8805 O=C(CCC1CO1)c2ccccc2I 1458a_100000187884_100000732470 [0,0,0,1,0,0|3,0,0]=4 5869 B15R2.8805 O=C(CCC1CO1)c2ccccc2O 1458a_100015234032_100000732470 [0,0,0,1,0,0|2,0,0]=3 5870 B15R2.8805 O=C(CCC1CO1)c2ccccc2[O-] 1458a_100009911694_100000732470 [0,0,0,1,0,0|2,0,1]=4 5871 B15R2.8805 O=C(CNC1CC1)c2ccccc2Br 34a_100000212008_100000199116 [0,0,0,1,0,0|3,0,0]=4 5872 B15R2.8805 O=C(CNC1CC1)c2ccccc2Cl 34a_100000212008_100000211432 [0,0,0,1,0,0|3,0,0]=4 5873 B15R2.8805 O=C(CNC1CC1)c2ccccc2F 34a_100000212008_100000204681 [0,0,0,1,0,0|3,0,0]=4 5874 B15R2.8805 O=C(CSC1CC1)c2ccccc2Br 62a_100000199116_100000211595 [0,0,0,1,0,0|3,0,0]=4 5875 B15R2.8805 O=C(CSC1CC1)c2ccccc2Cl 62a_100000211432_100000211595 [0,0,0,1,0,0|3,0,0]=4 5876 B15R2.8805 O=C(CSC1CC1)c2ccccc2F 62a_100000204681_100000211595 [0,0,0,1,0,0|3,0,0]=4 5877 B15R2.8805 O=C(CSC1CC1)c2ccccc2O 62a_100000188908_100000211595 [0,0,0,1,0,0|2,0,0]=3 5878 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 11a_100000735609_100000188424 [0,0,0,1,0,0|2,0,0]=3 5879 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 1626a_100000735609_100000188424 [0,0,0,1,0,0|2,0,0]=3 5880 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 240690a_100000735609_100000188424 [0,0,0,1,0,0|2,0,0]=3 5881 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 527a_100000735609_100000188424 [0,0,0,1,0,0|2,0,0]=3 5882 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 11a_100000735609_100000185844 [0,0,0,1,0,0|2,0,0]=3 5883 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 1626a_100000735609_100000185844 [0,0,0,1,0,0|2,0,0]=3 5884 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 240690a_100000735609_100000185844 [0,0,0,1,0,0|2,0,0]=3 5885 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 527a_100000735609_100000185844 [0,0,0,1,0,0|2,0,0]=3 5886 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 11a_100000735609_100000188656 [0,0,0,1,0,0|2,0,0]=3 5887 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 1626a_100000735609_100000188656 [0,0,0,1,0,0|2,0,0]=3 5888 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 240690a_100000735609_100000188656 [0,0,0,1,0,0|2,0,0]=3 5889 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 527a_100000735609_100000188656 [0,0,0,1,0,0|2,0,0]=3 5890 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 11a_100000735609_100000187884 [0,0,0,1,0,0|2,0,0]=3 5891 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 1626a_100000735609_100000187884 [0,0,0,1,0,0|2,0,0]=3 5892 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 240690a_100000735609_100000187884 [0,0,0,1,0,0|2,0,0]=3 5893 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 527a_100000735609_100000187884 [0,0,0,1,0,0|2,0,0]=3 5894 B15R2.8805 O=C(NCC1CC1)c2ccccc2O 240690a_100000735609_100015234032 [0,0,0,1,0,0|1,0,0]=2 5895 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 1626a_100000735609_100009911694 [0,0,0,1,0,0|1,0,1]=3 5896 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 240690a_100000735609_100009911694 [0,0,0,1,0,0|1,0,1]=3 5897 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 527a_100000735609_100009911694 [0,0,0,1,0,0|1,0,1]=3 5898 B15R2.8805 O=C(NNC1CC1)c2ccccc2Br 22a_100000701032_100000188424 [0,0,0,1,0,0|3,0,0]=4 5899 B15R2.8805 O=C(NNC1CC1)c2ccccc2Cl 22a_100000701032_100000185844 [0,0,0,1,0,0|3,0,0]=4 5900 B15R2.8805 O=C(NNC1CC1)c2ccccc2F 22a_100000701032_100000188656 [0,0,0,1,0,0|3,0,0]=4 5901 B15R2.8805 O=C(NNC1CC1)c2ccccc2I 22a_100000701032_100000187884 [0,0,0,1,0,0|3,0,0]=4 5902 B15R2.8805 O=C(NNC1CC1)c2ccccc2O 22a_100000701032_100015234032 [0,0,0,1,0,0|2,0,0]=3 5903 B15R2.8805 O=C(NNC1CC1)c2ccccc2[O-] 22a_100000701032_100009911694 [0,0,0,1,0,0|2,0,1]=4 5904 B15R2.43577 CC(OC1CCC1)c2ccccc2Br 34a_100000702211_100000749161 [0,0,0,1,0,0|2,0,1]=4 5905 B15R2.43577 CC(OC1CCC1)c2ccccc2Cl 34a_100000740796_100000749161 [0,0,0,1,0,0|2,0,1]=4 5906 B15R2.43577 CC(OC1CCC1)c2ccccc2F 34a_100000697922_100000749161 [0,0,0,1,0,0|2,0,1]=4 5907 B15R2.43577 CC(OC1CCC1)c2ccccc2F 34a_100000748187_200000741388 [0,0,0,1,0,0|2,0,1]=4 5908 B15R2.43577 CN(CC1CCC1)c2ccccc2O 269982a_100000033821_100000763275 [0,0,0,1,0,0|3,0,0]=4 5909 B15R2.43577 C[C@@H](NC1CCC1)c2ccccc2O 270004a_100025703389_100000241760 [0,0,0,1,0,0|2,0,1]=4 5910 B15R2.43577 Cc1ccccc1C(=O)CC2CCC2 1458a_100000212026_100000763275 [0,0,0,1,0,0|2,0,0]=3 5911 B15R2.43577 Cc1ccccc1C(=O)CC2CCO2 1458a_100000212026_100000103362 [0,0,0,1,0,0|3,0,0]=4 5912 B15R2.43577 Cc1ccccc1C(=O)CC2COC2 1458a_100000212026_100010264016 [0,0,0,1,0,0|3,0,0]=4 5913 B15R2.43577 Cc1ccccc1C(=O)CN2CCC2 269982a_100000754969_100000741374 [0,0,0,1,0,0|3,0,0]=4 5914 B15R2.43577 Cc1ccccc1C(=O)NC2CCC2 11a_100000749019_100000212026 [0,0,0,1,0,0|2,0,0]=3 5915 B15R2.43577 Cc1ccccc1C(=O)NC2CCC2 1626a_100000749019_100000212026 [0,0,0,1,0,0|2,0,0]=3 5916 B15R2.43577 Cc1ccccc1C(=O)NC2CCC2 240690a_100000749019_100000212026 [0,0,0,1,0,0|2,0,0]=3 5917 B15R2.43577 Cc1ccccc1C(=O)NC2CCC2 527a_100000749019_100000212026 [0,0,0,1,0,0|2,0,0]=3 5918 B15R2.43577 Cc1ccccc1C(=O)NC2COC2 11a_100016991112_100000212026 [0,0,0,1,0,0|3,0,0]=4 5919 B15R2.43577 Cc1ccccc1C(=O)NC2COC2 1626a_100016991112_100000212026 [0,0,0,1,0,0|3,0,0]=4 5920 B15R2.43577 Cc1ccccc1C(=O)NC2COC2 240690a_100016991112_100000212026 [0,0,0,1,0,0|3,0,0]=4 5921 B15R2.43577 Cc1ccccc1C(=O)NC2COC2 527a_100016991112_100000212026 [0,0,0,1,0,0|3,0,0]=4 5922 B15R2.43577 Cc1ccccc1C(=O)NC2CSC2 11a_100016994217_100000212026 [0,0,0,1,0,0|3,0,0]=4 5923 B15R2.43577 Cc1ccccc1C(=O)NC2CSC2 1626a_100016994217_100000212026 [0,0,0,1,0,0|3,0,0]=4 5924 B15R2.43577 Cc1ccccc1C(=O)NC2CSC2 240690a_100016994217_100000212026 [0,0,0,1,0,0|3,0,0]=4 5925 B15R2.43577 Cc1ccccc1C(=O)NC2CSC2 527a_100016994217_100000212026 [0,0,0,1,0,0|3,0,0]=4 5926 B15R2.43577 Cc1ccccc1C(C)OC2CCC2 34a_100000742021_100000749161 [0,0,0,1,0,0|2,0,1]=4 5927 B15R2.43577 O=C(CC1CCC1)c2ccccc2Br 1458a_100000188424_100000763275 [0,0,0,1,0,0|2,0,0]=3 5928 B15R2.43577 O=C(CC1CCC1)c2ccccc2Cl 1458a_100000185844_100000763275 [0,0,0,1,0,0|2,0,0]=3 5929 B15R2.43577 O=C(CC1CCC1)c2ccccc2F 1458a_100000188656_100000763275 [0,0,0,1,0,0|2,0,0]=3 5930 B15R2.43577 O=C(CC1CCC1)c2ccccc2I 1458a_100000187884_100000763275 [0,0,0,1,0,0|2,0,0]=3 5931 B15R2.43577 O=C(CC1CCC1)c2ccccc2O 1458a_100015234032_100000763275 [0,0,0,1,0,0|1,0,0]=2 5932 B15R2.43577 O=C(CC1CCC1)c2ccccc2[O-] 1458a_100009911694_100000763275 [0,0,0,1,0,0|1,0,1]=3 5933 B15R2.43577 O=C(CC1CCO1)c2ccccc2Br 1458a_100000188424_100000103362 [0,0,0,1,0,0|3,0,0]=4 5934 B15R2.43577 O=C(CC1CCO1)c2ccccc2Cl 1458a_100000185844_100000103362 [0,0,0,1,0,0|3,0,0]=4 5935 B15R2.43577 O=C(CC1CCO1)c2ccccc2F 1458a_100000188656_100000103362 [0,0,0,1,0,0|3,0,0]=4 5936 B15R2.43577 O=C(CC1CCO1)c2ccccc2I 1458a_100000187884_100000103362 [0,0,0,1,0,0|3,0,0]=4 5937 B15R2.43577 O=C(CC1CCO1)c2ccccc2O 1458a_100015234032_100000103362 [0,0,0,1,0,0|2,0,0]=3 5938 B15R2.43577 O=C(CC1CCO1)c2ccccc2[O-] 1458a_100009911694_100000103362 [0,0,0,1,0,0|2,0,1]=4 5939 B15R2.43577 O=C(CC1COC1)c2ccccc2Br 1458a_100000188424_100010264016 [0,0,0,1,0,0|3,0,0]=4 5940 B15R2.43577 O=C(CC1COC1)c2ccccc2Cl 1458a_100000185844_100010264016 [0,0,0,1,0,0|3,0,0]=4 5941 B15R2.43577 O=C(CC1COC1)c2ccccc2F 1458a_100000188656_100010264016 [0,0,0,1,0,0|3,0,0]=4 5942 B15R2.43577 O=C(CC1COC1)c2ccccc2I 1458a_100000187884_100010264016 [0,0,0,1,0,0|3,0,0]=4 5943 B15R2.43577 O=C(CC1COC1)c2ccccc2O 1458a_100015234032_100010264016 [0,0,0,1,0,0|2,0,0]=3 5944 B15R2.43577 O=C(CC1COC1)c2ccccc2[O-] 1458a_100009911694_100010264016 [0,0,0,1,0,0|2,0,1]=4 5945 B15R2.43577 O=C(CN1CCC1)c2ccccc2Br 269982a_100000754969_100000199116 [0,0,0,1,0,0|3,0,0]=4 5946 B15R2.43577 O=C(CN1CCC1)c2ccccc2Cl 269982a_100000754969_100000211432 [0,0,0,1,0,0|3,0,0]=4 5947 B15R2.43577 O=C(CN1CCC1)c2ccccc2F 269982a_100000754969_100000204681 [0,0,0,1,0,0|3,0,0]=4 5948 B15R2.43577 O=C(CN1CCC1)c2ccccc2O 269982a_100000754969_100000188908 [0,0,0,1,0,0|2,0,0]=3 5949 B15R2.43577 O=C(NC1CCC1)c2ccccc2Br 11a_100000749019_100000188424 [0,0,0,1,0,0|2,0,0]=3 5950 B15R2.43577 O=C(NC1CCC1)c2ccccc2Br 1626a_100000749019_100000188424 [0,0,0,1,0,0|2,0,0]=3 5951 B15R2.43577 O=C(NC1CCC1)c2ccccc2Br 240690a_100000749019_100000188424 [0,0,0,1,0,0|2,0,0]=3 5952 B15R2.43577 O=C(NC1CCC1)c2ccccc2Br 527a_100000749019_100000188424 [0,0,0,1,0,0|2,0,0]=3 5953 B15R2.43577 O=C(NC1CCC1)c2ccccc2Cl 11a_100000749019_100000185844 [0,0,0,1,0,0|2,0,0]=3 5954 B15R2.43577 O=C(NC1CCC1)c2ccccc2Cl 1626a_100000749019_100000185844 [0,0,0,1,0,0|2,0,0]=3 5955 B15R2.43577 O=C(NC1CCC1)c2ccccc2Cl 240690a_100000749019_100000185844 [0,0,0,1,0,0|2,0,0]=3 5956 B15R2.43577 O=C(NC1CCC1)c2ccccc2Cl 527a_100000749019_100000185844 [0,0,0,1,0,0|2,0,0]=3 5957 B15R2.43577 O=C(NC1CCC1)c2ccccc2F 11a_100000749019_100000188656 [0,0,0,1,0,0|2,0,0]=3 5958 B15R2.43577 O=C(NC1CCC1)c2ccccc2F 1626a_100000749019_100000188656 [0,0,0,1,0,0|2,0,0]=3 5959 B15R2.43577 O=C(NC1CCC1)c2ccccc2F 240690a_100000749019_100000188656 [0,0,0,1,0,0|2,0,0]=3 5960 B15R2.43577 O=C(NC1CCC1)c2ccccc2F 527a_100000749019_100000188656 [0,0,0,1,0,0|2,0,0]=3 5961 B15R2.43577 O=C(NC1CCC1)c2ccccc2I 11a_100000749019_100000187884 [0,0,0,1,0,0|2,0,0]=3 5962 B15R2.43577 O=C(NC1CCC1)c2ccccc2I 1626a_100000749019_100000187884 [0,0,0,1,0,0|2,0,0]=3 5963 B15R2.43577 O=C(NC1CCC1)c2ccccc2I 240690a_100000749019_100000187884 [0,0,0,1,0,0|2,0,0]=3 5964 B15R2.43577 O=C(NC1CCC1)c2ccccc2I 527a_100000749019_100000187884 [0,0,0,1,0,0|2,0,0]=3 5965 B15R2.43577 O=C(NC1CCC1)c2ccccc2O 240690a_100000749019_100015234032 [0,0,0,1,0,0|1,0,0]=2 5966 B15R2.43577 O=C(NC1CCC1)c2ccccc2[O-] 1626a_100000749019_100009911694 [0,0,0,1,0,0|1,0,1]=3 5967 B15R2.43577 O=C(NC1CCC1)c2ccccc2[O-] 240690a_100000749019_100009911694 [0,0,0,1,0,0|1,0,1]=3 5968 B15R2.43577 O=C(NC1CCC1)c2ccccc2[O-] 527a_100000749019_100009911694 [0,0,0,1,0,0|1,0,1]=3 5969 B15R2.43577 O=C(NC1COC1)c2ccccc2Br 11a_100016991112_100000188424 [0,0,0,1,0,0|3,0,0]=4 5970 B15R2.43577 O=C(NC1COC1)c2ccccc2Br 1626a_100016991112_100000188424 [0,0,0,1,0,0|3,0,0]=4 5971 B15R2.43577 O=C(NC1COC1)c2ccccc2Br 240690a_100016991112_100000188424 [0,0,0,1,0,0|3,0,0]=4 5972 B15R2.43577 O=C(NC1COC1)c2ccccc2Br 527a_100016991112_100000188424 [0,0,0,1,0,0|3,0,0]=4 5973 B15R2.43577 O=C(NC1COC1)c2ccccc2Cl 11a_100016991112_100000185844 [0,0,0,1,0,0|3,0,0]=4 5974 B15R2.43577 O=C(NC1COC1)c2ccccc2Cl 1626a_100016991112_100000185844 [0,0,0,1,0,0|3,0,0]=4 5975 B15R2.43577 O=C(NC1COC1)c2ccccc2Cl 240690a_100016991112_100000185844 [0,0,0,1,0,0|3,0,0]=4 5976 B15R2.43577 O=C(NC1COC1)c2ccccc2Cl 527a_100016991112_100000185844 [0,0,0,1,0,0|3,0,0]=4 5977 B15R2.43577 O=C(NC1COC1)c2ccccc2F 11a_100016991112_100000188656 [0,0,0,1,0,0|3,0,0]=4 5978 B15R2.43577 O=C(NC1COC1)c2ccccc2F 1626a_100016991112_100000188656 [0,0,0,1,0,0|3,0,0]=4 5979 B15R2.43577 O=C(NC1COC1)c2ccccc2F 240690a_100016991112_100000188656 [0,0,0,1,0,0|3,0,0]=4 5980 B15R2.43577 O=C(NC1COC1)c2ccccc2F 527a_100016991112_100000188656 [0,0,0,1,0,0|3,0,0]=4 5981 B15R2.43577 O=C(NC1COC1)c2ccccc2I 11a_100016991112_100000187884 [0,0,0,1,0,0|3,0,0]=4 5982 B15R2.43577 O=C(NC1COC1)c2ccccc2I 1626a_100016991112_100000187884 [0,0,0,1,0,0|3,0,0]=4 5983 B15R2.43577 O=C(NC1COC1)c2ccccc2I 240690a_100016991112_100000187884 [0,0,0,1,0,0|3,0,0]=4 5984 B15R2.43577 O=C(NC1COC1)c2ccccc2I 527a_100016991112_100000187884 [0,0,0,1,0,0|3,0,0]=4 5985 B15R2.43577 O=C(NC1COC1)c2ccccc2O 240690a_100016991112_100015234032 [0,0,0,1,0,0|2,0,0]=3 5986 B15R2.43577 O=C(NC1COC1)c2ccccc2[O-] 1626a_100016991112_100009911694 [0,0,0,1,0,0|2,0,1]=4 5987 B15R2.43577 O=C(NC1COC1)c2ccccc2[O-] 240690a_100016991112_100009911694 [0,0,0,1,0,0|2,0,1]=4 5988 B15R2.43577 O=C(NC1COC1)c2ccccc2[O-] 527a_100016991112_100009911694 [0,0,0,1,0,0|2,0,1]=4 5989 B15R2.43577 O=C(NC1CSC1)c2ccccc2Br 11a_100016994217_100000188424 [0,0,0,1,0,0|3,0,0]=4 5990 B15R2.43577 O=C(NC1CSC1)c2ccccc2Br 1626a_100016994217_100000188424 [0,0,0,1,0,0|3,0,0]=4 5991 B15R2.43577 O=C(NC1CSC1)c2ccccc2Br 240690a_100016994217_100000188424 [0,0,0,1,0,0|3,0,0]=4 5992 B15R2.43577 O=C(NC1CSC1)c2ccccc2Br 527a_100016994217_100000188424 [0,0,0,1,0,0|3,0,0]=4 5993 B15R2.43577 O=C(NC1CSC1)c2ccccc2Cl 11a_100016994217_100000185844 [0,0,0,1,0,0|3,0,0]=4 5994 B15R2.43577 O=C(NC1CSC1)c2ccccc2Cl 1626a_100016994217_100000185844 [0,0,0,1,0,0|3,0,0]=4 5995 B15R2.43577 O=C(NC1CSC1)c2ccccc2Cl 240690a_100016994217_100000185844 [0,0,0,1,0,0|3,0,0]=4 5996 B15R2.43577 O=C(NC1CSC1)c2ccccc2Cl 527a_100016994217_100000185844 [0,0,0,1,0,0|3,0,0]=4 5997 B15R2.43577 O=C(NC1CSC1)c2ccccc2F 11a_100016994217_100000188656 [0,0,0,1,0,0|3,0,0]=4 5998 B15R2.43577 O=C(NC1CSC1)c2ccccc2F 1626a_100016994217_100000188656 [0,0,0,1,0,0|3,0,0]=4 5999 B15R2.43577 O=C(NC1CSC1)c2ccccc2F 240690a_100016994217_100000188656 [0,0,0,1,0,0|3,0,0]=4 6000 B15R2.43577 O=C(NC1CSC1)c2ccccc2F 527a_100016994217_100000188656 [0,0,0,1,0,0|3,0,0]=4 6001 B15R2.43577 O=C(NC1CSC1)c2ccccc2I 11a_100016994217_100000187884 [0,0,0,1,0,0|3,0,0]=4 6002 B15R2.43577 O=C(NC1CSC1)c2ccccc2I 1626a_100016994217_100000187884 [0,0,0,1,0,0|3,0,0]=4 6003 B15R2.43577 O=C(NC1CSC1)c2ccccc2I 240690a_100016994217_100000187884 [0,0,0,1,0,0|3,0,0]=4 6004 B15R2.43577 O=C(NC1CSC1)c2ccccc2I 527a_100016994217_100000187884 [0,0,0,1,0,0|3,0,0]=4 6005 B15R2.43577 O=C(NC1CSC1)c2ccccc2O 240690a_100016994217_100015234032 [0,0,0,1,0,0|2,0,0]=3 6006 B15R2.43577 O=C(NC1CSC1)c2ccccc2[O-] 1626a_100016994217_100009911694 [0,0,0,1,0,0|2,0,1]=4 6007 B15R2.43577 O=C(NC1CSC1)c2ccccc2[O-] 240690a_100016994217_100009911694 [0,0,0,1,0,0|2,0,1]=4 6008 B15R2.43577 O=C(NC1CSC1)c2ccccc2[O-] 527a_100016994217_100009911694 [0,0,0,1,0,0|2,0,1]=4 6009 B15R1.1409 C#CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000731252 [0,0,0,0,0,1|1,0,2]=4 6010 B15R1.1409 C#CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000690238 [0,0,0,0,0,1|1,0,2]=4 6011 B15R1.1409 C#CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000690238 [0,0,0,0,0,1|1,0,2]=4 6012 B15R1.1409 C#CCCNC(=O)Cc1ccccc1O 240690a_100000755551_100000743006 [0,0,0,0,0,1|1,0,2]=4 6013 B15R1.1409 C#CCCNC(=O)Cc1ccccc1O 527a_100000755551_100000743006 [0,0,0,0,0,1|1,0,2]=4 6014 B15R1.1409 C#CCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000755551 [0,0,0,0,0,1|1,0,2]=4 6015 B15R1.1409 C=CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000757094 [0,0,0,0,0,1|1,0,2]=4 6016 B15R1.1409 C=CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000766728 [0,0,0,0,0,1|1,0,2]=4 6017 B15R1.1409 C=CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000766728 [0,0,0,0,0,1|1,0,2]=4 6018 B15R1.1409 C=CCCNC(=O)Cc1ccccc1O 240690a_100015191253_100000743006 [0,0,0,0,0,1|1,0,2]=4 6019 B15R1.1409 C=CCCNC(=O)Cc1ccccc1O 527a_100015191253_100000743006 [0,0,0,0,0,1|1,0,2]=4 6020 B15R1.1409 C=CCCNC(=O)Nc1ccccc1O 2430a_100000185747_100015191253 [0,0,0,0,0,1|1,0,2]=4 6021 B15R1.1409 CC#CCNC(=O)Cc1ccccc1O 527a_100000685387_100000743006 [0,0,0,0,0,1|1,0,2]=4 6022 B15R1.1409 CC#CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000685387 [0,0,0,0,0,1|1,0,2]=4 6023 B15R1.1409 CC/C=C/CC(=O)Nc1ccccc1O 22a_100000185747_100016274230 [0,0,0,0,0,1|1,0,2]=4 6024 B15R1.1409 CC/C=C/CC(=O)Nc1ccccc1O 527a_100000185747_100016274230 [0,0,0,0,0,1|1,0,2]=4 6025 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1O 1458a_100000743006_100103147603 [0,0,0,0,0,1|1,0,2]=4 6026 B15R1.1409 CCC#CCC(=O)Cc1ccccc1O 1458a_100000743006_100009813939 [0,0,0,0,0,1|1,0,2]=4 6027 B15R1.1409 CCCC#CC(=O)Cc1ccccc1Br 1458a_200011218047_100000184730 [0,0,0,0,0,1|2,0,1]=4 6028 B15R1.1409 CCCC#CC(=O)Cc1ccccc1C 1458a_200011218047_100000211839 [0,0,0,0,0,1|2,0,1]=4 6029 B15R1.1409 CCCC#CC(=O)Cc1ccccc1Cl 1458a_200011218047_100000187162 [0,0,0,0,0,1|2,0,1]=4 6030 B15R1.1409 CCCC#CC(=O)Cc1ccccc1F 1458a_200011218047_100000187165 [0,0,0,0,0,1|2,0,1]=4 6031 B15R1.1409 CCCC#CC(=O)Cc1ccccc1I 1458a_200011218047_100011216222 [0,0,0,0,0,1|2,0,1]=4 6032 B15R1.1409 CCCC#CC(=O)Cc1ncccc1O 1458a_200011218047_200020655725 [0,0,0,0,0,1|2,0,1]=4 6033 B15R1.1409 CCCC#CC(=O)Nc1ccccc1C 22a_100015192222_200011218047 [0,0,0,0,0,1|2,0,1]=4 6034 B15R1.1409 CCCC#CC(=O)Nc1ccccc1Cl 22a_100000185783_200011218047 [0,0,0,0,0,1|2,0,1]=4 6035 B15R1.1409 CCCC#CC(=O)Nc1ccccc1F 22a_100000210422_200011218047 [0,0,0,0,0,1|2,0,1]=4 6036 B15R1.1409 CCCC#CC(=O)Nc1ccccc1O 22a_100000185747_200011218047 [0,0,0,0,0,1|1,0,1]=3 6037 B15R1.1409 CCCC=CC(=O)Cc1ccccc1Br 1458a_100000212230_100000184730 [0,0,0,0,0,1|2,0,1]=4 6038 B15R1.1409 CCCC=CC(=O)Cc1ccccc1C 1458a_100000212230_100000211839 [0,0,0,0,0,1|2,0,1]=4 6039 B15R1.1409 CCCC=CC(=O)Cc1ccccc1Cl 1458a_100000212230_100000187162 [0,0,0,0,0,1|2,0,1]=4 6040 B15R1.1409 CCCC=CC(=O)Cc1ccccc1F 1458a_100000212230_100000187165 [0,0,0,0,0,1|2,0,1]=4 6041 B15R1.1409 CCCC=CC(=O)Cc1ccccc1I 1458a_100000212230_100011216222 [0,0,0,0,0,1|2,0,1]=4 6042 B15R1.1409 CCCC=CC(=O)Cc1ncccc1O 1458a_100000212230_200020655725 [0,0,0,0,0,1|2,0,1]=4 6043 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Br 11a_100000210017_100000212230 [0,0,0,0,0,1|2,0,1]=4 6044 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000212230 [0,0,0,0,0,1|2,0,1]=4 6045 B15R1.1409 CCCC=CC(=O)Nc1ccccc1C 11a_100015192222_100000212230 [0,0,0,0,0,1|2,0,1]=4 6046 B15R1.1409 CCCC=CC(=O)Nc1ccccc1C 1626a_100015192222_100000212230 [0,0,0,0,0,1|2,0,1]=4 6047 B15R1.1409 CCCC=CC(=O)Nc1ccccc1C 22a_100015192222_100000212230 [0,0,0,0,0,1|2,0,1]=4 6048 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100000212230 [0,0,0,0,0,1|2,0,1]=4 6049 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000212230 [0,0,0,0,0,1|2,0,1]=4 6050 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000212230 [0,0,0,0,0,1|2,0,1]=4 6051 B15R1.1409 CCCC=CC(=O)Nc1ccccc1F 11a_100000210422_100000212230 [0,0,0,0,0,1|2,0,1]=4 6052 B15R1.1409 CCCC=CC(=O)Nc1ccccc1F 1626a_100000210422_100000212230 [0,0,0,0,0,1|2,0,1]=4 6053 B15R1.1409 CCCC=CC(=O)Nc1ccccc1F 22a_100000210422_100000212230 [0,0,0,0,0,1|2,0,1]=4 6054 B15R1.1409 CCCC=CC(=O)Nc1ccccc1I 11a_100000210053_100000212230 [0,0,0,0,0,1|2,0,1]=4 6055 B15R1.1409 CCCC=CC(=O)Nc1ccccc1I 1626a_100000210053_100000212230 [0,0,0,0,0,1|2,0,1]=4 6056 B15R1.1409 CCCC=CC(=O)Nc1ccccc1O 22a_100000185747_100000212230 [0,0,0,0,0,1|1,0,1]=3 6057 B15R1.1409 CCCCCC(=O)Cc1ccccc1Br 1458a_100000212188_100000184730 [0,0,0,0,0,1|2,0,0]=3 6058 B15R1.1409 CCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210326 [0,0,0,0,0,1|2,0,0]=3 6059 B15R1.1409 CCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210326 [0,0,0,0,0,1|2,0,0]=3 6060 B15R1.1409 CCCCCC(=O)Cc1ccccc1C 1458a_100000212188_100000211839 [0,0,0,0,0,1|2,0,0]=3 6061 B15R1.1409 CCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210326 [0,0,0,0,0,1|2,0,0]=3 6062 B15R1.1409 CCCCCC(=O)Cc1ccccc1Cl 1458a_100000212188_100000187162 [0,0,0,0,0,1|2,0,0]=3 6063 B15R1.1409 CCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210326 [0,0,0,0,0,1|2,0,0]=3 6064 B15R1.1409 CCCCCC(=O)Cc1ccccc1F 1458a_100000212188_100000187165 [0,0,0,0,0,1|2,0,0]=3 6065 B15R1.1409 CCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210326 [0,0,0,0,0,1|2,0,0]=3 6066 B15R1.1409 CCCCCC(=O)Cc1ccccc1I 1458a_100000212188_100011216222 [0,0,0,0,0,1|2,0,0]=3 6067 B15R1.1409 CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210326 [0,0,0,0,0,1|1,0,0]=2 6068 B15R1.1409 CCCCCC(=O)Cc1cccnc1Br 1458a_100000212188_100010140945 [0,0,0,0,0,1|3,0,0]=4 6069 B15R1.1409 CCCCCC(=O)Cc1cccnc1C 1458a_100000212188_100000732876 [0,0,0,0,0,1|3,0,0]=4 6070 B15R1.1409 CCCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210326 [0,0,0,0,0,1|3,0,0]=4 6071 B15R1.1409 CCCCCC(=O)Cc1cccnc1Cl 1458a_100000212188_100000045678 [0,0,0,0,0,1|3,0,0]=4 6072 B15R1.1409 CCCCCC(=O)Cc1cccnc1F 1458a_100000212188_100000099810 [0,0,0,0,0,1|3,0,0]=4 6073 B15R1.1409 CCCCCC(=O)Cc1ccncc1C 1458a_100000212188_100020672808 [0,0,0,0,0,1|3,0,0]=4 6074 B15R1.1409 CCCCCC(=O)Cc1ccncc1Cl 1458a_100000212188_100000763264 [0,0,0,0,0,1|3,0,0]=4 6075 B15R1.1409 CCCCCC(=O)Cc1cnccc1C 1458a_100000212188_100000690890 [0,0,0,0,0,1|3,0,0]=4 6076 B15R1.1409 CCCCCC(=O)Cc1ncccc1Br 1458a_100000212188_100025702911 [0,0,0,0,0,1|3,0,0]=4 6077 B15R1.1409 CCCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210326 [0,0,0,0,0,1|3,0,0]=4 6078 B15R1.1409 CCCCCC(=O)Cc1ncccc1C 1458a_100000212188_100000696600 [0,0,0,0,0,1|3,0,0]=4 6079 B15R1.1409 CCCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210326 [0,0,0,0,0,1|3,0,0]=4 6080 B15R1.1409 CCCCCC(=O)Cc1ncccc1Cl 1458a_100000212188_100000099807 [0,0,0,0,0,1|3,0,0]=4 6081 B15R1.1409 CCCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210326 [0,0,0,0,0,1|3,0,0]=4 6082 B15R1.1409 CCCCCC(=O)Cc1ncccc1F 1458a_100000212188_100000104219 [0,0,0,0,0,1|3,0,0]=4 6083 B15R1.1409 CCCCCC(=O)Cc1ncccc1O 1458a_100000212188_200020655725 [0,0,0,0,0,1|2,0,0]=3 6084 B15R1.1409 CCCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210326 [0,0,0,0,0,1|2,0,1]=4 6085 B15R1.1409 CCCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000212188 [0,0,0,0,0,1|2,0,0]=3 6086 B15R1.1409 CCCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000212188 [0,0,0,0,0,1|2,0,0]=3 6087 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 11a_100015192222_100000212188 [0,0,0,0,0,1|2,0,0]=3 6088 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000212188 [0,0,0,0,0,1|2,0,0]=3 6089 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 22a_100015192222_100000212188 [0,0,0,0,0,1|2,0,0]=3 6090 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 527a_100015192222_100000212188 [0,0,0,0,0,1|2,0,0]=3 6091 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000212188 [0,0,0,0,0,1|2,0,0]=3 6092 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000212188 [0,0,0,0,0,1|2,0,0]=3 6093 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000212188 [0,0,0,0,0,1|2,0,0]=3 6094 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000212188 [0,0,0,0,0,1|2,0,0]=3 6095 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 11a_100000210422_100000212188 [0,0,0,0,0,1|2,0,0]=3 6096 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000212188 [0,0,0,0,0,1|2,0,0]=3 6097 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 22a_100000210422_100000212188 [0,0,0,0,0,1|2,0,0]=3 6098 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 527a_100000210422_100000212188 [0,0,0,0,0,1|2,0,0]=3 6099 B15R1.1409 CCCCCC(=O)Nc1ccccc1I 11a_100000210053_100000212188 [0,0,0,0,0,1|2,0,0]=3 6100 B15R1.1409 CCCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000212188 [0,0,0,0,0,1|2,0,0]=3 6101 B15R1.1409 CCCCCC(=O)Nc1ccccc1O 22a_100000185747_100000212188 [0,0,0,0,0,1|1,0,0]=2 6102 B15R1.1409 CCCCCC(=O)Nc1ccccc1O 527a_100000185747_100000212188 [0,0,0,0,0,1|1,0,0]=2 6103 B15R1.1409 CCCCCC(C)Nc1ccccc1O 34a_100000185747_200011218191 [0,0,0,0,0,1|2,0,1]=4 6104 B15R1.1409 CCCCCC(C)Sc1ccccc1O 62a_100000739446_200011218191 [0,0,0,0,0,1|2,0,1]=4 6105 B15R1.1409 CCCCCC(C)Sc1ccccc1O 62a_200011218191_100000739446 [0,0,0,0,0,1|2,0,1]=4 6106 B15R1.1409 CCCCCN(C)Cc1ccccc1O 2230a_100015189988_100000210326 [0,0,0,0,0,1|3,0,0]=4 6107 B15R1.1409 CCCCCN(C)Cc1ccccc1O 269982a_100015189988_100000210215 [0,0,0,0,0,1|3,0,0]=4 6108 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 11a_100000102301_100000751119 [0,0,0,0,0,1|2,0,0]=3 6109 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 240690a_100000102301_100000751119 [0,0,0,0,0,1|2,0,0]=3 6110 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 527a_100000102301_100000751119 [0,0,0,0,0,1|2,0,0]=3 6111 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 11a_100000102301_100000212180 [0,0,0,0,0,1|2,0,0]=3 6112 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 1626a_100000102301_100000212180 [0,0,0,0,0,1|2,0,0]=3 6113 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 240690a_100000102301_100000212180 [0,0,0,0,0,1|2,0,0]=3 6114 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 527a_100000102301_100000212180 [0,0,0,0,0,1|2,0,0]=3 6115 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 11a_100000102301_100000183793 [0,0,0,0,0,1|2,0,0]=3 6116 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 1626a_100000102301_100000183793 [0,0,0,0,0,1|2,0,0]=3 6117 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 240690a_100000102301_100000183793 [0,0,0,0,0,1|2,0,0]=3 6118 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 527a_100000102301_100000183793 [0,0,0,0,0,1|2,0,0]=3 6119 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 11a_100000102301_100000212012 [0,0,0,0,0,1|2,0,0]=3 6120 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 1626a_100000102301_100000212012 [0,0,0,0,0,1|2,0,0]=3 6121 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 240690a_100000102301_100000212012 [0,0,0,0,0,1|2,0,0]=3 6122 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 527a_100000102301_100000212012 [0,0,0,0,0,1|2,0,0]=3 6123 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 11a_100000102301_100000036491 [0,0,0,0,0,1|2,0,0]=3 6124 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 1626a_100000102301_100000036491 [0,0,0,0,0,1|2,0,0]=3 6125 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 240690a_100000102301_100000036491 [0,0,0,0,0,1|2,0,0]=3 6126 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 527a_100000102301_100000036491 [0,0,0,0,0,1|2,0,0]=3 6127 B15R1.1409 CCCCNC(=O)Cc1ccccc1O 240690a_100000102301_100000743006 [0,0,0,0,0,1|1,0,0]=2 6128 B15R1.1409 CCCCNC(=O)Cc1ccccc1O 527a_100000102301_100000743006 [0,0,0,0,0,1|1,0,0]=2 6129 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 11a_100000102301_100000093521 [0,0,0,0,0,1|3,0,0]=4 6130 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 1626a_100000102301_100000093521 [0,0,0,0,0,1|3,0,0]=4 6131 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 240690a_100000102301_100000093521 [0,0,0,0,0,1|3,0,0]=4 6132 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 527a_100000102301_100000093521 [0,0,0,0,0,1|3,0,0]=4 6133 B15R1.1409 CCCCNC(=O)Cc1ncccc1Br 11a_100000102301_200012357574 [0,0,0,0,0,1|3,0,0]=4 6134 B15R1.1409 CCCCNC(=O)Cc1ncccc1Br 240690a_100000102301_200012357574 [0,0,0,0,0,1|3,0,0]=4 6135 B15R1.1409 CCCCNC(=O)Cc1ncccc1C 11a_100000102301_200000722269 [0,0,0,0,0,1|3,0,0]=4 6136 B15R1.1409 CCCCNC(=O)Cc1ncccc1C 1626a_100000102301_200000722269 [0,0,0,0,0,1|3,0,0]=4 6137 B15R1.1409 CCCCNC(=O)Cc1ncccc1C 240690a_100000102301_200000722269 [0,0,0,0,0,1|3,0,0]=4 6138 B15R1.1409 CCCCNC(=O)Cc1ncccc1Cl 11a_100000102301_100011998755 [0,0,0,0,0,1|3,0,0]=4 6139 B15R1.1409 CCCCNC(=O)Cc1ncccc1Cl 240690a_100000102301_100011998755 [0,0,0,0,0,1|3,0,0]=4 6140 B15R1.1409 CCCCNC(=O)Cc1ncccc1Cl 527a_100000102301_100011998755 [0,0,0,0,0,1|3,0,0]=4 6141 B15R1.1409 CCCCNC(=O)Cn1ccccc1=O 1626a_100000102301_100000189665 [0,0,0,0,0,1|2,0,1]=4 6142 B15R1.1409 CCCCNC(=O)Cn1ccccc1=O 240690a_100000102301_100000189665 [0,0,0,0,0,1|2,0,1]=4 6143 B15R1.1409 CCCCNC(=O)Cn1ccccc1=O 527a_100000102301_100000189665 [0,0,0,0,0,1|2,0,1]=4 6144 B15R1.1409 CCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000102301 [0,0,0,0,0,1|2,0,0]=3 6145 B15R1.1409 CCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000102301 [0,0,0,0,0,1|2,0,0]=3 6146 B15R1.1409 CCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000102301 [0,0,0,0,0,1|2,0,0]=3 6147 B15R1.1409 CCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000102301 [0,0,0,0,0,1|2,0,0]=3 6148 B15R1.1409 CCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000102301 [0,0,0,0,0,1|2,0,0]=3 6149 B15R1.1409 CCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000102301 [0,0,0,0,0,1|1,0,0]=2 6150 B15R1.1409 CCCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210303 [0,0,0,0,0,1|3,0,0]=4 6151 B15R1.1409 CCCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210303 [0,0,0,0,0,1|3,0,0]=4 6152 B15R1.1409 CCCNNC(=O)Cc1ccccc1Br 22a_100000740057_100000751119 [0,0,0,0,0,1|3,0,0]=4 6153 B15R1.1409 CCCNNC(=O)Cc1ccccc1C 22a_100000740057_100000212180 [0,0,0,0,0,1|3,0,0]=4 6154 B15R1.1409 CCCNNC(=O)Cc1ccccc1Cl 22a_100000740057_100000183793 [0,0,0,0,0,1|3,0,0]=4 6155 B15R1.1409 CCCNNC(=O)Cc1ccccc1F 22a_100000740057_100000212012 [0,0,0,0,0,1|3,0,0]=4 6156 B15R1.1409 CCCNNC(=O)Cc1ccccc1I 22a_100000740057_100000036491 [0,0,0,0,0,1|3,0,0]=4 6157 B15R1.1409 CCCNNC(=O)Cc1ccccc1O 22a_100000740057_100000743006 [0,0,0,0,0,1|2,0,0]=3 6158 B15R1.1409 CCCOCC(=O)Cc1ccccc1Br 1458a_100000745993_100000184730 [0,0,0,0,0,1|3,0,0]=4 6159 B15R1.1409 CCCOCC(=O)Cc1ccccc1Br 34a_100000210258_100000700504 [0,0,0,0,0,1|3,0,0]=4 6160 B15R1.1409 CCCOCC(=O)Cc1ccccc1C 1458a_100000745993_100000211839 [0,0,0,0,0,1|3,0,0]=4 6161 B15R1.1409 CCCOCC(=O)Cc1ccccc1Cl 1458a_100000745993_100000187162 [0,0,0,0,0,1|3,0,0]=4 6162 B15R1.1409 CCCOCC(=O)Cc1ccccc1F 1458a_100000745993_100000187165 [0,0,0,0,0,1|3,0,0]=4 6163 B15R1.1409 CCCOCC(=O)Cc1ccccc1I 1458a_100000745993_100011216222 [0,0,0,0,0,1|3,0,0]=4 6164 B15R1.1409 CCCOCC(=O)Cc1ncccc1O 1458a_100000745993_200020655725 [0,0,0,0,0,1|3,0,0]=4 6165 B15R1.1409 CCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000745993 [0,0,0,0,0,1|3,0,0]=4 6166 B15R1.1409 CCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000745993 [0,0,0,0,0,1|3,0,0]=4 6167 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000745993 [0,0,0,0,0,1|3,0,0]=4 6168 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000745993 [0,0,0,0,0,1|3,0,0]=4 6169 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000745993 [0,0,0,0,0,1|3,0,0]=4 6170 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 34a_100000210258_100000183529 [0,0,0,0,0,1|3,0,0]=4 6171 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000745993 [0,0,0,0,0,1|3,0,0]=4 6172 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000745993 [0,0,0,0,0,1|3,0,0]=4 6173 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000745993 [0,0,0,0,0,1|3,0,0]=4 6174 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000745993 [0,0,0,0,0,1|3,0,0]=4 6175 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 34a_100000210258_100000182448 [0,0,0,0,0,1|3,0,0]=4 6176 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000745993 [0,0,0,0,0,1|3,0,0]=4 6177 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000745993 [0,0,0,0,0,1|3,0,0]=4 6178 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000745993 [0,0,0,0,0,1|3,0,0]=4 6179 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000745993 [0,0,0,0,0,1|3,0,0]=4 6180 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 34a_100000210258_100000243840 [0,0,0,0,0,1|3,0,0]=4 6181 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000745993 [0,0,0,0,0,1|3,0,0]=4 6182 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000745993 [0,0,0,0,0,1|3,0,0]=4 6183 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000745993 [0,0,0,0,0,1|3,0,0]=4 6184 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 34a_100000210258_100000180142 [0,0,0,0,0,1|3,0,0]=4 6185 B15R1.1409 CCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000745993 [0,0,0,0,0,1|2,0,0]=3 6186 B15R1.1409 CCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000745993 [0,0,0,0,0,1|2,0,0]=3 6187 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 1458a_100000217233_100000184730 [0,0,0,0,0,1|3,0,0]=4 6188 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 62a_100000210303_100000700504 [0,0,0,0,0,1|3,0,0]=4 6189 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210303 [0,0,0,0,0,1|3,0,0]=4 6190 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 1458a_100000217233_100000211839 [0,0,0,0,0,1|3,0,0]=4 6191 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 62a_100000210303_100011223134 [0,0,0,0,0,1|3,0,0]=4 6192 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210303 [0,0,0,0,0,1|3,0,0]=4 6193 B15R1.1409 CCCSCC(=O)Cc1ccccc1Cl 1458a_100000217233_100000187162 [0,0,0,0,0,1|3,0,0]=4 6194 B15R1.1409 CCCSCC(=O)Cc1ccccc1F 1458a_100000217233_100000187165 [0,0,0,0,0,1|3,0,0]=4 6195 B15R1.1409 CCCSCC(=O)Cc1ccccc1I 1458a_100000217233_100011216222 [0,0,0,0,0,1|3,0,0]=4 6196 B15R1.1409 CCCSCC(=O)Cc1ncccc1O 1458a_100000217233_200020655725 [0,0,0,0,0,1|3,0,0]=4 6197 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000217233 [0,0,0,0,0,1|3,0,0]=4 6198 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000217233 [0,0,0,0,0,1|3,0,0]=4 6199 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210303 [0,0,0,0,0,1|3,0,0]=4 6200 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 62a_100000210303_100000182372 [0,0,0,0,0,1|3,0,0]=4 6201 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 11a_100015192222_100000217233 [0,0,0,0,0,1|3,0,0]=4 6202 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000217233 [0,0,0,0,0,1|3,0,0]=4 6203 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 22a_100015192222_100000217233 [0,0,0,0,0,1|3,0,0]=4 6204 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 527a_100015192222_100000217233 [0,0,0,0,0,1|3,0,0]=4 6205 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 62a_100000210303_100000183529 [0,0,0,0,0,1|3,0,0]=4 6206 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000217233 [0,0,0,0,0,1|3,0,0]=4 6207 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000217233 [0,0,0,0,0,1|3,0,0]=4 6208 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000217233 [0,0,0,0,0,1|3,0,0]=4 6209 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000217233 [0,0,0,0,0,1|3,0,0]=4 6210 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 62a_100000210303_100000182448 [0,0,0,0,0,1|3,0,0]=4 6211 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210303 [0,0,0,0,0,1|3,0,0]=4 6212 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 11a_100000210422_100000217233 [0,0,0,0,0,1|3,0,0]=4 6213 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000217233 [0,0,0,0,0,1|3,0,0]=4 6214 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 22a_100000210422_100000217233 [0,0,0,0,0,1|3,0,0]=4 6215 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 527a_100000210422_100000217233 [0,0,0,0,0,1|3,0,0]=4 6216 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210303 [0,0,0,0,0,1|3,0,0]=4 6217 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 62a_100000210303_100000182988 [0,0,0,0,0,1|3,0,0]=4 6218 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 11a_100000210053_100000217233 [0,0,0,0,0,1|3,0,0]=4 6219 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000217233 [0,0,0,0,0,1|3,0,0]=4 6220 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210303 [0,0,0,0,0,1|3,0,0]=4 6221 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 62a_100000210303_100000180142 [0,0,0,0,0,1|3,0,0]=4 6222 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 22a_100000185747_100000217233 [0,0,0,0,0,1|2,0,0]=3 6223 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 527a_100000185747_100000217233 [0,0,0,0,0,1|2,0,0]=3 6224 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 62a_100000210303_100000014494 [0,0,0,0,0,1|2,0,0]=3 6225 B15R1.1409 CCNCCC(=O)Nc1ccccc1Br 2230a_100015525214_100000181489 [0,0,0,0,0,1|3,0,0]=4 6226 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 2230a_100015525214_200011206476 [0,0,0,0,0,1|3,0,0]=4 6227 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 2230a_200015185780_100000210202 [0,0,0,0,0,1|3,0,0]=4 6228 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 34a_200015185780_100000210202 [0,0,0,0,0,1|3,0,0]=4 6229 B15R1.1409 CCNCCC(=O)Nc1ccccc1Cl 2230a_100015525214_100000242055 [0,0,0,0,0,1|3,0,0]=4 6230 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 2230a_100015185137_100000210202 [0,0,0,0,0,1|3,0,0]=4 6231 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 2230a_100015525214_100000242066 [0,0,0,0,0,1|3,0,0]=4 6232 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 34a_100015185137_100000210202 [0,0,0,0,0,1|3,0,0]=4 6233 B15R1.1409 CCOC=CC(=O)Nc1ccccc1O 22a_100000185747_100016266692 [0,0,0,0,0,1|2,0,1]=4 6234 B15R1.1409 CCOCCC(=O)Cc1ccccc1Br 1458a_100000749530_100000184730 [0,0,0,0,0,1|3,0,0]=4 6235 B15R1.1409 CCOCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215890 [0,0,0,0,0,1|3,0,0]=4 6236 B15R1.1409 CCOCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215890 [0,0,0,0,0,1|3,0,0]=4 6237 B15R1.1409 CCOCCC(=O)Cc1ccccc1C 1458a_100000749530_100000211839 [0,0,0,0,0,1|3,0,0]=4 6238 B15R1.1409 CCOCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215890 [0,0,0,0,0,1|3,0,0]=4 6239 B15R1.1409 CCOCCC(=O)Cc1ccccc1Cl 1458a_100000749530_100000187162 [0,0,0,0,0,1|3,0,0]=4 6240 B15R1.1409 CCOCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215890 [0,0,0,0,0,1|3,0,0]=4 6241 B15R1.1409 CCOCCC(=O)Cc1ccccc1F 1458a_100000749530_100000187165 [0,0,0,0,0,1|3,0,0]=4 6242 B15R1.1409 CCOCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215890 [0,0,0,0,0,1|3,0,0]=4 6243 B15R1.1409 CCOCCC(=O)Cc1ccccc1I 1458a_100000749530_100011216222 [0,0,0,0,0,1|3,0,0]=4 6244 B15R1.1409 CCOCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215890 [0,0,0,0,0,1|2,0,0]=3 6245 B15R1.1409 CCOCCC(=O)Cc1ncccc1O 1458a_100000749530_200020655725 [0,0,0,0,0,1|3,0,0]=4 6246 B15R1.1409 CCOCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749530 [0,0,0,0,0,1|3,0,0]=4 6247 B15R1.1409 CCOCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749530 [0,0,0,0,0,1|3,0,0]=4 6248 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 11a_100015192222_100000749530 [0,0,0,0,0,1|3,0,0]=4 6249 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749530 [0,0,0,0,0,1|3,0,0]=4 6250 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 22a_100015192222_100000749530 [0,0,0,0,0,1|3,0,0]=4 6251 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 527a_100015192222_100000749530 [0,0,0,0,0,1|3,0,0]=4 6252 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749530 [0,0,0,0,0,1|3,0,0]=4 6253 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749530 [0,0,0,0,0,1|3,0,0]=4 6254 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749530 [0,0,0,0,0,1|3,0,0]=4 6255 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749530 [0,0,0,0,0,1|3,0,0]=4 6256 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 11a_100000210422_100000749530 [0,0,0,0,0,1|3,0,0]=4 6257 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749530 [0,0,0,0,0,1|3,0,0]=4 6258 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 22a_100000210422_100000749530 [0,0,0,0,0,1|3,0,0]=4 6259 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 527a_100000210422_100000749530 [0,0,0,0,0,1|3,0,0]=4 6260 B15R1.1409 CCOCCC(=O)Nc1ccccc1I 11a_100000210053_100000749530 [0,0,0,0,0,1|3,0,0]=4 6261 B15R1.1409 CCOCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749530 [0,0,0,0,0,1|3,0,0]=4 6262 B15R1.1409 CCOCCC(=O)Nc1ccccc1O 22a_100000185747_100000749530 [0,0,0,0,0,1|2,0,0]=3 6263 B15R1.1409 CCOCCC(=O)Nc1ccccc1O 527a_100000185747_100000749530 [0,0,0,0,0,1|2,0,0]=3 6264 B15R1.1409 CCSCCC(=O)Cc1ccccc1Br 1458a_100000230768_100000184730 [0,0,0,0,0,1|3,0,0]=4 6265 B15R1.1409 CCSCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000757381 [0,0,0,0,0,1|3,0,0]=4 6266 B15R1.1409 CCSCCC(=O)Cc1ccccc1C 1458a_100000212180_100000757381 [0,0,0,0,0,1|3,0,0]=4 6267 B15R1.1409 CCSCCC(=O)Cc1ccccc1C 1458a_100000230768_100000211839 [0,0,0,0,0,1|3,0,0]=4 6268 B15R1.1409 CCSCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000757381 [0,0,0,0,0,1|3,0,0]=4 6269 B15R1.1409 CCSCCC(=O)Cc1ccccc1Cl 1458a_100000230768_100000187162 [0,0,0,0,0,1|3,0,0]=4 6270 B15R1.1409 CCSCCC(=O)Cc1ccccc1F 1458a_100000212012_100000757381 [0,0,0,0,0,1|3,0,0]=4 6271 B15R1.1409 CCSCCC(=O)Cc1ccccc1F 1458a_100000230768_100000187165 [0,0,0,0,0,1|3,0,0]=4 6272 B15R1.1409 CCSCCC(=O)Cc1ccccc1I 1458a_100000036491_100000757381 [0,0,0,0,0,1|3,0,0]=4 6273 B15R1.1409 CCSCCC(=O)Cc1ccccc1I 1458a_100000230768_100011216222 [0,0,0,0,0,1|3,0,0]=4 6274 B15R1.1409 CCSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000757381 [0,0,0,0,0,1|2,0,0]=3 6275 B15R1.1409 CCSCCC(=O)Cc1ncccc1O 1458a_100000230768_200020655725 [0,0,0,0,0,1|3,0,0]=4 6276 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 11a_100000210017_100000230768 [0,0,0,0,0,1|3,0,0]=4 6277 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000230768 [0,0,0,0,0,1|3,0,0]=4 6278 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 62a_100000181489_100000210202 [0,0,0,0,0,1|3,0,0]=4 6279 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 62a_100000210202_100000181489 [0,0,0,0,0,1|3,0,0]=4 6280 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 11a_100015192222_100000230768 [0,0,0,0,0,1|3,0,0]=4 6281 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 1626a_100015192222_100000230768 [0,0,0,0,0,1|3,0,0]=4 6282 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 22a_100015192222_100000230768 [0,0,0,0,0,1|3,0,0]=4 6283 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 527a_100015192222_100000230768 [0,0,0,0,0,1|3,0,0]=4 6284 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 62a_100000210202_200011206476 [0,0,0,0,0,1|3,0,0]=4 6285 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000230768 [0,0,0,0,0,1|3,0,0]=4 6286 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000230768 [0,0,0,0,0,1|3,0,0]=4 6287 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000230768 [0,0,0,0,0,1|3,0,0]=4 6288 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000230768 [0,0,0,0,0,1|3,0,0]=4 6289 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 62a_100000210202_100000242055 [0,0,0,0,0,1|3,0,0]=4 6290 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 11a_100000210422_100000230768 [0,0,0,0,0,1|3,0,0]=4 6291 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 1626a_100000210422_100000230768 [0,0,0,0,0,1|3,0,0]=4 6292 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 22a_100000210422_100000230768 [0,0,0,0,0,1|3,0,0]=4 6293 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 527a_100000210422_100000230768 [0,0,0,0,0,1|3,0,0]=4 6294 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 62a_100000210202_100000242066 [0,0,0,0,0,1|3,0,0]=4 6295 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 62a_100011216740_100000210202 [0,0,0,0,0,1|3,0,0]=4 6296 B15R1.1409 CCSCCC(=O)Nc1ccccc1I 11a_100000210053_100000230768 [0,0,0,0,0,1|3,0,0]=4 6297 B15R1.1409 CCSCCC(=O)Nc1ccccc1I 1626a_100000210053_100000230768 [0,0,0,0,0,1|3,0,0]=4 6298 B15R1.1409 CCSCCC(=O)Nc1ccccc1O 22a_100000185747_100000230768 [0,0,0,0,0,1|2,0,0]=3 6299 B15R1.1409 CCSCCC(=O)Nc1ccccc1O 527a_100000185747_100000230768 [0,0,0,0,0,1|2,0,0]=3 6300 B15R1.1409 CNCCOC(=O)Nc1ccccc1Br 34a_100102657272_100020589338 [0,0,0,0,0,1|2,0,0]=3 6301 B15R1.1409 CNCCOC(=O)Nc1ccccc1Br 7a_106832991635_100020589338 [0,0,0,0,0,1|2,0,0]=3 6302 B15R1.1409 CNCCOC(=O)Nc1ccccc1Cl 34a_100102657272_200000178450 [0,0,0,0,0,1|2,0,0]=3 6303 B15R1.1409 CNCCOC(=O)Nc1ccccc1Cl 7a_106832991635_200000178450 [0,0,0,0,0,1|2,0,0]=3 6304 B15R1.1409 COCC=CC(=O)Nc1ccccc1O 22a_100000185747_100016285016 [0,0,0,0,0,1|2,0,1]=4 6305 B15R1.1409 COCCCC(=O)Cc1ccccc1Br 1458a_100000741012_100000184730 [0,0,0,0,0,1|3,0,0]=4 6306 B15R1.1409 COCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000740836 [0,0,0,0,0,1|3,0,0]=4 6307 B15R1.1409 COCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000740836 [0,0,0,0,0,1|3,0,0]=4 6308 B15R1.1409 COCCCC(=O)Cc1ccccc1C 1458a_100000741012_100000211839 [0,0,0,0,0,1|3,0,0]=4 6309 B15R1.1409 COCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000740836 [0,0,0,0,0,1|3,0,0]=4 6310 B15R1.1409 COCCCC(=O)Cc1ccccc1Cl 1458a_100000741012_100000187162 [0,0,0,0,0,1|3,0,0]=4 6311 B15R1.1409 COCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000740836 [0,0,0,0,0,1|3,0,0]=4 6312 B15R1.1409 COCCCC(=O)Cc1ccccc1F 1458a_100000741012_100000187165 [0,0,0,0,0,1|3,0,0]=4 6313 B15R1.1409 COCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000740836 [0,0,0,0,0,1|3,0,0]=4 6314 B15R1.1409 COCCCC(=O)Cc1ccccc1I 1458a_100000741012_100011216222 [0,0,0,0,0,1|3,0,0]=4 6315 B15R1.1409 COCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000740836 [0,0,0,0,0,1|2,0,0]=3 6316 B15R1.1409 COCCCC(=O)Cc1ncccc1O 1458a_100000741012_200020655725 [0,0,0,0,0,1|3,0,0]=4 6317 B15R1.1409 COCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000741012 [0,0,0,0,0,1|3,0,0]=4 6318 B15R1.1409 COCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000741012 [0,0,0,0,0,1|3,0,0]=4 6319 B15R1.1409 COCCCC(=O)Nc1ccccc1C 11a_100015192222_100000741012 [0,0,0,0,0,1|3,0,0]=4 6320 B15R1.1409 COCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000741012 [0,0,0,0,0,1|3,0,0]=4 6321 B15R1.1409 COCCCC(=O)Nc1ccccc1C 22a_100015192222_100000741012 [0,0,0,0,0,1|3,0,0]=4 6322 B15R1.1409 COCCCC(=O)Nc1ccccc1C 527a_100015192222_100000741012 [0,0,0,0,0,1|3,0,0]=4 6323 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000741012 [0,0,0,0,0,1|3,0,0]=4 6324 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000741012 [0,0,0,0,0,1|3,0,0]=4 6325 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000741012 [0,0,0,0,0,1|3,0,0]=4 6326 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000741012 [0,0,0,0,0,1|3,0,0]=4 6327 B15R1.1409 COCCCC(=O)Nc1ccccc1F 11a_100000210422_100000741012 [0,0,0,0,0,1|3,0,0]=4 6328 B15R1.1409 COCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000741012 [0,0,0,0,0,1|3,0,0]=4 6329 B15R1.1409 COCCCC(=O)Nc1ccccc1F 22a_100000210422_100000741012 [0,0,0,0,0,1|3,0,0]=4 6330 B15R1.1409 COCCCC(=O)Nc1ccccc1F 527a_100000210422_100000741012 [0,0,0,0,0,1|3,0,0]=4 6331 B15R1.1409 COCCCC(=O)Nc1ccccc1I 11a_100000210053_100000741012 [0,0,0,0,0,1|3,0,0]=4 6332 B15R1.1409 COCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000741012 [0,0,0,0,0,1|3,0,0]=4 6333 B15R1.1409 COCCCC(=O)Nc1ccccc1O 22a_100000185747_100000741012 [0,0,0,0,0,1|2,0,0]=3 6334 B15R1.1409 COCCCC(=O)Nc1ccccc1O 527a_100000185747_100000741012 [0,0,0,0,0,1|2,0,0]=3 6335 B15R1.1409 COCCNC(=O)Cc1ccccc1Br 240690a_100000209980_100000751119 [0,0,0,0,0,1|3,0,0]=4 6336 B15R1.1409 COCCNC(=O)Cc1ccccc1Br 527a_100000209980_100000751119 [0,0,0,0,0,1|3,0,0]=4 6337 B15R1.1409 COCCNC(=O)Cc1ccccc1C 1626a_100000209980_100000212180 [0,0,0,0,0,1|3,0,0]=4 6338 B15R1.1409 COCCNC(=O)Cc1ccccc1C 240690a_100000209980_100000212180 [0,0,0,0,0,1|3,0,0]=4 6339 B15R1.1409 COCCNC(=O)Cc1ccccc1C 527a_100000209980_100000212180 [0,0,0,0,0,1|3,0,0]=4 6340 B15R1.1409 COCCNC(=O)Cc1ccccc1Cl 1626a_100000209980_100000183793 [0,0,0,0,0,1|3,0,0]=4 6341 B15R1.1409 COCCNC(=O)Cc1ccccc1Cl 240690a_100000209980_100000183793 [0,0,0,0,0,1|3,0,0]=4 6342 B15R1.1409 COCCNC(=O)Cc1ccccc1Cl 527a_100000209980_100000183793 [0,0,0,0,0,1|3,0,0]=4 6343 B15R1.1409 COCCNC(=O)Cc1ccccc1F 1626a_100000209980_100000212012 [0,0,0,0,0,1|3,0,0]=4 6344 B15R1.1409 COCCNC(=O)Cc1ccccc1F 240690a_100000209980_100000212012 [0,0,0,0,0,1|3,0,0]=4 6345 B15R1.1409 COCCNC(=O)Cc1ccccc1F 527a_100000209980_100000212012 [0,0,0,0,0,1|3,0,0]=4 6346 B15R1.1409 COCCNC(=O)Cc1ccccc1I 1626a_100000209980_100000036491 [0,0,0,0,0,1|3,0,0]=4 6347 B15R1.1409 COCCNC(=O)Cc1ccccc1I 240690a_100000209980_100000036491 [0,0,0,0,0,1|3,0,0]=4 6348 B15R1.1409 COCCNC(=O)Cc1ccccc1I 527a_100000209980_100000036491 [0,0,0,0,0,1|3,0,0]=4 6349 B15R1.1409 COCCNC(=O)Cc1ccccc1O 240690a_100000209980_100000743006 [0,0,0,0,0,1|2,0,0]=3 6350 B15R1.1409 COCCNC(=O)Cc1ccccc1O 527a_100000209980_100000743006 [0,0,0,0,0,1|2,0,0]=3 6351 B15R1.1409 COCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000209980 [0,0,0,0,0,1|3,0,0]=4 6352 B15R1.1409 COCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000209980 [0,0,0,0,0,1|3,0,0]=4 6353 B15R1.1409 COCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000209980 [0,0,0,0,0,1|3,0,0]=4 6354 B15R1.1409 COCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000209980 [0,0,0,0,0,1|3,0,0]=4 6355 B15R1.1409 COCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000209980 [0,0,0,0,0,1|3,0,0]=4 6356 B15R1.1409 COCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000209980 [0,0,0,0,0,1|2,0,0]=3 6357 B15R1.1409 COCCOC(=O)Nc1ccccc1Br 34a_100138415774_100020589338 [0,0,0,0,0,1|2,0,0]=3 6358 B15R1.1409 COCCOC(=O)Nc1ccccc1Cl 34a_100138415774_200000178450 [0,0,0,0,0,1|2,0,0]=3 6359 B15R1.1409 COCSCC(=O)Nc1ccccc1O 62a_100000766300_100000014494 [0,0,0,0,0,1|3,0,0]=4 6360 B15R1.1409 CSCCCC(=O)Cc1ccccc1Br 1458a_100000173376_100000184730 [0,0,0,0,0,1|3,0,0]=4 6361 B15R1.1409 CSCCCC(=O)Cc1ccccc1C 1458a_100000173376_100000211839 [0,0,0,0,0,1|3,0,0]=4 6362 B15R1.1409 CSCCCC(=O)Cc1ccccc1Cl 1458a_100000173376_100000187162 [0,0,0,0,0,1|3,0,0]=4 6363 B15R1.1409 CSCCCC(=O)Cc1ccccc1F 1458a_100000173376_100000187165 [0,0,0,0,0,1|3,0,0]=4 6364 B15R1.1409 CSCCCC(=O)Cc1ccccc1I 1458a_100000173376_100011216222 [0,0,0,0,0,1|3,0,0]=4 6365 B15R1.1409 CSCCCC(=O)Cc1ncccc1O 1458a_100000173376_200020655725 [0,0,0,0,0,1|3,0,0]=4 6366 B15R1.1409 CSCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000173376 [0,0,0,0,0,1|3,0,0]=4 6367 B15R1.1409 CSCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000173376 [0,0,0,0,0,1|3,0,0]=4 6368 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 11a_100015192222_100000173376 [0,0,0,0,0,1|3,0,0]=4 6369 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000173376 [0,0,0,0,0,1|3,0,0]=4 6370 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 22a_100015192222_100000173376 [0,0,0,0,0,1|3,0,0]=4 6371 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 527a_100015192222_100000173376 [0,0,0,0,0,1|3,0,0]=4 6372 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000173376 [0,0,0,0,0,1|3,0,0]=4 6373 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000173376 [0,0,0,0,0,1|3,0,0]=4 6374 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000173376 [0,0,0,0,0,1|3,0,0]=4 6375 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000173376 [0,0,0,0,0,1|3,0,0]=4 6376 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 11a_100000210422_100000173376 [0,0,0,0,0,1|3,0,0]=4 6377 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000173376 [0,0,0,0,0,1|3,0,0]=4 6378 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 22a_100000210422_100000173376 [0,0,0,0,0,1|3,0,0]=4 6379 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 527a_100000210422_100000173376 [0,0,0,0,0,1|3,0,0]=4 6380 B15R1.1409 CSCCCC(=O)Nc1ccccc1I 11a_100000210053_100000173376 [0,0,0,0,0,1|3,0,0]=4 6381 B15R1.1409 CSCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000173376 [0,0,0,0,0,1|3,0,0]=4 6382 B15R1.1409 CSCCCC(=O)Nc1ccccc1O 22a_100000185747_100000173376 [0,0,0,0,0,1|2,0,0]=3 6383 B15R1.1409 CSCCCC(=O)Nc1ccccc1O 527a_100000185747_100000173376 [0,0,0,0,0,1|2,0,0]=3 6384 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br 11a_100020590264_100000751119 [0,0,0,0,0,1|3,0,0]=4 6385 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br 240690a_100020590264_100000751119 [0,0,0,0,0,1|3,0,0]=4 6386 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br 527a_100020590264_100000751119 [0,0,0,0,0,1|3,0,0]=4 6387 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 11a_100020590264_100000212180 [0,0,0,0,0,1|3,0,0]=4 6388 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 1626a_100020590264_100000212180 [0,0,0,0,0,1|3,0,0]=4 6389 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 240690a_100020590264_100000212180 [0,0,0,0,0,1|3,0,0]=4 6390 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 527a_100020590264_100000212180 [0,0,0,0,0,1|3,0,0]=4 6391 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 11a_100020590264_100000183793 [0,0,0,0,0,1|3,0,0]=4 6392 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 1626a_100020590264_100000183793 [0,0,0,0,0,1|3,0,0]=4 6393 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 240690a_100020590264_100000183793 [0,0,0,0,0,1|3,0,0]=4 6394 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 527a_100020590264_100000183793 [0,0,0,0,0,1|3,0,0]=4 6395 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 11a_100020590264_100000212012 [0,0,0,0,0,1|3,0,0]=4 6396 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 1626a_100020590264_100000212012 [0,0,0,0,0,1|3,0,0]=4 6397 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 240690a_100020590264_100000212012 [0,0,0,0,0,1|3,0,0]=4 6398 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 527a_100020590264_100000212012 [0,0,0,0,0,1|3,0,0]=4 6399 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 11a_100020590264_100000036491 [0,0,0,0,0,1|3,0,0]=4 6400 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 1626a_100020590264_100000036491 [0,0,0,0,0,1|3,0,0]=4 6401 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 240690a_100020590264_100000036491 [0,0,0,0,0,1|3,0,0]=4 6402 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 527a_100020590264_100000036491 [0,0,0,0,0,1|3,0,0]=4 6403 B15R1.1409 CSCCNC(=O)Cc1ccccc1O 240690a_100020590264_100000743006 [0,0,0,0,0,1|2,0,0]=3 6404 B15R1.1409 CSCCNC(=O)Cc1ccccc1O 527a_100020590264_100000743006 [0,0,0,0,0,1|2,0,0]=3 6405 B15R1.1409 CSCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100020590264 [0,0,0,0,0,1|3,0,0]=4 6406 B15R1.1409 CSCCNC(=O)Nc1ccccc1C 2430a_100015192222_100020590264 [0,0,0,0,0,1|3,0,0]=4 6407 B15R1.1409 CSCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020590264 [0,0,0,0,0,1|3,0,0]=4 6408 B15R1.1409 CSCCNC(=O)Nc1ccccc1F 2430a_100000210422_100020590264 [0,0,0,0,0,1|3,0,0]=4 6409 B15R1.1409 CSCCNC(=O)Nc1ccccc1I 2430a_100000210053_100020590264 [0,0,0,0,0,1|3,0,0]=4 6410 B15R1.1409 CSCCNC(=O)Nc1ccccc1O 2430a_100000185747_100020590264 [0,0,0,0,0,1|2,0,0]=3 6411 B15R1.1409 CSCCOC(=O)Nc1ccccc1Br 62a_100020589338_200000210301 [0,0,0,0,0,1|2,0,0]=3 6412 B15R1.1409 CSCCOC(=O)Nc1ccccc1Br 62a_200000210301_100020589338 [0,0,0,0,0,1|2,0,0]=3 6413 B15R1.1409 CSCCOC(=O)Nc1ccccc1Cl 62a_200000210301_200000178450 [0,0,0,0,0,1|2,0,0]=3 6414 B15R1.1409 CSCSCC(=O)Nc1ccccc1O 62a_100011218213_100000014494 [0,0,0,0,0,1|3,0,0]=4 6415 B15R1.1409 Cc1ccccc1CC(=O)CCCCF 1458a_100000212180_100000729493 [0,0,0,0,0,1|3,0,0]=4 6416 B15R1.1409 Cc1ccccc1CC(=O)CCCCO 1458a_100000212180_100000210776 [0,0,0,0,0,1|3,0,0]=4 6417 B15R1.1409 Cc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000211839 [0,0,0,0,0,1|3,0,0]=4 6418 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 11a_100015189416_100000212180 [0,0,0,0,0,1|3,0,0]=4 6419 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 1626a_100015189416_100000212180 [0,0,0,0,0,1|3,0,0]=4 6420 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 240690a_100015189416_100000212180 [0,0,0,0,0,1|3,0,0]=4 6421 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 527a_100015189416_100000212180 [0,0,0,0,0,1|3,0,0]=4 6422 B15R1.1409 Cc1ccccc1CC(=O)NCCCO 240690a_100000182051_100000212180 [0,0,0,0,0,1|3,0,0]=4 6423 B15R1.1409 Cc1ccccc1CC(=O)NCCCO 527a_100000182051_100000212180 [0,0,0,0,0,1|3,0,0]=4 6424 B15R1.1409 Cc1ccccc1NC(=O)CCCCO 1626a_100015192222_100000695505 [0,0,0,0,0,1|3,0,0]=4 6425 B15R1.1409 Cc1ccccc1NC(=O)NCCCF 2430a_100015192222_100015189416 [0,0,0,0,0,1|3,0,0]=4 6426 B15R1.1409 Cc1ccccc1NC(=O)NCCCO 2430a_100015192222_100000182051 [0,0,0,0,0,1|3,0,0]=4 6427 B15R1.1409 N#CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000211468 [0,0,0,0,0,1|2,0,1]=4 6428 B15R1.1409 N#CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000075515 [0,0,0,0,0,1|2,0,1]=4 6429 B15R1.1409 N#CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000075515 [0,0,0,0,0,1|2,0,1]=4 6430 B15R1.1409 N#CCCNC(=O)Cc1ccccc1O 240690a_100000720768_100000743006 [0,0,0,0,0,1|2,0,1]=4 6431 B15R1.1409 N#CCCNC(=O)Cc1ccccc1O 527a_100000720768_100000743006 [0,0,0,0,0,1|2,0,1]=4 6432 B15R1.1409 N#CCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000720768 [0,0,0,0,0,1|2,0,1]=4 6433 B15R1.1409 O=C(CCCCF)Cc1ccccc1Br 1458a_100000751119_100000729493 [0,0,0,0,0,1|3,0,0]=4 6434 B15R1.1409 O=C(CCCCF)Cc1ccccc1Cl 1458a_100000183793_100000729493 [0,0,0,0,0,1|3,0,0]=4 6435 B15R1.1409 O=C(CCCCF)Cc1ccccc1F 1458a_100000212012_100000729493 [0,0,0,0,0,1|3,0,0]=4 6436 B15R1.1409 O=C(CCCCF)Cc1ccccc1I 1458a_100000036491_100000729493 [0,0,0,0,0,1|3,0,0]=4 6437 B15R1.1409 O=C(CCCCF)Cc1ccccc1O 1458a_100000743006_100000729493 [0,0,0,0,0,1|2,0,0]=3 6438 B15R1.1409 O=C(CCCCO)Cc1ccccc1Br 1458a_100000695505_100000184730 [0,0,0,0,0,1|3,0,0]=4 6439 B15R1.1409 O=C(CCCCO)Cc1ccccc1Br 1458a_100000751119_100000210776 [0,0,0,0,0,1|3,0,0]=4 6440 B15R1.1409 O=C(CCCCO)Cc1ccccc1Cl 1458a_100000183793_100000210776 [0,0,0,0,0,1|3,0,0]=4 6441 B15R1.1409 O=C(CCCCO)Cc1ccccc1Cl 1458a_100000695505_100000187162 [0,0,0,0,0,1|3,0,0]=4 6442 B15R1.1409 O=C(CCCCO)Cc1ccccc1F 1458a_100000212012_100000210776 [0,0,0,0,0,1|3,0,0]=4 6443 B15R1.1409 O=C(CCCCO)Cc1ccccc1F 1458a_100000695505_100000187165 [0,0,0,0,0,1|3,0,0]=4 6444 B15R1.1409 O=C(CCCCO)Cc1ccccc1I 1458a_100000036491_100000210776 [0,0,0,0,0,1|3,0,0]=4 6445 B15R1.1409 O=C(CCCCO)Cc1ccccc1I 1458a_100000695505_100011216222 [0,0,0,0,0,1|3,0,0]=4 6446 B15R1.1409 O=C(CCCCO)Cc1ccccc1O 1458a_100000743006_100000210776 [0,0,0,0,0,1|2,0,0]=3 6447 B15R1.1409 O=C(CCCCO)Cc1ncccc1O 1458a_100000695505_200020655725 [0,0,0,0,0,1|3,0,0]=4 6448 B15R1.1409 O=C(CCCCO)Nc1ccccc1Br 1626a_100000210017_100000695505 [0,0,0,0,0,1|3,0,0]=4 6449 B15R1.1409 O=C(CCCCO)Nc1ccccc1Cl 1626a_100000185783_100000695505 [0,0,0,0,0,1|3,0,0]=4 6450 B15R1.1409 O=C(CCCCO)Nc1ccccc1F 1626a_100000210422_100000695505 [0,0,0,0,0,1|3,0,0]=4 6451 B15R1.1409 O=C(CCCCO)Nc1ccccc1I 1626a_100000210053_100000695505 [0,0,0,0,0,1|3,0,0]=4 6452 B15R1.1409 O=C(CSCCF)Nc1ccccc1O 62a_100011217306_100000014494 [0,0,0,0,0,1|3,0,0]=4 6453 B15R1.1409 O=C(CSCCO)Nc1ccccc1O 62a_100000211926_100000014494 [0,0,0,0,0,1|3,0,0]=4 6454 B15R1.1409 O=C(Cc1ccccc1Br)NCCCF 11a_100015189416_100000751119 [0,0,0,0,0,1|3,0,0]=4 6455 B15R1.1409 O=C(Cc1ccccc1Br)NCCCF 240690a_100015189416_100000751119 [0,0,0,0,0,1|3,0,0]=4 6456 B15R1.1409 O=C(Cc1ccccc1Br)NCCCF 527a_100015189416_100000751119 [0,0,0,0,0,1|3,0,0]=4 6457 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO 240690a_100000182051_100000751119 [0,0,0,0,0,1|3,0,0]=4 6458 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO 527a_100000182051_100000751119 [0,0,0,0,0,1|3,0,0]=4 6459 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 11a_100015189416_100000183793 [0,0,0,0,0,1|3,0,0]=4 6460 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 1626a_100015189416_100000183793 [0,0,0,0,0,1|3,0,0]=4 6461 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 240690a_100015189416_100000183793 [0,0,0,0,0,1|3,0,0]=4 6462 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 527a_100015189416_100000183793 [0,0,0,0,0,1|3,0,0]=4 6463 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO 240690a_100000182051_100000183793 [0,0,0,0,0,1|3,0,0]=4 6464 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO 527a_100000182051_100000183793 [0,0,0,0,0,1|3,0,0]=4 6465 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 11a_100015189416_100000212012 [0,0,0,0,0,1|3,0,0]=4 6466 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 1626a_100015189416_100000212012 [0,0,0,0,0,1|3,0,0]=4 6467 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 240690a_100015189416_100000212012 [0,0,0,0,0,1|3,0,0]=4 6468 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 527a_100015189416_100000212012 [0,0,0,0,0,1|3,0,0]=4 6469 B15R1.1409 O=C(Cc1ccccc1F)NCCCO 240690a_100000182051_100000212012 [0,0,0,0,0,1|3,0,0]=4 6470 B15R1.1409 O=C(Cc1ccccc1F)NCCCO 527a_100000182051_100000212012 [0,0,0,0,0,1|3,0,0]=4 6471 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 11a_100015189416_100000036491 [0,0,0,0,0,1|3,0,0]=4 6472 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 1626a_100015189416_100000036491 [0,0,0,0,0,1|3,0,0]=4 6473 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 240690a_100015189416_100000036491 [0,0,0,0,0,1|3,0,0]=4 6474 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 527a_100015189416_100000036491 [0,0,0,0,0,1|3,0,0]=4 6475 B15R1.1409 O=C(Cc1ccccc1I)NCCCO 240690a_100000182051_100000036491 [0,0,0,0,0,1|3,0,0]=4 6476 B15R1.1409 O=C(Cc1ccccc1I)NCCCO 527a_100000182051_100000036491 [0,0,0,0,0,1|3,0,0]=4 6477 B15R1.1409 O=C(Cc1ccccc1O)NCCCF 240690a_100015189416_100000743006 [0,0,0,0,0,1|2,0,0]=3 6478 B15R1.1409 O=C(Cc1ccccc1O)NCCCF 527a_100015189416_100000743006 [0,0,0,0,0,1|2,0,0]=3 6479 B15R1.1409 O=C(Cc1ccccc1O)NCCCO 240690a_100000182051_100000743006 [0,0,0,0,0,1|2,0,0]=3 6480 B15R1.1409 O=C(Cc1ccccc1O)NCCCO 527a_100000182051_100000743006 [0,0,0,0,0,1|2,0,0]=3 6481 B15R1.1409 O=C(Cc1ccccc1O)NNCCO 22a_100000210001_100000743006 [0,0,0,0,0,1|3,0,0]=4 6482 B15R1.1409 O=C(NCCCF)Nc1ccccc1Br 2430a_100000210017_100015189416 [0,0,0,0,0,1|3,0,0]=4 6483 B15R1.1409 O=C(NCCCF)Nc1ccccc1Cl 2430a_100000185783_100015189416 [0,0,0,0,0,1|3,0,0]=4 6484 B15R1.1409 O=C(NCCCF)Nc1ccccc1F 2430a_100000210422_100015189416 [0,0,0,0,0,1|3,0,0]=4 6485 B15R1.1409 O=C(NCCCF)Nc1ccccc1I 2430a_100000210053_100015189416 [0,0,0,0,0,1|3,0,0]=4 6486 B15R1.1409 O=C(NCCCF)Nc1ccccc1O 2430a_100000185747_100015189416 [0,0,0,0,0,1|2,0,0]=3 6487 B15R1.1409 O=C(NCCCO)Nc1ccccc1Br 2430a_100000210017_100000182051 [0,0,0,0,0,1|3,0,0]=4 6488 B15R1.1409 O=C(NCCCO)Nc1ccccc1Cl 2430a_100000185783_100000182051 [0,0,0,0,0,1|3,0,0]=4 6489 B15R1.1409 O=C(NCCCO)Nc1ccccc1F 2430a_100000210422_100000182051 [0,0,0,0,0,1|3,0,0]=4 6490 B15R1.1409 O=C(NCCCO)Nc1ccccc1I 2430a_100000210053_100000182051 [0,0,0,0,0,1|3,0,0]=4 6491 B15R1.1409 O=C(NCCCO)Nc1ccccc1O 2430a_100000185747_100000182051 [0,0,0,0,0,1|2,0,0]=3 6492 B15R1.1409 [13CH3]SCCOC(=O)Nc1ccccc1Br 62a_100020589338_200025704644 [0,0,0,0,0,1|2,0,0]=3 6493 B15R1.1409 [13CH3]SCCOC(=O)Nc1ccccc1Br 62a_200025704644_100020589338 [0,0,0,0,0,1|2,0,0]=3 6494 B15R1.1409 [13CH3]SCCOC(=O)Nc1ccccc1Cl 62a_200025704644_200000178450 [0,0,0,0,0,1|2,0,0]=3 6495 B12R0.103 C=CC=CC(=O)CC(=O)OCCC 1458a_100016291481_200011215008 [1,0,1,0,0,0|0,0,2]=4 6496 B12R1.8 BrCCCOCc1ccccc1 34a_100011217188_100015291786 [2,0,0,0,0,0|1,0,1]=4 6497 B12R1.8 CCCCC=Cc1ccccc1 271570a_100016275911_100000210277 [2,0,0,0,0,0|1,0,0]=3 6498 B12R1.8 CCCCC=Cc1ccccn1 271570a_100016275911_100011216584 [2,0,0,0,0,0|2,0,0]=4 6499 B12R1.8 CCCCC=Cc1cccnc1 271570a_100016275911_100000752921 [2,0,0,0,0,0|2,0,0]=4 6500 B12R1.8 CCCCC=Cc1ccncc1 271570a_100016275911_100000035832 [2,0,0,0,0,0|2,0,0]=4 6501 B12R1.8 CCCCCNc1ccccc1 34a_100000106764_100000718602 [2,0,0,0,0,0|2,0,0]=4 6502 B12R1.8 CCCCCOc1ccccc1 34a_100000210340_100000718602 [2,0,0,0,0,0|2,0,0]=4 6503 B12R1.8 CCCCCOc1ccccc1 7a_100000210340_100000210326 [2,0,0,0,0,0|2,0,0]=4 6504 B12R1.8 CCCCCSc1ccccc1 62a_100000210326_100000041952 [2,0,0,0,0,0|2,0,0]=4 6505 B12R1.8 CCCCCSc1ccccc1 62a_100000719477_100000210326 [2,0,0,0,0,0|2,0,0]=4 6506 B12R1.8 CCCCNCc1ccccc1 207a_100000102301_100015611070 [2,0,0,0,0,0|1,0,1]=4 6507 B12R1.8 CCCCNCc1ccccc1 2230a_100000102301_100015291786 [2,0,0,0,0,0|1,0,1]=4 6508 B12R1.8 CCCCNCc1ccccc1 2230a_100015324214_100000210211 [2,0,0,0,0,0|1,0,1]=4 6509 B12R1.8 CCCCNCc1ccccc1 270004a_100000102301_100015611070 [2,0,0,0,0,0|1,0,1]=4 6510 B12R1.8 CCCCNCc1ccccc1 34a_100015324214_100000210210 [2,0,0,0,0,0|1,0,1]=4 6511 B12R1.8 CCCCNCc1ccccc1 7a_106832991798_100000211182 [2,0,0,0,0,0|1,0,1]=4 6512 B12R1.8 CCCCOCc1ccccc1 34a_100000210227_100015291786 [2,0,0,0,0,0|0,0,1]=3 6513 B12R1.8 CCCCOCc1ccccc1 34a_100000210790_100000210210 [2,0,0,0,0,0|0,0,1]=3 6514 B12R1.8 CCCCOCc1ccccc1 7a_100000210227_100000211182 [2,0,0,0,0,0|0,0,1]=3 6515 B12R1.8 CCCCOCc1ccccc1 7a_100000210790_100000210211 [2,0,0,0,0,0|0,0,1]=3 6516 B12R1.8 CCCCOCc1ccccn1 34a_100000210227_100000721315 [2,0,0,0,0,0|1,0,1]=4 6517 B12R1.8 CCCCOCc1ccccn1 7a_100000210227_100000721315 [2,0,0,0,0,0|1,0,1]=4 6518 B12R1.8 CCCCOCc1cccnc1 34a_100000210227_100000733263 [2,0,0,0,0,0|1,0,1]=4 6519 B12R1.8 CCCCOCc1cccnc1 7a_100000210227_100000741622 [2,0,0,0,0,0|1,0,1]=4 6520 B12R1.8 CCCCOCc1ccncc1 7a_100000210227_100015193705 [2,0,0,0,0,0|1,0,1]=4 6521 B12R1.8 CCCCSCc1ccccc1 62a_100000210211_100015291786 [2,0,0,0,0,0|0,1,1]=4 6522 B12R1.8 CCCCSCc1ccccc1 62a_100000211182_100000210210 [2,0,0,0,0,0|0,1,1]=4 6523 B12R1.8 CCCNN=Cc1ccccc1 4a_100000740057_100015611070 [2,0,0,0,0,0|2,0,0]=4 6524 B12R1.8 CCNC/C=C/c1ccccc1 2230a_100015525214_100016265936 [2,0,0,0,0,0|2,0,0]=4 6525 B12R1.8 CCNC/C=C/c1ccccc1 2230a_100020603302_100000210202 [2,0,0,0,0,0|2,0,0]=4 6526 B12R1.8 CCNC/C=C/c1ccccc1 34a_100020603302_100000210202 [2,0,0,0,0,0|2,0,0]=4 6527 B12R1.8 CCNCC=Cc1ccccc1 270004a_100015525214_100000210105 [2,0,0,0,0,0|2,0,0]=4 6528 B12R1.8 CCNCOCc1ccccc1 2230a_100015525214_100000763385 [2,0,0,0,0,0|1,0,1]=4 6529 B12R1.8 CCOC/C=C/c1ccccc1 34a_100000210256_100000210202 [2,0,0,0,0,0|2,0,0]=4 6530 B12R1.8 CCOC/C=C/c1ccccc1 34a_100121572206_100016265936 [2,0,0,0,0,0|2,0,0]=4 6531 B12R1.8 CCOCOCc1ccccc1 34a_100121572206_100000763385 [2,0,0,0,0,0|1,0,1]=4 6532 B12R1.8 CCSC/C=C/c1ccccc1 62a_100000210202_100016265936 [2,0,0,0,0,0|2,0,0]=4 6533 B12R1.8 CCSC/C=C/c1ccccc1 62a_100016265936_100000210202 [2,0,0,0,0,0|2,0,0]=4 6534 B12R1.8 CCSCOCc1ccccc1 62a_100000210202_100000763385 [2,0,0,0,0,0|1,0,1]=4 6535 B12R1.8 CCSCOCc1ccccc1 62a_100000763385_100000210202 [2,0,0,0,0,0|1,0,1]=4 6536 B12R1.8 CNCCOCc1ccccc1 2230a_100000753106_200000210301 [2,0,0,0,0,0|1,0,1]=4 6537 B12R1.8 CNCCOCc1ccccc1 2230a_106832991635_100000234347 [2,0,0,0,0,0|1,0,1]=4 6538 B12R1.8 CNCCOCc1ccccc1 34a_100000753106_200000210301 [2,0,0,0,0,0|1,0,1]=4 6539 B12R1.8 CNCCOCc1ccccc1 34a_100102657272_100000234347 [2,0,0,0,0,0|1,0,1]=4 6540 B12R1.8 CNCCOCc1ccccc1 7a_106832991635_100000234347 [2,0,0,0,0,0|1,0,1]=4 6541 B12R1.8 COCCOCc1ccccc1 34a_100000210237_100015291786 [2,0,0,0,0,0|1,0,1]=4 6542 B12R1.8 COCCOCc1ccccc1 34a_100000210790_100011201679 [2,0,0,0,0,0|1,0,1]=4 6543 B12R1.8 COCCOCc1ccccc1 34a_100000759325_200000210301 [2,0,0,0,0,0|1,0,1]=4 6544 B12R1.8 COCCOCc1ccccc1 34a_100138415774_100000234347 [2,0,0,0,0,0|1,0,1]=4 6545 B12R1.8 COCCOCc1ccccc1 7a_100000210790_100000233755 [2,0,0,0,0,0|1,0,1]=4 6546 B12R1.8 COCCOCc1ccccc1 7a_100000759325_200000210301 [2,0,0,0,0,0|1,0,1]=4 6547 B12R1.8 CSCCOCc1ccccc1 34a_100000210790_100000212216 [2,0,0,0,0,0|1,0,1]=4 6548 B12R1.8 CSCCOCc1ccccc1 34a_100000230434_100015291786 [2,0,0,0,0,0|1,0,1]=4 6549 B12R1.8 CSCCOCc1ccccc1 62a_100000234347_200000210301 [2,0,0,0,0,0|1,0,1]=4 6550 B12R1.8 CSCCOCc1ccccc1 62a_200000210301_100000234347 [2,0,0,0,0,0|1,0,1]=4 6551 B12R1.8 CSCCOCc1ccccc1 7a_100000210790_100000212216 [2,0,0,0,0,0|1,0,1]=4 6552 B12R1.8 CSCCOCc1ccccc1 7a_100000230434_100000211182 [2,0,0,0,0,0|1,0,1]=4 6553 B12R1.8 ClCCCOCc1ccccc1 34a_100000230001_100015291786 [2,0,0,0,0,0|1,0,1]=4 6554 B12R1.8 FCCCOCc1ccccc1 34a_100000210790_100011934791 [2,0,0,0,0,0|1,0,1]=4 6555 B12R1.8 FCCCOCc1ccccc1 34a_100000759539_100015291786 [2,0,0,0,0,0|1,0,1]=4 6556 B12R1.8 FCCCOCc1ccccc1 7a_100000210790_100011934791 [2,0,0,0,0,0|1,0,1]=4 6557 B12R1.8 NCCCOCc1ccccc1 34a_100000182051_100015291786 [2,0,0,0,0,0|1,0,1]=4 6558 B12R1.8 OCCCOCc1ccccc1 34a_100000210790_100000230001 [2,0,0,0,0,0|1,0,1]=4 6559 B12R1.8 OCCCOCc1ccccc1 7a_100000210790_100011215043 [2,0,0,0,0,0|1,0,1]=4 6560 B12R1.8 [13CH3]NCCOCc1ccccc1 2230a_100000753106_200025704644 [2,0,0,0,0,0|1,0,1]=4 6561 B12R1.8 [13CH3]NCCOCc1ccccc1 34a_100000753106_200025704644 [2,0,0,0,0,0|1,0,1]=4 6562 B12R1.8 [13CH3]OCCOCc1ccccc1 34a_100000759325_200025704644 [2,0,0,0,0,0|1,0,1]=4 6563 B12R1.8 [13CH3]OCCOCc1ccccc1 7a_100000759325_200025704644 [2,0,0,0,0,0|1,0,1]=4 6564 B12R1.8 [13CH3]SCCOCc1ccccc1 62a_100000234347_200025704644 [2,0,0,0,0,0|1,0,1]=4 6565 B12R1.8 [13CH3]SCCOCc1ccccc1 62a_200025704644_100000234347 [2,0,0,0,0,0|1,0,1]=4 6566 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [2,0,0,0,0,0|0,0,2]=4 6567 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [2,0,0,0,0,0|0,0,2]=4 6568 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [2,0,0,0,0,0|0,0,2]=4 6569 B12R1.30 CC#CCC(=O)c1ccccc1 1458a_100000185807_100000748600 [2,0,0,0,0,0|0,0,2]=4 6570 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [2,0,0,0,0,0|0,0,2]=4 6571 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [2,0,0,0,0,0|0,0,0]=2 6572 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000210012_100000210211 [2,0,0,0,0,0|2,0,0]=4 6573 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000211623_200000210301 [2,0,0,0,0,0|2,0,0]=4 6574 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000210012_100000210211 [2,0,0,0,0,0|2,0,0]=4 6575 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000211623_200000210301 [2,0,0,0,0,0|2,0,0]=4 6576 B12R1.30 CCCCN(C)c1ccccc1 34a_100000210012_100000210210 [2,0,0,0,0,0|2,0,0]=4 6577 B12R1.30 CCCCN(C)c1ccccc1 34a_100000211623_200000210301 [2,0,0,0,0,0|2,0,0]=4 6578 B12R1.30 CCCCN([13CH3])c1ccccc1 2230a_100000211623_200025704644 [2,0,0,0,0,0|2,0,0]=4 6579 B12R1.30 CCCCN([13CH3])c1ccccc1 269982a_100000211623_200025704644 [2,0,0,0,0,0|2,0,0]=4 6580 B12R1.30 CCCCN([13CH3])c1ccccc1 34a_100000211623_200025704644 [2,0,0,0,0,0|2,0,0]=4 6581 B12R1.30 CCCNC(=O)c1ccccc1 11a_100020643023_100000185807 [2,0,0,0,0,0|1,0,0]=3 6582 B12R1.30 CCCNC(=O)c1ccccc1 1626a_100020643023_100000185807 [2,0,0,0,0,0|1,0,0]=3 6583 B12R1.30 CCCNC(=O)c1ccccc1 240690a_100020643023_100000185807 [2,0,0,0,0,0|1,0,0]=3 6584 B12R1.30 CCCNC(=O)c1ccccc1 527a_100020643023_100000185807 [2,0,0,0,0,0|1,0,0]=3 6585 B12R1.30 CCCOC(C)c1ccccc1 34a_100000210258_100000211855 [2,0,0,0,0,0|1,0,1]=4 6586 B12R1.30 CCCO[C@H](C)c1ccccc1 34a_100000761318_100000210303 [2,0,0,0,0,0|1,0,1]=4 6587 B12R1.30 CCCO[C@H](C)c1ccccc1 7a_100000761318_100000210303 [2,0,0,0,0,0|1,0,1]=4 6588 B12R1.30 CCNNC(=O)c1ccccc1 22a_100000756455_100000185807 [2,0,0,0,0,0|2,0,0]=4 6589 B12R1.30 CCOCC(=O)c1ccccn1 34a_100121572206_100000027445 [2,0,0,0,0,0|2,0,0]=4 6590 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000210202_100000211460 [2,0,0,0,0,0|1,0,0]=3 6591 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000211460_100000210202 [2,0,0,0,0,0|1,0,0]=3 6592 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000027445_100000210202 [2,0,0,0,0,0|2,0,0]=4 6593 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000210202_100000027445 [2,0,0,0,0,0|2,0,0]=4 6594 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000210202_100000757877 [2,0,0,0,0,0|2,0,0]=4 6595 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000757877_100000210202 [2,0,0,0,0,0|2,0,0]=4 6596 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000027454_100000210202 [2,0,0,0,0,0|2,0,0]=4 6597 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000210202_100000027454 [2,0,0,0,0,0|2,0,0]=4 6598 B12R1.30 CCSCS(=O)c1ccccc1 62a_100000210202_100000031784 [2,0,0,0,0,0|2,0,0]=4 6599 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [2,0,0,0,0,0|1,0,0]=3 6600 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [2,0,0,0,0,0|1,0,0]=3 6601 B12R1.30 CNCCS(=O)c1ccccc1 2230a_106832991635_100000740319 [2,0,0,0,0,0|2,0,0]=4 6602 B12R1.30 CNCCS(=O)c1ccccc1 7a_106832991635_100000740319 [2,0,0,0,0,0|2,0,0]=4 6603 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [2,0,0,0,0,0|1,0,0]=3 6604 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [2,0,0,0,0,0|1,0,0]=3 6605 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [2,0,0,0,0,0|1,0,0]=3 6606 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [2,0,0,0,0,0|1,0,0]=3 6607 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [2,0,0,0,0,0|1,0,0]=3 6608 B12R1.30 CSCCS(=O)c1ccccc1 62a_200000210301_100000740319 [2,0,0,0,0,0|2,0,0]=4 6609 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [2,0,0,0,0,0|1,0,0]=3 6610 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [2,0,0,0,0,0|1,0,0]=3 6611 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [2,0,0,0,0,0|1,0,1]=4 6612 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [2,0,0,0,0,0|1,0,0]=3 6613 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [2,0,0,0,0,0|1,0,0]=3 6614 B12R1.30 O=C(CSCF)c1ccccc1 62a_100000211460_100015361967 [2,0,0,0,0,0|2,0,0]=4 6615 B12R1.30 O=C(CSCF)c1ccccc1 62a_100015361967_100000211460 [2,0,0,0,0,0|2,0,0]=4 6616 B12R1.30 O=C(NCCF)c1ccccc1 11a_100000724931_100000185807 [2,0,0,0,0,0|2,0,0]=4 6617 B12R1.30 O=C(NCCF)c1ccccc1 1626a_100000724931_100000185807 [2,0,0,0,0,0|2,0,0]=4 6618 B12R1.30 O=C(NCCF)c1ccccc1 240690a_100000724931_100000185807 [2,0,0,0,0,0|2,0,0]=4 6619 B12R1.30 O=C(NCCF)c1ccccc1 527a_100000724931_100000185807 [2,0,0,0,0,0|2,0,0]=4 6620 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [2,0,0,0,0,0|2,0,0]=4 6621 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [2,0,0,0,0,0|2,0,0]=4 6622 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [2,0,0,0,0,0|1,0,0]=3 6623 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [2,0,0,0,0,0|1,0,0]=3 6624 B12R1.30 [13CH3]SCCS(=O)c1ccccc1 62a_200025704644_100000740319 [2,0,0,0,0,0|2,0,0]=4 6625 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [2,0,0,0,0,0|1,0,0]=3 6626 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [2,0,0,0,0,0|1,0,0]=3 6627 B12R1.267 CCCC=Cc1ccccc1Br 271570a_100016258520_100000695589 [2,0,0,0,0,0|1,0,1]=4 6628 B12R1.267 CCCC=Cc1ccccc1C 271570a_100016258520_100000210755 [2,0,0,0,0,0|1,0,1]=4 6629 B12R1.267 CCCC=Cc1ccccc1Cl 271570a_100016258520_100000764095 [2,0,0,0,0,0|1,0,1]=4 6630 B12R1.267 CCCC=Cc1ccccc1F 271570a_100016258520_100011215700 [2,0,0,0,0,0|1,0,1]=4 6631 B12R1.267 CCCC=Cc1ccccc1N 271570a_100016258520_100000210017 [2,0,0,0,0,0|1,0,1]=4 6632 B12R1.267 CCCC=Cc1ccccc1O 271570a_100016258520_100000739446 [2,0,0,0,0,0|0,0,1]=3 6633 B12R1.267 CCCC=Cc1ccncc1O 271570a_100016258520_100009817591 [2,0,0,0,0,0|1,0,1]=4 6634 B12R1.267 CCCC=Cc1ncccc1O 271570a_100016258520_100000034122 [2,0,0,0,0,0|1,0,1]=4 6635 B12R1.267 CCCCNc1ccccc1Br 34a_100000210017_100000210210 [2,0,0,0,0,0|2,0,0]=4 6636 B12R1.267 CCCCNc1ccccc1C 34a_100015192222_100000210210 [2,0,0,0,0,0|2,0,0]=4 6637 B12R1.267 CCCCNc1ccccc1Cl 34a_100000185783_100000210210 [2,0,0,0,0,0|2,0,0]=4 6638 B12R1.267 CCCCNc1ccccc1F 34a_100000210422_100000210210 [2,0,0,0,0,0|2,0,0]=4 6639 B12R1.267 CCCCNc1ccccc1I 34a_100000210053_100000210210 [2,0,0,0,0,0|2,0,0]=4 6640 B12R1.267 CCCCNc1ccccc1O 34a_100000185747_100000210210 [2,0,0,0,0,0|1,0,0]=3 6641 B12R1.267 CCCCOc1cccc[n+]1[O-] 7a_100000211761_100000210211 [2,0,0,0,0,0|1,0,1]=4 6642 B12R1.267 CCCCOc1ccccc1Br 34a_100000181306_100000210210 [2,0,0,0,0,0|1,0,0]=3 6643 B12R1.267 CCCCOc1ccccc1Br 7a_100000181306_100000210211 [2,0,0,0,0,0|1,0,0]=3 6644 B12R1.267 CCCCOc1ccccc1C 34a_100000210338_100000210210 [2,0,0,0,0,0|1,0,0]=3 6645 B12R1.267 CCCCOc1ccccc1C 7a_100000210338_100000210211 [2,0,0,0,0,0|1,0,0]=3 6646 B12R1.267 CCCCOc1ccccc1Cl 34a_100000210172_100000210210 [2,0,0,0,0,0|1,0,0]=3 6647 B12R1.267 CCCCOc1ccccc1Cl 7a_100000210172_100000210211 [2,0,0,0,0,0|1,0,0]=3 6648 B12R1.267 CCCCOc1ccccc1F 34a_100000210171_100000210210 [2,0,0,0,0,0|1,0,0]=3 6649 B12R1.267 CCCCOc1ccccc1F 7a_100000210171_100000210211 [2,0,0,0,0,0|1,0,0]=3 6650 B12R1.267 CCCCOc1ccccc1I 34a_100000739446_100000210210 [2,0,0,0,0,0|1,0,0]=3 6651 B12R1.267 CCCCOc1ccccc1I 7a_100000739446_100000210211 [2,0,0,0,0,0|1,0,0]=3 6652 B12R1.267 CCCCOc1ccccc1N 34a_100000185747_100000210210 [2,0,0,0,0,0|1,0,0]=3 6653 B12R1.267 CCCCOc1ccccc1N 7a_100000185747_100000210211 [2,0,0,0,0,0|1,0,0]=3 6654 B12R1.267 CCCCOc1ccccc1O 271570a_203496583355_100000230755 [2,0,0,0,0,0|0,0,0]=2 6655 B12R1.267 CCCCOc1cccnc1Br 34a_100000744436_100000210210 [2,0,0,0,0,0|2,0,0]=4 6656 B12R1.267 CCCCOc1cccnc1Br 7a_100000744436_100000210211 [2,0,0,0,0,0|2,0,0]=4 6657 B12R1.267 CCCCOc1cccnc1C 34a_100000745507_100000210210 [2,0,0,0,0,0|2,0,0]=4 6658 B12R1.267 CCCCOc1cccnc1C 7a_100000745507_100000210211 [2,0,0,0,0,0|2,0,0]=4 6659 B12R1.267 CCCCOc1cccnc1Cl 34a_100000757616_100000210210 [2,0,0,0,0,0|2,0,0]=4 6660 B12R1.267 CCCCOc1cccnc1Cl 7a_100000757616_100000210211 [2,0,0,0,0,0|2,0,0]=4 6661 B12R1.267 CCCCOc1cccnc1F 34a_100000061740_100000210210 [2,0,0,0,0,0|2,0,0]=4 6662 B12R1.267 CCCCOc1cccnc1F 7a_100000061740_100000210211 [2,0,0,0,0,0|2,0,0]=4 6663 B12R1.267 CCCCOc1cccnc1I 34a_100000034122_100000210210 [2,0,0,0,0,0|2,0,0]=4 6664 B12R1.267 CCCCOc1cccnc1I 7a_100000034122_100000210211 [2,0,0,0,0,0|2,0,0]=4 6665 B12R1.267 CCCCOc1cccnc1N 34a_100000211975_100000210210 [2,0,0,0,0,0|2,0,0]=4 6666 B12R1.267 CCCCOc1cccnc1N 7a_100000211975_100000210211 [2,0,0,0,0,0|2,0,0]=4 6667 B12R1.267 CCCCOc1cccoc1=O 34a_100000077404_100000210210 [2,0,0,0,0,0|1,0,1]=4 6668 B12R1.267 CCCCOc1cccoc1=O 7a_100000077404_100000210211 [2,0,0,0,0,0|1,0,1]=4 6669 B12R1.267 CCCCOc1ccncc1Br 34a_100011996408_100000210210 [2,0,0,0,0,0|2,0,0]=4 6670 B12R1.267 CCCCOc1ccncc1C 34a_100000694293_100000210210 [2,0,0,0,0,0|2,0,0]=4 6671 B12R1.267 CCCCOc1ccncc1Cl 34a_100011997054_100000210210 [2,0,0,0,0,0|2,0,0]=4 6672 B12R1.267 CCCCOc1ccncc1F 34a_200000081243_100000210210 [2,0,0,0,0,0|2,0,0]=4 6673 B12R1.267 CCCCOc1cnccc1C 34a_100011997053_100000210210 [2,0,0,0,0,0|2,0,0]=4 6674 B12R1.267 CCCCOc1cnccc1C 7a_100011997053_100000210211 [2,0,0,0,0,0|2,0,0]=4 6675 B12R1.267 CCCCOc1cnccc1Cl 34a_100011996695_100000210210 [2,0,0,0,0,0|2,0,0]=4 6676 B12R1.267 CCCCOc1cnccc1I 34a_100000050107_100000210210 [2,0,0,0,0,0|2,0,0]=4 6677 B12R1.267 CCCCOc1cnccc1N 34a_100000753702_100000210210 [2,0,0,0,0,0|2,0,0]=4 6678 B12R1.267 CCCCOc1coccc1=O 34a_100000060831_100000210210 [2,0,0,0,0,0|1,0,1]=4 6679 B12R1.267 CCCCOc1ncccc1Cl 34a_100011290957_100000210210 [2,0,0,0,0,0|2,0,0]=4 6680 B12R1.267 CCCCOc1ncccc1F 34a_100011219419_100000210210 [2,0,0,0,0,0|2,0,0]=4 6681 B12R1.267 CCCCOc1ncccc1N 34a_100000746358_100000210210 [2,0,0,0,0,0|2,0,0]=4 6682 B12R1.267 CCCCSc1ccccc1Br 62a_100000210211_100000695589 [2,0,0,0,0,0|1,1,0]=4 6683 B12R1.267 CCCCSc1ccccc1Br 62a_100000695589_100000210210 [2,0,0,0,0,0|1,1,0]=4 6684 B12R1.267 CCCCSc1ccccc1C 62a_100000210211_100000210755 [2,0,0,0,0,0|1,1,0]=4 6685 B12R1.267 CCCCSc1ccccc1C 62a_100000210755_100000210210 [2,0,0,0,0,0|1,1,0]=4 6686 B12R1.267 CCCCSc1ccccc1Cl 62a_100000210211_100000764095 [2,0,0,0,0,0|1,1,0]=4 6687 B12R1.267 CCCCSc1ccccc1Cl 62a_100000764095_100000210210 [2,0,0,0,0,0|1,1,0]=4 6688 B12R1.267 CCCCSc1ccccc1F 62a_100000210211_100011215700 [2,0,0,0,0,0|1,1,0]=4 6689 B12R1.267 CCCCSc1ccccc1F 62a_100011215700_100000210210 [2,0,0,0,0,0|1,1,0]=4 6690 B12R1.267 CCCCSc1ccccc1N 62a_100000210017_100000210210 [2,0,0,0,0,0|1,1,0]=4 6691 B12R1.267 CCCCSc1ccccc1N 62a_100000210211_100000210017 [2,0,0,0,0,0|1,1,0]=4 6692 B12R1.267 CCCCSc1ccccc1O 62a_100000210211_100000739446 [2,0,0,0,0,0|0,1,0]=3 6693 B12R1.267 CCCCSc1ccccc1O 62a_100000739446_100000210210 [2,0,0,0,0,0|0,1,0]=3 6694 B12R1.267 CCCCSc1cccnc1O 62a_100000210211_100000760158 [2,0,0,0,0,0|1,1,0]=4 6695 B12R1.267 CCCCSc1cccnc1O 62a_100000760158_100000210210 [2,0,0,0,0,0|1,1,0]=4 6696 B12R1.267 CCCCSc1ccncc1O 62a_100000210211_100009817591 [2,0,0,0,0,0|1,1,0]=4 6697 B12R1.267 CCCCSc1ccncc1O 62a_100009817591_100000210210 [2,0,0,0,0,0|1,1,0]=4 6698 B12R1.267 CCCCSc1ncccc1O 62a_100000034122_100000210210 [2,0,0,0,0,0|1,1,0]=4 6699 B12R1.267 CCCCSc1ncccc1O 62a_100000210211_100000034122 [2,0,0,0,0,0|1,1,0]=4 6700 B12R1.267 CCCNCc1ccccc1O 271570a_203496583355_100000196483 [2,0,0,0,0,0|1,0,1]=4 6701 B12R1.267 CCCNCc1ccccc1O 34a_100000185550_100000210303 [2,0,0,0,0,0|1,0,1]=4 6702 B12R1.267 CCCOCc1ccccc1Br 34a_100000210258_100000184730 [2,0,0,0,0,0|1,0,1]=4 6703 B12R1.267 CCCOCc1ccccc1Br 34a_100000756307_100000210303 [2,0,0,0,0,0|1,0,1]=4 6704 B12R1.267 CCCOCc1ccccc1Br 7a_100000756307_100000210303 [2,0,0,0,0,0|1,0,1]=4 6705 B12R1.267 CCCOCc1ccccc1C 34a_100000210258_100000211839 [2,0,0,0,0,0|1,0,1]=4 6706 B12R1.267 CCCOCc1ccccc1C 34a_100000698903_100000210303 [2,0,0,0,0,0|1,0,1]=4 6707 B12R1.267 CCCOCc1ccccc1C 7a_100000698903_100000210303 [2,0,0,0,0,0|1,0,1]=4 6708 B12R1.267 CCCOCc1ccccc1Cl 34a_100000210258_100000187162 [2,0,0,0,0,0|1,0,1]=4 6709 B12R1.267 CCCOCc1ccccc1Cl 34a_100000210847_100000210303 [2,0,0,0,0,0|1,0,1]=4 6710 B12R1.267 CCCOCc1ccccc1Cl 7a_100000210847_100000210303 [2,0,0,0,0,0|1,0,1]=4 6711 B12R1.267 CCCOCc1ccccc1F 34a_100000210258_100000211605 [2,0,0,0,0,0|1,0,1]=4 6712 B12R1.267 CCCOCc1ccccc1F 34a_100000211962_100000210303 [2,0,0,0,0,0|1,0,1]=4 6713 B12R1.267 CCCOCc1ccccc1F 7a_100000211962_100000210303 [2,0,0,0,0,0|1,0,1]=4 6714 B12R1.267 CCCOCc1ccccc1I 34a_100000187465_100000210303 [2,0,0,0,0,0|1,0,1]=4 6715 B12R1.267 CCCOCc1ccccc1I 34a_100000210258_100011215278 [2,0,0,0,0,0|1,0,1]=4 6716 B12R1.267 CCCOCc1ccccc1I 7a_100000187465_100000210303 [2,0,0,0,0,0|1,0,1]=4 6717 B12R1.267 CCCOCc1ccccc1N 34a_100000212039_100000210303 [2,0,0,0,0,0|1,0,1]=4 6718 B12R1.267 CCCOCc1ncccc1O 34a_100000210258_200020655725 [2,0,0,0,0,0|1,0,1]=4 6719 B12R1.267 CCCSCc1ccccc1O 271570a_203496583355_200000173363 [2,0,0,0,0,0|0,1,1]=4 6720 B12R1.267 CCNCCc1ccccc1O 34a_100011207237_100000210202 [2,0,0,0,0,0|1,0,1]=4 6721 B12R1.267 CCNN=Cc1ccccc1O 4a_100000756455_100000185834 [2,0,0,0,0,0|2,0,0]=4 6722 B12R1.267 CCOC=Cc1ccccc1O 271570a_100016256518_100000739446 [2,0,0,0,0,0|1,0,1]=4 6723 B12R1.267 CCOCCc1ccccc1O 34a_100121572206_100000722297 [2,0,0,0,0,0|1,0,1]=4 6724 B12R1.267 CCOCSc1ccccc1O 62a_100000739092_100000739446 [2,0,0,0,0,0|1,1,0]=4 6725 B12R1.267 CCOCSc1ccccc1O 62a_100000739446_100000739092 [2,0,0,0,0,0|1,1,0]=4 6726 B12R1.267 CCSCCc1ccccc1O 62a_100000210202_100000722297 [2,0,0,0,0,0|1,0,1]=4 6727 B12R1.267 CCSCCc1ccccc1O 62a_100000722297_100000210202 [2,0,0,0,0,0|1,0,1]=4 6728 B12R1.267 CNCCOc1ccccc1Br 2230a_100000744007_200000210301 [2,0,0,0,0,0|2,0,0]=4 6729 B12R1.267 CNCCOc1ccccc1Br 2230a_106832991635_100000695877 [2,0,0,0,0,0|2,0,0]=4 6730 B12R1.267 CNCCOc1ccccc1Br 34a_100000744007_200000210301 [2,0,0,0,0,0|2,0,0]=4 6731 B12R1.267 CNCCOc1ccccc1Br 34a_100102657272_100000695877 [2,0,0,0,0,0|2,0,0]=4 6732 B12R1.267 CNCCOc1ccccc1Br 7a_106832991635_100000695877 [2,0,0,0,0,0|2,0,0]=4 6733 B12R1.267 CNCCOc1ccccc1C 2230a_100000743344_200000210301 [2,0,0,0,0,0|2,0,0]=4 6734 B12R1.267 CNCCOc1ccccc1C 2230a_106832991635_100000184434 [2,0,0,0,0,0|2,0,0]=4 6735 B12R1.267 CNCCOc1ccccc1C 34a_100000743344_200000210301 [2,0,0,0,0,0|2,0,0]=4 6736 B12R1.267 CNCCOc1ccccc1C 34a_100102657272_100000184434 [2,0,0,0,0,0|2,0,0]=4 6737 B12R1.267 CNCCOc1ccccc1C 7a_106832991635_100000184434 [2,0,0,0,0,0|2,0,0]=4 6738 B12R1.267 CNCCOc1ccccc1Cl 2230a_100000174932_200000210301 [2,0,0,0,0,0|2,0,0]=4 6739 B12R1.267 CNCCOc1ccccc1Cl 34a_100000174932_200000210301 [2,0,0,0,0,0|2,0,0]=4 6740 B12R1.267 CNCCOc1ccccc1F 2230a_100000683764_200000210301 [2,0,0,0,0,0|2,0,0]=4 6741 B12R1.267 CNCCOc1ccccc1F 2230a_106832991635_100000183290 [2,0,0,0,0,0|2,0,0]=4 6742 B12R1.267 CNCCOc1ccccc1F 34a_100000683764_200000210301 [2,0,0,0,0,0|2,0,0]=4 6743 B12R1.267 CNCCOc1ccccc1F 34a_100102657272_100000183290 [2,0,0,0,0,0|2,0,0]=4 6744 B12R1.267 CNCCOc1ccccc1F 7a_106832991635_100000183290 [2,0,0,0,0,0|2,0,0]=4 6745 B12R1.267 COCC=Cc1ccccc1O 271570a_100016286323_100000739446 [2,0,0,0,0,0|1,0,1]=4 6746 B12R1.267 COCCNc1ccccc1O 34a_100000185747_100011201679 [2,0,0,0,0,0|2,0,0]=4 6747 B12R1.267 COCCOc1ccccc1Br 34a_100000181306_100011201679 [2,0,0,0,0,0|2,0,0]=4 6748 B12R1.267 COCCOc1ccccc1Br 34a_100000230753_200000210301 [2,0,0,0,0,0|2,0,0]=4 6749 B12R1.267 COCCOc1ccccc1Br 34a_100138415774_100000695877 [2,0,0,0,0,0|2,0,0]=4 6750 B12R1.267 COCCOc1ccccc1Br 7a_100000181306_100000233755 [2,0,0,0,0,0|2,0,0]=4 6751 B12R1.267 COCCOc1ccccc1Br 7a_100000230753_200000210301 [2,0,0,0,0,0|2,0,0]=4 6752 B12R1.267 COCCOc1ccccc1C 34a_100000210338_100011201679 [2,0,0,0,0,0|2,0,0]=4 6753 B12R1.267 COCCOc1ccccc1C 34a_100138415774_100000184434 [2,0,0,0,0,0|2,0,0]=4 6754 B12R1.267 COCCOc1ccccc1C 7a_100000210338_100000233755 [2,0,0,0,0,0|2,0,0]=4 6755 B12R1.267 COCCOc1ccccc1Cl 34a_100000210172_100011201679 [2,0,0,0,0,0|2,0,0]=4 6756 B12R1.267 COCCOc1ccccc1Cl 34a_200000230518_200000210301 [2,0,0,0,0,0|2,0,0]=4 6757 B12R1.267 COCCOc1ccccc1Cl 7a_100000210172_100000233755 [2,0,0,0,0,0|2,0,0]=4 6758 B12R1.267 COCCOc1ccccc1Cl 7a_200000230518_200000210301 [2,0,0,0,0,0|2,0,0]=4 6759 B12R1.267 COCCOc1ccccc1F 34a_100000210171_100011201679 [2,0,0,0,0,0|2,0,0]=4 6760 B12R1.267 COCCOc1ccccc1F 34a_100000756447_200000210301 [2,0,0,0,0,0|2,0,0]=4 6761 B12R1.267 COCCOc1ccccc1F 34a_100138415774_100000183290 [2,0,0,0,0,0|2,0,0]=4 6762 B12R1.267 COCCOc1ccccc1F 7a_100000210171_100000233755 [2,0,0,0,0,0|2,0,0]=4 6763 B12R1.267 COCCOc1ccccc1F 7a_100000756447_200000210301 [2,0,0,0,0,0|2,0,0]=4 6764 B12R1.267 COCCOc1ccccc1I 34a_100000739446_100011201679 [2,0,0,0,0,0|2,0,0]=4 6765 B12R1.267 COCCOc1ccccc1I 7a_100000739446_100000233755 [2,0,0,0,0,0|2,0,0]=4 6766 B12R1.267 COCCOc1ccccc1N 34a_100000185747_100011201679 [2,0,0,0,0,0|2,0,0]=4 6767 B12R1.267 COCCOc1ccccc1N 34a_100132302172_200000210301 [2,0,0,0,0,0|2,0,0]=4 6768 B12R1.267 COCCOc1ccccc1N 7a_100000185747_100000233755 [2,0,0,0,0,0|2,0,0]=4 6769 B12R1.267 COCCOc1ccccc1O 271570a_203496583355_100000234100 [2,0,0,0,0,0|1,0,0]=3 6770 B12R1.267 COCCOc1ncccc1O 271570a_203496583355_100000754258 [2,0,0,0,0,0|2,0,0]=4 6771 B12R1.267 COCCSc1ccccc1O 271570a_203496583355_200016336083 [2,0,0,0,0,0|1,1,0]=4 6772 B12R1.267 COCCSc1ccccc1O 62a_100000233755_100000739446 [2,0,0,0,0,0|1,1,0]=4 6773 B12R1.267 COCCSc1ccccc1O 62a_100000739446_100000233755 [2,0,0,0,0,0|1,1,0]=4 6774 B12R1.267 CSCCNc1ccccc1O 34a_100000185747_100000212216 [2,0,0,0,0,0|2,0,0]=4 6775 B12R1.267 CSCCOc1ccccc1Br 34a_100000181306_100000212216 [2,0,0,0,0,0|2,0,0]=4 6776 B12R1.267 CSCCOc1ccccc1Br 62a_100000695877_200000210301 [2,0,0,0,0,0|2,0,0]=4 6777 B12R1.267 CSCCOc1ccccc1Br 62a_200000210301_100000695877 [2,0,0,0,0,0|2,0,0]=4 6778 B12R1.267 CSCCOc1ccccc1Br 7a_100000181306_100000212216 [2,0,0,0,0,0|2,0,0]=4 6779 B12R1.267 CSCCOc1ccccc1C 34a_100000210338_100000212216 [2,0,0,0,0,0|2,0,0]=4 6780 B12R1.267 CSCCOc1ccccc1C 62a_100000184434_200000210301 [2,0,0,0,0,0|2,0,0]=4 6781 B12R1.267 CSCCOc1ccccc1C 62a_200000210301_100000184434 [2,0,0,0,0,0|2,0,0]=4 6782 B12R1.267 CSCCOc1ccccc1C 7a_100000210338_100000212216 [2,0,0,0,0,0|2,0,0]=4 6783 B12R1.267 CSCCOc1ccccc1Cl 34a_100000210172_100000212216 [2,0,0,0,0,0|2,0,0]=4 6784 B12R1.267 CSCCOc1ccccc1Cl 7a_100000210172_100000212216 [2,0,0,0,0,0|2,0,0]=4 6785 B12R1.267 CSCCOc1ccccc1F 34a_100000210171_100000212216 [2,0,0,0,0,0|2,0,0]=4 6786 B12R1.267 CSCCOc1ccccc1F 62a_100000183290_200000210301 [2,0,0,0,0,0|2,0,0]=4 6787 B12R1.267 CSCCOc1ccccc1F 62a_200000210301_100000183290 [2,0,0,0,0,0|2,0,0]=4 6788 B12R1.267 CSCCOc1ccccc1F 7a_100000210171_100000212216 [2,0,0,0,0,0|2,0,0]=4 6789 B12R1.267 CSCCOc1ccccc1I 34a_100000739446_100000212216 [2,0,0,0,0,0|2,0,0]=4 6790 B12R1.267 CSCCOc1ccccc1I 7a_100000739446_100000212216 [2,0,0,0,0,0|2,0,0]=4 6791 B12R1.267 CSCCOc1ccccc1N 34a_100000185747_100000212216 [2,0,0,0,0,0|2,0,0]=4 6792 B12R1.267 CSCCOc1ccccc1N 7a_100000185747_100000212216 [2,0,0,0,0,0|2,0,0]=4 6793 B12R1.267 CSCCSc1ccccc1O 62a_100000212216_100000739446 [2,0,0,0,0,0|1,1,0]=4 6794 B12R1.267 CSCCSc1ccccc1O 62a_100000739446_100000751147 [2,0,0,0,0,0|1,1,0]=4 6795 B12R1.267 Cc1ccccc1OCCCF 34a_100000210338_100011934791 [2,0,0,0,0,0|2,0,0]=4 6796 B12R1.267 Cc1ccccc1OCCCF 7a_100000210338_100011934791 [2,0,0,0,0,0|2,0,0]=4 6797 B12R1.267 Cc1ccccc1OCCCO 34a_100000210338_100000230001 [2,0,0,0,0,0|2,0,0]=4 6798 B12R1.267 Cc1ccccc1OCCCO 7a_100000210338_100011215043 [2,0,0,0,0,0|2,0,0]=4 6799 B12R1.267 Cc1ccccc1OCCN[13CH3] 2230a_100000743344_200025704644 [2,0,0,0,0,0|2,0,0]=4 6800 B12R1.267 Cc1ccccc1OCCN[13CH3] 34a_100000743344_200025704644 [2,0,0,0,0,0|2,0,0]=4 6801 B12R1.267 Cc1ccccc1OCCS[13CH3] 62a_100000184434_200025704644 [2,0,0,0,0,0|2,0,0]=4 6802 B12R1.267 Cc1ccccc1OCCS[13CH3] 62a_200025704644_100000184434 [2,0,0,0,0,0|2,0,0]=4 6803 B12R1.267 FCCCOc1ccccc1Br 34a_100000181306_100011934791 [2,0,0,0,0,0|2,0,0]=4 6804 B12R1.267 FCCCOc1ccccc1Br 7a_100000181306_100011934791 [2,0,0,0,0,0|2,0,0]=4 6805 B12R1.267 FCCCOc1ccccc1Cl 34a_100000210172_100011934791 [2,0,0,0,0,0|2,0,0]=4 6806 B12R1.267 FCCCOc1ccccc1Cl 7a_100000210172_100011934791 [2,0,0,0,0,0|2,0,0]=4 6807 B12R1.267 FCCCOc1ccccc1F 34a_100000210171_100011934791 [2,0,0,0,0,0|2,0,0]=4 6808 B12R1.267 FCCCOc1ccccc1F 7a_100000210171_100011934791 [2,0,0,0,0,0|2,0,0]=4 6809 B12R1.267 FCCCOc1ccccc1I 34a_100000739446_100011934791 [2,0,0,0,0,0|2,0,0]=4 6810 B12R1.267 FCCCOc1ccccc1I 7a_100000739446_100011934791 [2,0,0,0,0,0|2,0,0]=4 6811 B12R1.267 Nc1ccccc1OCCCF 34a_100000185747_100011934791 [2,0,0,0,0,0|2,0,0]=4 6812 B12R1.267 Nc1ccccc1OCCCF 7a_100000185747_100011934791 [2,0,0,0,0,0|2,0,0]=4 6813 B12R1.267 Nc1ccccc1OCCCO 34a_100000185747_100000230001 [2,0,0,0,0,0|2,0,0]=4 6814 B12R1.267 Nc1ccccc1OCCCO 7a_100000185747_100011215043 [2,0,0,0,0,0|2,0,0]=4 6815 B12R1.267 OCCCCc1ccccc1O 271570a_203496583355_100012092669 [2,0,0,0,0,0|1,0,1]=4 6816 B12R1.267 OCCCNc1ccccc1O 34a_100000185747_100000230001 [2,0,0,0,0,0|2,0,0]=4 6817 B12R1.267 OCCCOc1ccccc1Br 34a_100000181306_100000230001 [2,0,0,0,0,0|2,0,0]=4 6818 B12R1.267 OCCCOc1ccccc1Br 7a_100000181306_100011215043 [2,0,0,0,0,0|2,0,0]=4 6819 B12R1.267 OCCCOc1ccccc1Cl 34a_100000210172_100000230001 [2,0,0,0,0,0|2,0,0]=4 6820 B12R1.267 OCCCOc1ccccc1Cl 7a_100000210172_100011215043 [2,0,0,0,0,0|2,0,0]=4 6821 B12R1.267 OCCCOc1ccccc1F 34a_100000210171_100000230001 [2,0,0,0,0,0|2,0,0]=4 6822 B12R1.267 OCCCOc1ccccc1F 7a_100000210171_100011215043 [2,0,0,0,0,0|2,0,0]=4 6823 B12R1.267 OCCCOc1ccccc1I 34a_100000739446_100000230001 [2,0,0,0,0,0|2,0,0]=4 6824 B12R1.267 OCCCOc1ccccc1I 7a_100000739446_100011215043 [2,0,0,0,0,0|2,0,0]=4 6825 B12R1.267 OCCCSc1ccccc1O 62a_100000739446_100011215043 [2,0,0,0,0,0|1,1,0]=4 6826 B12R1.267 OCCCSc1ccccc1O 62a_100011215043_100000739446 [2,0,0,0,0,0|1,1,0]=4 6827 B12R1.267 Oc1ccccc1NCCCF 34a_100000185747_100011934791 [2,0,0,0,0,0|2,0,0]=4 6828 B12R1.267 Oc1ccccc1SCCCF 62a_100000739446_100011934791 [2,0,0,0,0,0|1,1,0]=4 6829 B12R1.267 Oc1ccccc1SCCCF 62a_100011934791_100000739446 [2,0,0,0,0,0|1,1,0]=4 6830 B12R1.267 [13CH3]NCCOc1ccccc1Br 2230a_100000744007_200025704644 [2,0,0,0,0,0|2,0,0]=4 6831 B12R1.267 [13CH3]NCCOc1ccccc1Br 34a_100000744007_200025704644 [2,0,0,0,0,0|2,0,0]=4 6832 B12R1.267 [13CH3]NCCOc1ccccc1Cl 2230a_100000174932_200025704644 [2,0,0,0,0,0|2,0,0]=4 6833 B12R1.267 [13CH3]NCCOc1ccccc1Cl 34a_100000174932_200025704644 [2,0,0,0,0,0|2,0,0]=4 6834 B12R1.267 [13CH3]NCCOc1ccccc1F 2230a_100000683764_200025704644 [2,0,0,0,0,0|2,0,0]=4 6835 B12R1.267 [13CH3]NCCOc1ccccc1F 34a_100000683764_200025704644 [2,0,0,0,0,0|2,0,0]=4 6836 B12R1.267 [13CH3]OCCOc1ccccc1Br 34a_100000230753_200025704644 [2,0,0,0,0,0|2,0,0]=4 6837 B12R1.267 [13CH3]OCCOc1ccccc1Br 7a_100000230753_200025704644 [2,0,0,0,0,0|2,0,0]=4 6838 B12R1.267 [13CH3]OCCOc1ccccc1Cl 34a_200000230518_200025704644 [2,0,0,0,0,0|2,0,0]=4 6839 B12R1.267 [13CH3]OCCOc1ccccc1Cl 7a_200000230518_200025704644 [2,0,0,0,0,0|2,0,0]=4 6840 B12R1.267 [13CH3]OCCOc1ccccc1F 34a_100000756447_200025704644 [2,0,0,0,0,0|2,0,0]=4 6841 B12R1.267 [13CH3]OCCOc1ccccc1F 7a_100000756447_200025704644 [2,0,0,0,0,0|2,0,0]=4 6842 B12R1.267 [13CH3]OCCOc1ccccc1N 34a_100132302172_200025704644 [2,0,0,0,0,0|2,0,0]=4 6843 B12R1.267 [13CH3]SCCOc1ccccc1Br 62a_100000695877_200025704644 [2,0,0,0,0,0|2,0,0]=4 6844 B12R1.267 [13CH3]SCCOc1ccccc1Br 62a_200025704644_100000695877 [2,0,0,0,0,0|2,0,0]=4 6845 B12R1.267 [13CH3]SCCOc1ccccc1F 62a_100000183290_200025704644 [2,0,0,0,0,0|2,0,0]=4 6846 B12R1.267 [13CH3]SCCOc1ccccc1F 62a_200025704644_100000183290 [2,0,0,0,0,0|2,0,0]=4 6847 B12R1.308 C#CCC(=O)c1ccccc1O 1458a_100015234032_100000184674 [2,0,0,0,0,0|0,0,2]=4 6848 B12R1.308 C=CCC(=O)c1ccccc1O 1458a_100015234032_100000210623 [2,0,0,0,0,0|0,0,2]=4 6849 B12R1.308 CCCC(=O)c1ccccc1Br 1458a_100000188424_100000210303 [2,0,0,0,0,0|1,0,0]=3 6850 B12R1.308 CCCC(=O)c1ccccc1C 1458a_100000212026_100000210303 [2,0,0,0,0,0|1,0,0]=3 6851 B12R1.308 CCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210303 [2,0,0,0,0,0|1,0,0]=3 6852 B12R1.308 CCCC(=O)c1ccccc1F 1458a_100000188656_100000210303 [2,0,0,0,0,0|1,0,0]=3 6853 B12R1.308 CCCC(=O)c1ccccc1I 1458a_100000187884_100000210303 [2,0,0,0,0,0|1,0,0]=3 6854 B12R1.308 CCCC(=O)c1ccccc1O 1458a_100015234032_100000210303 [2,0,0,0,0,0|0,0,0]=2 6855 B12R1.308 CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210303 [2,0,0,0,0,0|0,0,1]=3 6856 B12R1.308 CCCN(C)c1ccccc1O 269982a_100000033821_100000210303 [2,0,0,0,0,0|2,0,0]=4 6857 B12R1.308 CCNC(=O)c1ccccc1Br 11a_100015525214_100000188424 [2,0,0,0,0,0|2,0,0]=4 6858 B12R1.308 CCNC(=O)c1ccccc1Br 240690a_100015525214_100000188424 [2,0,0,0,0,0|2,0,0]=4 6859 B12R1.308 CCNC(=O)c1ccccc1Br 527a_100015525214_100000188424 [2,0,0,0,0,0|2,0,0]=4 6860 B12R1.308 CCNC(=O)c1ccccc1C 11a_100015525214_100000212026 [2,0,0,0,0,0|2,0,0]=4 6861 B12R1.308 CCNC(=O)c1ccccc1C 240690a_100015525214_100000212026 [2,0,0,0,0,0|2,0,0]=4 6862 B12R1.308 CCNC(=O)c1ccccc1C 527a_100015525214_100000212026 [2,0,0,0,0,0|2,0,0]=4 6863 B12R1.308 CCNC(=O)c1ccccc1Cl 11a_100015525214_100000185844 [2,0,0,0,0,0|2,0,0]=4 6864 B12R1.308 CCNC(=O)c1ccccc1Cl 240690a_100015525214_100000185844 [2,0,0,0,0,0|2,0,0]=4 6865 B12R1.308 CCNC(=O)c1ccccc1Cl 527a_100015525214_100000185844 [2,0,0,0,0,0|2,0,0]=4 6866 B12R1.308 CCNC(=O)c1ccccc1F 11a_100015525214_100000188656 [2,0,0,0,0,0|2,0,0]=4 6867 B12R1.308 CCNC(=O)c1ccccc1F 240690a_100015525214_100000188656 [2,0,0,0,0,0|2,0,0]=4 6868 B12R1.308 CCNC(=O)c1ccccc1F 527a_100015525214_100000188656 [2,0,0,0,0,0|2,0,0]=4 6869 B12R1.308 CCNC(=O)c1ccccc1I 11a_100015525214_100000187884 [2,0,0,0,0,0|2,0,0]=4 6870 B12R1.308 CCNC(=O)c1ccccc1I 240690a_100015525214_100000187884 [2,0,0,0,0,0|2,0,0]=4 6871 B12R1.308 CCNC(=O)c1ccccc1I 527a_100015525214_100000187884 [2,0,0,0,0,0|2,0,0]=4 6872 B12R1.308 CCNC(=O)c1ccccc1O 240690a_100015525214_100015234032 [2,0,0,0,0,0|1,0,0]=3 6873 B12R1.308 CCNC(=O)c1ccccc1O 271570a_203496583355_200000155173 [2,0,0,0,0,0|1,0,0]=3 6874 B12R1.308 CCNC(=O)c1ccccc1[O-] 240690a_100015525214_100009911694 [2,0,0,0,0,0|1,0,1]=4 6875 B12R1.308 CCNC(=O)c1ccccc1[O-] 527a_100015525214_100009911694 [2,0,0,0,0,0|1,0,1]=4 6876 B12R1.308 CCNC(=O)c1cccnc1O 271570a_203496583355_100000160120 [2,0,0,0,0,0|2,0,0]=4 6877 B12R1.308 CCOC(=O)c1ccccc1O 271570a_203496583355_100000169879 [2,0,0,0,0,0|0,0,0]=2 6878 B12R1.308 CCOC(=O)c1cccnc1O 271570a_203496583355_100000170124 [2,0,0,0,0,0|1,0,0]=3 6879 B12R1.308 CCOC(=O)c1ccncc1O 271570a_203496583355_100010238393 [2,0,0,0,0,0|1,0,0]=3 6880 B12R1.308 CCOC(=O)c1cnccc1O 271570a_203496583355_100016987518 [2,0,0,0,0,0|1,0,0]=3 6881 B12R1.308 CCOC(=O)c1cncnc1O 271570a_203496583355_100011998183 [2,0,0,0,0,0|2,0,0]=4 6882 B12R1.308 CCOC(=O)c1ncccc1O 271570a_203496583355_100012351660 [2,0,0,0,0,0|1,0,0]=3 6883 B12R1.308 CCOC(=O)c1ncncc1O 271570a_203496583355_100012344254 [2,0,0,0,0,0|2,0,0]=4 6884 B12R1.308 CNCC(=O)c1ccccc1Br 34a_100102657272_100000199116 [2,0,0,0,0,0|2,0,0]=4 6885 B12R1.308 CNCC(=O)c1ccccc1C 2230a_106832991635_100000741374 [2,0,0,0,0,0|2,0,0]=4 6886 B12R1.308 CNCC(=O)c1ccccc1C 34a_100102657272_100000741374 [2,0,0,0,0,0|2,0,0]=4 6887 B12R1.308 CNCC(=O)c1ccccc1C 7a_106832991635_100000741374 [2,0,0,0,0,0|2,0,0]=4 6888 B12R1.308 CNCC(=O)c1ccccc1Cl 34a_100102657272_100000211432 [2,0,0,0,0,0|2,0,0]=4 6889 B12R1.308 CNCC(=O)c1ccccc1F 34a_100102657272_100000204681 [2,0,0,0,0,0|2,0,0]=4 6890 B12R1.308 CNCC(=O)c1ccccc1F 7a_106832991635_100000204681 [2,0,0,0,0,0|2,0,0]=4 6891 B12R1.308 CNCC(=O)c1ccccc1O 7a_106832991635_100000188908 [2,0,0,0,0,0|1,0,0]=3 6892 B12R1.308 CNNC(=O)c1ccccc1O 22a_100016993582_100015234032 [2,0,0,0,0,0|2,0,0]=4 6893 B12R1.308 COCC(=O)c1ccccc1Br 34a_100138415774_100000199116 [2,0,0,0,0,0|2,0,0]=4 6894 B12R1.308 COCC(=O)c1ccccc1C 34a_100138415774_100000741374 [2,0,0,0,0,0|2,0,0]=4 6895 B12R1.308 COCC(=O)c1ccccc1Cl 34a_100138415774_100000211432 [2,0,0,0,0,0|2,0,0]=4 6896 B12R1.308 COCC(=O)c1ccccc1F 34a_100138415774_100000204681 [2,0,0,0,0,0|2,0,0]=4 6897 B12R1.308 CSCC(=O)c1ccccc1Br 62a_100000199116_200000210301 [2,0,0,0,0,0|2,0,0]=4 6898 B12R1.308 CSCC(=O)c1ccccc1C 62a_100000741374_200000210301 [2,0,0,0,0,0|2,0,0]=4 6899 B12R1.308 CSCC(=O)c1ccccc1C 62a_200000210301_100000741374 [2,0,0,0,0,0|2,0,0]=4 6900 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_100000211432_200000210301 [2,0,0,0,0,0|2,0,0]=4 6901 B12R1.308 CSCC(=O)c1ccccc1Cl 62a_200000210301_100000211432 [2,0,0,0,0,0|2,0,0]=4 6902 B12R1.308 CSCC(=O)c1ccccc1F 62a_100000204681_200000210301 [2,0,0,0,0,0|2,0,0]=4 6903 B12R1.308 CSCC(=O)c1ccccc1F 62a_200000210301_100000204681 [2,0,0,0,0,0|2,0,0]=4 6904 B12R1.308 CSCC(=O)c1ccccc1O 62a_100000188908_200000210301 [2,0,0,0,0,0|1,0,0]=3 6905 B12R1.308 CSCC(=O)c1ccccc1O 62a_200000210301_100000188908 [2,0,0,0,0,0|1,0,0]=3 6906 B12R1.308 Cc1ccccc1C(=O)CCF 1458a_100000212026_100011217306 [2,0,0,0,0,0|2,0,0]=4 6907 B12R1.308 Cc1ccccc1C(=O)CCO 1458a_100000212026_100000211926 [2,0,0,0,0,0|2,0,0]=4 6908 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_100000741374_200025704644 [2,0,0,0,0,0|2,0,0]=4 6909 B12R1.308 Cc1ccccc1C(=O)CS[13CH3] 62a_200025704644_100000741374 [2,0,0,0,0,0|2,0,0]=4 6910 B12R1.308 N#CCC(=O)c1ccccc1O 1458a_100015234032_100011214920 [2,0,0,0,0,0|1,0,1]=4 6911 B12R1.308 N#CCC(=O)c1ccccc1O 271570a_203496583355_100011225204 [2,0,0,0,0,0|1,0,1]=4 6912 B12R1.308 O=C(CCF)c1ccccc1Br 1458a_100000188424_100011217306 [2,0,0,0,0,0|2,0,0]=4 6913 B12R1.308 O=C(CCF)c1ccccc1Cl 1458a_100000185844_100011217306 [2,0,0,0,0,0|2,0,0]=4 6914 B12R1.308 O=C(CCF)c1ccccc1F 1458a_100000188656_100011217306 [2,0,0,0,0,0|2,0,0]=4 6915 B12R1.308 O=C(CCF)c1ccccc1I 1458a_100000187884_100011217306 [2,0,0,0,0,0|2,0,0]=4 6916 B12R1.308 O=C(CCF)c1ccccc1O 1458a_100015234032_100011217306 [2,0,0,0,0,0|1,0,0]=3 6917 B12R1.308 O=C(CCF)c1ccccc1[O-] 1458a_100009911694_100011217306 [2,0,0,0,0,0|1,0,1]=4 6918 B12R1.308 O=C(CCO)c1ccccc1Br 1458a_100000188424_100000211926 [2,0,0,0,0,0|2,0,0]=4 6919 B12R1.308 O=C(CCO)c1ccccc1Cl 1458a_100000185844_100000211926 [2,0,0,0,0,0|2,0,0]=4 6920 B12R1.308 O=C(CCO)c1ccccc1F 1458a_100000188656_100000211926 [2,0,0,0,0,0|2,0,0]=4 6921 B12R1.308 O=C(CCO)c1ccccc1I 1458a_100000187884_100000211926 [2,0,0,0,0,0|2,0,0]=4 6922 B12R1.308 O=C(CCO)c1ccccc1O 1458a_100015234032_100000211926 [2,0,0,0,0,0|1,0,0]=3 6923 B12R1.308 O=C(CCO)c1ccccc1[O-] 1458a_100009911694_100000211926 [2,0,0,0,0,0|1,0,1]=4 6924 B12R1.308 [13CH3]SCC(=O)c1ccccc1Br 62a_100000199116_200025704644 [2,0,0,0,0,0|2,0,0]=4 6925 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_100000211432_200025704644 [2,0,0,0,0,0|2,0,0]=4 6926 B12R1.308 [13CH3]SCC(=O)c1ccccc1Cl 62a_200025704644_100000211432 [2,0,0,0,0,0|2,0,0]=4 6927 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_100000204681_200025704644 [2,0,0,0,0,0|2,0,0]=4 6928 B12R1.308 [13CH3]SCC(=O)c1ccccc1F 62a_200025704644_100000204681 [2,0,0,0,0,0|2,0,0]=4 6929 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_100000188908_200025704644 [2,0,0,0,0,0|1,0,0]=3 6930 B12R1.308 [13CH3]SCC(=O)c1ccccc1O 62a_200025704644_100000188908 [2,0,0,0,0,0|1,0,0]=3 6931 B14R0.203 C=CC=CC(=O)CC(=O)OCCOCC 1458a_100016291481_200000101388 [0,1,1,0,0,0|0,0,2]=4 6932 B14R0.474 C=CC=CC(=O)C(C)C(=O)OCCCC 1458a_100016291481_100000759602 [0,1,1,0,0,0|0,0,2]=4 6933 B14R0.1444 C/C=C/C=CC(=O)CC(=O)OCCCC 1458a_100000185730_100000211628 [0,1,1,0,0,0|0,0,2]=4 6934 B14R1.19 CCCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210326 [1,1,0,0,0,0|1,0,0]=3 6935 B14R1.19 CCCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210326 [1,1,0,0,0,0|1,0,0]=3 6936 B14R1.19 CCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210326 [1,1,0,0,0,0|1,0,0]=3 6937 B14R1.19 CCCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210326 [1,1,0,0,0,0|1,0,0]=3 6938 B14R1.19 CCCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210326 [1,1,0,0,0,0|1,0,0]=3 6939 B14R1.19 CCCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210326 [1,1,0,0,0,0|1,0,0]=3 6940 B14R1.19 CCCCCC(=O)c1ccc(cc1)O 271570a_203496583355_200011267725 [1,1,0,0,0,0|1,0,0]=3 6941 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 11a_100000102301_100000185839 [1,1,0,0,0,0|1,0,0]=3 6942 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 1626a_100000102301_100000185839 [1,1,0,0,0,0|1,0,0]=3 6943 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 240690a_100000102301_100000185839 [1,1,0,0,0,0|1,0,0]=3 6944 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 527a_100000102301_100000185839 [1,1,0,0,0,0|1,0,0]=3 6945 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 11a_100000102301_100000188618 [1,1,0,0,0,0|1,0,0]=3 6946 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 1626a_100000102301_100000188618 [1,1,0,0,0,0|1,0,0]=3 6947 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 240690a_100000102301_100000188618 [1,1,0,0,0,0|1,0,0]=3 6948 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 527a_100000102301_100000188618 [1,1,0,0,0,0|1,0,0]=3 6949 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 11a_100000102301_100000210187 [1,1,0,0,0,0|1,0,0]=3 6950 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 1626a_100000102301_100000210187 [1,1,0,0,0,0|1,0,0]=3 6951 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 240690a_100000102301_100000210187 [1,1,0,0,0,0|1,0,0]=3 6952 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 527a_100000102301_100000210187 [1,1,0,0,0,0|1,0,0]=3 6953 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 11a_100000102301_100000187176 [1,1,0,0,0,0|1,0,0]=3 6954 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 1626a_100000102301_100000187176 [1,1,0,0,0,0|1,0,0]=3 6955 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 240690a_100000102301_100000187176 [1,1,0,0,0,0|1,0,0]=3 6956 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 527a_100000102301_100000187176 [1,1,0,0,0,0|1,0,0]=3 6957 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 11a_100000102301_100000187904 [1,1,0,0,0,0|1,0,0]=3 6958 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 1626a_100000102301_100000187904 [1,1,0,0,0,0|1,0,0]=3 6959 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 240690a_100000102301_100000187904 [1,1,0,0,0,0|1,0,0]=3 6960 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 527a_100000102301_100000187904 [1,1,0,0,0,0|1,0,0]=3 6961 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 240690a_100000102301_100000212099 [1,1,0,0,0,0|1,0,0]=3 6962 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000154866 [1,1,0,0,0,0|1,0,0]=3 6963 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 527a_100000102301_100000212099 [1,1,0,0,0,0|1,0,0]=3 6964 B14R1.19 CCCCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781281 [1,1,0,0,0,0|2,0,0]=4 6965 B14R1.19 CCCCOC(C)c1ccc(cc1)Br 34a_100000210227_100000755118 [1,1,0,0,0,0|1,0,1]=4 6966 B14R1.19 CCCCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210210 [1,1,0,0,0,0|1,0,1]=4 6967 B14R1.19 CCCCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210211 [1,1,0,0,0,0|1,0,1]=4 6968 B14R1.19 CCCCOC(C)c1ccc(cc1)C 34a_100000210227_100011261388 [1,1,0,0,0,0|1,0,1]=4 6969 B14R1.19 CCCCOC(C)c1ccc(cc1)C 7a_100000210227_100011261388 [1,1,0,0,0,0|1,0,1]=4 6970 B14R1.19 CCCCOC(C)c1ccc(cc1)Cl 7a_100000210227_100000684792 [1,1,0,0,0,0|1,0,1]=4 6971 B14R1.19 CCCCOC(C)c1ccc(cc1)F 34a_100000181323_100000210210 [1,1,0,0,0,0|1,0,1]=4 6972 B14R1.19 CCCCOC(C)c1ccc(cc1)F 34a_100000210227_100000743420 [1,1,0,0,0,0|1,0,1]=4 6973 B14R1.19 CCCCOC(C)c1ccc(cc1)F 7a_100000181323_100000210211 [1,1,0,0,0,0|1,0,1]=4 6974 B14R1.19 CCCCOC(C)c1ccc(cc1)F 7a_100000210227_100000743420 [1,1,0,0,0,0|1,0,1]=4 6975 B14R1.19 CCCCOC(C)c1ccc(cc1)N 34a_100011216399_100000210210 [1,1,0,0,0,0|1,0,1]=4 6976 B14R1.19 CCCCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210210 [1,1,0,0,0,0|1,0,1]=4 6977 B14R1.19 CCCCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210211 [1,1,0,0,0,0|1,0,1]=4 6978 B14R1.19 CCCCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210210 [1,1,0,0,0,0|1,0,1]=4 6979 B14R1.19 CCCCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210211 [1,1,0,0,0,0|1,0,1]=4 6980 B14R1.19 CCCNNC(=O)c1ccc(cc1)Br 22a_100000740057_100000185839 [1,1,0,0,0,0|2,0,0]=4 6981 B14R1.19 CCCNNC(=O)c1ccc(cc1)C 22a_100000740057_100000188618 [1,1,0,0,0,0|2,0,0]=4 6982 B14R1.19 CCCNNC(=O)c1ccc(cc1)Cl 22a_100000740057_100000210187 [1,1,0,0,0,0|2,0,0]=4 6983 B14R1.19 CCCNNC(=O)c1ccc(cc1)F 22a_100000740057_100000187176 [1,1,0,0,0,0|2,0,0]=4 6984 B14R1.19 CCCNNC(=O)c1ccc(cc1)I 22a_100000740057_100000187904 [1,1,0,0,0,0|2,0,0]=4 6985 B14R1.19 CCCNNC(=O)c1ccc(cc1)O 22a_100000740057_100000212099 [1,1,0,0,0,0|2,0,0]=4 6986 B14R1.19 CCCOCC(=O)c1ccc(cc1)Br 34a_100000210258_100000188085 [1,1,0,0,0,0|2,0,0]=4 6987 B14R1.19 CCCOCC(=O)c1ccc(cc1)C 34a_100000210258_100000211441 [1,1,0,0,0,0|2,0,0]=4 6988 B14R1.19 CCCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210303 [1,1,0,0,0,0|2,0,0]=4 6989 B14R1.19 CCCOCC(=O)c1ccc(cc1)I 34a_100000210258_100011216261 [1,1,0,0,0,0|2,0,0]=4 6990 B14R1.19 CCCOCC(=O)c1ccc(cc1)O 34a_100000210258_100009814261 [1,1,0,0,0,0|2,0,0]=4 6991 B14R1.19 CCCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210303 [1,1,0,0,0,0|2,0,0]=4 6992 B14R1.19 CCCSCC(=O)c1ccc(cc1)C 62a_100000210303_100000211441 [1,1,0,0,0,0|2,0,0]=4 6993 B14R1.19 CCCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210303 [1,1,0,0,0,0|2,0,0]=4 6994 B14R1.19 CCCSCC(=O)c1ccc(cc1)Cl 62a_100000210303_100000211071 [1,1,0,0,0,0|2,0,0]=4 6995 B14R1.19 CCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210303 [1,1,0,0,0,0|2,0,0]=4 6996 B14R1.19 CCCSCC(=O)c1ccc(cc1)F 62a_100000210303_100000211279 [1,1,0,0,0,0|2,0,0]=4 6997 B14R1.19 CCCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210303 [1,1,0,0,0,0|2,0,0]=4 6998 B14R1.19 CCCSCC(=O)c1ccc(cc1)I 62a_100000210303_100011216261 [1,1,0,0,0,0|2,0,0]=4 6999 B14R1.19 CCCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210303 [1,1,0,0,0,0|2,0,0]=4 7000 B14R1.19 CCCSCC(=O)c1ccc(cc1)O 62a_100000210303_100009814261 [1,1,0,0,0,0|2,0,0]=4 7001 B14R1.19 CCCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210303 [1,1,0,0,0,0|2,0,0]=4 7002 B14R1.19 CCNCCC(=O)c1ccc(cc1)C 2230a_100015525214_100000701375 [1,1,0,0,0,0|2,0,0]=4 7003 B14R1.19 CCNCCC(=O)c1ccc(cc1)F 2230a_100015525214_100000211231 [1,1,0,0,0,0|2,0,0]=4 7004 B14R1.19 CCNCCC(=O)c1ccc(cc1)O 2230a_100015525214_100009879949 [1,1,0,0,0,0|2,0,0]=4 7005 B14R1.19 CCOCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215890 [1,1,0,0,0,0|2,0,0]=4 7006 B14R1.19 CCOCCC(=O)c1ccc(cc1)C 1458a_100000188618_100011215890 [1,1,0,0,0,0|2,0,0]=4 7007 B14R1.19 CCOCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215890 [1,1,0,0,0,0|2,0,0]=4 7008 B14R1.19 CCOCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215890 [1,1,0,0,0,0|2,0,0]=4 7009 B14R1.19 CCOCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215890 [1,1,0,0,0,0|2,0,0]=4 7010 B14R1.19 CCOCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215890 [1,1,0,0,0,0|2,0,0]=4 7011 B14R1.19 CCOCCC(=O)c1ccc(cc1)O 271570a_203496583355_100018808408 [1,1,0,0,0,0|2,0,0]=4 7012 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000757381 [1,1,0,0,0,0|2,0,0]=4 7013 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 62a_100000210202_100011215963 [1,1,0,0,0,0|2,0,0]=4 7014 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 62a_100011215963_100000210202 [1,1,0,0,0,0|2,0,0]=4 7015 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000757381 [1,1,0,0,0,0|2,0,0]=4 7016 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 62a_100000210202_100000701375 [1,1,0,0,0,0|2,0,0]=4 7017 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 62a_100000701375_100000210202 [1,1,0,0,0,0|2,0,0]=4 7018 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000757381 [1,1,0,0,0,0|2,0,0]=4 7019 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 62a_100000210202_100011216492 [1,1,0,0,0,0|2,0,0]=4 7020 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210202 [1,1,0,0,0,0|2,0,0]=4 7021 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000757381 [1,1,0,0,0,0|2,0,0]=4 7022 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 62a_100000210202_100000211231 [1,1,0,0,0,0|2,0,0]=4 7023 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 62a_100000211231_100000210202 [1,1,0,0,0,0|2,0,0]=4 7024 B14R1.19 CCSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000757381 [1,1,0,0,0,0|2,0,0]=4 7025 B14R1.19 CCSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000757381 [1,1,0,0,0,0|2,0,0]=4 7026 B14R1.19 CCSCCC(=O)c1ccc(cc1)O 62a_100000210202_100009879949 [1,1,0,0,0,0|2,0,0]=4 7027 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 2230a_106832991635_100000211046 [1,1,0,0,0,0|2,0,0]=4 7028 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 34a_100102657272_100000211046 [1,1,0,0,0,0|2,0,0]=4 7029 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 7a_106832991635_100000211046 [1,1,0,0,0,0|2,0,0]=4 7030 B14R1.19 CNCCCC(=O)c1ccc(cc1)Cl 7a_106832991635_200011217871 [1,1,0,0,0,0|2,0,0]=4 7031 B14R1.19 CNCCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211961 [1,1,0,0,0,0|2,0,0]=4 7032 B14R1.19 CNCCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211961 [1,1,0,0,0,0|2,0,0]=4 7033 B14R1.19 CNCCCC(=O)c1ccc(cc1)O 2230a_106832991635_100000039620 [1,1,0,0,0,0|2,0,0]=4 7034 B14R1.19 CNCCCC(=O)c1ccc(cc1)O 7a_106832991635_100000039620 [1,1,0,0,0,0|2,0,0]=4 7035 B14R1.19 CNCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_200000210301 [1,1,0,0,0,0|2,0,0]=4 7036 B14R1.19 CNCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_200000210301 [1,1,0,0,0,0|2,0,0]=4 7037 B14R1.19 CNCCNC(=O)c1ccc(cc1)F 2230a_100000753910_200000210301 [1,1,0,0,0,0|2,0,0]=4 7038 B14R1.19 CNCCNC(=O)c1ccc(cc1)F 34a_100000753910_200000210301 [1,1,0,0,0,0|2,0,0]=4 7039 B14R1.19 COCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000740836 [1,1,0,0,0,0|2,0,0]=4 7040 B14R1.19 COCCCC(=O)c1ccc(cc1)Br 34a_100138415774_100000211046 [1,1,0,0,0,0|2,0,0]=4 7041 B14R1.19 COCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000740836 [1,1,0,0,0,0|2,0,0]=4 7042 B14R1.19 COCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000740836 [1,1,0,0,0,0|2,0,0]=4 7043 B14R1.19 COCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000740836 [1,1,0,0,0,0|2,0,0]=4 7044 B14R1.19 COCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000740836 [1,1,0,0,0,0|2,0,0]=4 7045 B14R1.19 COCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000740836 [1,1,0,0,0,0|2,0,0]=4 7046 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 1626a_100000209980_100000185839 [1,1,0,0,0,0|2,0,0]=4 7047 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 240690a_100000209980_100000185839 [1,1,0,0,0,0|2,0,0]=4 7048 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 34a_200000158904_200000210301 [1,1,0,0,0,0|2,0,0]=4 7049 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 527a_100000209980_100000185839 [1,1,0,0,0,0|2,0,0]=4 7050 B14R1.19 COCCNC(=O)c1ccc(cc1)C 1626a_100000209980_100000188618 [1,1,0,0,0,0|2,0,0]=4 7051 B14R1.19 COCCNC(=O)c1ccc(cc1)C 240690a_100000209980_100000188618 [1,1,0,0,0,0|2,0,0]=4 7052 B14R1.19 COCCNC(=O)c1ccc(cc1)C 34a_200000158910_200000210301 [1,1,0,0,0,0|2,0,0]=4 7053 B14R1.19 COCCNC(=O)c1ccc(cc1)C 527a_100000209980_100000188618 [1,1,0,0,0,0|2,0,0]=4 7054 B14R1.19 COCCNC(=O)c1ccc(cc1)C 7a_200000158910_200000210301 [1,1,0,0,0,0|2,0,0]=4 7055 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 1626a_100000209980_100000210187 [1,1,0,0,0,0|2,0,0]=4 7056 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 240690a_100000209980_100000210187 [1,1,0,0,0,0|2,0,0]=4 7057 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 527a_100000209980_100000210187 [1,1,0,0,0,0|2,0,0]=4 7058 B14R1.19 COCCNC(=O)c1ccc(cc1)F 1626a_100000209980_100000187176 [1,1,0,0,0,0|2,0,0]=4 7059 B14R1.19 COCCNC(=O)c1ccc(cc1)F 240690a_100000209980_100000187176 [1,1,0,0,0,0|2,0,0]=4 7060 B14R1.19 COCCNC(=O)c1ccc(cc1)F 527a_100000209980_100000187176 [1,1,0,0,0,0|2,0,0]=4 7061 B14R1.19 COCCNC(=O)c1ccc(cc1)I 1626a_100000209980_100000187904 [1,1,0,0,0,0|2,0,0]=4 7062 B14R1.19 COCCNC(=O)c1ccc(cc1)I 240690a_100000209980_100000187904 [1,1,0,0,0,0|2,0,0]=4 7063 B14R1.19 COCCNC(=O)c1ccc(cc1)I 527a_100000209980_100000187904 [1,1,0,0,0,0|2,0,0]=4 7064 B14R1.19 COCCNC(=O)c1ccc(cc1)N 34a_100000740983_200000210301 [1,1,0,0,0,0|2,0,0]=4 7065 B14R1.19 COCCNC(=O)c1ccc(cc1)O 240690a_100000209980_100000212099 [1,1,0,0,0,0|2,0,0]=4 7066 B14R1.19 COCCNC(=O)c1ccc(cc1)O 527a_100000209980_100000212099 [1,1,0,0,0,0|2,0,0]=4 7067 B14R1.19 COCCOC(=O)c1ccc(cc1)C 7a_200000031072_200000210301 [1,1,0,0,0,0|1,0,0]=3 7068 B14R1.19 CSCCCC(=O)c1ccc(cc1)Br 62a_100000211046_200000210301 [1,1,0,0,0,0|2,0,0]=4 7069 B14R1.19 CSCCCC(=O)c1ccc(cc1)Br 62a_200000210301_100000211046 [1,1,0,0,0,0|2,0,0]=4 7070 B14R1.19 CSCCCC(=O)c1ccc(cc1)Cl 62a_200000210301_200011217871 [1,1,0,0,0,0|2,0,0]=4 7071 B14R1.19 CSCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_200000210301 [1,1,0,0,0,0|2,0,0]=4 7072 B14R1.19 CSCCCC(=O)c1ccc(cc1)F 62a_100000211961_200000210301 [1,1,0,0,0,0|2,0,0]=4 7073 B14R1.19 CSCCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211961 [1,1,0,0,0,0|2,0,0]=4 7074 B14R1.19 CSCCCC(=O)c1ccc(cc1)O 62a_200000210301_100000039620 [1,1,0,0,0,0|2,0,0]=4 7075 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 11a_100020590264_100000185839 [1,1,0,0,0,0|2,0,0]=4 7076 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 1626a_100020590264_100000185839 [1,1,0,0,0,0|2,0,0]=4 7077 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 240690a_100020590264_100000185839 [1,1,0,0,0,0|2,0,0]=4 7078 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 527a_100020590264_100000185839 [1,1,0,0,0,0|2,0,0]=4 7079 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 11a_100020590264_100000188618 [1,1,0,0,0,0|2,0,0]=4 7080 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 1626a_100020590264_100000188618 [1,1,0,0,0,0|2,0,0]=4 7081 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 240690a_100020590264_100000188618 [1,1,0,0,0,0|2,0,0]=4 7082 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 527a_100020590264_100000188618 [1,1,0,0,0,0|2,0,0]=4 7083 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 11a_100020590264_100000210187 [1,1,0,0,0,0|2,0,0]=4 7084 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 1626a_100020590264_100000210187 [1,1,0,0,0,0|2,0,0]=4 7085 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 240690a_100020590264_100000210187 [1,1,0,0,0,0|2,0,0]=4 7086 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 527a_100020590264_100000210187 [1,1,0,0,0,0|2,0,0]=4 7087 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 11a_100020590264_100000187176 [1,1,0,0,0,0|2,0,0]=4 7088 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 1626a_100020590264_100000187176 [1,1,0,0,0,0|2,0,0]=4 7089 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 240690a_100020590264_100000187176 [1,1,0,0,0,0|2,0,0]=4 7090 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 527a_100020590264_100000187176 [1,1,0,0,0,0|2,0,0]=4 7091 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 11a_100020590264_100000187904 [1,1,0,0,0,0|2,0,0]=4 7092 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 1626a_100020590264_100000187904 [1,1,0,0,0,0|2,0,0]=4 7093 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 240690a_100020590264_100000187904 [1,1,0,0,0,0|2,0,0]=4 7094 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 527a_100020590264_100000187904 [1,1,0,0,0,0|2,0,0]=4 7095 B14R1.19 CSCCNC(=O)c1ccc(cc1)O 240690a_100020590264_100000212099 [1,1,0,0,0,0|2,0,0]=4 7096 B14R1.19 CSCCNC(=O)c1ccc(cc1)O 527a_100020590264_100000212099 [1,1,0,0,0,0|2,0,0]=4 7097 B14R1.19 Cc1ccc(cc1)C(=O)CCCCF 1458a_100000188618_100000729493 [1,1,0,0,0,0|2,0,0]=4 7098 B14R1.19 Cc1ccc(cc1)C(=O)CCCCO 1458a_100000188618_100000210776 [1,1,0,0,0,0|2,0,0]=4 7099 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000188618 [1,1,0,0,0,0|2,0,0]=4 7100 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000188618 [1,1,0,0,0,0|2,0,0]=4 7101 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000188618 [1,1,0,0,0,0|2,0,0]=4 7102 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000188618 [1,1,0,0,0,0|2,0,0]=4 7103 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000188618 [1,1,0,0,0,0|2,0,0]=4 7104 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000188618 [1,1,0,0,0,0|2,0,0]=4 7105 B14R1.19 Cc1ccc(cc1)C(=O)NCCO[13CH3] 34a_200000158910_200025704644 [1,1,0,0,0,0|2,0,0]=4 7106 B14R1.19 Cc1ccc(cc1)C(=O)NCCO[13CH3] 7a_200000158910_200025704644 [1,1,0,0,0,0|2,0,0]=4 7107 B14R1.19 Cc1ccc(cc1)C(=O)OCCO[13CH3] 7a_200000031072_200025704644 [1,1,0,0,0,0|1,0,0]=3 7108 B14R1.19 O=C(CCCCF)c1ccc(cc1)Br 1458a_100000185839_100000729493 [1,1,0,0,0,0|2,0,0]=4 7109 B14R1.19 O=C(CCCCF)c1ccc(cc1)Cl 1458a_100000210187_100000729493 [1,1,0,0,0,0|2,0,0]=4 7110 B14R1.19 O=C(CCCCF)c1ccc(cc1)F 1458a_100000187176_100000729493 [1,1,0,0,0,0|2,0,0]=4 7111 B14R1.19 O=C(CCCCF)c1ccc(cc1)I 1458a_100000187904_100000729493 [1,1,0,0,0,0|2,0,0]=4 7112 B14R1.19 O=C(CCCCF)c1ccc(cc1)O 1458a_100000212099_100000729493 [1,1,0,0,0,0|2,0,0]=4 7113 B14R1.19 O=C(CCCCO)c1ccc(cc1)Br 1458a_100000185839_100000210776 [1,1,0,0,0,0|2,0,0]=4 7114 B14R1.19 O=C(CCCCO)c1ccc(cc1)Cl 1458a_100000210187_100000210776 [1,1,0,0,0,0|2,0,0]=4 7115 B14R1.19 O=C(CCCCO)c1ccc(cc1)F 1458a_100000187176_100000210776 [1,1,0,0,0,0|2,0,0]=4 7116 B14R1.19 O=C(CCCCO)c1ccc(cc1)I 1458a_100000187904_100000210776 [1,1,0,0,0,0|2,0,0]=4 7117 B14R1.19 O=C(CCCCO)c1ccc(cc1)O 1458a_100000212099_100000210776 [1,1,0,0,0,0|2,0,0]=4 7118 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 11a_100015189416_100000185839 [1,1,0,0,0,0|2,0,0]=4 7119 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 1626a_100015189416_100000185839 [1,1,0,0,0,0|2,0,0]=4 7120 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 240690a_100015189416_100000185839 [1,1,0,0,0,0|2,0,0]=4 7121 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 527a_100015189416_100000185839 [1,1,0,0,0,0|2,0,0]=4 7122 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 11a_100015189416_100000210187 [1,1,0,0,0,0|2,0,0]=4 7123 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 1626a_100015189416_100000210187 [1,1,0,0,0,0|2,0,0]=4 7124 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 240690a_100015189416_100000210187 [1,1,0,0,0,0|2,0,0]=4 7125 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 527a_100015189416_100000210187 [1,1,0,0,0,0|2,0,0]=4 7126 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 11a_100015189416_100000187176 [1,1,0,0,0,0|2,0,0]=4 7127 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 1626a_100015189416_100000187176 [1,1,0,0,0,0|2,0,0]=4 7128 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 240690a_100015189416_100000187176 [1,1,0,0,0,0|2,0,0]=4 7129 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 527a_100015189416_100000187176 [1,1,0,0,0,0|2,0,0]=4 7130 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 11a_100015189416_100000187904 [1,1,0,0,0,0|2,0,0]=4 7131 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 1626a_100015189416_100000187904 [1,1,0,0,0,0|2,0,0]=4 7132 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 240690a_100015189416_100000187904 [1,1,0,0,0,0|2,0,0]=4 7133 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 527a_100015189416_100000187904 [1,1,0,0,0,0|2,0,0]=4 7134 B14R1.19 O=C(NCCCF)c1ccc(cc1)O 240690a_100015189416_100000212099 [1,1,0,0,0,0|2,0,0]=4 7135 B14R1.19 O=C(NCCCF)c1ccc(cc1)O 527a_100015189416_100000212099 [1,1,0,0,0,0|2,0,0]=4 7136 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br 240690a_100000182051_100000185839 [1,1,0,0,0,0|2,0,0]=4 7137 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br 527a_100000182051_100000185839 [1,1,0,0,0,0|2,0,0]=4 7138 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl 240690a_100000182051_100000210187 [1,1,0,0,0,0|2,0,0]=4 7139 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl 527a_100000182051_100000210187 [1,1,0,0,0,0|2,0,0]=4 7140 B14R1.19 O=C(NCCCO)c1ccc(cc1)F 240690a_100000182051_100000187176 [1,1,0,0,0,0|2,0,0]=4 7141 B14R1.19 O=C(NCCCO)c1ccc(cc1)F 527a_100000182051_100000187176 [1,1,0,0,0,0|2,0,0]=4 7142 B14R1.19 O=C(NCCCO)c1ccc(cc1)I 240690a_100000182051_100000187904 [1,1,0,0,0,0|2,0,0]=4 7143 B14R1.19 O=C(NCCCO)c1ccc(cc1)I 527a_100000182051_100000187904 [1,1,0,0,0,0|2,0,0]=4 7144 B14R1.19 O=C(NCCCO)c1ccc(cc1)O 240690a_100000182051_100000212099 [1,1,0,0,0,0|2,0,0]=4 7145 B14R1.19 O=C(NCCCO)c1ccc(cc1)O 527a_100000182051_100000212099 [1,1,0,0,0,0|2,0,0]=4 7146 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_200025704644 [1,1,0,0,0,0|2,0,0]=4 7147 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_200025704644 [1,1,0,0,0,0|2,0,0]=4 7148 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)F 2230a_100000753910_200025704644 [1,1,0,0,0,0|2,0,0]=4 7149 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)F 34a_100000753910_200025704644 [1,1,0,0,0,0|2,0,0]=4 7150 B14R1.19 [13CH3]OCCNC(=O)c1ccc(cc1)Br 34a_200000158904_200025704644 [1,1,0,0,0,0|2,0,0]=4 7151 B14R1.19 [13CH3]OCCNC(=O)c1ccc(cc1)N 34a_100000740983_200025704644 [1,1,0,0,0,0|2,0,0]=4 7152 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Br 62a_100000211046_200025704644 [1,1,0,0,0,0|2,0,0]=4 7153 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Br 62a_200025704644_100000211046 [1,1,0,0,0,0|2,0,0]=4 7154 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_200025704644 [1,1,0,0,0,0|2,0,0]=4 7155 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Cl 62a_200025704644_200011217871 [1,1,0,0,0,0|2,0,0]=4 7156 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)F 62a_100000211961_200025704644 [1,1,0,0,0,0|2,0,0]=4 7157 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211961 [1,1,0,0,0,0|2,0,0]=4 7158 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)O 62a_200025704644_100000039620 [1,1,0,0,0,0|2,0,0]=4 7159 B14R1.19 [2H]C(OCCCC)c1ccc(cc1)F 34a_217856618577_100000210210 [1,1,0,0,0,0|1,0,1]=4 7160 B14R1.19 [2H]C(OCCCC)c1ccc(cc1)F 7a_217856618577_100000210211 [1,1,0,0,0,0|1,0,1]=4 7161 B14R1.20 CCCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210326 [1,1,0,0,0,0|1,0,0]=3 7162 B14R1.20 CCCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210326 [1,1,0,0,0,0|1,0,0]=3 7163 B14R1.20 CCCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210326 [1,1,0,0,0,0|1,0,0]=3 7164 B14R1.20 CCCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210326 [1,1,0,0,0,0|1,0,0]=3 7165 B14R1.20 CCCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210326 [1,1,0,0,0,0|1,0,0]=3 7166 B14R1.20 CCCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210326 [1,1,0,0,0,0|1,0,0]=3 7167 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 11a_100000102301_100000210664 [1,1,0,0,0,0|1,0,0]=3 7168 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 1626a_100000102301_100000210664 [1,1,0,0,0,0|1,0,0]=3 7169 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 240690a_100000102301_100000210664 [1,1,0,0,0,0|1,0,0]=3 7170 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 527a_100000102301_100000210664 [1,1,0,0,0,0|1,0,0]=3 7171 B14R1.20 CCCCNC(=O)c1cccc(c1)C 11a_100000102301_100000189346 [1,1,0,0,0,0|1,0,0]=3 7172 B14R1.20 CCCCNC(=O)c1cccc(c1)C 1626a_100000102301_100000189346 [1,1,0,0,0,0|1,0,0]=3 7173 B14R1.20 CCCCNC(=O)c1cccc(c1)C 240690a_100000102301_100000189346 [1,1,0,0,0,0|1,0,0]=3 7174 B14R1.20 CCCCNC(=O)c1cccc(c1)C 527a_100000102301_100000189346 [1,1,0,0,0,0|1,0,0]=3 7175 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 11a_100000102301_100000210390 [1,1,0,0,0,0|1,0,0]=3 7176 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 1626a_100000102301_100000210390 [1,1,0,0,0,0|1,0,0]=3 7177 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 240690a_100000102301_100000210390 [1,1,0,0,0,0|1,0,0]=3 7178 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 527a_100000102301_100000210390 [1,1,0,0,0,0|1,0,0]=3 7179 B14R1.20 CCCCNC(=O)c1cccc(c1)F 11a_100000102301_100000210950 [1,1,0,0,0,0|1,0,0]=3 7180 B14R1.20 CCCCNC(=O)c1cccc(c1)F 1626a_100000102301_100000210950 [1,1,0,0,0,0|1,0,0]=3 7181 B14R1.20 CCCCNC(=O)c1cccc(c1)F 240690a_100000102301_100000210950 [1,1,0,0,0,0|1,0,0]=3 7182 B14R1.20 CCCCNC(=O)c1cccc(c1)F 527a_100000102301_100000210950 [1,1,0,0,0,0|1,0,0]=3 7183 B14R1.20 CCCCNC(=O)c1cccc(c1)I 11a_100000102301_100000184098 [1,1,0,0,0,0|1,0,0]=3 7184 B14R1.20 CCCCNC(=O)c1cccc(c1)I 1626a_100000102301_100000184098 [1,1,0,0,0,0|1,0,0]=3 7185 B14R1.20 CCCCNC(=O)c1cccc(c1)I 240690a_100000102301_100000184098 [1,1,0,0,0,0|1,0,0]=3 7186 B14R1.20 CCCCNC(=O)c1cccc(c1)I 527a_100000102301_100000184098 [1,1,0,0,0,0|1,0,0]=3 7187 B14R1.20 CCCCNC(=O)c1cccc(c1)O 240690a_100000102301_100000183914 [1,1,0,0,0,0|1,0,0]=3 7188 B14R1.20 CCCCNC(=O)c1cccc(c1)O 271570a_203496583355_200000154868 [1,1,0,0,0,0|1,0,0]=3 7189 B14R1.20 CCCCNC(=O)c1cccc(c1)O 527a_100000102301_100000183914 [1,1,0,0,0,0|1,0,0]=3 7190 B14R1.20 CCCCNC(=O)c1cncc(c1)O 271570a_203496583355_200000154871 [1,1,0,0,0,0|2,0,0]=4 7191 B14R1.20 CCCCOC(C)c1cccc(c1)Br 34a_100000246457_100000210210 [1,1,0,0,0,0|1,0,1]=4 7192 B14R1.20 CCCCOC(C)c1cccc(c1)Br 7a_100000246457_100000210211 [1,1,0,0,0,0|1,0,1]=4 7193 B14R1.20 CCCCOC(C)c1cccc(c1)C 34a_100000757818_100000210210 [1,1,0,0,0,0|1,0,1]=4 7194 B14R1.20 CCCCOC(C)c1cccc(c1)C 7a_100000757818_100000210211 [1,1,0,0,0,0|1,0,1]=4 7195 B14R1.20 CCCCOC(C)c1cccc(c1)F 34a_100000744526_100000210210 [1,1,0,0,0,0|1,0,1]=4 7196 B14R1.20 CCCCOC(C)c1cccc(c1)F 7a_100000744526_100000210211 [1,1,0,0,0,0|1,0,1]=4 7197 B14R1.20 CCCCOC(C)c1cccc(c1)I 34a_100013085317_100000210210 [1,1,0,0,0,0|1,0,1]=4 7198 B14R1.20 CCCCOC(C)c1cccc(c1)I 7a_100013085317_100000210211 [1,1,0,0,0,0|1,0,1]=4 7199 B14R1.20 CCCCOC(C)c1cccc(c1)N 34a_100011217120_100000210210 [1,1,0,0,0,0|1,0,1]=4 7200 B14R1.20 CCCCOC(C)c1cccc(c1)N 7a_100011217120_100000210211 [1,1,0,0,0,0|1,0,1]=4 7201 B14R1.20 CCCCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210210 [1,1,0,0,0,0|1,0,1]=4 7202 B14R1.20 CCCCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210211 [1,1,0,0,0,0|1,0,1]=4 7203 B14R1.20 CCCNNC(=O)c1cccc(c1)Br 22a_100000740057_100000210664 [1,1,0,0,0,0|2,0,0]=4 7204 B14R1.20 CCCNNC(=O)c1cccc(c1)C 22a_100000740057_100000189346 [1,1,0,0,0,0|2,0,0]=4 7205 B14R1.20 CCCNNC(=O)c1cccc(c1)Cl 22a_100000740057_100000210390 [1,1,0,0,0,0|2,0,0]=4 7206 B14R1.20 CCCNNC(=O)c1cccc(c1)F 22a_100000740057_100000210950 [1,1,0,0,0,0|2,0,0]=4 7207 B14R1.20 CCCNNC(=O)c1cccc(c1)I 22a_100000740057_100000184098 [1,1,0,0,0,0|2,0,0]=4 7208 B14R1.20 CCCNNC(=O)c1cccc(c1)O 22a_100000740057_100000183914 [1,1,0,0,0,0|2,0,0]=4 7209 B14R1.20 CCCOCC(=O)c1cccc(c1)Br 34a_100000210258_100000212080 [1,1,0,0,0,0|2,0,0]=4 7210 B14R1.20 CCCOCC(=O)c1cccc(c1)C 34a_100000210258_100000739480 [1,1,0,0,0,0|2,0,0]=4 7211 B14R1.20 CCCOCC(=O)c1cccc(c1)Cl 34a_100000210258_100000211444 [1,1,0,0,0,0|2,0,0]=4 7212 B14R1.20 CCCOCC(=O)c1cccc(c1)Cl 7a_200011592804_100000210303 [1,1,0,0,0,0|2,0,0]=4 7213 B14R1.20 CCCOCC(=O)c1cccc(c1)F 34a_100000210258_100000215616 [1,1,0,0,0,0|2,0,0]=4 7214 B14R1.20 CCCOCC(=O)c1cccc(c1)F 34a_100011592800_100000210303 [1,1,0,0,0,0|2,0,0]=4 7215 B14R1.20 CCCOCC(=O)c1cccc(c1)F 7a_100011592800_100000210303 [1,1,0,0,0,0|2,0,0]=4 7216 B14R1.20 CCCOCC(=O)c1cccc(c1)O 34a_100000210258_100009813753 [1,1,0,0,0,0|2,0,0]=4 7217 B14R1.20 CCCSCC(=O)c1cccc(c1)Br 62a_100000210303_100000212080 [1,1,0,0,0,0|2,0,0]=4 7218 B14R1.20 CCCSCC(=O)c1cccc(c1)Br 62a_100000212080_100000210303 [1,1,0,0,0,0|2,0,0]=4 7219 B14R1.20 CCCSCC(=O)c1cccc(c1)C 62a_100000210303_100000739480 [1,1,0,0,0,0|2,0,0]=4 7220 B14R1.20 CCCSCC(=O)c1cccc(c1)C 62a_100000739480_100000210303 [1,1,0,0,0,0|2,0,0]=4 7221 B14R1.20 CCCSCC(=O)c1cccc(c1)Cl 62a_100000210303_100000211444 [1,1,0,0,0,0|2,0,0]=4 7222 B14R1.20 CCCSCC(=O)c1cccc(c1)Cl 62a_100000211444_100000210303 [1,1,0,0,0,0|2,0,0]=4 7223 B14R1.20 CCCSCC(=O)c1cccc(c1)F 62a_100000210303_100000215616 [1,1,0,0,0,0|2,0,0]=4 7224 B14R1.20 CCCSCC(=O)c1cccc(c1)F 62a_100000215616_100000210303 [1,1,0,0,0,0|2,0,0]=4 7225 B14R1.20 CCCSCC(=O)c1cccc(c1)O 62a_100000210303_100009813753 [1,1,0,0,0,0|2,0,0]=4 7226 B14R1.20 CCCSCC(=O)c1cccc(c1)O 62a_100009813753_100000210303 [1,1,0,0,0,0|2,0,0]=4 7227 B14R1.20 CCOCCC(=O)c1cccc(c1)Br 1458a_100000210664_100011215890 [1,1,0,0,0,0|2,0,0]=4 7228 B14R1.20 CCOCCC(=O)c1cccc(c1)C 1458a_100000189346_100011215890 [1,1,0,0,0,0|2,0,0]=4 7229 B14R1.20 CCOCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011215890 [1,1,0,0,0,0|2,0,0]=4 7230 B14R1.20 CCOCCC(=O)c1cccc(c1)F 1458a_100000210950_100011215890 [1,1,0,0,0,0|2,0,0]=4 7231 B14R1.20 CCOCCC(=O)c1cccc(c1)I 1458a_100000184098_100011215890 [1,1,0,0,0,0|2,0,0]=4 7232 B14R1.20 CCOCCC(=O)c1cccc(c1)O 1458a_100000183914_100011215890 [1,1,0,0,0,0|2,0,0]=4 7233 B14R1.20 CCSCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000757381 [1,1,0,0,0,0|2,0,0]=4 7234 B14R1.20 CCSCCC(=O)c1cccc(c1)C 1458a_100000189346_100000757381 [1,1,0,0,0,0|2,0,0]=4 7235 B14R1.20 CCSCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000757381 [1,1,0,0,0,0|2,0,0]=4 7236 B14R1.20 CCSCCC(=O)c1cccc(c1)F 1458a_100000210950_100000757381 [1,1,0,0,0,0|2,0,0]=4 7237 B14R1.20 CCSCCC(=O)c1cccc(c1)I 1458a_100000184098_100000757381 [1,1,0,0,0,0|2,0,0]=4 7238 B14R1.20 CCSCCC(=O)c1cccc(c1)O 1458a_100000183914_100000757381 [1,1,0,0,0,0|2,0,0]=4 7239 B14R1.20 COCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000740836 [1,1,0,0,0,0|2,0,0]=4 7240 B14R1.20 COCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000740836 [1,1,0,0,0,0|2,0,0]=4 7241 B14R1.20 COCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000740836 [1,1,0,0,0,0|2,0,0]=4 7242 B14R1.20 COCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000740836 [1,1,0,0,0,0|2,0,0]=4 7243 B14R1.20 COCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000740836 [1,1,0,0,0,0|2,0,0]=4 7244 B14R1.20 COCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000740836 [1,1,0,0,0,0|2,0,0]=4 7245 B14R1.20 COCCNC(=O)c1cccc(c1)Br 1626a_100000209980_100000210664 [1,1,0,0,0,0|2,0,0]=4 7246 B14R1.20 COCCNC(=O)c1cccc(c1)Br 240690a_100000209980_100000210664 [1,1,0,0,0,0|2,0,0]=4 7247 B14R1.20 COCCNC(=O)c1cccc(c1)Br 34a_200000158903_200000210301 [1,1,0,0,0,0|2,0,0]=4 7248 B14R1.20 COCCNC(=O)c1cccc(c1)Br 527a_100000209980_100000210664 [1,1,0,0,0,0|2,0,0]=4 7249 B14R1.20 COCCNC(=O)c1cccc(c1)Br 7a_200000158903_200000210301 [1,1,0,0,0,0|2,0,0]=4 7250 B14R1.20 COCCNC(=O)c1cccc(c1)C 1626a_100000209980_100000189346 [1,1,0,0,0,0|2,0,0]=4 7251 B14R1.20 COCCNC(=O)c1cccc(c1)C 240690a_100000209980_100000189346 [1,1,0,0,0,0|2,0,0]=4 7252 B14R1.20 COCCNC(=O)c1cccc(c1)C 527a_100000209980_100000189346 [1,1,0,0,0,0|2,0,0]=4 7253 B14R1.20 COCCNC(=O)c1cccc(c1)Cl 1626a_100000209980_100000210390 [1,1,0,0,0,0|2,0,0]=4 7254 B14R1.20 COCCNC(=O)c1cccc(c1)Cl 240690a_100000209980_100000210390 [1,1,0,0,0,0|2,0,0]=4 7255 B14R1.20 COCCNC(=O)c1cccc(c1)Cl 527a_100000209980_100000210390 [1,1,0,0,0,0|2,0,0]=4 7256 B14R1.20 COCCNC(=O)c1cccc(c1)F 1626a_100000209980_100000210950 [1,1,0,0,0,0|2,0,0]=4 7257 B14R1.20 COCCNC(=O)c1cccc(c1)F 240690a_100000209980_100000210950 [1,1,0,0,0,0|2,0,0]=4 7258 B14R1.20 COCCNC(=O)c1cccc(c1)F 527a_100000209980_100000210950 [1,1,0,0,0,0|2,0,0]=4 7259 B14R1.20 COCCNC(=O)c1cccc(c1)I 1626a_100000209980_100000184098 [1,1,0,0,0,0|2,0,0]=4 7260 B14R1.20 COCCNC(=O)c1cccc(c1)I 240690a_100000209980_100000184098 [1,1,0,0,0,0|2,0,0]=4 7261 B14R1.20 COCCNC(=O)c1cccc(c1)I 527a_100000209980_100000184098 [1,1,0,0,0,0|2,0,0]=4 7262 B14R1.20 COCCNC(=O)c1cccc(c1)O 240690a_100000209980_100000183914 [1,1,0,0,0,0|2,0,0]=4 7263 B14R1.20 COCCNC(=O)c1cccc(c1)O 527a_100000209980_100000183914 [1,1,0,0,0,0|2,0,0]=4 7264 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 11a_100020590264_100000210664 [1,1,0,0,0,0|2,0,0]=4 7265 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 1626a_100020590264_100000210664 [1,1,0,0,0,0|2,0,0]=4 7266 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 240690a_100020590264_100000210664 [1,1,0,0,0,0|2,0,0]=4 7267 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 527a_100020590264_100000210664 [1,1,0,0,0,0|2,0,0]=4 7268 B14R1.20 CSCCNC(=O)c1cccc(c1)C 11a_100020590264_100000189346 [1,1,0,0,0,0|2,0,0]=4 7269 B14R1.20 CSCCNC(=O)c1cccc(c1)C 1626a_100020590264_100000189346 [1,1,0,0,0,0|2,0,0]=4 7270 B14R1.20 CSCCNC(=O)c1cccc(c1)C 240690a_100020590264_100000189346 [1,1,0,0,0,0|2,0,0]=4 7271 B14R1.20 CSCCNC(=O)c1cccc(c1)C 527a_100020590264_100000189346 [1,1,0,0,0,0|2,0,0]=4 7272 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 11a_100020590264_100000210390 [1,1,0,0,0,0|2,0,0]=4 7273 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 1626a_100020590264_100000210390 [1,1,0,0,0,0|2,0,0]=4 7274 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 240690a_100020590264_100000210390 [1,1,0,0,0,0|2,0,0]=4 7275 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 527a_100020590264_100000210390 [1,1,0,0,0,0|2,0,0]=4 7276 B14R1.20 CSCCNC(=O)c1cccc(c1)F 11a_100020590264_100000210950 [1,1,0,0,0,0|2,0,0]=4 7277 B14R1.20 CSCCNC(=O)c1cccc(c1)F 1626a_100020590264_100000210950 [1,1,0,0,0,0|2,0,0]=4 7278 B14R1.20 CSCCNC(=O)c1cccc(c1)F 240690a_100020590264_100000210950 [1,1,0,0,0,0|2,0,0]=4 7279 B14R1.20 CSCCNC(=O)c1cccc(c1)F 527a_100020590264_100000210950 [1,1,0,0,0,0|2,0,0]=4 7280 B14R1.20 CSCCNC(=O)c1cccc(c1)I 11a_100020590264_100000184098 [1,1,0,0,0,0|2,0,0]=4 7281 B14R1.20 CSCCNC(=O)c1cccc(c1)I 1626a_100020590264_100000184098 [1,1,0,0,0,0|2,0,0]=4 7282 B14R1.20 CSCCNC(=O)c1cccc(c1)I 240690a_100020590264_100000184098 [1,1,0,0,0,0|2,0,0]=4 7283 B14R1.20 CSCCNC(=O)c1cccc(c1)I 527a_100020590264_100000184098 [1,1,0,0,0,0|2,0,0]=4 7284 B14R1.20 CSCCNC(=O)c1cccc(c1)O 240690a_100020590264_100000183914 [1,1,0,0,0,0|2,0,0]=4 7285 B14R1.20 CSCCNC(=O)c1cccc(c1)O 527a_100020590264_100000183914 [1,1,0,0,0,0|2,0,0]=4 7286 B14R1.20 Cc1cccc(c1)C(=O)CCCCF 1458a_100000189346_100000729493 [1,1,0,0,0,0|2,0,0]=4 7287 B14R1.20 Cc1cccc(c1)C(=O)CCCCO 1458a_100000189346_100000210776 [1,1,0,0,0,0|2,0,0]=4 7288 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 11a_100015189416_100000189346 [1,1,0,0,0,0|2,0,0]=4 7289 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 1626a_100015189416_100000189346 [1,1,0,0,0,0|2,0,0]=4 7290 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 240690a_100015189416_100000189346 [1,1,0,0,0,0|2,0,0]=4 7291 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 527a_100015189416_100000189346 [1,1,0,0,0,0|2,0,0]=4 7292 B14R1.20 Cc1cccc(c1)C(=O)NCCCO 240690a_100000182051_100000189346 [1,1,0,0,0,0|2,0,0]=4 7293 B14R1.20 Cc1cccc(c1)C(=O)NCCCO 527a_100000182051_100000189346 [1,1,0,0,0,0|2,0,0]=4 7294 B14R1.20 NCCCNC(=O)c1cccc(c1)O 271570a_203496583355_100000748816 [1,1,0,0,0,0|2,0,0]=4 7295 B14R1.20 O=C(CCCCF)c1cccc(c1)Br 1458a_100000210664_100000729493 [1,1,0,0,0,0|2,0,0]=4 7296 B14R1.20 O=C(CCCCF)c1cccc(c1)Cl 1458a_100000210390_100000729493 [1,1,0,0,0,0|2,0,0]=4 7297 B14R1.20 O=C(CCCCF)c1cccc(c1)F 1458a_100000210950_100000729493 [1,1,0,0,0,0|2,0,0]=4 7298 B14R1.20 O=C(CCCCF)c1cccc(c1)I 1458a_100000184098_100000729493 [1,1,0,0,0,0|2,0,0]=4 7299 B14R1.20 O=C(CCCCF)c1cccc(c1)O 1458a_100000183914_100000729493 [1,1,0,0,0,0|2,0,0]=4 7300 B14R1.20 O=C(CCCCO)c1cccc(c1)Br 1458a_100000210664_100000210776 [1,1,0,0,0,0|2,0,0]=4 7301 B14R1.20 O=C(CCCCO)c1cccc(c1)Cl 1458a_100000210390_100000210776 [1,1,0,0,0,0|2,0,0]=4 7302 B14R1.20 O=C(CCCCO)c1cccc(c1)F 1458a_100000210950_100000210776 [1,1,0,0,0,0|2,0,0]=4 7303 B14R1.20 O=C(CCCCO)c1cccc(c1)I 1458a_100000184098_100000210776 [1,1,0,0,0,0|2,0,0]=4 7304 B14R1.20 O=C(CCCCO)c1cccc(c1)O 1458a_100000183914_100000210776 [1,1,0,0,0,0|2,0,0]=4 7305 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 11a_100015189416_100000210664 [1,1,0,0,0,0|2,0,0]=4 7306 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 1626a_100015189416_100000210664 [1,1,0,0,0,0|2,0,0]=4 7307 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 240690a_100015189416_100000210664 [1,1,0,0,0,0|2,0,0]=4 7308 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 527a_100015189416_100000210664 [1,1,0,0,0,0|2,0,0]=4 7309 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 11a_100015189416_100000210390 [1,1,0,0,0,0|2,0,0]=4 7310 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 1626a_100015189416_100000210390 [1,1,0,0,0,0|2,0,0]=4 7311 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 240690a_100015189416_100000210390 [1,1,0,0,0,0|2,0,0]=4 7312 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 527a_100015189416_100000210390 [1,1,0,0,0,0|2,0,0]=4 7313 B14R1.20 O=C(NCCCF)c1cccc(c1)F 11a_100015189416_100000210950 [1,1,0,0,0,0|2,0,0]=4 7314 B14R1.20 O=C(NCCCF)c1cccc(c1)F 1626a_100015189416_100000210950 [1,1,0,0,0,0|2,0,0]=4 7315 B14R1.20 O=C(NCCCF)c1cccc(c1)F 240690a_100015189416_100000210950 [1,1,0,0,0,0|2,0,0]=4 7316 B14R1.20 O=C(NCCCF)c1cccc(c1)F 527a_100015189416_100000210950 [1,1,0,0,0,0|2,0,0]=4 7317 B14R1.20 O=C(NCCCF)c1cccc(c1)I 11a_100015189416_100000184098 [1,1,0,0,0,0|2,0,0]=4 7318 B14R1.20 O=C(NCCCF)c1cccc(c1)I 1626a_100015189416_100000184098 [1,1,0,0,0,0|2,0,0]=4 7319 B14R1.20 O=C(NCCCF)c1cccc(c1)I 240690a_100015189416_100000184098 [1,1,0,0,0,0|2,0,0]=4 7320 B14R1.20 O=C(NCCCF)c1cccc(c1)I 527a_100015189416_100000184098 [1,1,0,0,0,0|2,0,0]=4 7321 B14R1.20 O=C(NCCCF)c1cccc(c1)O 240690a_100015189416_100000183914 [1,1,0,0,0,0|2,0,0]=4 7322 B14R1.20 O=C(NCCCF)c1cccc(c1)O 527a_100015189416_100000183914 [1,1,0,0,0,0|2,0,0]=4 7323 B14R1.20 O=C(NCCCO)c1cccc(c1)Br 240690a_100000182051_100000210664 [1,1,0,0,0,0|2,0,0]=4 7324 B14R1.20 O=C(NCCCO)c1cccc(c1)Br 527a_100000182051_100000210664 [1,1,0,0,0,0|2,0,0]=4 7325 B14R1.20 O=C(NCCCO)c1cccc(c1)Cl 240690a_100000182051_100000210390 [1,1,0,0,0,0|2,0,0]=4 7326 B14R1.20 O=C(NCCCO)c1cccc(c1)Cl 527a_100000182051_100000210390 [1,1,0,0,0,0|2,0,0]=4 7327 B14R1.20 O=C(NCCCO)c1cccc(c1)F 240690a_100000182051_100000210950 [1,1,0,0,0,0|2,0,0]=4 7328 B14R1.20 O=C(NCCCO)c1cccc(c1)F 527a_100000182051_100000210950 [1,1,0,0,0,0|2,0,0]=4 7329 B14R1.20 O=C(NCCCO)c1cccc(c1)I 240690a_100000182051_100000184098 [1,1,0,0,0,0|2,0,0]=4 7330 B14R1.20 O=C(NCCCO)c1cccc(c1)I 527a_100000182051_100000184098 [1,1,0,0,0,0|2,0,0]=4 7331 B14R1.20 O=C(NCCCO)c1cccc(c1)O 240690a_100000182051_100000183914 [1,1,0,0,0,0|2,0,0]=4 7332 B14R1.20 O=C(NCCCO)c1cccc(c1)O 527a_100000182051_100000183914 [1,1,0,0,0,0|2,0,0]=4 7333 B14R1.20 [13CH3]OCCNC(=O)c1cccc(c1)Br 34a_200000158903_200025704644 [1,1,0,0,0,0|2,0,0]=4 7334 B14R1.20 [13CH3]OCCNC(=O)c1cccc(c1)Br 7a_200000158903_200025704644 [1,1,0,0,0,0|2,0,0]=4 7335 B14R1.29 CCCC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747444 [1,1,0,0,0,0|1,0,1]=4 7336 B14R1.29 CCCC(=O)CC(=O)c1ccccc1 1458a_100000211992_100000211460 [1,1,0,0,0,0|1,0,1]=4 7337 B14R1.29 CCCC(C)CC(=O)c1ccccc1 1458a_100000185807_100011216630 [1,1,0,0,0,0|1,0,0]=3 7338 B14R1.29 CCCC(C)NC(=O)c1ccccc1 11a_100000741246_100000185807 [1,1,0,0,0,0|1,0,0]=3 7339 B14R1.29 CCCC(C)NC(=O)c1ccccc1 1626a_100000741246_100000185807 [1,1,0,0,0,0|1,0,0]=3 7340 B14R1.29 CCCC(C)NC(=O)c1ccccc1 240690a_100000741246_100000185807 [1,1,0,0,0,0|1,0,0]=3 7341 B14R1.29 CCCC(C)NC(=O)c1ccccc1 527a_100000741246_100000185807 [1,1,0,0,0,0|1,0,0]=3 7342 B14R1.29 CCCC(C)OC(C)c1ccccc1 34a_100000764384_100000211855 [1,1,0,0,0,0|1,0,1]=4 7343 B14R1.29 CCCC(C)OC(C)c1ccccc1 7a_100000764384_100000230085 [1,1,0,0,0,0|1,0,1]=4 7344 B14R1.29 CCCC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000766640 [1,1,0,0,0,0|1,0,1]=4 7345 B14R1.29 CCCC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000766640 [1,1,0,0,0,0|1,0,1]=4 7346 B14R1.29 CCCN(C)CC(=O)c1ccccc1 269982a_100000747261_100000211460 [1,1,0,0,0,0|2,0,0]=4 7347 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 11a_100000764878_100000185807 [1,1,0,0,0,0|2,0,0]=4 7348 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 1626a_100000764878_100000185807 [1,1,0,0,0,0|2,0,0]=4 7349 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 240690a_100000764878_100000185807 [1,1,0,0,0,0|2,0,0]=4 7350 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 527a_100000764878_100000185807 [1,1,0,0,0,0|2,0,0]=4 7351 B14R1.29 C[C@H](CCO)NC(=O)c1ccccc1 240690a_100000706166_100000185807 [1,1,0,0,0,0|2,0,0]=4 7352 B14R1.29 C[C@H](CCO)NC(=O)c1ccccc1 527a_100000706166_100000185807 [1,1,0,0,0,0|2,0,0]=4 7353 B14R1.38 C#CCCCCC(=O)c1ccccc1 1458a_100000185807_100010269958 [1,1,0,0,0,0|1,0,1]=4 7354 B14R1.38 C#CCCCNC(=O)c1ccccc1 11a_100000718082_100000185807 [1,1,0,0,0,0|1,0,1]=4 7355 B14R1.38 C#CCCCNC(=O)c1ccccc1 1626a_100000718082_100000185807 [1,1,0,0,0,0|1,0,1]=4 7356 B14R1.38 C#CCCCNC(=O)c1ccccc1 240690a_100000718082_100000185807 [1,1,0,0,0,0|1,0,1]=4 7357 B14R1.38 C#CCCCNC(=O)c1ccccc1 527a_100000718082_100000185807 [1,1,0,0,0,0|1,0,1]=4 7358 B14R1.38 C#CCSCOC(=O)c1ccccc1 62a_100000038162_100000073877 [1,1,0,0,0,0|0,0,2]=4 7359 B14R1.38 C=CCCCCC(=O)c1ccccc1 1458a_100000185807_100011215482 [1,1,0,0,0,0|1,0,1]=4 7360 B14R1.38 C=CCCCNC(=O)c1ccccc1 11a_100000700776_100000185807 [1,1,0,0,0,0|1,0,1]=4 7361 B14R1.38 C=CCCCNC(=O)c1ccccc1 1626a_100000700776_100000185807 [1,1,0,0,0,0|1,0,1]=4 7362 B14R1.38 C=CCCCNC(=O)c1ccccc1 240690a_100000700776_100000185807 [1,1,0,0,0,0|1,0,1]=4 7363 B14R1.38 C=CCCCNC(=O)c1ccccc1 527a_100000700776_100000185807 [1,1,0,0,0,0|1,0,1]=4 7364 B14R1.38 C=CCSCOC(=O)c1ccccc1 62a_100000073877_100000210623 [1,1,0,0,0,0|0,0,2]=4 7365 B14R1.38 C=CCSCOC(=O)c1ccccc1 62a_100000210623_100000073877 [1,1,0,0,0,0|0,0,2]=4 7366 B14R1.38 CC(OCCCCBr)c1ccccc1 34a_100011216708_100000211855 [1,1,0,0,0,0|1,0,1]=4 7367 B14R1.38 CC(OCCCCCl)c1ccccc1 34a_100000210776_100000211855 [1,1,0,0,0,0|1,0,1]=4 7368 B14R1.38 CC(OCCCCCl)c1ccccc1 7a_100000210776_100000230085 [1,1,0,0,0,0|1,0,1]=4 7369 B14R1.38 CC(OCCCCF)c1ccccc1 34a_100011995726_100000211855 [1,1,0,0,0,0|1,0,1]=4 7370 B14R1.38 CC(OCCCCF)c1ccccc1 7a_100011995726_100000230085 [1,1,0,0,0,0|1,0,1]=4 7371 B14R1.38 CC(OCCCCI)c1ccccc1 34a_200012148704_100000211855 [1,1,0,0,0,0|1,0,1]=4 7372 B14R1.38 CC(OCCCCN)c1ccccc1 34a_100000750430_100000211855 [1,1,0,0,0,0|1,0,1]=4 7373 B14R1.38 CC(OCCCN[13CH3])c1ccccc1 2230a_100000206020_200025704644 [1,1,0,0,0,0|1,0,1]=4 7374 B14R1.38 CC(OCCCN[13CH3])c1ccccc1 34a_100000206020_200025704644 [1,1,0,0,0,0|1,0,1]=4 7375 B14R1.38 CC/C=C\CCC(=O)c1ccccc1 1458a_100000185807_100015370543 [1,1,0,0,0,0|1,0,1]=4 7376 B14R1.38 CCCC=NNC(=O)c1ccccc1 4a_100000184135_100000185831 [1,1,0,0,0,0|1,0,1]=4 7377 B14R1.38 CCCCCCC(=O)c1ccccc1 1458a_100000185807_100000210757 [1,1,0,0,0,0|1,0,0]=3 7378 B14R1.38 CCCCCNC(=O)c1ccccc1 11a_100000209983_100000185807 [1,1,0,0,0,0|1,0,0]=3 7379 B14R1.38 CCCCCNC(=O)c1ccccc1 1626a_100000209983_100000185807 [1,1,0,0,0,0|1,0,0]=3 7380 B14R1.38 CCCCCNC(=O)c1ccccc1 240690a_100000209983_100000185807 [1,1,0,0,0,0|1,0,0]=3 7381 B14R1.38 CCCCCNC(=O)c1ccccc1 527a_100000209983_100000185807 [1,1,0,0,0,0|1,0,0]=3 7382 B14R1.38 CCCCCOC(C)c1ccccc1 34a_100000210253_100000211855 [1,1,0,0,0,0|1,0,1]=4 7383 B14R1.38 CCCCCOC(C)c1ccccc1 7a_100000210253_100000230085 [1,1,0,0,0,0|1,0,1]=4 7384 B14R1.38 CCCCCO[C@H](C)c1ccccc1 34a_100000761318_100000718602 [1,1,0,0,0,0|1,0,1]=4 7385 B14R1.38 CCCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210326 [1,1,0,0,0,0|1,0,1]=4 7386 B14R1.38 CCCCNCC(=O)c1ccccc1 7a_106832991798_100000211460 [1,1,0,0,0,0|1,0,0]=3 7387 B14R1.38 CCCCNCC(=O)c1ccccn1 7a_106832991798_100000027445 [1,1,0,0,0,0|2,0,0]=4 7388 B14R1.38 CCCCNCC(=O)c1ccncc1 7a_106832991798_100015248511 [1,1,0,0,0,0|2,0,0]=4 7389 B14R1.38 CCCCNN=C(C)c1ccccc1 4a_100025702795_100000185851 [1,1,0,0,0,0|2,0,0]=4 7390 B14R1.38 CCCCNNC(=O)c1ccccc1 22a_100025702795_100000185807 [1,1,0,0,0,0|1,0,0]=3 7391 B14R1.38 CCCCOCC(=O)c1ccccc1 1458a_100000185807_100011995733 [1,1,0,0,0,0|0,0,0]=2 7392 B14R1.38 CCCCOCC(=O)c1ccccc1 7a_100000210227_100000211460 [1,1,0,0,0,0|0,0,0]=2 7393 B14R1.38 CCCCOCC(=O)c1ccccn1 34a_100000210227_100000027445 [1,1,0,0,0,0|1,0,0]=3 7394 B14R1.38 CCCCOCC(=O)c1ccccn1 7a_100000210227_100000027445 [1,1,0,0,0,0|1,0,0]=3 7395 B14R1.38 CCCCOCC(=O)c1ccncc1 7a_100000210227_100015248511 [1,1,0,0,0,0|1,0,0]=3 7396 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100000210227_100000756946 [1,1,0,0,0,0|1,0,1]=4 7397 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100011215166_100000210210 [1,1,0,0,0,0|1,0,1]=4 7398 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100000210227_100000756946 [1,1,0,0,0,0|1,0,1]=4 7399 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100011215166_100000210211 [1,1,0,0,0,0|1,0,1]=4 7400 B14R1.38 CCCCOCC(O)c1ccccc1 34a_100000210227_100000185958 [1,1,0,0,0,0|0,0,2]=4 7401 B14R1.38 CCCCOCC(O)c1ccccc1 7a_100000210227_100000185958 [1,1,0,0,0,0|0,0,2]=4 7402 B14R1.38 CCCCOCN(C)c1ccccc1 2230a_100000210012_100011995733 [1,1,0,0,0,0|2,0,0]=4 7403 B14R1.38 CCCCOCN(C)c1ccccc1 269982a_100000210012_100011995733 [1,1,0,0,0,0|2,0,0]=4 7404 B14R1.38 CCCCOCN(C)c1ccccc1 34a_100000210012_100011995733 [1,1,0,0,0,0|2,0,0]=4 7405 B14R1.38 CCCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210210 [1,1,0,0,0,0|1,0,1]=4 7406 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 34a_100000210227_100011933945 [1,1,0,0,0,0|0,0,2]=4 7407 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 7a_100000210227_100011933945 [1,1,0,0,0,0|0,0,2]=4 7408 B14R1.38 CCCCSCC(=O)c1ccccc1 62a_100000210211_100000211460 [1,1,0,0,0,0|0,1,0]=3 7409 B14R1.38 CCCCSCC(=O)c1ccccc1 62a_100000211460_100000210210 [1,1,0,0,0,0|0,1,0]=3 7410 B14R1.38 CCCCSCC(=O)c1ccccn1 62a_100000027445_100000210210 [1,1,0,0,0,0|1,1,0]=4 7411 B14R1.38 CCCCSCC(=O)c1ccccn1 62a_100000210211_100000027445 [1,1,0,0,0,0|1,1,0]=4 7412 B14R1.38 CCCCSCC(=O)c1cccnc1 62a_100000210211_100000757877 [1,1,0,0,0,0|1,1,0]=4 7413 B14R1.38 CCCCSCC(=O)c1cccnc1 62a_100000757877_100000210210 [1,1,0,0,0,0|1,1,0]=4 7414 B14R1.38 CCCCSCC(=O)c1ccncc1 62a_100000027454_100000210210 [1,1,0,0,0,0|1,1,0]=4 7415 B14R1.38 CCCCSCC(=O)c1ccncc1 62a_100000210211_100000027454 [1,1,0,0,0,0|1,1,0]=4 7416 B14R1.38 CCCCSCS(=O)c1ccccc1 62a_100000210211_100000031784 [1,1,0,0,0,0|1,1,0]=4 7417 B14R1.38 CCCOCCC(=O)c1ccccc1 1458a_100000185807_100011215938 [1,1,0,0,0,0|1,0,0]=3 7418 B14R1.38 CCCSCCC(=O)c1ccccc1 62a_100000210303_100000750707 [1,1,0,0,0,0|1,0,0]=3 7419 B14R1.38 CCCSCCC(=O)c1ccccc1 62a_100000750707_100000210303 [1,1,0,0,0,0|1,0,0]=3 7420 B14R1.38 CCCSCCS(=O)c1ccccc1 62a_100000210303_100000740319 [1,1,0,0,0,0|2,0,0]=4 7421 B14R1.38 CCCSCOC(=O)c1ccccc1 62a_100000073877_100000210303 [1,1,0,0,0,0|0,0,0]=2 7422 B14R1.38 CCCSCOC(=O)c1ccccc1 62a_100000210303_100000073877 [1,1,0,0,0,0|0,0,0]=2 7423 B14R1.38 CCNCCCC(=O)c1ccccc1 2230a_100015525214_100000211006 [1,1,0,0,0,0|1,0,0]=3 7424 B14R1.38 CCNCCNC(=O)c1ccccc1 2230a_100000736134_100000210202 [1,1,0,0,0,0|1,0,0]=3 7425 B14R1.38 CCNCCNC(=O)c1ccncc1 2230a_200011198449_100000210202 [1,1,0,0,0,0|2,0,0]=4 7426 B14R1.38 CCOCCCC(=O)c1ccccc1 1458a_100000185807_100012232248 [1,1,0,0,0,0|1,0,0]=3 7427 B14R1.38 CCOCCNC(=O)c1ccccc1 11a_100011200944_100000185807 [1,1,0,0,0,0|1,0,0]=3 7428 B14R1.38 CCOCCNC(=O)c1ccccc1 1626a_102516460346_100000185807 [1,1,0,0,0,0|1,0,0]=3 7429 B14R1.38 CCOCCNC(=O)c1ccccc1 240690a_100011200944_100000185807 [1,1,0,0,0,0|1,0,0]=3 7430 B14R1.38 CCOCCNC(=O)c1ccccc1 34a_200000158897_100000210202 [1,1,0,0,0,0|1,0,0]=3 7431 B14R1.38 CCOCCNC(=O)c1ccccc1 527a_100011200944_100000185807 [1,1,0,0,0,0|1,0,0]=3 7432 B14R1.38 CCOCCNC(=O)c1ccccc1 7a_200000158897_100000210202 [1,1,0,0,0,0|1,0,0]=3 7433 B14R1.38 CCOCCOC(=O)c1ccccc1 34a_100121572206_100009812718 [1,1,0,0,0,0|0,0,0]=2 7434 B14R1.38 CCOCCOC(=O)c1ccccc1 7a_100000025465_100000210202 [1,1,0,0,0,0|0,0,0]=2 7435 B14R1.38 CCOCCOC(C)c1ccccc1 34a_100000210136_100000211855 [1,1,0,0,0,0|1,0,1]=4 7436 B14R1.38 CCOCCOC(C)c1ccccc1 7a_100000210136_100000230085 [1,1,0,0,0,0|1,0,1]=4 7437 B14R1.38 CCOCCO[C@H](C)c1ccccc1 34a_100000761318_100000210147 [1,1,0,0,0,0|1,0,1]=4 7438 B14R1.38 CCOCCO[C@H](C)c1ccccc1 7a_100000761318_100011215890 [1,1,0,0,0,0|1,0,1]=4 7439 B14R1.38 CCOCSCC(=O)c1ccccc1 62a_100000211460_100000739092 [1,1,0,0,0,0|1,1,0]=4 7440 B14R1.38 CCOCSCC(=O)c1ccccc1 62a_100000739092_100000211460 [1,1,0,0,0,0|1,1,0]=4 7441 B14R1.38 CCSCCCC(=O)c1ccccc1 62a_100000210202_100000211006 [1,1,0,0,0,0|1,0,0]=3 7442 B14R1.38 CCSCCCC(=O)c1ccccc1 62a_100000211006_100000210202 [1,1,0,0,0,0|1,0,0]=3 7443 B14R1.38 CCSCCNC(=O)c1ccccc1 11a_100000106463_100000185807 [1,1,0,0,0,0|1,0,0]=3 7444 B14R1.38 CCSCCNC(=O)c1ccccc1 1626a_100000106463_100000185807 [1,1,0,0,0,0|1,0,0]=3 7445 B14R1.38 CCSCCNC(=O)c1ccccc1 240690a_100000106463_100000185807 [1,1,0,0,0,0|1,0,0]=3 7446 B14R1.38 CCSCCNC(=O)c1ccccc1 527a_100000106463_100000185807 [1,1,0,0,0,0|1,0,0]=3 7447 B14R1.38 CCSCCNC(=O)c1ccccc1 62a_100000210202_200011215302 [1,1,0,0,0,0|1,0,0]=3 7448 B14R1.38 CCSCCNC(=O)c1ccccc1 62a_200011215302_100000210202 [1,1,0,0,0,0|1,0,0]=3 7449 B14R1.38 CCSCCOC(=O)c1ccccc1 62a_100000210202_100009812718 [1,1,0,0,0,0|0,0,0]=2 7450 B14R1.38 CCSCCOC(=O)c1ccccc1 62a_100009812718_100000210202 [1,1,0,0,0,0|0,0,0]=2 7451 B14R1.38 CCSCCOC(C)c1ccccc1 34a_100000212035_100000211855 [1,1,0,0,0,0|1,0,1]=4 7452 B14R1.38 CCSCCOC(C)c1ccccc1 7a_100000212035_100000230085 [1,1,0,0,0,0|1,0,1]=4 7453 B14R1.38 CCSCCO[C@H](C)c1ccccc1 34a_100000761318_100000757381 [1,1,0,0,0,0|1,0,1]=4 7454 B14R1.38 CCSCCO[C@H](C)c1ccccc1 7a_100000761318_100000757381 [1,1,0,0,0,0|1,0,1]=4 7455 B14R1.38 CNCCCOC(=O)c1ccccc1 34a_100102657272_200009892979 [1,1,0,0,0,0|0,0,0]=2 7456 B14R1.38 CNCCCOC(=O)c1ccccc1 7a_106832991635_200009892979 [1,1,0,0,0,0|0,0,0]=2 7457 B14R1.38 CNCCCOC(C)c1ccccc1 2230a_100000206020_200000210301 [1,1,0,0,0,0|1,0,1]=4 7458 B14R1.38 CNCCCOC(C)c1ccccc1 34a_100000206020_200000210301 [1,1,0,0,0,0|1,0,1]=4 7459 B14R1.38 CNCCCOC(C)c1ccccc1 34a_100000213112_100000211855 [1,1,0,0,0,0|1,0,1]=4 7460 B14R1.38 COCCCCC(=O)c1ccccc1 1458a_100000185807_100000755781 [1,1,0,0,0,0|1,0,0]=3 7461 B14R1.38 COCCCNC(=O)c1ccccc1 1626a_100150723488_100000185807 [1,1,0,0,0,0|1,0,0]=3 7462 B14R1.38 COCCCNC(=O)c1ccccc1 240690a_100150723488_100000185807 [1,1,0,0,0,0|1,0,0]=3 7463 B14R1.38 COCCCNC(=O)c1ccccc1 527a_100150723488_100000185807 [1,1,0,0,0,0|1,0,0]=3 7464 B14R1.38 COCCCOC(=O)c1ccccc1 34a_100138415774_200009892979 [1,1,0,0,0,0|0,0,0]=2 7465 B14R1.38 COCCCOC(C)c1ccccc1 34a_100000740835_100000211855 [1,1,0,0,0,0|1,0,1]=4 7466 B14R1.38 COCCCO[C@H](C)c1ccccc1 34a_100000761318_100000740836 [1,1,0,0,0,0|1,0,1]=4 7467 B14R1.38 COCCCO[C@H](C)c1ccccc1 7a_100000761318_100000740836 [1,1,0,0,0,0|1,0,1]=4 7468 B14R1.38 COCCNNC(=O)c1ccccc1 22a_100000741390_100000185807 [1,1,0,0,0,0|2,0,0]=4 7469 B14R1.38 COCCOCC(=O)c1ccccn1 34a_100000210237_100000027445 [1,1,0,0,0,0|2,0,0]=4 7470 B14R1.38 COCCSCC(=O)c1ccccc1 62a_100000211460_100000233755 [1,1,0,0,0,0|1,1,0]=4 7471 B14R1.38 COCCSCC(=O)c1ccccc1 62a_100000233755_100000211460 [1,1,0,0,0,0|1,1,0]=4 7472 B14R1.38 COCSCCC(=O)c1ccccc1 62a_100000750707_100000766300 [1,1,0,0,0,0|2,0,0]=4 7473 B14R1.38 COCSCCC(=O)c1ccccc1 62a_100000766300_100000750707 [1,1,0,0,0,0|2,0,0]=4 7474 B14R1.38 COCSCOC(=O)c1ccccc1 62a_100000073877_100000766300 [1,1,0,0,0,0|1,0,0]=3 7475 B14R1.38 COCSCOC(=O)c1ccccc1 62a_100000766300_100000073877 [1,1,0,0,0,0|1,0,0]=3 7476 B14R1.38 CSCCCNC(=O)c1ccccc1 11a_100000749238_100000185807 [1,1,0,0,0,0|1,0,0]=3 7477 B14R1.38 CSCCCNC(=O)c1ccccc1 1626a_100000749238_100000185807 [1,1,0,0,0,0|1,0,0]=3 7478 B14R1.38 CSCCCNC(=O)c1ccccc1 240690a_100000749238_100000185807 [1,1,0,0,0,0|1,0,0]=3 7479 B14R1.38 CSCCCNC(=O)c1ccccc1 527a_100000749238_100000185807 [1,1,0,0,0,0|1,0,0]=3 7480 B14R1.38 CSCCCOC(=O)c1ccccc1 62a_200000210301_200009892979 [1,1,0,0,0,0|0,0,0]=2 7481 B14R1.38 CSCCCOC(=O)c1ccccc1 62a_200009892979_200000210301 [1,1,0,0,0,0|0,0,0]=2 7482 B14R1.38 CSCCCOC(C)c1ccccc1 34a_100000690336_100000211855 [1,1,0,0,0,0|1,0,1]=4 7483 B14R1.38 CSCCCOC(C)c1ccccc1 7a_100000690336_100000230085 [1,1,0,0,0,0|1,0,1]=4 7484 B14R1.38 CSCCOCC(=O)c1ccccc1 7a_100000230434_100000211460 [1,1,0,0,0,0|1,0,0]=3 7485 B14R1.38 CSCCOCC(=O)c1ccccn1 34a_100000230434_100000027445 [1,1,0,0,0,0|2,0,0]=4 7486 B14R1.38 CSCCOCC(=O)c1ccccn1 7a_100000230434_100000027445 [1,1,0,0,0,0|2,0,0]=4 7487 B14R1.38 CSCCOCC(=O)c1ccncc1 7a_100000230434_100015248511 [1,1,0,0,0,0|2,0,0]=4 7488 B14R1.38 CSCCSCC(=O)c1ccccc1 62a_100000211460_100000751147 [1,1,0,0,0,0|1,1,0]=4 7489 B14R1.38 CSCCSCC(=O)c1ccccc1 62a_100000212216_100000211460 [1,1,0,0,0,0|1,1,0]=4 7490 B14R1.38 CSCSCCC(=O)c1ccccc1 62a_100000750707_100011218213 [1,1,0,0,0,0|2,0,0]=4 7491 B14R1.38 CSCSCCC(=O)c1ccccc1 62a_100011218213_100000750707 [1,1,0,0,0,0|2,0,0]=4 7492 B14R1.38 CSCSCOC(=O)c1ccccc1 62a_100000073877_100011218213 [1,1,0,0,0,0|1,0,0]=3 7493 B14R1.38 CSCSCOC(=O)c1ccccc1 62a_100011218213_100000073877 [1,1,0,0,0,0|1,0,0]=3 7494 B14R1.38 C[C@@H](OCCCCF)c1ccccc1 34a_100000761318_100000729493 [1,1,0,0,0,0|1,0,1]=4 7495 B14R1.38 C[C@@H](OCCCCF)c1ccccc1 7a_100000761318_100000729493 [1,1,0,0,0,0|1,0,1]=4 7496 B14R1.38 C[C@@H](OCCCCO)c1ccccc1 34a_100000761318_100011216708 [1,1,0,0,0,0|1,0,1]=4 7497 B14R1.38 C[C@@H](OCCCCO)c1ccccc1 7a_100000761318_100000210776 [1,1,0,0,0,0|1,0,1]=4 7498 B14R1.38 N#CCCCCC(=O)c1ccccc1 1458a_100000185807_100000211819 [1,1,0,0,0,0|1,0,1]=4 7499 B14R1.38 N#CCSCOC(=O)c1ccccc1 62a_100000073877_100011215382 [1,1,0,0,0,0|1,0,1]=4 7500 B14R1.38 N#CCSCOC(=O)c1ccccc1 62a_100011215382_100000073877 [1,1,0,0,0,0|1,0,1]=4 7501 B14R1.38 NCCCOCC(=O)c1ccccn1 34a_100000182051_100000027445 [1,1,0,0,0,0|2,0,0]=4 7502 B14R1.38 O=C(CCCCCF)c1ccccc1 1458a_100000185807_100000729378 [1,1,0,0,0,0|1,0,0]=3 7503 B14R1.38 O=C(CCCCCO)c1ccccc1 1458a_100000185807_100000746330 [1,1,0,0,0,0|1,0,0]=3 7504 B14R1.38 O=C(CCCSCF)c1ccccc1 62a_100000211006_100015361967 [1,1,0,0,0,0|2,0,0]=4 7505 B14R1.38 O=C(CCCSCF)c1ccccc1 62a_100015361967_100000211006 [1,1,0,0,0,0|2,0,0]=4 7506 B14R1.38 O=C(CCNCCO)c1ccccc1 2230a_100016997473_100000750707 [1,1,0,0,0,0|2,0,0]=4 7507 B14R1.38 O=C(CCOCCO)c1ccccc1 1458a_100000185807_100011215305 [1,1,0,0,0,0|2,0,0]=4 7508 B14R1.38 O=C(CCSCCF)c1ccccc1 62a_100000750707_100011217306 [1,1,0,0,0,0|2,0,0]=4 7509 B14R1.38 O=C(CCSCCF)c1ccccc1 62a_100011217306_100000750707 [1,1,0,0,0,0|2,0,0]=4 7510 B14R1.38 O=C(CCSCCO)c1ccccc1 62a_100000211926_100000750707 [1,1,0,0,0,0|2,0,0]=4 7511 B14R1.38 O=C(CCSCCO)c1ccccc1 62a_100000750707_100000211926 [1,1,0,0,0,0|2,0,0]=4 7512 B14R1.38 O=C(COCCCBr)c1ccccn1 34a_100011217188_100000027445 [1,1,0,0,0,0|2,0,0]=4 7513 B14R1.38 O=C(COCCCCl)c1ccccn1 34a_100000230001_100000027445 [1,1,0,0,0,0|2,0,0]=4 7514 B14R1.38 O=C(COCCCF)c1ccccn1 34a_100000759539_100000027445 [1,1,0,0,0,0|2,0,0]=4 7515 B14R1.38 O=C(CSCCCF)c1ccccc1 62a_100000211460_100011934791 [1,1,0,0,0,0|1,1,0]=4 7516 B14R1.38 O=C(CSCCCF)c1ccccc1 62a_100011934791_100000211460 [1,1,0,0,0,0|1,1,0]=4 7517 B14R1.38 O=C(CSCCCO)c1ccccc1 62a_100000211460_100011215043 [1,1,0,0,0,0|1,1,0]=4 7518 B14R1.38 O=C(CSCCCO)c1ccccc1 62a_100011215043_100000211460 [1,1,0,0,0,0|1,1,0]=4 7519 B14R1.38 O=C(NCCCCO)c1ccccc1 240690a_100000750430_100000185807 [1,1,0,0,0,0|1,0,0]=3 7520 B14R1.38 O=C(NCCCCO)c1ccccc1 527a_100000750430_100000185807 [1,1,0,0,0,0|1,0,0]=3 7521 B14R1.38 O=C(NCCOCF)c1ccccc1 34a_200000158897_100015361967 [1,1,0,0,0,0|2,0,0]=4 7522 B14R1.38 O=C(NCCOCF)c1ccccc1 7a_200000158897_100015361967 [1,1,0,0,0,0|2,0,0]=4 7523 B14R1.38 O=C(NCCSCF)c1ccccc1 62a_100015361967_200011215302 [1,1,0,0,0,0|2,0,0]=4 7524 B14R1.38 O=C(NCCSCF)c1ccccc1 62a_200011215302_100015361967 [1,1,0,0,0,0|2,0,0]=4 7525 B14R1.38 O=C(OCCOCF)c1ccccc1 7a_100000025465_100015361967 [1,1,0,0,0,0|1,0,0]=3 7526 B14R1.38 O=C(OCCSCF)c1ccccc1 62a_100009812718_100015361967 [1,1,0,0,0,0|1,0,0]=3 7527 B14R1.38 O=C(OCCSCF)c1ccccc1 62a_100015361967_100009812718 [1,1,0,0,0,0|1,0,0]=3 7528 B14R1.38 O=C(OCSCCF)c1ccccc1 62a_100000073877_100011217306 [1,1,0,0,0,0|1,0,0]=3 7529 B14R1.38 O=C(OCSCCF)c1ccccc1 62a_100011217306_100000073877 [1,1,0,0,0,0|1,0,0]=3 7530 B14R1.38 O=C(OCSCCO)c1ccccc1 62a_100000073877_100000211926 [1,1,0,0,0,0|1,0,0]=3 7531 B14R1.38 O=C(OCSCCO)c1ccccc1 62a_100000211926_100000073877 [1,1,0,0,0,0|1,0,0]=3 7532 B14R1.38 O=CCSCOC(=O)c1ccccc1 62a_100000073877_200015260668 [1,1,0,0,0,0|1,0,1]=4 7533 B14R1.38 O=CCSCOC(=O)c1ccccc1 62a_200015260668_100000073877 [1,1,0,0,0,0|1,0,1]=4 7534 B14R1.38 [13CH3]SCCCOC(=O)c1ccccc1 62a_200009892979_200025704644 [1,1,0,0,0,0|0,0,0]=2 7535 B14R1.38 [13CH3]SCCCOC(=O)c1ccccc1 62a_200025704644_200009892979 [1,1,0,0,0,0|0,0,0]=2 7536 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 270084a_100000102301_100000210345 [1,1,0,0,0,0|2,0,0]=4 7537 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 274078a_100000102301_100000210345 [1,1,0,0,0,0|2,0,0]=4 7538 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 40a_100000102301_100000032697 [1,1,0,0,0,0|2,0,0]=4 7539 B14R1.46 CCCCOC(C)(C)c1ccccc1 7a_100000694644_100000210211 [1,1,0,0,0,0|1,0,1]=4 7540 B14R1.46 CCCCOC(F)(F)c1ccccc1 7a_100000210227_100000036403 [1,1,0,0,0,0|1,0,1]=4 7541 B14R1.46 CNCCOS(=O)(=O)c1ccccc1 34a_100102657272_200000070464 [1,1,0,0,0,0|2,0,0]=4 7542 B14R1.46 CNCCOS(=O)(=O)c1ccccc1 7a_106832991635_200000070464 [1,1,0,0,0,0|2,0,0]=4 7543 B14R1.46 COCCOS(=O)(=O)c1ccccc1 34a_100138415774_200000070464 [1,1,0,0,0,0|2,0,0]=4 7544 B14R1.46 CSCCOS(=O)(=O)c1ccccc1 62a_200000210301_200000070464 [1,1,0,0,0,0|2,0,0]=4 7545 B14R1.46 [13CH3]SCCOS(=O)(=O)c1ccccc1 62a_200025704644_200000070464 [1,1,0,0,0,0|2,0,0]=4 7546 B14R1.121 C#CC(OCCCC)c1ccccc1 34a_100011219616_100000210210 [1,1,0,0,0,0|1,0,1]=4 7547 B14R1.121 C#CC(OCCCC)c1ccccc1 7a_100011219616_100000210211 [1,1,0,0,0,0|1,0,1]=4 7548 B14R1.121 C=CC(OCCCC)c1ccccc1 34a_100011215659_100000210210 [1,1,0,0,0,0|1,0,1]=4 7549 B14R1.121 C=CC(OCCCC)c1ccccc1 7a_100011215659_100000210211 [1,1,0,0,0,0|1,0,1]=4 7550 B14R1.121 CCCCOC(C#N)c1ccccc1 7a_100011217353_100000210211 [1,1,0,0,0,0|1,0,1]=4 7551 B14R1.121 CCCCOC(CBr)c1ccccc1 7a_100000185958_100000210211 [1,1,0,0,0,0|1,0,1]=4 7552 B14R1.121 CCCCOC(CC)c1ccccc1 34a_100000698172_100000210210 [1,1,0,0,0,0|1,0,1]=4 7553 B14R1.121 CCCCOC(CC)c1ccccc1 7a_100000698172_100000210211 [1,1,0,0,0,0|1,0,1]=4 7554 B14R1.121 CCCCOC(CN)c1ccccc1 34a_100000210709_100000210210 [1,1,0,0,0,0|1,0,1]=4 7555 B14R1.121 CCCCO[C@H](CCl)c1ccccc1 34a_100011933945_100000210210 [1,1,0,0,0,0|1,0,1]=4 7556 B14R1.121 CCCCO[C@H](CCl)c1ccccc1 7a_100011933945_100000210211 [1,1,0,0,0,0|1,0,1]=4 7557 B14R1.163 CC(CCC(=O)c1ccccc1)O[13CH3] 7a_200012571355_200025704644 [1,1,0,0,0,0|2,0,0]=4 7558 B14R1.163 CC(CO)CNC(=O)c1ccccc1 240690a_100000744482_100000185807 [1,1,0,0,0,0|2,0,0]=4 7559 B14R1.163 CC(CO)CNC(=O)c1ccccc1 527a_100000744482_100000185807 [1,1,0,0,0,0|2,0,0]=4 7560 B14R1.163 CCC(=O)CCC(=O)c1ccccc1 1458a_100000210414_100000750707 [1,1,0,0,0,0|1,0,1]=4 7561 B14R1.163 CCC(=O)CNC(=O)c1ccccc1 1458a_100000182045_100000210202 [1,1,0,0,0,0|1,0,1]=4 7562 B14R1.163 CCC(=O)COC(=O)c1ccccc1 1458a_100000210414_100000073877 [1,1,0,0,0,0|0,0,1]=3 7563 B14R1.163 CCC(C)CNC(=O)c1ccccc1 11a_100020588543_100000185807 [1,1,0,0,0,0|1,0,0]=3 7564 B14R1.163 CCC(C)CNC(=O)c1ccccc1 1626a_100020588543_100000185807 [1,1,0,0,0,0|1,0,0]=3 7565 B14R1.163 CCC(C)CNC(=O)c1ccccc1 240690a_100020588543_100000185807 [1,1,0,0,0,0|1,0,0]=3 7566 B14R1.163 CCC(C)CNC(=O)c1ccccc1 527a_100020588543_100000185807 [1,1,0,0,0,0|1,0,0]=3 7567 B14R1.163 CCC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000748023 [1,1,0,0,0,0|1,0,1]=4 7568 B14R1.163 CCC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000748023 [1,1,0,0,0,0|1,0,1]=4 7569 B14R1.163 CCC(C)NNC(=O)c1ccccc1 22a_100000718999_100000185807 [1,1,0,0,0,0|2,0,0]=4 7570 B14R1.163 CCC(C)OCC(=O)c1ccccc1 7a_100000210228_100000211460 [1,1,0,0,0,0|2,0,0]=4 7571 B14R1.163 CCC(C)SCC(=O)c1ccccc1 62a_100000211460_100000758301 [1,1,0,0,0,0|2,0,0]=4 7572 B14R1.163 CCC(C)SCC(=O)c1ccccc1 62a_100000758301_100000211460 [1,1,0,0,0,0|2,0,0]=4 7573 B14R1.163 CCC(O)CNC(=O)c1ccccc1 11a_100011218483_100000185807 [1,1,0,0,0,0|1,0,0]=3 7574 B14R1.163 CCC(O)CNC(=O)c1ccccc1 240690a_100011218483_100000185807 [1,1,0,0,0,0|1,0,0]=3 7575 B14R1.163 CCC(O)CNC(=O)c1ccccc1 527a_100011218483_100000185807 [1,1,0,0,0,0|1,0,0]=3 7576 B14R1.163 CCC(O)CO[C@H](C)c1ccccc1 34a_100000761318_100011218378 [1,1,0,0,0,0|1,0,1]=4 7577 B14R1.163 CCC(O)CO[C@H](C)c1ccccc1 7a_100000761318_100011218378 [1,1,0,0,0,0|1,0,1]=4 7578 B14R1.163 CCN(C)CCC(=O)c1ccccc1 2230a_100000225621_100000750707 [1,1,0,0,0,0|2,0,0]=4 7579 B14R1.163 CCN(C)CCC(=O)c1ccccc1 269982a_100000225621_100000750707 [1,1,0,0,0,0|2,0,0]=4 7580 B14R1.163 CCN(C)COC(=O)c1ccccc1 269982a_100000225621_100000073877 [1,1,0,0,0,0|1,0,0]=3 7581 B14R1.163 CC[C@H](C)COC(C)c1ccccc1 7a_100009816381_100000230085 [1,1,0,0,0,0|1,0,1]=4 7582 B14R1.163 CC[C@H](C)CO[C@H](C)c1ccccc1 34a_100000761318_100009816398 [1,1,0,0,0,0|1,0,1]=4 7583 B14R1.163 CC[C@H](C)CO[C@H](C)c1ccccc1 7a_100000761318_100009816398 [1,1,0,0,0,0|1,0,1]=4 7584 B14R1.163 CNC(C)COC(=O)c1ccccc1 270004a_106832991635_100000000904 [1,1,0,0,0,0|1,0,0]=3 7585 B14R1.163 COC(C)CCC(=O)c1ccccc1 7a_200012571355_200000210301 [1,1,0,0,0,0|2,0,0]=4 7586 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 11a_100020591295_100000185807 [1,1,0,0,0,0|2,0,0]=4 7587 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 1626a_100020591295_100000185807 [1,1,0,0,0,0|2,0,0]=4 7588 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 240690a_100020591295_100000185807 [1,1,0,0,0,0|2,0,0]=4 7589 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 527a_100020591295_100000185807 [1,1,0,0,0,0|2,0,0]=4 7590 B14R1.163 O=C(CO)COC(=O)c1ccccc1 1458a_100000210174_100000073877 [1,1,0,0,0,0|1,0,1]=4 7591 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 240690a_100015665980_100000185807 [1,1,0,0,0,0|2,0,0]=4 7592 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 527a_100015665980_100000185807 [1,1,0,0,0,0|2,0,0]=4 7593 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 240690a_100020644852_100000185807 [1,1,0,0,0,0|2,0,0]=4 7594 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 527a_100020644852_100000185807 [1,1,0,0,0,0|2,0,0]=4 7595 B14R1.166 C=C(C(=O)CCCC)c1ccccc1 1458a_100000065200_100000210211 [1,1,0,0,0,0|2,0,0]=4 7596 B14R1.166 CCCCC(C)C(=O)c1ccccc1 1458a_100000185807_200011215066 [1,1,0,0,0,0|1,0,0]=3 7597 B14R1.166 CCCCN(C)C(=O)c1ccccc1 11a_100000207549_100000185807 [1,1,0,0,0,0|1,0,0]=3 7598 B14R1.166 CCCCN(C)C(=O)c1ccccc1 1626a_100000207549_100000185807 [1,1,0,0,0,0|1,0,0]=3 7599 B14R1.166 CCCCN(C)C(=O)c1ccccc1 240690a_100000207549_100000185807 [1,1,0,0,0,0|1,0,0]=3 7600 B14R1.166 CCCCN(C)C(=O)c1ccccc1 527a_100000207549_100000185807 [1,1,0,0,0,0|1,0,0]=3 7601 B14R1.166 CCCSC(C)C(=O)c1ccccc1 62a_100000210303_100000239700 [1,1,0,0,0,0|2,0,0]=4 7602 B14R1.166 CCCSC(C)C(=O)c1ccccc1 62a_100000239700_100000210303 [1,1,0,0,0,0|2,0,0]=4 7603 B14R1.166 CN(CCCO)C(=O)c1ccccc1 240690a_100000213112_100000185807 [1,1,0,0,0,0|2,0,0]=4 7604 B14R1.166 CN(CCCO)C(=O)c1ccccc1 527a_100000213112_100000185807 [1,1,0,0,0,0|2,0,0]=4 7605 B14R1.166 COCCN(C)C(=O)c1ccccc1 11a_100000743101_100000185807 [1,1,0,0,0,0|2,0,0]=4 7606 B14R1.166 COCCN(C)C(=O)c1ccccc1 1626a_100000743101_100000185807 [1,1,0,0,0,0|2,0,0]=4 7607 B14R1.166 COCCN(C)C(=O)c1ccccc1 240690a_100000743101_100000185807 [1,1,0,0,0,0|2,0,0]=4 7608 B14R1.166 COCCN(C)C(=O)c1ccccc1 527a_100000743101_100000185807 [1,1,0,0,0,0|2,0,0]=4 7609 B14R1.166 CSCCN(C)C(=O)c1ccccc1 11a_100000686725_100000185807 [1,1,0,0,0,0|2,0,0]=4 7610 B14R1.166 CSCCN(C)C(=O)c1ccccc1 1626a_100000686725_100000185807 [1,1,0,0,0,0|2,0,0]=4 7611 B14R1.166 CSCCN(C)C(=O)c1ccccc1 240690a_100000686725_100000185807 [1,1,0,0,0,0|2,0,0]=4 7612 B14R1.166 CSCCN(C)C(=O)c1ccccc1 527a_100000686725_100000185807 [1,1,0,0,0,0|2,0,0]=4 7613 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000070787_100000211006 [1,1,0,0,0,0|1,0,1]=4 7614 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100011215641 [1,1,0,0,0,0|1,0,1]=4 7615 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000070787_200011215302 [1,1,0,0,0,0|1,0,1]=4 7616 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200000210301 [1,1,0,0,0,0|1,0,1]=4 7617 B14R1.420 CC(=O)CCOC(=O)c1ccccc1 1458a_100000070787_100000184176 [1,1,0,0,0,0|0,0,1]=3 7618 B14R1.420 CC(Br)CCOC(C)c1ccccc1 34a_100009893172_100000211855 [1,1,0,0,0,0|1,0,1]=4 7619 B14R1.420 CC(C)CCCC(=O)c1ccccc1 1458a_100000185807_100011214892 [1,1,0,0,0,0|1,0,0]=3 7620 B14R1.420 CC(C)CCNC(=O)c1ccccc1 11a_100000210545_100000185807 [1,1,0,0,0,0|1,0,0]=3 7621 B14R1.420 CC(C)CCNC(=O)c1ccccc1 1626a_100000210545_100000185807 [1,1,0,0,0,0|1,0,0]=3 7622 B14R1.420 CC(C)CCNC(=O)c1ccccc1 240690a_100000210545_100000185807 [1,1,0,0,0,0|1,0,0]=3 7623 B14R1.420 CC(C)CCNC(=O)c1ccccc1 527a_100000210545_100000185807 [1,1,0,0,0,0|1,0,0]=3 7624 B14R1.420 CC(C)CCOC(C)c1ccccc1 34a_100000210254_100000211855 [1,1,0,0,0,0|1,0,1]=4 7625 B14R1.420 CC(C)CCOC(C)c1ccccc1 7a_100000210254_100000230085 [1,1,0,0,0,0|1,0,1]=4 7626 B14R1.420 CC(C)CCO[C@H](C)c1ccccc1 34a_100000761318_100000210312 [1,1,0,0,0,0|1,0,1]=4 7627 B14R1.420 CC(C)CCO[C@H](C)c1ccccc1 7a_100000761318_100000210626 [1,1,0,0,0,0|1,0,1]=4 7628 B14R1.420 CC(C)CNNC(=O)c1ccccc1 22a_100000696102_100000185807 [1,1,0,0,0,0|2,0,0]=4 7629 B14R1.420 CC(C)CSCC(=O)c1ccccc1 62a_100000210624_100000211460 [1,1,0,0,0,0|2,0,0]=4 7630 B14R1.420 CC(C)CSCC(=O)c1ccccc1 62a_100000211460_100000210760 [1,1,0,0,0,0|2,0,0]=4 7631 B14R1.420 CC(C)NCCC(=O)c1ccccc1 2230a_100138425928_100000750707 [1,1,0,0,0,0|2,0,0]=4 7632 B14R1.420 CC(C)OCCC(=O)c1ccccc1 1458a_100000185807_100000211751 [1,1,0,0,0,0|2,0,0]=4 7633 B14R1.420 CC(C)SCCC(=O)c1ccccc1 1458a_100000185807_100000730970 [1,1,0,0,0,0|2,0,0]=4 7634 B14R1.420 CC(C)SCCC(=O)c1ccccc1 62a_100000210206_100000750707 [1,1,0,0,0,0|2,0,0]=4 7635 B14R1.420 CC(C)SCCC(=O)c1ccccc1 62a_100000750707_100000210206 [1,1,0,0,0,0|2,0,0]=4 7636 B14R1.420 CC(C)SCOC(=O)c1ccccc1 62a_100000073877_100000210206 [1,1,0,0,0,0|1,0,0]=3 7637 B14R1.420 CC(C)SCOC(=O)c1ccccc1 62a_100000210206_100000073877 [1,1,0,0,0,0|1,0,0]=3 7638 B14R1.420 CC(O)CCCC(=O)c1ccccc1 1458a_100000185807_200000718107 [1,1,0,0,0,0|1,0,0]=3 7639 B14R1.420 CC(O)CCNC(=O)c1ccccc1 240690a_200000755665_100000185807 [1,1,0,0,0,0|1,0,0]=3 7640 B14R1.420 CC(O)CCNC(=O)c1ccccc1 527a_200000755665_100000185807 [1,1,0,0,0,0|1,0,0]=3 7641 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 34a_100000761318_100012276601 [1,1,0,0,0,0|1,0,1]=4 7642 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 7a_100000761318_100012276601 [1,1,0,0,0,0|1,0,1]=4 7643 B14R1.420 CC(O)CNNC(=O)c1ccccc1 22a_200000730056_100000185807 [1,1,0,0,0,0|2,0,0]=4 7644 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100000211460_100011218427 [1,1,0,0,0,0|2,0,0]=4 7645 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100011218427_100000211460 [1,1,0,0,0,0|2,0,0]=4 7646 B14R1.420 CC(OCC[C@@H](C)N)c1ccccc1 34a_100000706166_100000211855 [1,1,0,0,0,0|1,0,1]=4 7647 B14R1.420 CN(C)CCCC(=O)c1ccccc1 1458a_100000185807_100000695564 [1,1,0,0,0,0|2,0,0]=4 7648 B14R1.420 CN(C)CCCC(=O)c1ccccc1 2230a_100102631434_100000211006 [1,1,0,0,0,0|2,0,0]=4 7649 B14R1.420 CN(C)CCCC(=O)c1ccccc1 269982a_100102631434_100000211006 [1,1,0,0,0,0|2,0,0]=4 7650 B14R1.420 CN(C)CCNC(=O)c1ccccc1 240690a_100000210585_100000185807 [1,1,0,0,0,0|2,0,0]=4 7651 B14R1.420 CN(C)CCNC(=O)c1ccccc1 269982a_100102631434_200011215302 [1,1,0,0,0,0|2,0,0]=4 7652 B14R1.420 CN(C)CCNC(=O)c1ccccc1 527a_100000210585_100000185807 [1,1,0,0,0,0|2,0,0]=4 7653 B14R1.420 CN(C)CCOC(=O)c1ccccc1 269982a_100102631434_100009812718 [1,1,0,0,0,0|1,0,0]=3 7654 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100000211460_100009817552 [1,1,0,0,0,0|2,0,0]=4 7655 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100009817552_100000211460 [1,1,0,0,0,0|2,0,0]=4 7656 B14R1.420 [13CH3]C(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200025704644 [1,1,0,0,0,0|1,0,1]=4 7657 B14R1.9 CCCCC=Cc1cccc(c1Br)O 271570a_100016275911_100010187914 [1,1,0,0,0,0|2,0,0]=4 7658 B14R1.9 CCCCC=Cc1cccc(c1C)Br 271570a_100016275911_100012353703 [1,1,0,0,0,0|2,0,0]=4 7659 B14R1.9 CCCCC=Cc1cccc(c1C)C 271570a_100016275911_100011214922 [1,1,0,0,0,0|2,0,0]=4 7660 B14R1.9 CCCCC=Cc1cccc(c1C)Cl 271570a_100016275911_100000726075 [1,1,0,0,0,0|2,0,0]=4 7661 B14R1.9 CCCCC=Cc1cccc(c1C)F 271570a_100016275911_100011216893 [1,1,0,0,0,0|2,0,0]=4 7662 B14R1.9 CCCCC=Cc1cccc(c1C)N 271570a_100016275911_100000761887 [1,1,0,0,0,0|2,0,0]=4 7663 B14R1.9 CCCCC=Cc1cccc(c1C)O 271570a_100016275911_100012002258 [1,1,0,0,0,0|2,0,0]=4 7664 B14R1.9 CCCCC=Cc1cccc(c1Cl)Br 271570a_100016275911_100010142854 [1,1,0,0,0,0|2,0,0]=4 7665 B14R1.9 CCCCC=Cc1cccc(c1Cl)C 271570a_100016275911_200012352035 [1,1,0,0,0,0|2,0,0]=4 7666 B14R1.9 CCCCC=Cc1cccc(c1Cl)Cl 271570a_100016275911_100011215384 [1,1,0,0,0,0|2,0,0]=4 7667 B14R1.9 CCCCC=Cc1cccc(c1Cl)F 271570a_100016275911_200010234923 [1,1,0,0,0,0|2,0,0]=4 7668 B14R1.9 CCCCC=Cc1cccc(c1Cl)O 271570a_100016275911_100000049636 [1,1,0,0,0,0|2,0,0]=4 7669 B14R1.9 CCCCC=Cc1cccc(c1F)Br 271570a_100016275911_100000702267 [1,1,0,0,0,0|2,0,0]=4 7670 B14R1.9 CCCCC=Cc1cccc(c1F)C 271570a_100016275911_100000717567 [1,1,0,0,0,0|2,0,0]=4 7671 B14R1.9 CCCCC=Cc1cccc(c1F)Cl 271570a_100016275911_100011217346 [1,1,0,0,0,0|2,0,0]=4 7672 B14R1.9 CCCCC=Cc1cccc(c1F)F 271570a_100016275911_100000694657 [1,1,0,0,0,0|2,0,0]=4 7673 B14R1.9 CCCCC=Cc1cccc(c1F)N 271570a_100016275911_100011935091 [1,1,0,0,0,0|2,0,0]=4 7674 B14R1.9 CCCCC=Cc1cccc(c1F)O 271570a_100016275911_100009817021 [1,1,0,0,0,0|2,0,0]=4 7675 B14R1.9 CCCCC=Cc1cccc(c1N)Br 271570a_100016275911_100010146558 [1,1,0,0,0,0|2,0,0]=4 7676 B14R1.9 CCCCC=Cc1cccc(c1N)C 271570a_100016275911_100011834072 [1,1,0,0,0,0|2,0,0]=4 7677 B14R1.9 CCCCC=Cc1cccc(c1N)Cl 271570a_100016275911_100010190421 [1,1,0,0,0,0|2,0,0]=4 7678 B14R1.9 CCCCC=Cc1cccc(c1N)F 271570a_100016275911_100000042321 [1,1,0,0,0,0|2,0,0]=4 7679 B14R1.9 CCCCC=Cc1cccc(c1N)N 271570a_100016275911_100015191791 [1,1,0,0,0,0|2,0,0]=4 7680 B14R1.9 CCCCC=Cc1cccc(c1N)O 271570a_100016275911_100011934926 [1,1,0,0,0,0|2,0,0]=4 7681 B14R1.9 CCCCC=Cc1cccc(c1O)Br 271570a_100016275911_100010084509 [1,1,0,0,0,0|1,0,0]=3 7682 B14R1.9 CCCCC=Cc1cccc(c1O)C 271570a_100016275911_100009817157 [1,1,0,0,0,0|1,0,0]=3 7683 B14R1.9 CCCCC=Cc1cccc(c1O)Cl 271570a_100016275911_100010202889 [1,1,0,0,0,0|1,0,0]=3 7684 B14R1.9 CCCCC=Cc1cccc(c1O)F 271570a_100016275911_100009813666 [1,1,0,0,0,0|1,0,0]=3 7685 B14R1.9 CCCCC=Cc1cccc(c1O)N 271570a_100016275911_100011934915 [1,1,0,0,0,0|1,0,0]=3 7686 B14R1.9 CCCCC=Cc1cccc(c1O)O 271570a_100016275911_100009815950 [1,1,0,0,0,0|1,0,0]=3 7687 B14R1.9 CCCCC=Cc1nccc(c1O)C 271570a_100016275911_100000696282 [1,1,0,0,0,0|2,0,0]=4 7688 B14R1.9 CCCCC=Cc1nccc(c1O)F 271570a_100016275911_100009867227 [1,1,0,0,0,0|2,0,0]=4 7689 B14R1.9 CCCCCNc1cccc(c1O)Br 34a_100011934915_100000718602 [1,1,0,0,0,0|2,0,0]=4 7690 B14R1.9 CCCCCNc1cccc(c1O)C 34a_100000756359_100000718602 [1,1,0,0,0,0|2,0,0]=4 7691 B14R1.9 CCCCCNc1cccc(c1O)Cl 34a_100000754742_100000718602 [1,1,0,0,0,0|2,0,0]=4 7692 B14R1.9 CCCCCNc1cccc(c1O)F 34a_100011934987_100000718602 [1,1,0,0,0,0|2,0,0]=4 7693 B14R1.9 CCCCCSc1cccc(c1O)Br 62a_100000210326_100010084509 [1,1,0,0,0,0|2,0,0]=4 7694 B14R1.9 CCCCCSc1cccc(c1O)Br 62a_100010084509_100000210326 [1,1,0,0,0,0|2,0,0]=4 7695 B14R1.9 CCCCCSc1cccc(c1O)C 62a_100000210326_100009817157 [1,1,0,0,0,0|2,0,0]=4 7696 B14R1.9 CCCCCSc1cccc(c1O)C 62a_100009817157_100000210326 [1,1,0,0,0,0|2,0,0]=4 7697 B14R1.9 CCCCCSc1cccc(c1O)Cl 62a_100000210326_100010202889 [1,1,0,0,0,0|2,0,0]=4 7698 B14R1.9 CCCCCSc1cccc(c1O)Cl 62a_100010202889_100000210326 [1,1,0,0,0,0|2,0,0]=4 7699 B14R1.9 CCCCCSc1cccc(c1O)F 62a_100000210326_100009813666 [1,1,0,0,0,0|2,0,0]=4 7700 B14R1.9 CCCCCSc1cccc(c1O)F 62a_100009813666_100000210326 [1,1,0,0,0,0|2,0,0]=4 7701 B14R1.9 CCCCCSc1cccc(c1O)N 62a_100000210326_100010084371 [1,1,0,0,0,0|2,0,0]=4 7702 B14R1.9 CCCCCSc1cccc(c1O)N 62a_100011934915_100000210326 [1,1,0,0,0,0|2,0,0]=4 7703 B14R1.9 CCCCCSc1cccc(c1O)O 62a_100000210326_100009815950 [1,1,0,0,0,0|2,0,0]=4 7704 B14R1.9 CCCCNCc1cccc(c1O)C 34a_100020639391_100000210210 [1,1,0,0,0,0|1,0,1]=4 7705 B14R1.9 CCCCOCc1cccc(c1Br)C 34a_100000210227_200012349612 [1,1,0,0,0,0|1,0,1]=4 7706 B14R1.9 CCCCOCc1cccc(c1Br)C 34a_100011659289_100000210210 [1,1,0,0,0,0|1,0,1]=4 7707 B14R1.9 CCCCOCc1cccc(c1Br)C 7a_100000210227_200012349612 [1,1,0,0,0,0|1,0,1]=4 7708 B14R1.9 CCCCOCc1cccc(c1Br)C 7a_100011659289_100000210211 [1,1,0,0,0,0|1,0,1]=4 7709 B14R1.9 CCCCOCc1cccc(c1Br)Cl 34a_100000210227_100010145525 [1,1,0,0,0,0|1,0,1]=4 7710 B14R1.9 CCCCOCc1cccc(c1Br)Cl 34a_100010168166_100000210210 [1,1,0,0,0,0|1,0,1]=4 7711 B14R1.9 CCCCOCc1cccc(c1Br)Cl 7a_100000210227_100010145525 [1,1,0,0,0,0|1,0,1]=4 7712 B14R1.9 CCCCOCc1cccc(c1Br)Cl 7a_100010168166_100000210211 [1,1,0,0,0,0|1,0,1]=4 7713 B14R1.9 CCCCOCc1cccc(c1Br)F 34a_100000210227_100012351116 [1,1,0,0,0,0|1,0,1]=4 7714 B14R1.9 CCCCOCc1cccc(c1Br)F 34a_100012351117_100000210210 [1,1,0,0,0,0|1,0,1]=4 7715 B14R1.9 CCCCOCc1cccc(c1Br)F 7a_100000210227_100012351116 [1,1,0,0,0,0|1,0,1]=4 7716 B14R1.9 CCCCOCc1cccc(c1Br)F 7a_100012351117_100000210211 [1,1,0,0,0,0|1,0,1]=4 7717 B14R1.9 CCCCOCc1cccc(c1Br)I 34a_100000210227_100010254545 [1,1,0,0,0,0|1,0,1]=4 7718 B14R1.9 CCCCOCc1cccc(c1Br)I 34a_100010240205_100000210210 [1,1,0,0,0,0|1,0,1]=4 7719 B14R1.9 CCCCOCc1cccc(c1Br)I 7a_100000210227_100010254545 [1,1,0,0,0,0|1,0,1]=4 7720 B14R1.9 CCCCOCc1cccc(c1Br)I 7a_100010240205_100000210211 [1,1,0,0,0,0|1,0,1]=4 7721 B14R1.9 CCCCOCc1cccc(c1C)Br 34a_100000210227_100000694682 [1,1,0,0,0,0|1,0,1]=4 7722 B14R1.9 CCCCOCc1cccc(c1C)Br 34a_100000694458_100000210210 [1,1,0,0,0,0|1,0,1]=4 7723 B14R1.9 CCCCOCc1cccc(c1C)Br 7a_100000210227_100000694682 [1,1,0,0,0,0|1,0,1]=4 7724 B14R1.9 CCCCOCc1cccc(c1C)Br 7a_100000694458_100000210211 [1,1,0,0,0,0|1,0,1]=4 7725 B14R1.9 CCCCOCc1cccc(c1C)C 34a_100000210227_100011273979 [1,1,0,0,0,0|1,0,1]=4 7726 B14R1.9 CCCCOCc1cccc(c1C)C 34a_100011219135_100000210210 [1,1,0,0,0,0|1,0,1]=4 7727 B14R1.9 CCCCOCc1cccc(c1C)C 7a_100000210227_100011515928 [1,1,0,0,0,0|1,0,1]=4 7728 B14R1.9 CCCCOCc1cccc(c1C)C 7a_100011219135_100000210211 [1,1,0,0,0,0|1,0,1]=4 7729 B14R1.9 CCCCOCc1cccc(c1C)Cl 34a_100000210227_100012186920 [1,1,0,0,0,0|1,0,1]=4 7730 B14R1.9 CCCCOCc1cccc(c1C)Cl 34a_100012000165_100000210210 [1,1,0,0,0,0|1,0,1]=4 7731 B14R1.9 CCCCOCc1cccc(c1C)Cl 7a_100000210227_100012186920 [1,1,0,0,0,0|1,0,1]=4 7732 B14R1.9 CCCCOCc1cccc(c1C)Cl 7a_100012000165_100000210211 [1,1,0,0,0,0|1,0,1]=4 7733 B14R1.9 CCCCOCc1cccc(c1C)F 34a_100000042775_100000210210 [1,1,0,0,0,0|1,0,1]=4 7734 B14R1.9 CCCCOCc1cccc(c1C)F 34a_100000210227_100009813626 [1,1,0,0,0,0|1,0,1]=4 7735 B14R1.9 CCCCOCc1cccc(c1C)F 7a_100000042775_100000210211 [1,1,0,0,0,0|1,0,1]=4 7736 B14R1.9 CCCCOCc1cccc(c1C)F 7a_100000210227_100009813626 [1,1,0,0,0,0|1,0,1]=4 7737 B14R1.9 CCCCOCc1cccc(c1C)I 34a_100000210227_100010150147 [1,1,0,0,0,0|1,0,1]=4 7738 B14R1.9 CCCCOCc1cccc(c1C)I 34a_100010150139_100000210210 [1,1,0,0,0,0|1,0,1]=4 7739 B14R1.9 CCCCOCc1cccc(c1C)I 7a_100000210227_100010150147 [1,1,0,0,0,0|1,0,1]=4 7740 B14R1.9 CCCCOCc1cccc(c1C)I 7a_100010150139_100000210211 [1,1,0,0,0,0|1,0,1]=4 7741 B14R1.9 CCCCOCc1cccc(c1C)N 34a_102495339961_100000210210 [1,1,0,0,0,0|1,0,1]=4 7742 B14R1.9 CCCCOCc1cccc(c1C)N 7a_102495339961_100000210211 [1,1,0,0,0,0|1,0,1]=4 7743 B14R1.9 CCCCOCc1cccc(c1Cl)Br 34a_100000210227_100012349491 [1,1,0,0,0,0|1,0,1]=4 7744 B14R1.9 CCCCOCc1cccc(c1Cl)Br 34a_100012351182_100000210210 [1,1,0,0,0,0|1,0,1]=4 7745 B14R1.9 CCCCOCc1cccc(c1Cl)Br 7a_100000210227_100012349491 [1,1,0,0,0,0|1,0,1]=4 7746 B14R1.9 CCCCOCc1cccc(c1Cl)Br 7a_100012351182_100000210211 [1,1,0,0,0,0|1,0,1]=4 7747 B14R1.9 CCCCOCc1cccc(c1Cl)C 34a_100000710031_100000210210 [1,1,0,0,0,0|1,0,1]=4 7748 B14R1.9 CCCCOCc1cccc(c1Cl)C 7a_100000710031_100000210211 [1,1,0,0,0,0|1,0,1]=4 7749 B14R1.9 CCCCOCc1cccc(c1Cl)Cl 34a_100000210227_100000723366 [1,1,0,0,0,0|1,0,1]=4 7750 B14R1.9 CCCCOCc1cccc(c1Cl)Cl 34a_100000720469_100000210210 [1,1,0,0,0,0|1,0,1]=4 7751 B14R1.9 CCCCOCc1cccc(c1Cl)Cl 7a_100000210227_100000723366 [1,1,0,0,0,0|1,0,1]=4 7752 B14R1.9 CCCCOCc1cccc(c1Cl)Cl 7a_100000720469_100000210211 [1,1,0,0,0,0|1,0,1]=4 7753 B14R1.9 CCCCOCc1cccc(c1Cl)F 34a_100000210227_100000696688 [1,1,0,0,0,0|1,0,1]=4 7754 B14R1.9 CCCCOCc1cccc(c1Cl)F 34a_100000696319_100000210210 [1,1,0,0,0,0|1,0,1]=4 7755 B14R1.9 CCCCOCc1cccc(c1Cl)F 7a_100000210227_100000696688 [1,1,0,0,0,0|1,0,1]=4 7756 B14R1.9 CCCCOCc1cccc(c1Cl)F 7a_100000696319_100000210211 [1,1,0,0,0,0|1,0,1]=4 7757 B14R1.9 CCCCOCc1cccc(c1F)Br 34a_100000210227_100012356506 [1,1,0,0,0,0|1,0,1]=4 7758 B14R1.9 CCCCOCc1cccc(c1F)Br 34a_100011935076_100000210210 [1,1,0,0,0,0|1,0,1]=4 7759 B14R1.9 CCCCOCc1cccc(c1F)Br 7a_100000210227_100012356506 [1,1,0,0,0,0|1,0,1]=4 7760 B14R1.9 CCCCOCc1cccc(c1F)Br 7a_100011935076_100000210211 [1,1,0,0,0,0|1,0,1]=4 7761 B14R1.9 CCCCOCc1cccc(c1F)C 34a_100000210227_100011216058 [1,1,0,0,0,0|1,0,1]=4 7762 B14R1.9 CCCCOCc1cccc(c1F)C 34a_200011219517_100000210210 [1,1,0,0,0,0|1,0,1]=4 7763 B14R1.9 CCCCOCc1cccc(c1F)C 7a_100000210227_100011216058 [1,1,0,0,0,0|1,0,1]=4 7764 B14R1.9 CCCCOCc1cccc(c1F)C 7a_200011219517_100000210211 [1,1,0,0,0,0|1,0,1]=4 7765 B14R1.9 CCCCOCc1cccc(c1F)Cl 34a_100000210227_100000716733 [1,1,0,0,0,0|1,0,1]=4 7766 B14R1.9 CCCCOCc1cccc(c1F)Cl 34a_100011216988_100000210210 [1,1,0,0,0,0|1,0,1]=4 7767 B14R1.9 CCCCOCc1cccc(c1F)Cl 7a_100000210227_100000716733 [1,1,0,0,0,0|1,0,1]=4 7768 B14R1.9 CCCCOCc1cccc(c1F)Cl 7a_100011216988_100000210211 [1,1,0,0,0,0|1,0,1]=4 7769 B14R1.9 CCCCOCc1cccc(c1F)F 34a_100000210227_100000217499 [1,1,0,0,0,0|1,0,1]=4 7770 B14R1.9 CCCCOCc1cccc(c1F)F 34a_100011218644_100000210210 [1,1,0,0,0,0|1,0,1]=4 7771 B14R1.9 CCCCOCc1cccc(c1F)F 7a_100000210227_100000217499 [1,1,0,0,0,0|1,0,1]=4 7772 B14R1.9 CCCCOCc1cccc(c1F)F 7a_100011218644_100000210211 [1,1,0,0,0,0|1,0,1]=4 7773 B14R1.9 CCCCOCc1cccc(c1F)I 34a_200010235739_100000210210 [1,1,0,0,0,0|1,0,1]=4 7774 B14R1.9 CCCCOCc1cccc(c1F)I 7a_200010235739_100000210211 [1,1,0,0,0,0|1,0,1]=4 7775 B14R1.9 CCCCOCc1cccc(c1F)N 34a_100012023829_100000210210 [1,1,0,0,0,0|1,0,1]=4 7776 B14R1.9 CCCCOCc1cccc(c1I)Br 34a_100010146604_100000210210 [1,1,0,0,0,0|1,0,1]=4 7777 B14R1.9 CCCCOCc1cccc(c1I)Br 7a_100010146604_100000210211 [1,1,0,0,0,0|1,0,1]=4 7778 B14R1.9 CCCCOCc1cccc(c1I)C 34a_100012349780_100000210210 [1,1,0,0,0,0|1,0,1]=4 7779 B14R1.9 CCCCOCc1cccc(c1I)C 7a_100012349780_100000210211 [1,1,0,0,0,0|1,0,1]=4 7780 B14R1.9 CCCCOCc1cccc(c1I)F 34a_100000210227_100010149603 [1,1,0,0,0,0|1,0,1]=4 7781 B14R1.9 CCCCOCc1cccc(c1I)F 34a_100000692438_100000210210 [1,1,0,0,0,0|1,0,1]=4 7782 B14R1.9 CCCCOCc1cccc(c1I)F 7a_100000210227_100010149603 [1,1,0,0,0,0|1,0,1]=4 7783 B14R1.9 CCCCOCc1cccc(c1I)F 7a_100000692438_100000210211 [1,1,0,0,0,0|1,0,1]=4 7784 B14R1.9 CCCCOCc1cccc(c1N)Br 34a_100012349457_100000210210 [1,1,0,0,0,0|1,0,1]=4 7785 B14R1.9 CCCCOCc1cccc(c1N)C 34a_100011215590_100000210210 [1,1,0,0,0,0|1,0,1]=4 7786 B14R1.9 CCCCOCc1cccc(c1N)Cl 34a_100012182729_100000210210 [1,1,0,0,0,0|1,0,1]=4 7787 B14R1.9 CCCCOCc1cccc(c1N)F 34a_100000692437_100000210210 [1,1,0,0,0,0|1,0,1]=4 7788 B14R1.9 CCCNN=Cc1cccc(c1O)Br 4a_100000740057_100000737635 [1,1,0,0,0,0|2,0,0]=4 7789 B14R1.9 CCCNN=Cc1cccc(c1O)C 4a_100000740057_100000744487 [1,1,0,0,0,0|2,0,0]=4 7790 B14R1.9 CCCNN=Cc1cccc(c1O)Cl 4a_100000740057_100000742778 [1,1,0,0,0,0|2,0,0]=4 7791 B14R1.9 CCCNN=Cc1cccc(c1O)F 4a_100000740057_100000745301 [1,1,0,0,0,0|2,0,0]=4 7792 B14R1.9 CCCNN=Cc1cccc(c1O)I 4a_100000740057_100010171435 [1,1,0,0,0,0|2,0,0]=4 7793 B14R1.9 CCCNN=Cc1cccc(c1O)O 4a_100000740057_100000183676 [1,1,0,0,0,0|2,0,0]=4 7794 B14R1.159 CC(Br)CCOCc1ccccc1Br 34a_100009893172_100000184730 [1,1,0,0,0,0|1,0,1]=4 7795 B14R1.159 CC(Br)CCOCc1ccccc1Cl 34a_100009893172_100000187162 [1,1,0,0,0,0|1,0,1]=4 7796 B14R1.159 CC(Br)CCOCc1ccccc1F 34a_100009893172_100000211605 [1,1,0,0,0,0|1,0,1]=4 7797 B14R1.159 CC(Br)CCOCc1ccccc1I 34a_100009893172_100011215278 [1,1,0,0,0,0|1,0,1]=4 7798 B14R1.159 CC(Br)CCOCc1ncccc1O 34a_100009893172_200020655725 [1,1,0,0,0,0|1,0,1]=4 7799 B14R1.159 CC(C)CCCNc1ccccc1O 34a_100000185747_100011214892 [1,1,0,0,0,0|2,0,0]=4 7800 B14R1.159 CC(C)CCCSc1ccccc1O 62a_100000739446_100011214892 [1,1,0,0,0,0|2,0,0]=4 7801 B14R1.159 CC(C)CCCSc1ccccc1O 62a_100011214892_100000739446 [1,1,0,0,0,0|2,0,0]=4 7802 B14R1.159 CC(C)CCNCc1ccccc1O 269862a_100000185550_100000185833 [1,1,0,0,0,0|1,0,1]=4 7803 B14R1.159 CC(C)CCNCc1ccccc1O 34a_100000185550_100000210312 [1,1,0,0,0,0|1,0,1]=4 7804 B14R1.159 CC(C)CCOCc1ccccc1Br 34a_100000210254_100000184730 [1,1,0,0,0,0|1,0,1]=4 7805 B14R1.159 CC(C)CCOCc1ccccc1Br 34a_100000756307_100000210312 [1,1,0,0,0,0|1,0,1]=4 7806 B14R1.159 CC(C)CCOCc1ccccc1Br 7a_100000210254_100000184730 [1,1,0,0,0,0|1,0,1]=4 7807 B14R1.159 CC(C)CCOCc1ccccc1Br 7a_100000756307_100000210626 [1,1,0,0,0,0|1,0,1]=4 7808 B14R1.159 CC(C)CCOCc1ccccc1Cl 34a_100000210254_100000187162 [1,1,0,0,0,0|1,0,1]=4 7809 B14R1.159 CC(C)CCOCc1ccccc1Cl 34a_100000210847_100000210312 [1,1,0,0,0,0|1,0,1]=4 7810 B14R1.159 CC(C)CCOCc1ccccc1Cl 7a_100000210254_100000187162 [1,1,0,0,0,0|1,0,1]=4 7811 B14R1.159 CC(C)CCOCc1ccccc1Cl 7a_100000210847_100000210626 [1,1,0,0,0,0|1,0,1]=4 7812 B14R1.159 CC(C)CCOCc1ccccc1F 34a_100000210254_100000211605 [1,1,0,0,0,0|1,0,1]=4 7813 B14R1.159 CC(C)CCOCc1ccccc1F 34a_100000211962_100000210312 [1,1,0,0,0,0|1,0,1]=4 7814 B14R1.159 CC(C)CCOCc1ccccc1F 7a_100000210254_100000211605 [1,1,0,0,0,0|1,0,1]=4 7815 B14R1.159 CC(C)CCOCc1ccccc1F 7a_100000211962_100000210626 [1,1,0,0,0,0|1,0,1]=4 7816 B14R1.159 CC(C)CCOCc1ccccc1I 34a_100000187465_100000210312 [1,1,0,0,0,0|1,0,1]=4 7817 B14R1.159 CC(C)CCOCc1ccccc1I 34a_100000210254_100011215278 [1,1,0,0,0,0|1,0,1]=4 7818 B14R1.159 CC(C)CCOCc1ccccc1I 7a_100000187465_100000210626 [1,1,0,0,0,0|1,0,1]=4 7819 B14R1.159 CC(C)CCOCc1ccccc1I 7a_100000210254_100011215278 [1,1,0,0,0,0|1,0,1]=4 7820 B14R1.159 CC(C)CCOCc1ccccc1N 34a_100000212039_100000210312 [1,1,0,0,0,0|1,0,1]=4 7821 B14R1.159 CC(C)CCOCc1ncccc1O 34a_100000210254_200020655725 [1,1,0,0,0,0|1,0,1]=4 7822 B14R1.159 CC(C)CCOCc1ncccc1O 7a_100000210254_200020655725 [1,1,0,0,0,0|1,0,1]=4 7823 B14R1.159 CC(O)CCCNc1ccccc1O 34a_100000185747_200000718107 [1,1,0,0,0,0|2,0,0]=4 7824 B14R1.159 CC(O)CCCSc1ccccc1O 62a_100000739446_200000718107 [1,1,0,0,0,0|2,0,0]=4 7825 B14R1.159 CC(O)CCCSc1ccccc1O 62a_200000718107_100000739446 [1,1,0,0,0,0|2,0,0]=4 7826 B14R1.159 CC(O)CCNCc1ccccc1O 34a_100000185550_100012276601 [1,1,0,0,0,0|1,0,1]=4 7827 B14R1.159 CC(O)CCOCc1ccccc1Br 34a_100000756307_100012276601 [1,1,0,0,0,0|1,0,1]=4 7828 B14R1.159 CC(O)CCOCc1ccccc1Br 7a_100000756307_100012276601 [1,1,0,0,0,0|1,0,1]=4 7829 B14R1.159 CC(O)CCOCc1ccccc1Cl 34a_100000210847_100012276601 [1,1,0,0,0,0|1,0,1]=4 7830 B14R1.159 CC(O)CCOCc1ccccc1Cl 7a_100000210847_100012276601 [1,1,0,0,0,0|1,0,1]=4 7831 B14R1.159 CC(O)CCOCc1ccccc1F 34a_100000211962_100012276601 [1,1,0,0,0,0|1,0,1]=4 7832 B14R1.159 CC(O)CCOCc1ccccc1F 7a_100000211962_100012276601 [1,1,0,0,0,0|1,0,1]=4 7833 B14R1.159 CC(O)CCOCc1ccccc1I 34a_100000187465_100012276601 [1,1,0,0,0,0|1,0,1]=4 7834 B14R1.159 CC(O)CCOCc1ccccc1I 7a_100000187465_100012276601 [1,1,0,0,0,0|1,0,1]=4 7835 B14R1.159 CC(O)CCOCc1ccccc1N 34a_100000212039_100012276601 [1,1,0,0,0,0|1,0,1]=4 7836 B14R1.159 CC(O)CNN=Cc1ccccc1O 4a_200000730056_100000185834 [1,1,0,0,0,0|2,0,0]=4 7837 B14R1.159 C[C@@H](N)CCOCc1ccccc1Br 34a_100000706166_100000184730 [1,1,0,0,0,0|1,0,1]=4 7838 B14R1.159 C[C@@H](N)CCOCc1ccccc1Cl 34a_100000706166_100000187162 [1,1,0,0,0,0|1,0,1]=4 7839 B14R1.159 C[C@@H](N)CCOCc1ccccc1F 34a_100000706166_100000211605 [1,1,0,0,0,0|1,0,1]=4 7840 B14R1.159 C[C@@H](N)CCOCc1ccccc1I 34a_100000706166_100011215278 [1,1,0,0,0,0|1,0,1]=4 7841 B14R1.159 C[C@@H](N)CCOCc1ncccc1O 34a_100000706166_200020655725 [1,1,0,0,0,0|1,0,1]=4 7842 B14R1.159 Cc1ccccc1COCCC(C)Br 34a_100009893172_100000211839 [1,1,0,0,0,0|1,0,1]=4 7843 B14R1.159 Cc1ccccc1COCCC(C)C 34a_100000210254_100000211839 [1,1,0,0,0,0|1,0,1]=4 7844 B14R1.159 Cc1ccccc1COCCC(C)C 34a_100000698903_100000210312 [1,1,0,0,0,0|1,0,1]=4 7845 B14R1.159 Cc1ccccc1COCCC(C)C 7a_100000210254_100000211839 [1,1,0,0,0,0|1,0,1]=4 7846 B14R1.159 Cc1ccccc1COCCC(C)C 7a_100000698903_100000210626 [1,1,0,0,0,0|1,0,1]=4 7847 B14R1.159 Cc1ccccc1COCCC(C)O 34a_100000698903_100012276601 [1,1,0,0,0,0|1,0,1]=4 7848 B14R1.159 Cc1ccccc1COCCC(C)O 7a_100000698903_100012276601 [1,1,0,0,0,0|1,0,1]=4 7849 B14R1.159 Cc1ccccc1COCC[C@@H](C)N 34a_100000706166_100000211839 [1,1,0,0,0,0|1,0,1]=4 7850 B14R1.218 CCCCC=Cc1cc(ccc1Br)Br 271570a_100016275911_100011483371 [1,1,0,0,0,0|2,0,0]=4 7851 B14R1.218 CCCCC=Cc1cc(ccc1Br)C 271570a_100016275911_100012353751 [1,1,0,0,0,0|2,0,0]=4 7852 B14R1.218 CCCCC=Cc1cc(ccc1Br)Cl 271570a_100016275911_100012339723 [1,1,0,0,0,0|2,0,0]=4 7853 B14R1.218 CCCCC=Cc1cc(ccc1Br)F 271570a_100016275911_100011217576 [1,1,0,0,0,0|2,0,0]=4 7854 B14R1.218 CCCCC=Cc1cc(ccc1Br)N 271570a_100016275911_100000750459 [1,1,0,0,0,0|2,0,0]=4 7855 B14R1.218 CCCCC=Cc1cc(ccc1Br)O 271570a_100016275911_100012339312 [1,1,0,0,0,0|2,0,0]=4 7856 B14R1.218 CCCCC=Cc1cc(ccc1C)Br 271570a_100016275911_100011344865 [1,1,0,0,0,0|2,0,0]=4 7857 B14R1.218 CCCCC=Cc1cc(ccc1C)C 271570a_100016275911_100000210833 [1,1,0,0,0,0|2,0,0]=4 7858 B14R1.218 CCCCC=Cc1cc(ccc1C)Cl 271570a_100016275911_100011263213 [1,1,0,0,0,0|2,0,0]=4 7859 B14R1.218 CCCCC=Cc1cc(ccc1C)F 271570a_100016275911_100011218078 [1,1,0,0,0,0|2,0,0]=4 7860 B14R1.218 CCCCC=Cc1cc(ccc1C)N 271570a_100016275911_100000736455 [1,1,0,0,0,0|2,0,0]=4 7861 B14R1.218 CCCCC=Cc1cc(ccc1C)O 271570a_100016275911_100011380479 [1,1,0,0,0,0|2,0,0]=4 7862 B14R1.218 CCCCC=Cc1cc(ccc1Cl)Br 271570a_100016275911_100011772130 [1,1,0,0,0,0|2,0,0]=4 7863 B14R1.218 CCCCC=Cc1cc(ccc1Cl)C 271570a_100016275911_100012356289 [1,1,0,0,0,0|2,0,0]=4 7864 B14R1.218 CCCCC=Cc1cc(ccc1Cl)Cl 271570a_100016275911_100000707729 [1,1,0,0,0,0|2,0,0]=4 7865 B14R1.218 CCCCC=Cc1cc(ccc1Cl)F 271570a_100016275911_100011217299 [1,1,0,0,0,0|2,0,0]=4 7866 B14R1.218 CCCCC=Cc1cc(ccc1Cl)N 271570a_100016275911_100012360549 [1,1,0,0,0,0|2,0,0]=4 7867 B14R1.218 CCCCC=Cc1cc(ccc1Cl)O 271570a_100016275911_100000049588 [1,1,0,0,0,0|2,0,0]=4 7868 B14R1.218 CCCCC=Cc1cc(ccc1F)Br 271570a_100016275911_100011217312 [1,1,0,0,0,0|2,0,0]=4 7869 B14R1.218 CCCCC=Cc1cc(ccc1F)C 271570a_100016275911_100000736223 [1,1,0,0,0,0|2,0,0]=4 7870 B14R1.218 CCCCC=Cc1cc(ccc1F)Cl 271570a_100016275911_100011218116 [1,1,0,0,0,0|2,0,0]=4 7871 B14R1.218 CCCCC=Cc1cc(ccc1F)F 271570a_100016275911_100000750033 [1,1,0,0,0,0|2,0,0]=4 7872 B14R1.218 CCCCC=Cc1cc(ccc1F)N 271570a_100016275911_100000760356 [1,1,0,0,0,0|2,0,0]=4 7873 B14R1.218 CCCCC=Cc1cc(ccc1F)O 271570a_100016275911_100000693481 [1,1,0,0,0,0|2,0,0]=4 7874 B14R1.218 CCCCC=Cc1cc(ccc1N)Br 271570a_100016275911_100000187925 [1,1,0,0,0,0|2,0,0]=4 7875 B14R1.218 CCCCC=Cc1cc(ccc1N)C 271570a_100016275911_100000210942 [1,1,0,0,0,0|2,0,0]=4 7876 B14R1.218 CCCCC=Cc1cc(ccc1N)Cl 271570a_100016275911_100000761889 [1,1,0,0,0,0|2,0,0]=4 7877 B14R1.218 CCCCC=Cc1cc(ccc1N)F 271570a_100016275911_100000760547 [1,1,0,0,0,0|2,0,0]=4 7878 B14R1.218 CCCCC=Cc1cc(ccc1N)N 271570a_100016275911_100011534242 [1,1,0,0,0,0|2,0,0]=4 7879 B14R1.218 CCCCC=Cc1cc(ccc1N)O 271570a_100016275911_100012001276 [1,1,0,0,0,0|2,0,0]=4 7880 B14R1.218 CCCCC=Cc1cc(ccc1O)Br 271570a_100016275911_100012355227 [1,1,0,0,0,0|1,0,0]=3 7881 B14R1.218 CCCCC=Cc1cc(ccc1O)C 271570a_100016275911_100000765521 [1,1,0,0,0,0|1,0,0]=3 7882 B14R1.218 CCCCC=Cc1cc(ccc1O)Cl 271570a_100016275911_100011356953 [1,1,0,0,0,0|1,0,0]=3 7883 B14R1.218 CCCCC=Cc1cc(ccc1O)F 271570a_100016275911_100000211999 [1,1,0,0,0,0|1,0,0]=3 7884 B14R1.218 CCCCC=Cc1cc(ccc1O)N 271570a_100016275911_100011534360 [1,1,0,0,0,0|1,0,0]=3 7885 B14R1.218 CCCCC=Cc1cc(ccc1O)O 271570a_100016275911_100009813629 [1,1,0,0,0,0|1,0,0]=3 7886 B14R1.218 CCCCC=Cc1cc(cnc1O)Br 271570a_100016275911_100010197142 [1,1,0,0,0,0|2,0,0]=4 7887 B14R1.218 CCCCC=Cc1cc(cnc1O)C 271570a_100016275911_100000049931 [1,1,0,0,0,0|2,0,0]=4 7888 B14R1.218 CCCCC=Cc1cc(cnc1O)Cl 271570a_100016275911_100010188700 [1,1,0,0,0,0|2,0,0]=4 7889 B14R1.218 CCCCC=Cc1cc(ncc1O)C 271570a_100016275911_100009843476 [1,1,0,0,0,0|2,0,0]=4 7890 B14R1.218 CCCCC=Cc1cc(ncc1O)Cl 271570a_100016275911_100000698892 [1,1,0,0,0,0|2,0,0]=4 7891 B14R1.218 CCCCC=Cc1nc(ccc1O)Br 271570a_100016275911_100010253912 [1,1,0,0,0,0|2,0,0]=4 7892 B14R1.218 CCCCC=Cc1nc(ccc1O)C 271570a_100016275911_100000702858 [1,1,0,0,0,0|2,0,0]=4 7893 B14R1.218 CCCCC=Cc1nc(ccc1O)Cl 271570a_100016275911_100000696390 [1,1,0,0,0,0|2,0,0]=4 7894 B14R1.218 CCCCC=Cc1nc(ccc1O)F 271570a_100016275911_100010382442 [1,1,0,0,0,0|2,0,0]=4 7895 B14R1.218 CCCCCNc1cc(ccc1O)Br 34a_100000752626_100000718602 [1,1,0,0,0,0|2,0,0]=4 7896 B14R1.218 CCCCCNc1cc(ccc1O)C 34a_100011215204_100000718602 [1,1,0,0,0,0|2,0,0]=4 7897 B14R1.218 CCCCCNc1cc(ccc1O)Cl 34a_100000210500_100000718602 [1,1,0,0,0,0|2,0,0]=4 7898 B14R1.218 CCCCCNc1cc(ccc1O)F 34a_100000759472_100000718602 [1,1,0,0,0,0|2,0,0]=4 7899 B14R1.218 CCCCCSc1cc(ccc1O)Br 62a_100000210326_100012355227 [1,1,0,0,0,0|2,0,0]=4 7900 B14R1.218 CCCCCSc1cc(ccc1O)Br 62a_100012355227_100000210326 [1,1,0,0,0,0|2,0,0]=4 7901 B14R1.218 CCCCCSc1cc(ccc1O)C 62a_100000210326_100000765521 [1,1,0,0,0,0|2,0,0]=4 7902 B14R1.218 CCCCCSc1cc(ccc1O)C 62a_100000765521_100000210326 [1,1,0,0,0,0|2,0,0]=4 7903 B14R1.218 CCCCCSc1cc(ccc1O)Cl 62a_100000210326_100011356953 [1,1,0,0,0,0|2,0,0]=4 7904 B14R1.218 CCCCCSc1cc(ccc1O)Cl 62a_100011356953_100000210326 [1,1,0,0,0,0|2,0,0]=4 7905 B14R1.218 CCCCCSc1cc(ccc1O)F 62a_100000210326_100000211999 [1,1,0,0,0,0|2,0,0]=4 7906 B14R1.218 CCCCCSc1cc(ccc1O)F 62a_100000211999_100000210326 [1,1,0,0,0,0|2,0,0]=4 7907 B14R1.218 CCCCCSc1cc(ccc1O)N 62a_100000210326_100011534360 [1,1,0,0,0,0|2,0,0]=4 7908 B14R1.218 CCCCCSc1cc(ccc1O)N 62a_100011534360_100000210326 [1,1,0,0,0,0|2,0,0]=4 7909 B14R1.218 CCCCCSc1cc(ccc1O)O 62a_100000210326_100009813629 [1,1,0,0,0,0|2,0,0]=4 7910 B14R1.218 CCCCNCc1cc(ccc1O)Br 34a_100000730032_100000210210 [1,1,0,0,0,0|1,0,1]=4 7911 B14R1.218 CCCCNCc1cc(ccc1O)Cl 34a_100000238540_100000210210 [1,1,0,0,0,0|1,0,1]=4 7912 B14R1.218 CCCCNCc1cc(ccc1O)F 7a_106832991798_100010161318 [1,1,0,0,0,0|1,0,1]=4 7913 B14R1.218 CCCCOCc1cc(ccc1Br)Br 34a_100000210227_100011982794 [1,1,0,0,0,0|1,0,1]=4 7914 B14R1.218 CCCCOCc1cc(ccc1Br)Br 34a_100011266457_100000210210 [1,1,0,0,0,0|1,0,1]=4 7915 B14R1.218 CCCCOCc1cc(ccc1Br)Br 7a_100000210227_100011982794 [1,1,0,0,0,0|1,0,1]=4 7916 B14R1.218 CCCCOCc1cc(ccc1Br)Br 7a_100011266457_100000210211 [1,1,0,0,0,0|1,0,1]=4 7917 B14R1.218 CCCCOCc1cc(ccc1Br)C 34a_100012361352_100000210210 [1,1,0,0,0,0|1,0,1]=4 7918 B14R1.218 CCCCOCc1cc(ccc1Br)C 7a_100012361352_100000210211 [1,1,0,0,0,0|1,0,1]=4 7919 B14R1.218 CCCCOCc1cc(ccc1Br)Cl 34a_100000210227_100000733903 [1,1,0,0,0,0|1,0,1]=4 7920 B14R1.218 CCCCOCc1cc(ccc1Br)Cl 34a_100012355668_100000210210 [1,1,0,0,0,0|1,0,1]=4 7921 B14R1.218 CCCCOCc1cc(ccc1Br)Cl 7a_100000210227_100000733903 [1,1,0,0,0,0|1,0,1]=4 7922 B14R1.218 CCCCOCc1cc(ccc1Br)Cl 7a_100012355668_100000210211 [1,1,0,0,0,0|1,0,1]=4 7923 B14R1.218 CCCCOCc1cc(ccc1Br)F 34a_100000210227_100000736370 [1,1,0,0,0,0|1,0,1]=4 7924 B14R1.218 CCCCOCc1cc(ccc1Br)F 34a_100011217561_100000210210 [1,1,0,0,0,0|1,0,1]=4 7925 B14R1.218 CCCCOCc1cc(ccc1Br)F 7a_100000210227_100000736370 [1,1,0,0,0,0|1,0,1]=4 7926 B14R1.218 CCCCOCc1cc(ccc1Br)F 7a_100011217561_100000210211 [1,1,0,0,0,0|1,0,1]=4 7927 B14R1.218 CCCCOCc1cc(ccc1Br)I 34a_100000210227_100012355412 [1,1,0,0,0,0|1,0,1]=4 7928 B14R1.218 CCCCOCc1cc(ccc1Br)I 7a_100000210227_100012355412 [1,1,0,0,0,0|1,0,1]=4 7929 B14R1.218 CCCCOCc1cc(ccc1Br)I 7a_100012359683_100000210211 [1,1,0,0,0,0|1,0,1]=4 7930 B14R1.218 CCCCOCc1cc(ccc1Br)N 34a_100012347228_100000210210 [1,1,0,0,0,0|1,0,1]=4 7931 B14R1.218 CCCCOCc1cc(ccc1C)Br 34a_100000700630_100000210210 [1,1,0,0,0,0|1,0,1]=4 7932 B14R1.218 CCCCOCc1cc(ccc1C)Br 7a_100000700630_100000210211 [1,1,0,0,0,0|1,0,1]=4 7933 B14R1.218 CCCCOCc1cc(ccc1C)C 34a_100000210227_100000184699 [1,1,0,0,0,0|1,0,1]=4 7934 B14R1.218 CCCCOCc1cc(ccc1C)C 34a_200011215349_100000210210 [1,1,0,0,0,0|1,0,1]=4 7935 B14R1.218 CCCCOCc1cc(ccc1C)C 7a_100000210227_100000184699 [1,1,0,0,0,0|1,0,1]=4 7936 B14R1.218 CCCCOCc1cc(ccc1C)C 7a_200011215349_100000210211 [1,1,0,0,0,0|1,0,1]=4 7937 B14R1.218 CCCCOCc1cc(ccc1C)Cl 34a_100000210227_100012186985 [1,1,0,0,0,0|1,0,1]=4 7938 B14R1.218 CCCCOCc1cc(ccc1C)Cl 34a_100012002407_100000210210 [1,1,0,0,0,0|1,0,1]=4 7939 B14R1.218 CCCCOCc1cc(ccc1C)Cl 7a_100000210227_100012186985 [1,1,0,0,0,0|1,0,1]=4 7940 B14R1.218 CCCCOCc1cc(ccc1C)Cl 7a_100012002407_100000210211 [1,1,0,0,0,0|1,0,1]=4 7941 B14R1.218 CCCCOCc1cc(ccc1C)F 34a_100000210227_100000709795 [1,1,0,0,0,0|1,0,1]=4 7942 B14R1.218 CCCCOCc1cc(ccc1C)F 34a_100011219218_100000210210 [1,1,0,0,0,0|1,0,1]=4 7943 B14R1.218 CCCCOCc1cc(ccc1C)F 7a_100000210227_100000709795 [1,1,0,0,0,0|1,0,1]=4 7944 B14R1.218 CCCCOCc1cc(ccc1C)F 7a_100011219218_100000210211 [1,1,0,0,0,0|1,0,1]=4 7945 B14R1.218 CCCCOCc1cc(ccc1C)I 34a_100010150140_100000210210 [1,1,0,0,0,0|1,0,1]=4 7946 B14R1.218 CCCCOCc1cc(ccc1C)I 7a_100010150140_100000210211 [1,1,0,0,0,0|1,0,1]=4 7947 B14R1.218 CCCCOCc1cc(ccc1Cl)Br 34a_100000210227_100000763347 [1,1,0,0,0,0|1,0,1]=4 7948 B14R1.218 CCCCOCc1cc(ccc1Cl)Br 34a_100011215897_100000210210 [1,1,0,0,0,0|1,0,1]=4 7949 B14R1.218 CCCCOCc1cc(ccc1Cl)Br 7a_100000210227_100000763347 [1,1,0,0,0,0|1,0,1]=4 7950 B14R1.218 CCCCOCc1cc(ccc1Cl)Br 7a_100011215897_100000210211 [1,1,0,0,0,0|1,0,1]=4 7951 B14R1.218 CCCCOCc1cc(ccc1Cl)C 34a_100000210227_100009871730 [1,1,0,0,0,0|1,0,1]=4 7952 B14R1.218 CCCCOCc1cc(ccc1Cl)C 34a_100009878994_100000210210 [1,1,0,0,0,0|1,0,1]=4 7953 B14R1.218 CCCCOCc1cc(ccc1Cl)C 7a_100000210227_100009871730 [1,1,0,0,0,0|1,0,1]=4 7954 B14R1.218 CCCCOCc1cc(ccc1Cl)C 7a_100009878994_100000210211 [1,1,0,0,0,0|1,0,1]=4 7955 B14R1.218 CCCCOCc1cc(ccc1Cl)Cl 34a_100000210227_100000756322 [1,1,0,0,0,0|1,0,1]=4 7956 B14R1.218 CCCCOCc1cc(ccc1Cl)Cl 34a_100000698905_100000210210 [1,1,0,0,0,0|1,0,1]=4 7957 B14R1.218 CCCCOCc1cc(ccc1Cl)Cl 7a_100000210227_100000756322 [1,1,0,0,0,0|1,0,1]=4 7958 B14R1.218 CCCCOCc1cc(ccc1Cl)Cl 7a_100000698905_100000210211 [1,1,0,0,0,0|1,0,1]=4 7959 B14R1.218 CCCCOCc1cc(ccc1Cl)F 34a_100000210227_100000709952 [1,1,0,0,0,0|1,0,1]=4 7960 B14R1.218 CCCCOCc1cc(ccc1Cl)F 34a_100011218361_100000210210 [1,1,0,0,0,0|1,0,1]=4 7961 B14R1.218 CCCCOCc1cc(ccc1Cl)F 7a_100000210227_100000709952 [1,1,0,0,0,0|1,0,1]=4 7962 B14R1.218 CCCCOCc1cc(ccc1Cl)F 7a_100011218361_100000210211 [1,1,0,0,0,0|1,0,1]=4 7963 B14R1.218 CCCCOCc1cc(ccc1Cl)I 34a_100000210227_100010188191 [1,1,0,0,0,0|1,0,1]=4 7964 B14R1.218 CCCCOCc1cc(ccc1Cl)I 34a_100010128486_100000210210 [1,1,0,0,0,0|1,0,1]=4 7965 B14R1.218 CCCCOCc1cc(ccc1Cl)I 7a_100000210227_100010188191 [1,1,0,0,0,0|1,0,1]=4 7966 B14R1.218 CCCCOCc1cc(ccc1Cl)I 7a_100010128486_100000210211 [1,1,0,0,0,0|1,0,1]=4 7967 B14R1.218 CCCCOCc1cc(ccc1Cl)N 34a_100011273577_100000210210 [1,1,0,0,0,0|1,0,1]=4 7968 B14R1.218 CCCCOCc1cc(ccc1F)Br 34a_100000210227_100000736399 [1,1,0,0,0,0|1,0,1]=4 7969 B14R1.218 CCCCOCc1cc(ccc1F)Br 34a_100000246282_100000210210 [1,1,0,0,0,0|1,0,1]=4 7970 B14R1.218 CCCCOCc1cc(ccc1F)Br 7a_100000210227_100000736399 [1,1,0,0,0,0|1,0,1]=4 7971 B14R1.218 CCCCOCc1cc(ccc1F)Br 7a_100000246282_100000210211 [1,1,0,0,0,0|1,0,1]=4 7972 B14R1.218 CCCCOCc1cc(ccc1F)C 34a_100000210227_100011260760 [1,1,0,0,0,0|1,0,1]=4 7973 B14R1.218 CCCCOCc1cc(ccc1F)C 34a_100011692775_100000210210 [1,1,0,0,0,0|1,0,1]=4 7974 B14R1.218 CCCCOCc1cc(ccc1F)C 7a_100000210227_100011260760 [1,1,0,0,0,0|1,0,1]=4 7975 B14R1.218 CCCCOCc1cc(ccc1F)C 7a_100011692775_100000210211 [1,1,0,0,0,0|1,0,1]=4 7976 B14R1.218 CCCCOCc1cc(ccc1F)Cl 34a_100000210227_100000716957 [1,1,0,0,0,0|1,0,1]=4 7977 B14R1.218 CCCCOCc1cc(ccc1F)Cl 34a_100011217248_100000210210 [1,1,0,0,0,0|1,0,1]=4 7978 B14R1.218 CCCCOCc1cc(ccc1F)Cl 7a_100000210227_100000716957 [1,1,0,0,0,0|1,0,1]=4 7979 B14R1.218 CCCCOCc1cc(ccc1F)Cl 7a_100011217248_100000210211 [1,1,0,0,0,0|1,0,1]=4 7980 B14R1.218 CCCCOCc1cc(ccc1F)F 34a_100000210227_100000741279 [1,1,0,0,0,0|1,0,1]=4 7981 B14R1.218 CCCCOCc1cc(ccc1F)F 34a_100011217725_100000210210 [1,1,0,0,0,0|1,0,1]=4 7982 B14R1.218 CCCCOCc1cc(ccc1F)F 7a_100000210227_100000741279 [1,1,0,0,0,0|1,0,1]=4 7983 B14R1.218 CCCCOCc1cc(ccc1F)F 7a_100011217725_100000210211 [1,1,0,0,0,0|1,0,1]=4 7984 B14R1.218 CCCCOCc1cc(ccc1F)I 34a_100000049604_100000210210 [1,1,0,0,0,0|1,0,1]=4 7985 B14R1.218 CCCCOCc1cc(ccc1F)I 34a_100000210227_200010149601 [1,1,0,0,0,0|1,0,1]=4 7986 B14R1.218 CCCCOCc1cc(ccc1F)I 7a_100000049604_100000210211 [1,1,0,0,0,0|1,0,1]=4 7987 B14R1.218 CCCCOCc1cc(ccc1F)I 7a_100000210227_200010149601 [1,1,0,0,0,0|1,0,1]=4 7988 B14R1.218 CCCCOCc1cc(ccc1F)N 34a_100011218011_100000210210 [1,1,0,0,0,0|1,0,1]=4 7989 B14R1.218 CCCCOCc1cc(ccc1I)Br 34a_100000210227_100012362523 [1,1,0,0,0,0|1,0,1]=4 7990 B14R1.218 CCCCOCc1cc(ccc1I)Br 34a_100011356890_100000210210 [1,1,0,0,0,0|1,0,1]=4 7991 B14R1.218 CCCCOCc1cc(ccc1I)Br 7a_100000210227_100012362523 [1,1,0,0,0,0|1,0,1]=4 7992 B14R1.218 CCCCOCc1cc(ccc1I)Br 7a_100011356890_100000210211 [1,1,0,0,0,0|1,0,1]=4 7993 B14R1.218 CCCCOCc1cc(ccc1I)Cl 34a_100000210227_100012348826 [1,1,0,0,0,0|1,0,1]=4 7994 B14R1.218 CCCCOCc1cc(ccc1I)Cl 7a_100000210227_100012348826 [1,1,0,0,0,0|1,0,1]=4 7995 B14R1.218 CCCCOCc1cc(ccc1I)F 34a_100000210227_100010149606 [1,1,0,0,0,0|1,0,1]=4 7996 B14R1.218 CCCCOCc1cc(ccc1I)F 34a_100010255287_100000210210 [1,1,0,0,0,0|1,0,1]=4 7997 B14R1.218 CCCCOCc1cc(ccc1I)F 7a_100000210227_100010149606 [1,1,0,0,0,0|1,0,1]=4 7998 B14R1.218 CCCCOCc1cc(ccc1I)F 7a_100010255287_100000210211 [1,1,0,0,0,0|1,0,1]=4 7999 B14R1.218 CCCCOCc1cc(ccc1N)Br 34a_100012353972_100000210210 [1,1,0,0,0,0|1,0,1]=4 8000 B14R1.218 CCCCOCc1cc(ccc1N)Br 7a_100012353972_100000210211 [1,1,0,0,0,0|1,0,1]=4 8001 B14R1.218 CCCCOCc1cc(ccc1N)C 34a_100011215565_100000210210 [1,1,0,0,0,0|1,0,1]=4 8002 B14R1.218 CCCCOCc1cc(ccc1N)C 7a_100011215565_100000210211 [1,1,0,0,0,0|1,0,1]=4 8003 B14R1.218 CCCCOCc1cc(ccc1N)Cl 34a_100011214999_100000210210 [1,1,0,0,0,0|1,0,1]=4 8004 B14R1.218 CCCCOCc1cc(ccc1N)Cl 7a_100011214999_100000210211 [1,1,0,0,0,0|1,0,1]=4 8005 B14R1.218 CCCCOCc1cc(ccc1N)F 34a_100011296978_100000210210 [1,1,0,0,0,0|1,0,1]=4 8006 B14R1.218 CCCCOCc1cc(ccc1N)F 7a_100011296978_100000210211 [1,1,0,0,0,0|1,0,1]=4 8007 B14R1.218 CCCCOCc1cc(ccc1O)F 34a_100000210227_100010161318 [1,1,0,0,0,0|0,0,1]=3 8008 B14R1.218 CCCCOCc1cc(ccc1O)F 7a_100000210227_100010161318 [1,1,0,0,0,0|0,0,1]=3 8009 B14R1.218 CCCCOCc1nc(ccc1O)C 34a_100000210227_100020630696 [1,1,0,0,0,0|1,0,1]=4 8010 B14R1.218 CCCCOCc1nc(ccc1O)C 7a_100000210227_100020630696 [1,1,0,0,0,0|1,0,1]=4 8011 B14R1.218 CCCCSCc1cc(ccc1O)F 62a_100000210211_100010161318 [1,1,0,0,0,0|0,1,1]=4 8012 B14R1.218 CCCCSCc1cc(ccc1O)F 62a_100010161318_100000210210 [1,1,0,0,0,0|0,1,1]=4 8013 B14R1.218 CCCNN=Cc1cc(ccc1O)Br 4a_100000740057_100000186750 [1,1,0,0,0,0|2,0,0]=4 8014 B14R1.218 CCCNN=Cc1cc(ccc1O)C 4a_100000740057_100000744884 [1,1,0,0,0,0|2,0,0]=4 8015 B14R1.218 CCCNN=Cc1cc(ccc1O)Cl 4a_100000740057_100000188317 [1,1,0,0,0,0|2,0,0]=4 8016 B14R1.218 CCCNN=Cc1cc(ccc1O)F 4a_100000740057_100000742802 [1,1,0,0,0,0|2,0,0]=4 8017 B14R1.218 CCCNN=Cc1cc(ccc1O)I 4a_100000740057_100011215628 [1,1,0,0,0,0|2,0,0]=4 8018 B14R1.218 CCCNN=Cc1cc(ccc1O)O 4a_100000740057_100011219918 [1,1,0,0,0,0|2,0,0]=4 8019 B14R1.218 COCCOCc1cc(ccc1O)F 34a_100000210237_100010161318 [1,1,0,0,0,0|1,0,1]=4 8020 B14R1.218 CSCCOCc1cc(ccc1O)F 34a_100000230434_100010161318 [1,1,0,0,0,0|1,0,1]=4 8021 B14R1.218 CSCCOCc1cc(ccc1O)F 7a_100000230434_100010161318 [1,1,0,0,0,0|1,0,1]=4 8022 B14R1.218 NCCCOCc1cc(ccc1O)F 34a_100000182051_100010161318 [1,1,0,0,0,0|1,0,1]=4 8023 B14R1.218 Oc1ccc(cc1COCCCBr)F 34a_100011217188_100010161318 [1,1,0,0,0,0|1,0,1]=4 8024 B14R1.218 Oc1ccc(cc1COCCCCl)F 34a_100000230001_100010161318 [1,1,0,0,0,0|1,0,1]=4 8025 B14R1.218 Oc1ccc(cc1COCCCF)F 34a_100000759539_100010161318 [1,1,0,0,0,0|1,0,1]=4 8026 B14R1.476 C#Cc1ccccc1COCCCC 34a_100000054652_100000210210 [1,1,0,0,0,0|1,0,1]=4 8027 B14R1.476 C#Cc1ccccc1COCCCC 7a_100000054652_100000210211 [1,1,0,0,0,0|1,0,1]=4 8028 B14R1.476 C=Cc1ccccc1COCCCC 34a_200010883148_100000210210 [1,1,0,0,0,0|1,0,1]=4 8029 B14R1.476 C=Cc1ccccc1COCCCC 7a_200010883148_100000210211 [1,1,0,0,0,0|1,0,1]=4 8030 B14R1.476 CCCCC=Cc1ccccc1C#N 271570a_100016275911_100000188569 [1,1,0,0,0,0|2,0,0]=4 8031 B14R1.476 CCCCC=Cc1ccccc1C=O 271570a_100016275911_100000211189 [1,1,0,0,0,0|1,0,1]=4 8032 B14R1.476 CCCCC=Cc1ccccc1CC 271570a_100016275911_100011215823 [1,1,0,0,0,0|2,0,0]=4 8033 B14R1.476 CCCCC=Cc1ccccc1CN 271570a_100016275911_100000689332 [1,1,0,0,0,0|2,0,0]=4 8034 B14R1.476 CCCCC=Cc1ccccc1CO 271570a_100016275911_100000187465 [1,1,0,0,0,0|1,0,0]=3 8035 B14R1.476 CCCCC=Cc1ccccc1NC 271570a_100016275911_100020606079 [1,1,0,0,0,0|2,0,0]=4 8036 B14R1.476 CCCCC=Cc1ccccc1NN 271570a_100016275911_100000241748 [1,1,0,0,0,0|2,0,0]=4 8037 B14R1.476 CCCCC=Cc1ccccc1OC 271570a_100016275911_100000174000 [1,1,0,0,0,0|1,0,0]=3 8038 B14R1.476 CCCCC=Cc1ccccc1SC 271570a_100016275911_100011217816 [1,1,0,0,0,0|1,1,0]=4 8039 B14R1.476 CCCCC=Cc1cccnc1CO 271570a_100016275911_100011996772 [1,1,0,0,0,0|2,0,0]=4 8040 B14R1.476 CCCCC=Cc1cccnc1OC 271570a_100016275911_100000047025 [1,1,0,0,0,0|2,0,0]=4 8041 B14R1.476 CCCCC=Cc1ccncc1CO 271570a_100016275911_100000117392 [1,1,0,0,0,0|2,0,0]=4 8042 B14R1.476 CCCCC=Cc1ccncc1OC 271570a_100016275911_100016988167 [1,1,0,0,0,0|2,0,0]=4 8043 B14R1.476 CCCCC=Cc1cnccc1CO 271570a_100016275911_100009873359 [1,1,0,0,0,0|2,0,0]=4 8044 B14R1.476 CCCCC=Cc1cnccc1OC 271570a_100016275911_100011997281 [1,1,0,0,0,0|2,0,0]=4 8045 B14R1.476 CCCCC=Cc1ncccc1CO 271570a_100016275911_100000748726 [1,1,0,0,0,0|2,0,0]=4 8046 B14R1.476 CCCCC=Cc1ncccc1OC 271570a_100016275911_100000690851 [1,1,0,0,0,0|2,0,0]=4 8047 B14R1.476 CCCCCNc1ccccc1CO 34a_100000212039_100000718602 [1,1,0,0,0,0|2,0,0]=4 8048 B14R1.476 CCCCCNc1ccccc1OC 34a_100000210025_100000718602 [1,1,0,0,0,0|2,0,0]=4 8049 B14R1.476 CCCCCOc1ccccc1CO 34a_100011216872_100000718602 [1,1,0,0,0,0|2,0,0]=4 8050 B14R1.476 CCCCCOc1ccccc1OC 34a_100000210385_100000718602 [1,1,0,0,0,0|2,0,0]=4 8051 B14R1.476 CCCCCSc1ccccc1CO 62a_100000187465_100000210326 [1,1,0,0,0,0|2,0,0]=4 8052 B14R1.476 CCCCCSc1ccccc1CO 62a_100000210326_100000187465 [1,1,0,0,0,0|2,0,0]=4 8053 B14R1.476 CCCCCSc1ccccc1OC 62a_100000210326_100000210334 [1,1,0,0,0,0|2,0,0]=4 8054 B14R1.476 CCCCCSc1ccccc1OC 62a_100000210334_100000210326 [1,1,0,0,0,0|2,0,0]=4 8055 B14R1.476 CCCCNCc1ccccc1CO 2230a_100000102301_100009816955 [1,1,0,0,0,0|1,0,1]=4 8056 B14R1.476 CCCCNCc1ccccc1CO 7a_106832991798_100009816955 [1,1,0,0,0,0|1,0,1]=4 8057 B14R1.476 CCCCNCc1ccccc1OC 207a_100000102301_100000169842 [1,1,0,0,0,0|1,0,1]=4 8058 B14R1.476 CCCCNCc1ccccc1OC 2230a_100000102301_100000210004 [1,1,0,0,0,0|1,0,1]=4 8059 B14R1.476 CCCCNCc1ccccc1OC 270004a_100000102301_100000169842 [1,1,0,0,0,0|1,0,1]=4 8060 B14R1.476 CCCCNCc1ccccc1OC 34a_100000188900_100000210210 [1,1,0,0,0,0|1,0,1]=4 8061 B14R1.476 CCCCNCc1ccccc1OC 7a_106832991798_100000210004 [1,1,0,0,0,0|1,0,1]=4 8062 B14R1.476 CCCCOCc1ccccc1C#N 34a_100000210227_100000181865 [1,1,0,0,0,0|1,0,1]=4 8063 B14R1.476 CCCCOCc1ccccc1C#N 34a_200011269968_100000210210 [1,1,0,0,0,0|1,0,1]=4 8064 B14R1.476 CCCCOCc1ccccc1C#N 7a_100000210227_100000181865 [1,1,0,0,0,0|1,0,1]=4 8065 B14R1.476 CCCCOCc1ccccc1C#N 7a_200011269968_100000210211 [1,1,0,0,0,0|1,0,1]=4 8066 B14R1.476 CCCCOCc1ccccc1C=O 34a_100000210227_200009853537 [1,1,0,0,0,0|0,0,2]=4 8067 B14R1.476 CCCCOCc1ccccc1C=O 7a_100000210227_200009853537 [1,1,0,0,0,0|0,0,2]=4 8068 B14R1.476 CCCCOCc1ccccc1CBr 34a_100009816955_100000210210 [1,1,0,0,0,0|1,0,1]=4 8069 B14R1.476 CCCCOCc1ccccc1CBr 7a_100009816955_100000210211 [1,1,0,0,0,0|1,0,1]=4 8070 B14R1.476 CCCCOCc1ccccc1CC 34a_100011663872_100000210210 [1,1,0,0,0,0|1,0,1]=4 8071 B14R1.476 CCCCOCc1ccccc1CC 7a_100011663872_100000210211 [1,1,0,0,0,0|1,0,1]=4 8072 B14R1.476 CCCCOCc1ccccc1CN 34a_100000743596_100000210210 [1,1,0,0,0,0|1,0,1]=4 8073 B14R1.476 CCCCOCc1ccccc1CO 34a_100000210227_100009816955 [1,1,0,0,0,0|0,0,1]=3 8074 B14R1.476 CCCCOCc1ccccc1CO 7a_100000210227_100009816955 [1,1,0,0,0,0|0,0,1]=3 8075 B14R1.476 CCCCOCc1ccccc1OC 34a_100000210227_100000210004 [1,1,0,0,0,0|0,0,1]=3 8076 B14R1.476 CCCCOCc1ccccc1OC 34a_100000211301_100000210210 [1,1,0,0,0,0|0,0,1]=3 8077 B14R1.476 CCCCOCc1ccccc1OC 7a_100000210227_100000210004 [1,1,0,0,0,0|0,0,1]=3 8078 B14R1.476 CCCCOCc1ccccc1SC 34a_100000210227_100000699184 [1,1,0,0,0,0|0,1,1]=4 8079 B14R1.476 CCCCOCc1ccccc1SC 34a_100000699167_100000210210 [1,1,0,0,0,0|0,1,1]=4 8080 B14R1.476 CCCCOCc1ccccc1SC 7a_100000210227_100000699184 [1,1,0,0,0,0|0,1,1]=4 8081 B14R1.476 CCCCOCc1cccnc1OC 34a_100000210227_100020631285 [1,1,0,0,0,0|1,0,1]=4 8082 B14R1.476 CCCCOCc1cccnc1OC 34a_100000717863_100000210210 [1,1,0,0,0,0|1,0,1]=4 8083 B14R1.476 CCCCOCc1cccnc1OC 7a_100000210227_100020631285 [1,1,0,0,0,0|1,0,1]=4 8084 B14R1.476 CCCCOCc1ccncc1OC 7a_100000210227_100020635607 [1,1,0,0,0,0|1,0,1]=4 8085 B14R1.476 CCCCOCc1ncccc1OC 34a_100011998681_100000210210 [1,1,0,0,0,0|1,0,1]=4 8086 B14R1.476 CCCCSCc1ccccc1CO 62a_100000210211_100009816955 [1,1,0,0,0,0|0,1,1]=4 8087 B14R1.476 CCCCSCc1ccccc1CO 62a_100009816955_100000210210 [1,1,0,0,0,0|0,1,1]=4 8088 B14R1.476 CCCCSCc1ccccc1OC 62a_100000210004_100000210210 [1,1,0,0,0,0|0,1,1]=4 8089 B14R1.476 CCCCSCc1ccccc1OC 62a_100000210211_100000210004 [1,1,0,0,0,0|0,1,1]=4 8090 B14R1.476 CCCNN=Cc1ccccc1OC 4a_100000740057_100000169842 [1,1,0,0,0,0|2,0,0]=4 8091 B14R1.476 CCNCC=Cc1ccccc1OC 270004a_100015525214_100000210733 [1,1,0,0,0,0|2,0,0]=4 8092 B14R1.476 COCCOCc1ccccc1CO 34a_100000210237_100009816955 [1,1,0,0,0,0|1,0,1]=4 8093 B14R1.476 COCCOCc1ccccc1OC 34a_100000210237_100000210004 [1,1,0,0,0,0|1,0,1]=4 8094 B14R1.476 COCCOCc1ccccc1OC 34a_100000211301_100011201679 [1,1,0,0,0,0|1,0,1]=4 8095 B14R1.476 COc1ccccc1COCCCBr 34a_100011217188_100000210004 [1,1,0,0,0,0|1,0,1]=4 8096 B14R1.476 COc1ccccc1COCCCCl 34a_100000230001_100000210004 [1,1,0,0,0,0|1,0,1]=4 8097 B14R1.476 COc1ccccc1COCCCF 34a_100000211301_100011934791 [1,1,0,0,0,0|1,0,1]=4 8098 B14R1.476 COc1ccccc1COCCCF 34a_100000759539_100000210004 [1,1,0,0,0,0|1,0,1]=4 8099 B14R1.476 COc1ccccc1COCCCN 34a_100000182051_100000210004 [1,1,0,0,0,0|1,0,1]=4 8100 B14R1.476 COc1ccccc1COCCCO 34a_100000211301_100000230001 [1,1,0,0,0,0|1,0,1]=4 8101 B14R1.476 COc1ccccc1COCCSC 34a_100000211301_100000212216 [1,1,0,0,0,0|1,0,1]=4 8102 B14R1.476 COc1ccccc1COCCSC 34a_100000230434_100000210004 [1,1,0,0,0,0|1,0,1]=4 8103 B14R1.476 COc1ccccc1COCCSC 7a_100000230434_100000210004 [1,1,0,0,0,0|1,0,1]=4 8104 B14R1.476 CSCCOCc1ccccc1CO 34a_100000230434_100009816955 [1,1,0,0,0,0|1,0,1]=4 8105 B14R1.476 CSCCOCc1ccccc1CO 7a_100000230434_100009816955 [1,1,0,0,0,0|1,0,1]=4 8106 B14R1.476 NCCCOCc1ccccc1CO 34a_100000182051_100009816955 [1,1,0,0,0,0|1,0,1]=4 8107 B14R1.476 OCc1ccccc1COCCCBr 34a_100011217188_100009816955 [1,1,0,0,0,0|1,0,1]=4 8108 B14R1.476 OCc1ccccc1COCCCCl 34a_100000230001_100009816955 [1,1,0,0,0,0|1,0,1]=4 8109 B14R1.476 OCc1ccccc1COCCCF 34a_100000759539_100009816955 [1,1,0,0,0,0|1,0,1]=4 8110 B14R1.598 CCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000210303 [1,1,0,0,0,0|1,0,1]=4 8111 B14R1.598 CCCC(C)CNc1ccccc1O 34a_100000185747_100011216630 [1,1,0,0,0,0|2,0,0]=4 8112 B14R1.598 CCCC(C)CSc1ccccc1O 62a_100000739446_100011216630 [1,1,0,0,0,0|2,0,0]=4 8113 B14R1.598 CCCC(C)CSc1ccccc1O 62a_100011216630_100000739446 [1,1,0,0,0,0|2,0,0]=4 8114 B14R1.598 CCCC(C)NCc1ccccc1O 270004a_100000185550_100000211909 [1,1,0,0,0,0|1,0,1]=4 8115 B14R1.598 CCCC(C)NCc1ccccc1O 34a_100000185550_100000766640 [1,1,0,0,0,0|1,0,1]=4 8116 B14R1.598 CCCC(C)OCc1ccccc1Br 34a_100000756307_100000766640 [1,1,0,0,0,0|1,0,1]=4 8117 B14R1.598 CCCC(C)OCc1ccccc1Br 34a_100000764384_100000184730 [1,1,0,0,0,0|1,0,1]=4 8118 B14R1.598 CCCC(C)OCc1ccccc1Br 7a_100000756307_100000766640 [1,1,0,0,0,0|1,0,1]=4 8119 B14R1.598 CCCC(C)OCc1ccccc1Br 7a_100000764384_100000184730 [1,1,0,0,0,0|1,0,1]=4 8120 B14R1.598 CCCC(C)OCc1ccccc1C 34a_100000698903_100000766640 [1,1,0,0,0,0|1,0,1]=4 8121 B14R1.598 CCCC(C)OCc1ccccc1C 34a_100000764384_100000211839 [1,1,0,0,0,0|1,0,1]=4 8122 B14R1.598 CCCC(C)OCc1ccccc1C 7a_100000698903_100000766640 [1,1,0,0,0,0|1,0,1]=4 8123 B14R1.598 CCCC(C)OCc1ccccc1C 7a_100000764384_100000211839 [1,1,0,0,0,0|1,0,1]=4 8124 B14R1.598 CCCC(C)OCc1ccccc1Cl 34a_100000210847_100000766640 [1,1,0,0,0,0|1,0,1]=4 8125 B14R1.598 CCCC(C)OCc1ccccc1Cl 34a_100000764384_100000187162 [1,1,0,0,0,0|1,0,1]=4 8126 B14R1.598 CCCC(C)OCc1ccccc1Cl 7a_100000210847_100000766640 [1,1,0,0,0,0|1,0,1]=4 8127 B14R1.598 CCCC(C)OCc1ccccc1Cl 7a_100000764384_100000187162 [1,1,0,0,0,0|1,0,1]=4 8128 B14R1.598 CCCC(C)OCc1ccccc1F 34a_100000211962_100000766640 [1,1,0,0,0,0|1,0,1]=4 8129 B14R1.598 CCCC(C)OCc1ccccc1F 34a_100000764384_100000211605 [1,1,0,0,0,0|1,0,1]=4 8130 B14R1.598 CCCC(C)OCc1ccccc1F 7a_100000211962_100000766640 [1,1,0,0,0,0|1,0,1]=4 8131 B14R1.598 CCCC(C)OCc1ccccc1F 7a_100000764384_100000211605 [1,1,0,0,0,0|1,0,1]=4 8132 B14R1.598 CCCC(C)OCc1ccccc1I 34a_100000187465_100000766640 [1,1,0,0,0,0|1,0,1]=4 8133 B14R1.598 CCCC(C)OCc1ccccc1I 34a_100000764384_100011215278 [1,1,0,0,0,0|1,0,1]=4 8134 B14R1.598 CCCC(C)OCc1ccccc1I 7a_100000187465_100000766640 [1,1,0,0,0,0|1,0,1]=4 8135 B14R1.598 CCCC(C)OCc1ccccc1I 7a_100000764384_100011215278 [1,1,0,0,0,0|1,0,1]=4 8136 B14R1.598 CCCC(C)OCc1ccccc1N 34a_100000212039_100000766640 [1,1,0,0,0,0|1,0,1]=4 8137 B14R1.598 CCCC(C)OCc1ncccc1O 34a_100000764384_200020655725 [1,1,0,0,0,0|1,0,1]=4 8138 B14R1.598 CCCC(C)OCc1ncccc1O 7a_100000764384_200020655725 [1,1,0,0,0,0|1,0,1]=4 8139 B14R1.774 CCCCC=Cc1ccc(cc1Br)Br 271570a_100016275911_100011484698 [1,1,0,0,0,0|2,0,0]=4 8140 B14R1.774 CCCCC=Cc1ccc(cc1Br)C 271570a_100016275911_100009813563 [1,1,0,0,0,0|2,0,0]=4 8141 B14R1.774 CCCCC=Cc1ccc(cc1Br)Cl 271570a_100016275911_100011219703 [1,1,0,0,0,0|2,0,0]=4 8142 B14R1.774 CCCCC=Cc1ccc(cc1Br)F 271570a_100016275911_100011217111 [1,1,0,0,0,0|2,0,0]=4 8143 B14R1.774 CCCCC=Cc1ccc(cc1Br)N 271570a_100016275911_100000750458 [1,1,0,0,0,0|2,0,0]=4 8144 B14R1.774 CCCCC=Cc1ccc(cc1Br)O 271570a_100016275911_100000701344 [1,1,0,0,0,0|2,0,0]=4 8145 B14R1.774 CCCCC=Cc1ccc(cc1C)Br 271570a_100016275911_100000701812 [1,1,0,0,0,0|2,0,0]=4 8146 B14R1.774 CCCCC=Cc1ccc(cc1C)C 271570a_100016275911_100011217332 [1,1,0,0,0,0|2,0,0]=4 8147 B14R1.774 CCCCC=Cc1ccc(cc1C)Cl 271570a_100016275911_100011219607 [1,1,0,0,0,0|2,0,0]=4 8148 B14R1.774 CCCCC=Cc1ccc(cc1C)F 271570a_100016275911_100011205405 [1,1,0,0,0,0|2,0,0]=4 8149 B14R1.774 CCCCC=Cc1ccc(cc1C)N 271570a_100016275911_100000210723 [1,1,0,0,0,0|2,0,0]=4 8150 B14R1.774 CCCCC=Cc1ccc(cc1C)O 271570a_100016275911_100000729255 [1,1,0,0,0,0|2,0,0]=4 8151 B14R1.774 CCCCC=Cc1ccc(cc1Cl)Br 271570a_100016275911_100011216062 [1,1,0,0,0,0|2,0,0]=4 8152 B14R1.774 CCCCC=Cc1ccc(cc1Cl)C 271570a_100016275911_100011263221 [1,1,0,0,0,0|2,0,0]=4 8153 B14R1.774 CCCCC=Cc1ccc(cc1Cl)Cl 271570a_100016275911_100000699841 [1,1,0,0,0,0|2,0,0]=4 8154 B14R1.774 CCCCC=Cc1ccc(cc1Cl)F 271570a_100016275911_100000733362 [1,1,0,0,0,0|2,0,0]=4 8155 B14R1.774 CCCCC=Cc1ccc(cc1Cl)N 271570a_100016275911_100000761885 [1,1,0,0,0,0|2,0,0]=4 8156 B14R1.774 CCCCC=Cc1ccc(cc1Cl)O 271570a_100016275911_100000047559 [1,1,0,0,0,0|2,0,0]=4 8157 B14R1.774 CCCCC=Cc1ccc(cc1F)Br 271570a_100016275911_100009814013 [1,1,0,0,0,0|2,0,0]=4 8158 B14R1.774 CCCCC=Cc1ccc(cc1F)C 271570a_100016275911_100011216119 [1,1,0,0,0,0|2,0,0]=4 8159 B14R1.774 CCCCC=Cc1ccc(cc1F)Cl 271570a_100016275911_100011216042 [1,1,0,0,0,0|2,0,0]=4 8160 B14R1.774 CCCCC=Cc1ccc(cc1F)F 271570a_100016275911_100000750030 [1,1,0,0,0,0|2,0,0]=4 8161 B14R1.774 CCCCC=Cc1ccc(cc1F)N 271570a_100016275911_100011356925 [1,1,0,0,0,0|2,0,0]=4 8162 B14R1.774 CCCCC=Cc1ccc(cc1F)O 271570a_100016275911_100000755031 [1,1,0,0,0,0|2,0,0]=4 8163 B14R1.774 CCCCC=Cc1ccc(cc1N)Br 271570a_100016275911_100000743836 [1,1,0,0,0,0|2,0,0]=4 8164 B14R1.774 CCCCC=Cc1ccc(cc1N)C 271570a_100016275911_100011216686 [1,1,0,0,0,0|2,0,0]=4 8165 B14R1.774 CCCCC=Cc1ccc(cc1N)Cl 271570a_100016275911_100000761886 [1,1,0,0,0,0|2,0,0]=4 8166 B14R1.774 CCCCC=Cc1ccc(cc1N)F 271570a_100016275911_100011218093 [1,1,0,0,0,0|2,0,0]=4 8167 B14R1.774 CCCCC=Cc1ccc(cc1N)N 271570a_100016275911_200012175722 [1,1,0,0,0,0|2,0,0]=4 8168 B14R1.774 CCCCC=Cc1ccc(cc1N)O 271570a_100016275911_100011999798 [1,1,0,0,0,0|2,0,0]=4 8169 B14R1.774 CCCCC=Cc1ccc(cc1O)Br 271570a_100016275911_100012344904 [1,1,0,0,0,0|1,0,0]=3 8170 B14R1.774 CCCCC=Cc1ccc(cc1O)C 271570a_100016275911_100012002257 [1,1,0,0,0,0|1,0,0]=3 8171 B14R1.774 CCCCC=Cc1ccc(cc1O)Cl 271570a_100016275911_100000050036 [1,1,0,0,0,0|1,0,0]=3 8172 B14R1.774 CCCCC=Cc1ccc(cc1O)F 271570a_100016275911_100000690578 [1,1,0,0,0,0|1,0,0]=3 8173 B14R1.774 CCCCC=Cc1ccc(cc1O)O 271570a_100016275911_100009813921 [1,1,0,0,0,0|1,0,0]=3 8174 B14R1.774 CCCCC=Cc1ccc(nc1O)C 271570a_100016275911_100009817604 [1,1,0,0,0,0|2,0,0]=4 8175 B14R1.774 CCCCC=Cc1cnc(cc1O)C 271570a_100016275911_100011016184 [1,1,0,0,0,0|2,0,0]=4 8176 B14R1.774 CCCCC=Cc1ncc(cc1O)Br 271570a_100016275911_100010210634 [1,1,0,0,0,0|2,0,0]=4 8177 B14R1.774 CCCCC=Cc1ncc(cc1O)C 271570a_100016275911_100012000487 [1,1,0,0,0,0|2,0,0]=4 8178 B14R1.774 CCCCC=Cc1ncc(cc1O)Cl 271570a_100016275911_100010233512 [1,1,0,0,0,0|2,0,0]=4 8179 B14R1.774 CCCCC=Cc1ncc(cc1O)F 271570a_100016275911_100000079967 [1,1,0,0,0,0|2,0,0]=4 8180 B14R1.774 CCCCCNc1ccc(cc1O)Br 34a_100000739049_100000718602 [1,1,0,0,0,0|2,0,0]=4 8181 B14R1.774 CCCCCNc1ccc(cc1O)C 34a_100000211527_100000718602 [1,1,0,0,0,0|2,0,0]=4 8182 B14R1.774 CCCCCNc1ccc(cc1O)Cl 34a_100000185728_100000718602 [1,1,0,0,0,0|2,0,0]=4 8183 B14R1.774 CCCCCNc1ccc(cc1O)F 34a_100000753323_100000718602 [1,1,0,0,0,0|2,0,0]=4 8184 B14R1.774 CCCCCNc1ccc(cc1O)O 34a_100000106777_100000718602 [1,1,0,0,0,0|2,0,0]=4 8185 B14R1.774 CCCCCSc1ccc(cc1O)Br 62a_100000210326_100012344904 [1,1,0,0,0,0|2,0,0]=4 8186 B14R1.774 CCCCCSc1ccc(cc1O)Br 62a_100012344904_100000210326 [1,1,0,0,0,0|2,0,0]=4 8187 B14R1.774 CCCCCSc1ccc(cc1O)C 62a_100000210326_100012002257 [1,1,0,0,0,0|2,0,0]=4 8188 B14R1.774 CCCCCSc1ccc(cc1O)C 62a_100012002257_100000210326 [1,1,0,0,0,0|2,0,0]=4 8189 B14R1.774 CCCCCSc1ccc(cc1O)Cl 62a_100000050036_100000210326 [1,1,0,0,0,0|2,0,0]=4 8190 B14R1.774 CCCCCSc1ccc(cc1O)Cl 62a_100000210326_100000050036 [1,1,0,0,0,0|2,0,0]=4 8191 B14R1.774 CCCCCSc1ccc(cc1O)F 62a_100000210326_100000690578 [1,1,0,0,0,0|2,0,0]=4 8192 B14R1.774 CCCCCSc1ccc(cc1O)F 62a_100000690578_100000210326 [1,1,0,0,0,0|2,0,0]=4 8193 B14R1.774 CCCCCSc1ccc(cc1O)O 62a_100000210326_100009813921 [1,1,0,0,0,0|2,0,0]=4 8194 B14R1.774 CCCCOCc1ccc(cc1Br)Br 34a_100000210227_200012351560 [1,1,0,0,0,0|1,0,1]=4 8195 B14R1.774 CCCCOCc1ccc(cc1Br)Br 34a_100012357508_100000210210 [1,1,0,0,0,0|1,0,1]=4 8196 B14R1.774 CCCCOCc1ccc(cc1Br)Br 7a_100000210227_200012351560 [1,1,0,0,0,0|1,0,1]=4 8197 B14R1.774 CCCCOCc1ccc(cc1Br)Br 7a_100012357508_100000210211 [1,1,0,0,0,0|1,0,1]=4 8198 B14R1.774 CCCCOCc1ccc(cc1Br)Cl 34a_100000210227_100000755608 [1,1,0,0,0,0|1,0,1]=4 8199 B14R1.774 CCCCOCc1ccc(cc1Br)Cl 34a_100000707881_100000210210 [1,1,0,0,0,0|1,0,1]=4 8200 B14R1.774 CCCCOCc1ccc(cc1Br)Cl 7a_100000210227_100000755608 [1,1,0,0,0,0|1,0,1]=4 8201 B14R1.774 CCCCOCc1ccc(cc1Br)Cl 7a_100000707881_100000210211 [1,1,0,0,0,0|1,0,1]=4 8202 B14R1.774 CCCCOCc1ccc(cc1Br)F 34a_100000210227_100000243222 [1,1,0,0,0,0|1,0,1]=4 8203 B14R1.774 CCCCOCc1ccc(cc1Br)F 34a_100000744086_100000210210 [1,1,0,0,0,0|1,0,1]=4 8204 B14R1.774 CCCCOCc1ccc(cc1Br)F 7a_100000210227_100000243222 [1,1,0,0,0,0|1,0,1]=4 8205 B14R1.774 CCCCOCc1ccc(cc1Br)F 7a_100000744086_100000210211 [1,1,0,0,0,0|1,0,1]=4 8206 B14R1.774 CCCCOCc1ccc(cc1Br)I 34a_100000210227_100010146610 [1,1,0,0,0,0|1,0,1]=4 8207 B14R1.774 CCCCOCc1ccc(cc1Br)I 7a_100000210227_100010146610 [1,1,0,0,0,0|1,0,1]=4 8208 B14R1.774 CCCCOCc1ccc(cc1Br)I 7a_100010240206_100000210211 [1,1,0,0,0,0|1,0,1]=4 8209 B14R1.774 CCCCOCc1ccc(cc1C)Br 34a_100000210227_100000708836 [1,1,0,0,0,0|1,0,1]=4 8210 B14R1.774 CCCCOCc1ccc(cc1C)Br 34a_100000748258_100000210210 [1,1,0,0,0,0|1,0,1]=4 8211 B14R1.774 CCCCOCc1ccc(cc1C)Br 7a_100000210227_100000708836 [1,1,0,0,0,0|1,0,1]=4 8212 B14R1.774 CCCCOCc1ccc(cc1C)Br 7a_100000748258_100000210211 [1,1,0,0,0,0|1,0,1]=4 8213 B14R1.774 CCCCOCc1ccc(cc1C)C 34a_100000210227_100011219618 [1,1,0,0,0,0|1,0,1]=4 8214 B14R1.774 CCCCOCc1ccc(cc1C)C 34a_100011215341_100000210210 [1,1,0,0,0,0|1,0,1]=4 8215 B14R1.774 CCCCOCc1ccc(cc1C)C 7a_100000210227_100011219618 [1,1,0,0,0,0|1,0,1]=4 8216 B14R1.774 CCCCOCc1ccc(cc1C)C 7a_100011215341_100000210211 [1,1,0,0,0,0|1,0,1]=4 8217 B14R1.774 CCCCOCc1ccc(cc1C)Cl 34a_100000210227_100012361307 [1,1,0,0,0,0|1,0,1]=4 8218 B14R1.774 CCCCOCc1ccc(cc1C)Cl 34a_100000702939_100000210210 [1,1,0,0,0,0|1,0,1]=4 8219 B14R1.774 CCCCOCc1ccc(cc1C)Cl 7a_100000210227_100012361307 [1,1,0,0,0,0|1,0,1]=4 8220 B14R1.774 CCCCOCc1ccc(cc1C)Cl 7a_100000702939_100000210211 [1,1,0,0,0,0|1,0,1]=4 8221 B14R1.774 CCCCOCc1ccc(cc1C)F 34a_100000210227_100000700533 [1,1,0,0,0,0|1,0,1]=4 8222 B14R1.774 CCCCOCc1ccc(cc1C)F 34a_100000700136_100000210210 [1,1,0,0,0,0|1,0,1]=4 8223 B14R1.774 CCCCOCc1ccc(cc1C)F 7a_100000210227_100000700533 [1,1,0,0,0,0|1,0,1]=4 8224 B14R1.774 CCCCOCc1ccc(cc1C)F 7a_100000700136_100000210211 [1,1,0,0,0,0|1,0,1]=4 8225 B14R1.774 CCCCOCc1ccc(cc1C)N 34a_100000102464_100000210210 [1,1,0,0,0,0|1,0,1]=4 8226 B14R1.774 CCCCOCc1ccc(cc1C)N 7a_100000102464_100000210211 [1,1,0,0,0,0|1,0,1]=4 8227 B14R1.774 CCCCOCc1ccc(cc1Cl)Br 34a_100000210227_100011740631 [1,1,0,0,0,0|1,0,1]=4 8228 B14R1.774 CCCCOCc1ccc(cc1Cl)Br 34a_100000756401_100000210210 [1,1,0,0,0,0|1,0,1]=4 8229 B14R1.774 CCCCOCc1ccc(cc1Cl)Br 7a_100000210227_100011740631 [1,1,0,0,0,0|1,0,1]=4 8230 B14R1.774 CCCCOCc1ccc(cc1Cl)Br 7a_100000756401_100000210211 [1,1,0,0,0,0|1,0,1]=4 8231 B14R1.774 CCCCOCc1ccc(cc1Cl)C 34a_100000210227_100012349684 [1,1,0,0,0,0|1,0,1]=4 8232 B14R1.774 CCCCOCc1ccc(cc1Cl)C 34a_100000720314_100000210210 [1,1,0,0,0,0|1,0,1]=4 8233 B14R1.774 CCCCOCc1ccc(cc1Cl)C 7a_100000210227_100012349684 [1,1,0,0,0,0|1,0,1]=4 8234 B14R1.774 CCCCOCc1ccc(cc1Cl)C 7a_100000720314_100000210211 [1,1,0,0,0,0|1,0,1]=4 8235 B14R1.774 CCCCOCc1ccc(cc1Cl)Cl 34a_100000210227_100000188473 [1,1,0,0,0,0|1,0,1]=4 8236 B14R1.774 CCCCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000210210 [1,1,0,0,0,0|1,0,1]=4 8237 B14R1.774 CCCCOCc1ccc(cc1Cl)Cl 7a_100000210227_100000188473 [1,1,0,0,0,0|1,0,1]=4 8238 B14R1.774 CCCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000210211 [1,1,0,0,0,0|1,0,1]=4 8239 B14R1.774 CCCCOCc1ccc(cc1Cl)F 34a_100000210227_100011216360 [1,1,0,0,0,0|1,0,1]=4 8240 B14R1.774 CCCCOCc1ccc(cc1Cl)F 34a_100011219954_100000210210 [1,1,0,0,0,0|1,0,1]=4 8241 B14R1.774 CCCCOCc1ccc(cc1Cl)F 7a_100000210227_100011216360 [1,1,0,0,0,0|1,0,1]=4 8242 B14R1.774 CCCCOCc1ccc(cc1Cl)F 7a_100011219954_100000210211 [1,1,0,0,0,0|1,0,1]=4 8243 B14R1.774 CCCCOCc1ccc(cc1Cl)N 34a_100000689119_100000210210 [1,1,0,0,0,0|1,0,1]=4 8244 B14R1.774 CCCCOCc1ccc(cc1F)Br 34a_100000210227_100000211606 [1,1,0,0,0,0|1,0,1]=4 8245 B14R1.774 CCCCOCc1ccc(cc1F)Br 34a_100011191541_100000210210 [1,1,0,0,0,0|1,0,1]=4 8246 B14R1.774 CCCCOCc1ccc(cc1F)Br 7a_100000210227_100000211606 [1,1,0,0,0,0|1,0,1]=4 8247 B14R1.774 CCCCOCc1ccc(cc1F)Br 7a_100011191541_100000210211 [1,1,0,0,0,0|1,0,1]=4 8248 B14R1.774 CCCCOCc1ccc(cc1F)C 34a_100000210227_100012002367 [1,1,0,0,0,0|1,0,1]=4 8249 B14R1.774 CCCCOCc1ccc(cc1F)C 34a_100011216587_100000210210 [1,1,0,0,0,0|1,0,1]=4 8250 B14R1.774 CCCCOCc1ccc(cc1F)C 7a_100000210227_100012002367 [1,1,0,0,0,0|1,0,1]=4 8251 B14R1.774 CCCCOCc1ccc(cc1F)C 7a_100011216587_100000210211 [1,1,0,0,0,0|1,0,1]=4 8252 B14R1.774 CCCCOCc1ccc(cc1F)Cl 34a_100000210227_100000709361 [1,1,0,0,0,0|1,0,1]=4 8253 B14R1.774 CCCCOCc1ccc(cc1F)Cl 34a_100011217562_100000210210 [1,1,0,0,0,0|1,0,1]=4 8254 B14R1.774 CCCCOCc1ccc(cc1F)Cl 7a_100000210227_100000709361 [1,1,0,0,0,0|1,0,1]=4 8255 B14R1.774 CCCCOCc1ccc(cc1F)Cl 7a_100011217562_100000210211 [1,1,0,0,0,0|1,0,1]=4 8256 B14R1.774 CCCCOCc1ccc(cc1F)F 34a_100000210227_100000748237 [1,1,0,0,0,0|1,0,1]=4 8257 B14R1.774 CCCCOCc1ccc(cc1F)F 34a_100011215441_100000210210 [1,1,0,0,0,0|1,0,1]=4 8258 B14R1.774 CCCCOCc1ccc(cc1F)F 7a_100000210227_100000748237 [1,1,0,0,0,0|1,0,1]=4 8259 B14R1.774 CCCCOCc1ccc(cc1F)F 7a_100011215441_100000210211 [1,1,0,0,0,0|1,0,1]=4 8260 B14R1.774 CCCCOCc1ccc(cc1F)I 34a_100000210227_100010244991 [1,1,0,0,0,0|1,0,1]=4 8261 B14R1.774 CCCCOCc1ccc(cc1F)I 34a_200010202041_100000210210 [1,1,0,0,0,0|1,0,1]=4 8262 B14R1.774 CCCCOCc1ccc(cc1F)I 7a_100000210227_100010244991 [1,1,0,0,0,0|1,0,1]=4 8263 B14R1.774 CCCCOCc1ccc(cc1F)I 7a_200010202041_100000210211 [1,1,0,0,0,0|1,0,1]=4 8264 B14R1.774 CCCCOCc1ccc(cc1I)Br 34a_100000210227_100010146615 [1,1,0,0,0,0|1,0,1]=4 8265 B14R1.774 CCCCOCc1ccc(cc1I)Br 7a_100000210227_100010146615 [1,1,0,0,0,0|1,0,1]=4 8266 B14R1.774 CCCCOCc1ccc(cc1I)Br 7a_100010146605_100000210211 [1,1,0,0,0,0|1,0,1]=4 8267 B14R1.774 CCCCOCc1ccc(cc1I)Cl 34a_100000210227_100010254388 [1,1,0,0,0,0|1,0,1]=4 8268 B14R1.774 CCCCOCc1ccc(cc1I)Cl 34a_100000722340_100000210210 [1,1,0,0,0,0|1,0,1]=4 8269 B14R1.774 CCCCOCc1ccc(cc1I)Cl 7a_100000210227_100010254388 [1,1,0,0,0,0|1,0,1]=4 8270 B14R1.774 CCCCOCc1ccc(cc1I)Cl 7a_100000722340_100000210211 [1,1,0,0,0,0|1,0,1]=4 8271 B14R1.774 CCCCOCc1ccc(cc1I)F 34a_100000210227_100012354799 [1,1,0,0,0,0|1,0,1]=4 8272 B14R1.774 CCCCOCc1ccc(cc1I)F 34a_100011356828_100000210210 [1,1,0,0,0,0|1,0,1]=4 8273 B14R1.774 CCCCOCc1ccc(cc1I)F 7a_100000210227_100012354799 [1,1,0,0,0,0|1,0,1]=4 8274 B14R1.774 CCCCOCc1ccc(cc1I)F 7a_100011356828_100000210211 [1,1,0,0,0,0|1,0,1]=4 8275 B14R1.774 CCCCOCc1ccc(cc1N)Br 34a_100000718831_100000210210 [1,1,0,0,0,0|1,0,1]=4 8276 B14R1.774 CCCCOCc1ccc(cc1N)Br 7a_100000718831_100000210211 [1,1,0,0,0,0|1,0,1]=4 8277 B14R1.774 CCCCOCc1ccc(cc1N)C 34a_100000087799_100000210210 [1,1,0,0,0,0|1,0,1]=4 8278 B14R1.774 CCCCOCc1ccc(cc1N)C 7a_100000087799_100000210211 [1,1,0,0,0,0|1,0,1]=4 8279 B14R1.774 CCCCOCc1ccc(cc1N)Cl 34a_100000238622_100000210210 [1,1,0,0,0,0|1,0,1]=4 8280 B14R1.774 CCCCOCc1ccc(cc1N)Cl 7a_100000238622_100000210211 [1,1,0,0,0,0|1,0,1]=4 8281 B14R1.774 CCCCOCc1ccc(cc1N)F 34a_100011996588_100000210210 [1,1,0,0,0,0|1,0,1]=4 8282 B14R1.774 CCCNN=Cc1ccc(cc1O)Br 4a_100000740057_100011277552 [1,1,0,0,0,0|2,0,0]=4 8283 B14R1.774 CCCNN=Cc1ccc(cc1O)C 4a_100000740057_100000050924 [1,1,0,0,0,0|2,0,0]=4 8284 B14R1.774 CCCNN=Cc1ccc(cc1O)Cl 4a_100000740057_100011243810 [1,1,0,0,0,0|2,0,0]=4 8285 B14R1.774 CCCNN=Cc1ccc(cc1O)F 4a_100000740057_100000038406 [1,1,0,0,0,0|2,0,0]=4 8286 B14R1.774 CCCNN=Cc1ccc(cc1O)I 4a_100000740057_100000050530 [1,1,0,0,0,0|2,0,0]=4 8287 B14R1.774 CCCNN=Cc1ccc(cc1O)O 4a_100000740057_100000212098 [1,1,0,0,0,0|2,0,0]=4 8288 B14R1.837 CCC(C)CNCc1ccccc1O 270004a_100000185550_100000243153 [1,1,0,0,0,0|1,0,1]=4 8289 B14R1.837 CCC(C)CNCc1ccccc1O 34a_100000185550_100000748023 [1,1,0,0,0,0|1,0,1]=4 8290 B14R1.837 CCC(C)COCc1ccccc1Br 34a_100000756307_100000748023 [1,1,0,0,0,0|1,0,1]=4 8291 B14R1.837 CCC(C)COCc1ccccc1Br 7a_100000756307_100000748023 [1,1,0,0,0,0|1,0,1]=4 8292 B14R1.837 CCC(C)COCc1ccccc1C 34a_100000698903_100000748023 [1,1,0,0,0,0|1,0,1]=4 8293 B14R1.837 CCC(C)COCc1ccccc1C 7a_100000698903_100000748023 [1,1,0,0,0,0|1,0,1]=4 8294 B14R1.837 CCC(C)COCc1ccccc1Cl 34a_100000210847_100000748023 [1,1,0,0,0,0|1,0,1]=4 8295 B14R1.837 CCC(C)COCc1ccccc1Cl 7a_100000210847_100000748023 [1,1,0,0,0,0|1,0,1]=4 8296 B14R1.837 CCC(C)COCc1ccccc1F 34a_100000211962_100000748023 [1,1,0,0,0,0|1,0,1]=4 8297 B14R1.837 CCC(C)COCc1ccccc1F 7a_100000211962_100000748023 [1,1,0,0,0,0|1,0,1]=4 8298 B14R1.837 CCC(C)COCc1ccccc1I 34a_100000187465_100000748023 [1,1,0,0,0,0|1,0,1]=4 8299 B14R1.837 CCC(C)COCc1ccccc1I 7a_100000187465_100000748023 [1,1,0,0,0,0|1,0,1]=4 8300 B14R1.837 CCC(C)COCc1ccccc1N 34a_100000212039_100000748023 [1,1,0,0,0,0|1,0,1]=4 8301 B14R1.837 CCC(C)NN=Cc1ccccc1O 4a_100000718999_100000185834 [1,1,0,0,0,0|2,0,0]=4 8302 B14R1.837 CCC(O)CNCc1ccccc1O 34a_100000185550_100011218378 [1,1,0,0,0,0|1,0,1]=4 8303 B14R1.837 CCC(O)COCc1ccccc1Br 34a_100000756307_100011218378 [1,1,0,0,0,0|1,0,1]=4 8304 B14R1.837 CCC(O)COCc1ccccc1Br 7a_100000756307_100011218378 [1,1,0,0,0,0|1,0,1]=4 8305 B14R1.837 CCC(O)COCc1ccccc1C 34a_100000698903_100011218378 [1,1,0,0,0,0|1,0,1]=4 8306 B14R1.837 CCC(O)COCc1ccccc1C 7a_100000698903_100011218378 [1,1,0,0,0,0|1,0,1]=4 8307 B14R1.837 CCC(O)COCc1ccccc1Cl 34a_100000210847_100011218378 [1,1,0,0,0,0|1,0,1]=4 8308 B14R1.837 CCC(O)COCc1ccccc1Cl 7a_100000210847_100011218378 [1,1,0,0,0,0|1,0,1]=4 8309 B14R1.837 CCC(O)COCc1ccccc1F 34a_100000211962_100011218378 [1,1,0,0,0,0|1,0,1]=4 8310 B14R1.837 CCC(O)COCc1ccccc1F 7a_100000211962_100011218378 [1,1,0,0,0,0|1,0,1]=4 8311 B14R1.837 CCC(O)COCc1ccccc1I 34a_100000187465_100011218378 [1,1,0,0,0,0|1,0,1]=4 8312 B14R1.837 CCC(O)COCc1ccccc1I 7a_100000187465_100011218378 [1,1,0,0,0,0|1,0,1]=4 8313 B14R1.837 CCC(O)COCc1ccccc1N 34a_100000212039_100011218378 [1,1,0,0,0,0|1,0,1]=4 8314 B14R1.837 CC[C@H](C)CNCc1ccccc1O 34a_100000185550_100009816398 [1,1,0,0,0,0|1,0,1]=4 8315 B14R1.837 CC[C@H](C)COCc1ccccc1Br 34a_100000756307_100009816398 [1,1,0,0,0,0|1,0,1]=4 8316 B14R1.837 CC[C@H](C)COCc1ccccc1Br 7a_100000756307_100009816398 [1,1,0,0,0,0|1,0,1]=4 8317 B14R1.837 CC[C@H](C)COCc1ccccc1Br 7a_100009816381_100000184730 [1,1,0,0,0,0|1,0,1]=4 8318 B14R1.837 CC[C@H](C)COCc1ccccc1C 34a_100000698903_100009816398 [1,1,0,0,0,0|1,0,1]=4 8319 B14R1.837 CC[C@H](C)COCc1ccccc1C 7a_100000698903_100009816398 [1,1,0,0,0,0|1,0,1]=4 8320 B14R1.837 CC[C@H](C)COCc1ccccc1C 7a_100009816381_100000211839 [1,1,0,0,0,0|1,0,1]=4 8321 B14R1.837 CC[C@H](C)COCc1ccccc1Cl 34a_100000210847_100009816398 [1,1,0,0,0,0|1,0,1]=4 8322 B14R1.837 CC[C@H](C)COCc1ccccc1Cl 7a_100000210847_100009816398 [1,1,0,0,0,0|1,0,1]=4 8323 B14R1.837 CC[C@H](C)COCc1ccccc1Cl 7a_100009816381_100000187162 [1,1,0,0,0,0|1,0,1]=4 8324 B14R1.837 CC[C@H](C)COCc1ccccc1F 34a_100000211962_100009816398 [1,1,0,0,0,0|1,0,1]=4 8325 B14R1.837 CC[C@H](C)COCc1ccccc1F 7a_100000211962_100009816398 [1,1,0,0,0,0|1,0,1]=4 8326 B14R1.837 CC[C@H](C)COCc1ccccc1F 7a_100009816381_100000211605 [1,1,0,0,0,0|1,0,1]=4 8327 B14R1.837 CC[C@H](C)COCc1ccccc1I 34a_100000187465_100009816398 [1,1,0,0,0,0|1,0,1]=4 8328 B14R1.837 CC[C@H](C)COCc1ccccc1I 7a_100000187465_100009816398 [1,1,0,0,0,0|1,0,1]=4 8329 B14R1.837 CC[C@H](C)COCc1ccccc1I 7a_100009816381_100011215278 [1,1,0,0,0,0|1,0,1]=4 8330 B14R1.837 CC[C@H](C)COCc1ccccc1N 34a_100000212039_100009816398 [1,1,0,0,0,0|1,0,1]=4 8331 B14R1.837 CC[C@H](C)COCc1ncccc1O 7a_100009816381_200020655725 [1,1,0,0,0,0|1,0,1]=4 8332 B14R1.882 BrCCCCOCc1ccccc1Br 34a_100011216708_100000184730 [1,1,0,0,0,0|1,0,1]=4 8333 B14R1.882 BrCCCCOCc1ccccc1I 34a_100011216708_100011215278 [1,1,0,0,0,0|1,0,1]=4 8334 B14R1.882 Brc1ccccc1COCCCCI 34a_200012148704_100000184730 [1,1,0,0,0,0|1,0,1]=4 8335 B14R1.882 CCCCCC=Cc1ccccc1Br 271570a_100000062253_100000695589 [1,1,0,0,0,0|2,0,0]=4 8336 B14R1.882 CCCCCC=Cc1ccccc1C 271570a_100000062253_100000210755 [1,1,0,0,0,0|2,0,0]=4 8337 B14R1.882 CCCCCC=Cc1ccccc1Cl 271570a_100000062253_100000764095 [1,1,0,0,0,0|2,0,0]=4 8338 B14R1.882 CCCCCC=Cc1ccccc1F 271570a_100000062253_100011215700 [1,1,0,0,0,0|2,0,0]=4 8339 B14R1.882 CCCCCC=Cc1ccccc1N 271570a_100000062253_100000210017 [1,1,0,0,0,0|2,0,0]=4 8340 B14R1.882 CCCCCC=Cc1ccccc1O 271570a_100000062253_100000739446 [1,1,0,0,0,0|1,0,0]=3 8341 B14R1.882 CCCCCC=Cc1ccncc1O 271570a_100000062253_100009817591 [1,1,0,0,0,0|2,0,0]=4 8342 B14R1.882 CCCCCC=Cc1ncccc1O 271570a_100000062253_100000034122 [1,1,0,0,0,0|2,0,0]=4 8343 B14R1.882 CCCCCCNc1ccccc1O 34a_100000185747_100000210314 [1,1,0,0,0,0|1,0,1]=4 8344 B14R1.882 CCCCCCSc1ccccc1O 62a_100000210314_100000739446 [1,1,0,0,0,0|1,0,1]=4 8345 B14R1.882 CCCCCCSc1ccccc1O 62a_100000739446_100000210757 [1,1,0,0,0,0|1,0,1]=4 8346 B14R1.882 CCCCCNCc1ccccc1O 34a_100000185550_100000718602 [1,1,0,0,0,0|1,0,1]=4 8347 B14R1.882 CCCCCOCc1ccccc1Br 34a_100000210253_100000184730 [1,1,0,0,0,0|1,0,1]=4 8348 B14R1.882 CCCCCOCc1ccccc1Br 34a_100000756307_100000718602 [1,1,0,0,0,0|1,0,1]=4 8349 B14R1.882 CCCCCOCc1ccccc1Br 7a_100000210253_100000184730 [1,1,0,0,0,0|1,0,1]=4 8350 B14R1.882 CCCCCOCc1ccccc1Br 7a_100000756307_100000210326 [1,1,0,0,0,0|1,0,1]=4 8351 B14R1.882 CCCCCOCc1ccccc1C 34a_100000210253_100000211839 [1,1,0,0,0,0|1,0,1]=4 8352 B14R1.882 CCCCCOCc1ccccc1C 34a_100000698903_100000718602 [1,1,0,0,0,0|1,0,1]=4 8353 B14R1.882 CCCCCOCc1ccccc1C 7a_100000210253_100000211839 [1,1,0,0,0,0|1,0,1]=4 8354 B14R1.882 CCCCCOCc1ccccc1C 7a_100000698903_100000210326 [1,1,0,0,0,0|1,0,1]=4 8355 B14R1.882 CCCCCOCc1ccccc1Cl 34a_100000210253_100000187162 [1,1,0,0,0,0|1,0,1]=4 8356 B14R1.882 CCCCCOCc1ccccc1Cl 34a_100000210847_100000718602 [1,1,0,0,0,0|1,0,1]=4 8357 B14R1.882 CCCCCOCc1ccccc1Cl 7a_100000210253_100000187162 [1,1,0,0,0,0|1,0,1]=4 8358 B14R1.882 CCCCCOCc1ccccc1Cl 7a_100000210847_100000210326 [1,1,0,0,0,0|1,0,1]=4 8359 B14R1.882 CCCCCOCc1ccccc1F 34a_100000210253_100000211605 [1,1,0,0,0,0|1,0,1]=4 8360 B14R1.882 CCCCCOCc1ccccc1F 34a_100000211962_100000718602 [1,1,0,0,0,0|1,0,1]=4 8361 B14R1.882 CCCCCOCc1ccccc1F 7a_100000210253_100000211605 [1,1,0,0,0,0|1,0,1]=4 8362 B14R1.882 CCCCCOCc1ccccc1F 7a_100000211962_100000210326 [1,1,0,0,0,0|1,0,1]=4 8363 B14R1.882 CCCCCOCc1ccccc1I 34a_100000187465_100000718602 [1,1,0,0,0,0|1,0,1]=4 8364 B14R1.882 CCCCCOCc1ccccc1I 34a_100000210253_100011215278 [1,1,0,0,0,0|1,0,1]=4 8365 B14R1.882 CCCCCOCc1ccccc1I 7a_100000187465_100000210326 [1,1,0,0,0,0|1,0,1]=4 8366 B14R1.882 CCCCCOCc1ccccc1I 7a_100000210253_100011215278 [1,1,0,0,0,0|1,0,1]=4 8367 B14R1.882 CCCCCOCc1ccccc1N 34a_100000212039_100000718602 [1,1,0,0,0,0|1,0,1]=4 8368 B14R1.882 CCCCCOCc1ncccc1O 34a_100000210253_200020655725 [1,1,0,0,0,0|1,0,1]=4 8369 B14R1.882 CCCCCOCc1ncccc1O 7a_100000210253_200020655725 [1,1,0,0,0,0|1,0,1]=4 8370 B14R1.882 CCCCNCCc1ccccc1O 34a_100011207237_100000210210 [1,1,0,0,0,0|1,0,1]=4 8371 B14R1.882 CCCCNCCc1ccccc1O 7a_106832991798_100000722297 [1,1,0,0,0,0|1,0,1]=4 8372 B14R1.882 CCCCNN=Cc1ccccc1Br 4a_100025702795_100000211189 [1,1,0,0,0,0|2,0,0]=4 8373 B14R1.882 CCCCNN=Cc1ccccc1C 4a_100025702795_100000211143 [1,1,0,0,0,0|2,0,0]=4 8374 B14R1.882 CCCCNN=Cc1ccccc1Cl 4a_100025702795_100000210073 [1,1,0,0,0,0|2,0,0]=4 8375 B14R1.882 CCCCNN=Cc1ccccc1F 4a_100025702795_100000210811 [1,1,0,0,0,0|2,0,0]=4 8376 B14R1.882 CCCCNN=Cc1ccccc1I 4a_100025702795_100000010305 [1,1,0,0,0,0|2,0,0]=4 8377 B14R1.882 CCCCNN=Cc1ccccc1O 4a_100025702795_100000185834 [1,1,0,0,0,0|1,0,0]=3 8378 B14R1.882 CCCCNN=Cc1cccnc1O 4a_100025702795_100011998315 [1,1,0,0,0,0|2,0,0]=4 8379 B14R1.882 CCCCNN=Cc1ccncc1O 4a_100025702795_100000077405 [1,1,0,0,0,0|2,0,0]=4 8380 B14R1.882 CCCCNN=Cc1ncccc1O 4a_100025702795_100000042352 [1,1,0,0,0,0|2,0,0]=4 8381 B14R1.882 CCCCOCCc1ccccc1Br 34a_100000210227_100012161201 [1,1,0,0,0,0|1,0,1]=4 8382 B14R1.882 CCCCOCCc1ccccc1Br 34a_100000731337_100000210210 [1,1,0,0,0,0|1,0,1]=4 8383 B14R1.882 CCCCOCCc1ccccc1Br 7a_100000210227_100012161201 [1,1,0,0,0,0|1,0,1]=4 8384 B14R1.882 CCCCOCCc1ccccc1Br 7a_100000731337_100000210211 [1,1,0,0,0,0|1,0,1]=4 8385 B14R1.882 CCCCOCCc1ccccc1C 34a_100000210227_100011713688 [1,1,0,0,0,0|1,0,1]=4 8386 B14R1.882 CCCCOCCc1ccccc1C 34a_100011220023_100000210210 [1,1,0,0,0,0|1,0,1]=4 8387 B14R1.882 CCCCOCCc1ccccc1C 7a_100000210227_100011713688 [1,1,0,0,0,0|1,0,1]=4 8388 B14R1.882 CCCCOCCc1ccccc1C 7a_100011220023_100000210211 [1,1,0,0,0,0|1,0,1]=4 8389 B14R1.882 CCCCOCCc1ccccc1Cl 34a_100000210227_100011713703 [1,1,0,0,0,0|1,0,1]=4 8390 B14R1.882 CCCCOCCc1ccccc1Cl 34a_100011215284_100000210210 [1,1,0,0,0,0|1,0,1]=4 8391 B14R1.882 CCCCOCCc1ccccc1Cl 7a_100000210227_100011713703 [1,1,0,0,0,0|1,0,1]=4 8392 B14R1.882 CCCCOCCc1ccccc1Cl 7a_100011215284_100000210211 [1,1,0,0,0,0|1,0,1]=4 8393 B14R1.882 CCCCOCCc1ccccc1F 34a_100000210227_100000720011 [1,1,0,0,0,0|1,0,1]=4 8394 B14R1.882 CCCCOCCc1ccccc1F 34a_100000753711_100000210210 [1,1,0,0,0,0|1,0,1]=4 8395 B14R1.882 CCCCOCCc1ccccc1F 7a_100000210227_100000720011 [1,1,0,0,0,0|1,0,1]=4 8396 B14R1.882 CCCCOCCc1ccccc1F 7a_100000753711_100000210211 [1,1,0,0,0,0|1,0,1]=4 8397 B14R1.882 CCCCOCCc1ccccc1I 34a_100010255290_100000210210 [1,1,0,0,0,0|1,0,1]=4 8398 B14R1.882 CCCCOCCc1ccccc1I 7a_100010255290_100000210211 [1,1,0,0,0,0|1,0,1]=4 8399 B14R1.882 CCCCOCCc1ccccc1N 34a_100011215289_100000210210 [1,1,0,0,0,0|1,0,1]=4 8400 B14R1.882 CCCCOCCc1ccccc1O 34a_100000210227_100000722297 [1,1,0,0,0,0|0,0,1]=3 8401 B14R1.882 CCCCOCCc1ccccc1O 7a_100000210227_100000722297 [1,1,0,0,0,0|0,0,1]=3 8402 B14R1.882 CCCCOCNc1ccccc1Br 34a_100000210017_100011995733 [1,1,0,0,0,0|1,0,1]=4 8403 B14R1.882 CCCCOCNc1ccccc1C 34a_100015192222_100011995733 [1,1,0,0,0,0|1,0,1]=4 8404 B14R1.882 CCCCOCNc1ccccc1Cl 34a_100000185783_100011995733 [1,1,0,0,0,0|1,0,1]=4 8405 B14R1.882 CCCCOCNc1ccccc1F 34a_100000210422_100011995733 [1,1,0,0,0,0|1,0,1]=4 8406 B14R1.882 CCCCOCNc1ccccc1I 34a_100000210053_100011995733 [1,1,0,0,0,0|1,0,1]=4 8407 B14R1.882 CCCCOCNc1ccccc1O 34a_100000185747_100011995733 [1,1,0,0,0,0|0,0,1]=3 8408 B14R1.882 CCCCOCOc1ccccc1Br 34a_100000181306_100011995733 [1,1,0,0,0,0|1,0,1]=4 8409 B14R1.882 CCCCOCOc1ccccc1C 34a_100000210338_100011995733 [1,1,0,0,0,0|1,0,1]=4 8410 B14R1.882 CCCCOCOc1ccccc1Cl 34a_100000210172_100011995733 [1,1,0,0,0,0|1,0,1]=4 8411 B14R1.882 CCCCOCOc1ccccc1F 34a_100000210171_100011995733 [1,1,0,0,0,0|1,0,1]=4 8412 B14R1.882 CCCCOCOc1ccccc1I 34a_100000739446_100011995733 [1,1,0,0,0,0|1,0,1]=4 8413 B14R1.882 CCCCOCOc1ccccc1N 34a_100000185747_100011995733 [1,1,0,0,0,0|1,0,1]=4 8414 B14R1.882 CCCCOCSc1ccccc1Br 62a_100000695589_100011995733 [1,1,0,0,0,0|1,0,1]=4 8415 B14R1.882 CCCCOCSc1ccccc1Br 62a_100011995733_100000695589 [1,1,0,0,0,0|1,0,1]=4 8416 B14R1.882 CCCCOCSc1ccccc1C 62a_100000210755_100011995733 [1,1,0,0,0,0|1,0,1]=4 8417 B14R1.882 CCCCOCSc1ccccc1C 62a_100011995733_100000210755 [1,1,0,0,0,0|1,0,1]=4 8418 B14R1.882 CCCCOCSc1ccccc1Cl 62a_100000764095_100011995733 [1,1,0,0,0,0|1,0,1]=4 8419 B14R1.882 CCCCOCSc1ccccc1Cl 62a_100011995733_100000764095 [1,1,0,0,0,0|1,0,1]=4 8420 B14R1.882 CCCCOCSc1ccccc1F 62a_100011215700_100011995733 [1,1,0,0,0,0|1,0,1]=4 8421 B14R1.882 CCCCOCSc1ccccc1F 62a_100011995733_100011215700 [1,1,0,0,0,0|1,0,1]=4 8422 B14R1.882 CCCCOCSc1ccccc1N 62a_100000210017_100011995733 [1,1,0,0,0,0|1,0,1]=4 8423 B14R1.882 CCCCOCSc1ccccc1N 62a_100011995733_100000210017 [1,1,0,0,0,0|1,0,1]=4 8424 B14R1.882 CCCCOCSc1ccccc1O 62a_100000739446_100011995733 [1,1,0,0,0,0|0,0,1]=3 8425 B14R1.882 CCCCOCSc1ccccc1O 62a_100011995733_100000739446 [1,1,0,0,0,0|0,0,1]=3 8426 B14R1.882 CCCCOCSc1cccnc1O 62a_100000760158_100011995733 [1,1,0,0,0,0|1,0,1]=4 8427 B14R1.882 CCCCOCSc1cccnc1O 62a_100011995733_100000760158 [1,1,0,0,0,0|1,0,1]=4 8428 B14R1.882 CCCCOCSc1ccncc1O 62a_100009817591_100011995733 [1,1,0,0,0,0|1,0,1]=4 8429 B14R1.882 CCCCOCSc1ccncc1O 62a_100011995733_100009817591 [1,1,0,0,0,0|1,0,1]=4 8430 B14R1.882 CCCCOCSc1ncccc1O 62a_100000034122_100011995733 [1,1,0,0,0,0|1,0,1]=4 8431 B14R1.882 CCCCOCSc1ncccc1O 62a_100011995733_100000034122 [1,1,0,0,0,0|1,0,1]=4 8432 B14R1.882 CCCCSCCc1ccccc1O 62a_100000210211_100000722297 [1,1,0,0,0,0|0,1,1]=4 8433 B14R1.882 CCCCSCCc1ccccc1O 62a_100000722297_100000210210 [1,1,0,0,0,0|0,1,1]=4 8434 B14R1.882 CCCNCC=Cc1ccccc1Br 270004a_100020643023_200016268969 [1,1,0,0,0,0|2,0,0]=4 8435 B14R1.882 CCCNCC=Cc1ccccc1Cl 270004a_100020643023_200102525841 [1,1,0,0,0,0|2,0,0]=4 8436 B14R1.882 CCCNCC=Cc1ccccc1F 270004a_100020643023_200102525844 [1,1,0,0,0,0|2,0,0]=4 8437 B14R1.882 CCCOCCNc1ccccc1O 34a_100000185747_100011215938 [1,1,0,0,0,0|2,0,0]=4 8438 B14R1.882 CCCOCCSc1ccccc1O 62a_100000739446_100011215938 [1,1,0,0,0,0|2,0,0]=4 8439 B14R1.882 CCCOCCSc1ccccc1O 62a_100011215938_100000739446 [1,1,0,0,0,0|2,0,0]=4 8440 B14R1.882 CCNCCOCc1ccccc1Cl 2230a_100000745786_100000210202 [1,1,0,0,0,0|1,0,1]=4 8441 B14R1.882 CCNCCOCc1ccccc1Cl 34a_100000745786_100000210202 [1,1,0,0,0,0|1,0,1]=4 8442 B14R1.882 CCOCCCNc1ccccc1O 34a_100000185747_100012232248 [1,1,0,0,0,0|2,0,0]=4 8443 B14R1.882 CCOCCCSc1ccccc1O 62a_100000739446_100012232248 [1,1,0,0,0,0|2,0,0]=4 8444 B14R1.882 CCOCCCSc1ccccc1O 62a_100012232248_100000739446 [1,1,0,0,0,0|2,0,0]=4 8445 B14R1.882 CCOCCNCc1ccccc1O 34a_100000185550_100000210147 [1,1,0,0,0,0|1,0,1]=4 8446 B14R1.882 CCOCCOCc1ccccc1Br 34a_100000210136_100000184730 [1,1,0,0,0,0|1,0,1]=4 8447 B14R1.882 CCOCCOCc1ccccc1Br 34a_100000756307_100000210147 [1,1,0,0,0,0|1,0,1]=4 8448 B14R1.882 CCOCCOCc1ccccc1Br 7a_100000210136_100000184730 [1,1,0,0,0,0|1,0,1]=4 8449 B14R1.882 CCOCCOCc1ccccc1Br 7a_100000756307_100011215890 [1,1,0,0,0,0|1,0,1]=4 8450 B14R1.882 CCOCCOCc1ccccc1C 34a_100000210136_100000211839 [1,1,0,0,0,0|1,0,1]=4 8451 B14R1.882 CCOCCOCc1ccccc1C 34a_100000698903_100000210147 [1,1,0,0,0,0|1,0,1]=4 8452 B14R1.882 CCOCCOCc1ccccc1C 7a_100000210136_100000211839 [1,1,0,0,0,0|1,0,1]=4 8453 B14R1.882 CCOCCOCc1ccccc1C 7a_100000698903_100011215890 [1,1,0,0,0,0|1,0,1]=4 8454 B14R1.882 CCOCCOCc1ccccc1Cl 34a_100000210136_100000187162 [1,1,0,0,0,0|1,0,1]=4 8455 B14R1.882 CCOCCOCc1ccccc1Cl 34a_100000210847_100000210147 [1,1,0,0,0,0|1,0,1]=4 8456 B14R1.882 CCOCCOCc1ccccc1Cl 7a_100000210136_100000187162 [1,1,0,0,0,0|1,0,1]=4 8457 B14R1.882 CCOCCOCc1ccccc1Cl 7a_100000210847_100011215890 [1,1,0,0,0,0|1,0,1]=4 8458 B14R1.882 CCOCCOCc1ccccc1F 34a_100000210136_100000211605 [1,1,0,0,0,0|1,0,1]=4 8459 B14R1.882 CCOCCOCc1ccccc1F 34a_100000211962_100000210147 [1,1,0,0,0,0|1,0,1]=4 8460 B14R1.882 CCOCCOCc1ccccc1F 7a_100000210136_100000211605 [1,1,0,0,0,0|1,0,1]=4 8461 B14R1.882 CCOCCOCc1ccccc1F 7a_100000211962_100011215890 [1,1,0,0,0,0|1,0,1]=4 8462 B14R1.882 CCOCCOCc1ccccc1I 34a_100000187465_100000210147 [1,1,0,0,0,0|1,0,1]=4 8463 B14R1.882 CCOCCOCc1ccccc1I 34a_100000210136_100011215278 [1,1,0,0,0,0|1,0,1]=4 8464 B14R1.882 CCOCCOCc1ccccc1I 7a_100000187465_100011215890 [1,1,0,0,0,0|1,0,1]=4 8465 B14R1.882 CCOCCOCc1ccccc1I 7a_100000210136_100011215278 [1,1,0,0,0,0|1,0,1]=4 8466 B14R1.882 CCOCCOCc1ccccc1N 34a_100000212039_100000210147 [1,1,0,0,0,0|1,0,1]=4 8467 B14R1.882 CCOCCOCc1ncccc1O 34a_100000210136_200020655725 [1,1,0,0,0,0|1,0,1]=4 8468 B14R1.882 CCOCCOCc1ncccc1O 7a_100000210136_200020655725 [1,1,0,0,0,0|1,0,1]=4 8469 B14R1.882 CCSCCNCc1ccccc1O 34a_100000185550_100000757381 [1,1,0,0,0,0|1,0,1]=4 8470 B14R1.882 CCSCCOCc1ccccc1Br 34a_100000212035_100000184730 [1,1,0,0,0,0|1,0,1]=4 8471 B14R1.882 CCSCCOCc1ccccc1Br 34a_100000756307_100000757381 [1,1,0,0,0,0|1,0,1]=4 8472 B14R1.882 CCSCCOCc1ccccc1Br 7a_100000212035_100000184730 [1,1,0,0,0,0|1,0,1]=4 8473 B14R1.882 CCSCCOCc1ccccc1Br 7a_100000756307_100000757381 [1,1,0,0,0,0|1,0,1]=4 8474 B14R1.882 CCSCCOCc1ccccc1C 34a_100000212035_100000211839 [1,1,0,0,0,0|1,0,1]=4 8475 B14R1.882 CCSCCOCc1ccccc1C 34a_100000698903_100000757381 [1,1,0,0,0,0|1,0,1]=4 8476 B14R1.882 CCSCCOCc1ccccc1C 7a_100000212035_100000211839 [1,1,0,0,0,0|1,0,1]=4 8477 B14R1.882 CCSCCOCc1ccccc1C 7a_100000698903_100000757381 [1,1,0,0,0,0|1,0,1]=4 8478 B14R1.882 CCSCCOCc1ccccc1Cl 34a_100000210847_100000757381 [1,1,0,0,0,0|1,0,1]=4 8479 B14R1.882 CCSCCOCc1ccccc1Cl 34a_100000212035_100000187162 [1,1,0,0,0,0|1,0,1]=4 8480 B14R1.882 CCSCCOCc1ccccc1Cl 7a_100000210847_100000757381 [1,1,0,0,0,0|1,0,1]=4 8481 B14R1.882 CCSCCOCc1ccccc1Cl 7a_100000212035_100000187162 [1,1,0,0,0,0|1,0,1]=4 8482 B14R1.882 CCSCCOCc1ccccc1F 34a_100000211962_100000757381 [1,1,0,0,0,0|1,0,1]=4 8483 B14R1.882 CCSCCOCc1ccccc1F 34a_100000212035_100000211605 [1,1,0,0,0,0|1,0,1]=4 8484 B14R1.882 CCSCCOCc1ccccc1F 7a_100000211962_100000757381 [1,1,0,0,0,0|1,0,1]=4 8485 B14R1.882 CCSCCOCc1ccccc1F 7a_100000212035_100000211605 [1,1,0,0,0,0|1,0,1]=4 8486 B14R1.882 CCSCCOCc1ccccc1I 34a_100000187465_100000757381 [1,1,0,0,0,0|1,0,1]=4 8487 B14R1.882 CCSCCOCc1ccccc1I 34a_100000212035_100011215278 [1,1,0,0,0,0|1,0,1]=4 8488 B14R1.882 CCSCCOCc1ccccc1I 7a_100000187465_100000757381 [1,1,0,0,0,0|1,0,1]=4 8489 B14R1.882 CCSCCOCc1ccccc1I 7a_100000212035_100011215278 [1,1,0,0,0,0|1,0,1]=4 8490 B14R1.882 CCSCCOCc1ccccc1N 34a_100000212039_100000757381 [1,1,0,0,0,0|1,0,1]=4 8491 B14R1.882 CCSCCOCc1ncccc1O 34a_100000212035_200020655725 [1,1,0,0,0,0|1,0,1]=4 8492 B14R1.882 CCSCCOCc1ncccc1O 7a_100000212035_200020655725 [1,1,0,0,0,0|1,0,1]=4 8493 B14R1.882 CNCCCOCc1ccccc1Br 34a_100000213112_100000184730 [1,1,0,0,0,0|1,0,1]=4 8494 B14R1.882 CNCCCOCc1ccccc1C 34a_100000213112_100000211839 [1,1,0,0,0,0|1,0,1]=4 8495 B14R1.882 CNCCCOCc1ccccc1Cl 34a_100000213112_100000187162 [1,1,0,0,0,0|1,0,1]=4 8496 B14R1.882 CNCCCOCc1ccccc1F 34a_100000213112_100000211605 [1,1,0,0,0,0|1,0,1]=4 8497 B14R1.882 CNCCCOCc1ccccc1I 34a_100000213112_100011215278 [1,1,0,0,0,0|1,0,1]=4 8498 B14R1.882 CNCCCOCc1ncccc1O 34a_100000213112_200020655725 [1,1,0,0,0,0|1,0,1]=4 8499 B14R1.882 COCCCCNc1ccccc1O 34a_100000185747_100000755781 [1,1,0,0,0,0|2,0,0]=4 8500 B14R1.882 COCCCCSc1ccccc1O 62a_100000730899_100000739446 [1,1,0,0,0,0|2,0,0]=4 8501 B14R1.882 COCCCCSc1ccccc1O 62a_100000739446_100000730899 [1,1,0,0,0,0|2,0,0]=4 8502 B14R1.882 COCCCNCc1ccccc1O 34a_100000185550_100000740836 [1,1,0,0,0,0|1,0,1]=4 8503 B14R1.882 COCCCOCc1ccccc1Br 34a_100000740835_100000184730 [1,1,0,0,0,0|1,0,1]=4 8504 B14R1.882 COCCCOCc1ccccc1Br 34a_100000756307_100000740836 [1,1,0,0,0,0|1,0,1]=4 8505 B14R1.882 COCCCOCc1ccccc1Br 7a_100000756307_100000740836 [1,1,0,0,0,0|1,0,1]=4 8506 B14R1.882 COCCCOCc1ccccc1C 34a_100000698903_100000740836 [1,1,0,0,0,0|1,0,1]=4 8507 B14R1.882 COCCCOCc1ccccc1C 34a_100000740835_100000211839 [1,1,0,0,0,0|1,0,1]=4 8508 B14R1.882 COCCCOCc1ccccc1C 7a_100000698903_100000740836 [1,1,0,0,0,0|1,0,1]=4 8509 B14R1.882 COCCCOCc1ccccc1Cl 34a_100000210847_100000740836 [1,1,0,0,0,0|1,0,1]=4 8510 B14R1.882 COCCCOCc1ccccc1Cl 34a_100000740835_100000187162 [1,1,0,0,0,0|1,0,1]=4 8511 B14R1.882 COCCCOCc1ccccc1Cl 7a_100000210847_100000740836 [1,1,0,0,0,0|1,0,1]=4 8512 B14R1.882 COCCCOCc1ccccc1F 34a_100000211962_100000740836 [1,1,0,0,0,0|1,0,1]=4 8513 B14R1.882 COCCCOCc1ccccc1F 34a_100000740835_100000211605 [1,1,0,0,0,0|1,0,1]=4 8514 B14R1.882 COCCCOCc1ccccc1F 7a_100000211962_100000740836 [1,1,0,0,0,0|1,0,1]=4 8515 B14R1.882 COCCCOCc1ccccc1I 34a_100000187465_100000740836 [1,1,0,0,0,0|1,0,1]=4 8516 B14R1.882 COCCCOCc1ccccc1I 34a_100000740835_100011215278 [1,1,0,0,0,0|1,0,1]=4 8517 B14R1.882 COCCCOCc1ccccc1I 7a_100000187465_100000740836 [1,1,0,0,0,0|1,0,1]=4 8518 B14R1.882 COCCCOCc1ccccc1N 34a_100000212039_100000740836 [1,1,0,0,0,0|1,0,1]=4 8519 B14R1.882 COCCCOCc1ncccc1O 34a_100000740835_200020655725 [1,1,0,0,0,0|1,0,1]=4 8520 B14R1.882 COCCOCCc1ccccc1O 34a_100000210237_100000722297 [1,1,0,0,0,0|1,0,1]=4 8521 B14R1.882 COCCOCSc1ccccc1O 62a_100000231047_100000739446 [1,1,0,0,0,0|1,0,1]=4 8522 B14R1.882 COCCOCSc1ccccc1O 62a_100000739446_100000231047 [1,1,0,0,0,0|1,0,1]=4 8523 B14R1.882 CSCCCOCc1ccccc1Br 34a_100000690336_100000184730 [1,1,0,0,0,0|1,0,1]=4 8524 B14R1.882 CSCCCOCc1ccccc1Br 7a_100000690336_100000184730 [1,1,0,0,0,0|1,0,1]=4 8525 B14R1.882 CSCCCOCc1ccccc1C 34a_100000690336_100000211839 [1,1,0,0,0,0|1,0,1]=4 8526 B14R1.882 CSCCCOCc1ccccc1C 7a_100000690336_100000211839 [1,1,0,0,0,0|1,0,1]=4 8527 B14R1.882 CSCCCOCc1ccccc1Cl 34a_100000690336_100000187162 [1,1,0,0,0,0|1,0,1]=4 8528 B14R1.882 CSCCCOCc1ccccc1Cl 7a_100000690336_100000187162 [1,1,0,0,0,0|1,0,1]=4 8529 B14R1.882 CSCCCOCc1ccccc1F 34a_100000690336_100000211605 [1,1,0,0,0,0|1,0,1]=4 8530 B14R1.882 CSCCCOCc1ccccc1F 7a_100000690336_100000211605 [1,1,0,0,0,0|1,0,1]=4 8531 B14R1.882 CSCCCOCc1ccccc1I 34a_100000690336_100011215278 [1,1,0,0,0,0|1,0,1]=4 8532 B14R1.882 CSCCCOCc1ccccc1I 7a_100000690336_100011215278 [1,1,0,0,0,0|1,0,1]=4 8533 B14R1.882 CSCCCOCc1ncccc1O 34a_100000690336_200020655725 [1,1,0,0,0,0|1,0,1]=4 8534 B14R1.882 CSCCCOCc1ncccc1O 7a_100000690336_200020655725 [1,1,0,0,0,0|1,0,1]=4 8535 B14R1.882 CSCCOCCc1ccccc1O 34a_100000230434_100000722297 [1,1,0,0,0,0|1,0,1]=4 8536 B14R1.882 CSCCOCCc1ccccc1O 7a_100000230434_100000722297 [1,1,0,0,0,0|1,0,1]=4 8537 B14R1.882 Cc1ccccc1COCCCCBr 34a_100011216708_100000211839 [1,1,0,0,0,0|1,0,1]=4 8538 B14R1.882 Cc1ccccc1COCCCCCl 34a_100000210776_100000211839 [1,1,0,0,0,0|1,0,1]=4 8539 B14R1.882 Cc1ccccc1COCCCCCl 7a_100000210776_100000211839 [1,1,0,0,0,0|1,0,1]=4 8540 B14R1.882 Cc1ccccc1COCCCCF 34a_100000698903_100000729493 [1,1,0,0,0,0|1,0,1]=4 8541 B14R1.882 Cc1ccccc1COCCCCF 34a_100011995726_100000211839 [1,1,0,0,0,0|1,0,1]=4 8542 B14R1.882 Cc1ccccc1COCCCCF 7a_100000698903_100000729493 [1,1,0,0,0,0|1,0,1]=4 8543 B14R1.882 Cc1ccccc1COCCCCF 7a_100011995726_100000211839 [1,1,0,0,0,0|1,0,1]=4 8544 B14R1.882 Cc1ccccc1COCCCCI 34a_200012148704_100000211839 [1,1,0,0,0,0|1,0,1]=4 8545 B14R1.882 Cc1ccccc1COCCCCN 34a_100000750430_100000211839 [1,1,0,0,0,0|1,0,1]=4 8546 B14R1.882 Cc1ccccc1COCCCCO 34a_100000698903_100011216708 [1,1,0,0,0,0|1,0,1]=4 8547 B14R1.882 Cc1ccccc1COCCCCO 7a_100000698903_100000210776 [1,1,0,0,0,0|1,0,1]=4 8548 B14R1.882 ClCCCCOCc1ccccc1Br 34a_100000210776_100000184730 [1,1,0,0,0,0|1,0,1]=4 8549 B14R1.882 ClCCCCOCc1ccccc1Br 7a_100000210776_100000184730 [1,1,0,0,0,0|1,0,1]=4 8550 B14R1.882 ClCCCCOCc1ccccc1Cl 34a_100000210776_100000187162 [1,1,0,0,0,0|1,0,1]=4 8551 B14R1.882 ClCCCCOCc1ccccc1Cl 7a_100000210776_100000187162 [1,1,0,0,0,0|1,0,1]=4 8552 B14R1.882 ClCCCCOCc1ccccc1I 34a_100000210776_100011215278 [1,1,0,0,0,0|1,0,1]=4 8553 B14R1.882 ClCCCCOCc1ccccc1I 7a_100000210776_100011215278 [1,1,0,0,0,0|1,0,1]=4 8554 B14R1.882 Clc1ccccc1COCCCCBr 34a_100011216708_100000187162 [1,1,0,0,0,0|1,0,1]=4 8555 B14R1.882 Clc1ccccc1COCCCCI 34a_200012148704_100000187162 [1,1,0,0,0,0|1,0,1]=4 8556 B14R1.882 FCCCCOCc1ccccc1Br 34a_100000756307_100000729493 [1,1,0,0,0,0|1,0,1]=4 8557 B14R1.882 FCCCCOCc1ccccc1Br 34a_100011995726_100000184730 [1,1,0,0,0,0|1,0,1]=4 8558 B14R1.882 FCCCCOCc1ccccc1Br 7a_100000756307_100000729493 [1,1,0,0,0,0|1,0,1]=4 8559 B14R1.882 FCCCCOCc1ccccc1Br 7a_100011995726_100000184730 [1,1,0,0,0,0|1,0,1]=4 8560 B14R1.882 FCCCCOCc1ccccc1Cl 34a_100000210847_100000729493 [1,1,0,0,0,0|1,0,1]=4 8561 B14R1.882 FCCCCOCc1ccccc1Cl 34a_100011995726_100000187162 [1,1,0,0,0,0|1,0,1]=4 8562 B14R1.882 FCCCCOCc1ccccc1Cl 7a_100000210847_100000729493 [1,1,0,0,0,0|1,0,1]=4 8563 B14R1.882 FCCCCOCc1ccccc1Cl 7a_100011995726_100000187162 [1,1,0,0,0,0|1,0,1]=4 8564 B14R1.882 FCCCCOCc1ccccc1F 34a_100000211962_100000729493 [1,1,0,0,0,0|1,0,1]=4 8565 B14R1.882 FCCCCOCc1ccccc1F 34a_100011995726_100000211605 [1,1,0,0,0,0|1,0,1]=4 8566 B14R1.882 FCCCCOCc1ccccc1F 7a_100000211962_100000729493 [1,1,0,0,0,0|1,0,1]=4 8567 B14R1.882 FCCCCOCc1ccccc1F 7a_100011995726_100000211605 [1,1,0,0,0,0|1,0,1]=4 8568 B14R1.882 FCCCCOCc1ccccc1I 34a_100000187465_100000729493 [1,1,0,0,0,0|1,0,1]=4 8569 B14R1.882 FCCCCOCc1ccccc1I 34a_100011995726_100011215278 [1,1,0,0,0,0|1,0,1]=4 8570 B14R1.882 FCCCCOCc1ccccc1I 7a_100000187465_100000729493 [1,1,0,0,0,0|1,0,1]=4 8571 B14R1.882 FCCCCOCc1ccccc1I 7a_100011995726_100011215278 [1,1,0,0,0,0|1,0,1]=4 8572 B14R1.882 Fc1ccccc1COCCCCBr 34a_100011216708_100000211605 [1,1,0,0,0,0|1,0,1]=4 8573 B14R1.882 Fc1ccccc1COCCCCCl 34a_100000210776_100000211605 [1,1,0,0,0,0|1,0,1]=4 8574 B14R1.882 Fc1ccccc1COCCCCCl 7a_100000210776_100000211605 [1,1,0,0,0,0|1,0,1]=4 8575 B14R1.882 Fc1ccccc1COCCCCI 34a_200012148704_100000211605 [1,1,0,0,0,0|1,0,1]=4 8576 B14R1.882 ICCCCOCc1ccccc1I 34a_200012148704_100011215278 [1,1,0,0,0,0|1,0,1]=4 8577 B14R1.882 NCCCCOCc1ccccc1Br 34a_100000750430_100000184730 [1,1,0,0,0,0|1,0,1]=4 8578 B14R1.882 NCCCCOCc1ccccc1Cl 34a_100000750430_100000187162 [1,1,0,0,0,0|1,0,1]=4 8579 B14R1.882 NCCCCOCc1ccccc1F 34a_100000750430_100000211605 [1,1,0,0,0,0|1,0,1]=4 8580 B14R1.882 NCCCCOCc1ccccc1I 34a_100000750430_100011215278 [1,1,0,0,0,0|1,0,1]=4 8581 B14R1.882 NCCCCOCc1ncccc1O 34a_100000750430_200020655725 [1,1,0,0,0,0|1,0,1]=4 8582 B14R1.882 NCCCOCCc1ccccc1O 34a_100000182051_100000722297 [1,1,0,0,0,0|1,0,1]=4 8583 B14R1.882 Nc1ccccc1COCCCCF 34a_100000212039_100000729493 [1,1,0,0,0,0|1,0,1]=4 8584 B14R1.882 Nc1ccccc1COCCCCO 34a_100000212039_100011216708 [1,1,0,0,0,0|1,0,1]=4 8585 B14R1.882 OCCCCCNc1ccccc1O 34a_100000185747_100000746330 [1,1,0,0,0,0|2,0,0]=4 8586 B14R1.882 OCCCCCSc1ccccc1O 62a_100000739446_100000746330 [1,1,0,0,0,0|2,0,0]=4 8587 B14R1.882 OCCCCCSc1ccccc1O 62a_100000746330_100000739446 [1,1,0,0,0,0|2,0,0]=4 8588 B14R1.882 OCCCCNCc1ccccc1O 34a_100000185550_100011216708 [1,1,0,0,0,0|1,0,1]=4 8589 B14R1.882 OCCCCOCc1ccccc1Br 34a_100000756307_100011216708 [1,1,0,0,0,0|1,0,1]=4 8590 B14R1.882 OCCCCOCc1ccccc1Br 7a_100000756307_100000210776 [1,1,0,0,0,0|1,0,1]=4 8591 B14R1.882 OCCCCOCc1ccccc1Cl 34a_100000210847_100011216708 [1,1,0,0,0,0|1,0,1]=4 8592 B14R1.882 OCCCCOCc1ccccc1Cl 7a_100000210847_100000210776 [1,1,0,0,0,0|1,0,1]=4 8593 B14R1.882 OCCCCOCc1ccccc1F 34a_100000211962_100011216708 [1,1,0,0,0,0|1,0,1]=4 8594 B14R1.882 OCCCCOCc1ccccc1F 7a_100000211962_100000210776 [1,1,0,0,0,0|1,0,1]=4 8595 B14R1.882 OCCCCOCc1ccccc1I 34a_100000187465_100011216708 [1,1,0,0,0,0|1,0,1]=4 8596 B14R1.882 OCCCCOCc1ccccc1I 7a_100000187465_100000210776 [1,1,0,0,0,0|1,0,1]=4 8597 B14R1.882 Oc1ccccc1CCOCCCBr 34a_100011217188_100000722297 [1,1,0,0,0,0|1,0,1]=4 8598 B14R1.882 Oc1ccccc1CCOCCCCl 34a_100000230001_100000722297 [1,1,0,0,0,0|1,0,1]=4 8599 B14R1.882 Oc1ccccc1CCOCCCF 34a_100000759539_100000722297 [1,1,0,0,0,0|1,0,1]=4 8600 B14R1.882 Oc1ccccc1CNCCCCF 34a_100000185550_100000729493 [1,1,0,0,0,0|1,0,1]=4 8601 B14R1.882 Oc1ccccc1NCCCCCF 34a_100000185747_100000729378 [1,1,0,0,0,0|2,0,0]=4 8602 B14R1.882 Oc1ccccc1SCCCCCF 62a_100000729378_100000739446 [1,1,0,0,0,0|2,0,0]=4 8603 B14R1.882 Oc1ccccc1SCCCCCF 62a_100000739446_100000729378 [1,1,0,0,0,0|2,0,0]=4 8604 B14R1.882 Oc1cccnc1COCCCCBr 34a_100011216708_200020655725 [1,1,0,0,0,0|1,0,1]=4 8605 B14R1.882 Oc1cccnc1COCCCCCl 34a_100000210776_200020655725 [1,1,0,0,0,0|1,0,1]=4 8606 B14R1.882 Oc1cccnc1COCCCCCl 7a_100000210776_200020655725 [1,1,0,0,0,0|1,0,1]=4 8607 B14R1.882 Oc1cccnc1COCCCCF 34a_100011995726_200020655725 [1,1,0,0,0,0|1,0,1]=4 8608 B14R1.882 Oc1cccnc1COCCCCF 7a_100011995726_200020655725 [1,1,0,0,0,0|1,0,1]=4 8609 B14R1.882 Oc1cccnc1COCCCCI 34a_200012148704_200020655725 [1,1,0,0,0,0|1,0,1]=4 8610 B14R1.946 CCCCC(=Cc1ccccc1Br)Br 271570a_206741709834_100000695589 [1,1,0,0,0,0|2,0,0]=4 8611 B14R1.946 CCCCC(=Cc1ccccc1C)Br 271570a_206741709834_100000210755 [1,1,0,0,0,0|2,0,0]=4 8612 B14R1.946 CCCCC(=Cc1ccccc1Cl)Br 271570a_206741709834_100000764095 [1,1,0,0,0,0|2,0,0]=4 8613 B14R1.946 CCCCC(=Cc1ccccc1F)Br 271570a_206741709834_100011215700 [1,1,0,0,0,0|2,0,0]=4 8614 B14R1.946 CCCCC(=Cc1ccccc1N)Br 271570a_206741709834_100000210017 [1,1,0,0,0,0|2,0,0]=4 8615 B14R1.946 CCCCC(=Cc1ccccc1O)Br 271570a_206741709834_100000739446 [1,1,0,0,0,0|1,0,0]=3 8616 B14R1.946 CCCCC(=Cc1ccncc1O)Br 271570a_206741709834_100009817591 [1,1,0,0,0,0|2,0,0]=4 8617 B14R1.946 CCCCC(=Cc1ncccc1O)Br 271570a_206741709834_100000034122 [1,1,0,0,0,0|2,0,0]=4 8618 B14R1.946 CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210211 [1,1,0,0,0,0|1,0,1]=4 8619 B14R1.946 CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000210183 [1,1,0,0,0,0|2,0,0]=4 8620 B14R1.946 CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000210183 [1,1,0,0,0,0|2,0,0]=4 8621 B14R1.946 CCCCC(C)Nc1ccccc1O 34a_100000185747_200011215066 [1,1,0,0,0,0|2,0,0]=4 8622 B14R1.946 CCCCC(C)Sc1ccccc1O 62a_100000739446_200011215066 [1,1,0,0,0,0|2,0,0]=4 8623 B14R1.946 CCCCC(C)Sc1ccccc1O 62a_200011215066_100000739446 [1,1,0,0,0,0|2,0,0]=4 8624 B14R1.946 CCCCN(C)Cc1ccccc1O 2230a_100015189988_100000210211 [1,1,0,0,0,0|1,0,1]=4 8625 B14R1.946 CCCCN(C)Cc1ccccc1O 269982a_100015189988_100000210211 [1,1,0,0,0,0|1,0,1]=4 8626 B14R1.20339 CCCCC=Cc1c(cccc1Br)Br 271570a_100016275911_100009994525 [1,1,0,0,0,0|2,0,0]=4 8627 B14R1.20339 CCCCC=Cc1c(cccc1Br)Cl 271570a_100016275911_100010214488 [1,1,0,0,0,0|2,0,0]=4 8628 B14R1.20339 CCCCC=Cc1c(cccc1Br)F 271570a_100016275911_100011219512 [1,1,0,0,0,0|2,0,0]=4 8629 B14R1.20339 CCCCC=Cc1c(cccc1Br)N 271570a_100016275911_100020590159 [1,1,0,0,0,0|2,0,0]=4 8630 B14R1.20339 CCCCC=Cc1c(cccc1Br)O 271570a_100016275911_100010187912 [1,1,0,0,0,0|1,0,0]=3 8631 B14R1.20339 CCCCC=Cc1c(cccc1C)C 271570a_100016275911_100000033847 [1,1,0,0,0,0|2,0,0]=4 8632 B14R1.20339 CCCCC=Cc1c(cccc1Cl)C 271570a_100016275911_100000043165 [1,1,0,0,0,0|2,0,0]=4 8633 B14R1.20339 CCCCC=Cc1c(cccc1Cl)Cl 271570a_100016275911_100000034237 [1,1,0,0,0,0|2,0,0]=4 8634 B14R1.20339 CCCCC=Cc1c(cccc1Cl)F 271570a_100016275911_100000050007 [1,1,0,0,0,0|2,0,0]=4 8635 B14R1.20339 CCCCC=Cc1c(cccc1Cl)N 271570a_100016275911_100000049713 [1,1,0,0,0,0|2,0,0]=4 8636 B14R1.20339 CCCCC=Cc1c(cccc1Cl)O 271570a_100016275911_100000050174 [1,1,0,0,0,0|1,0,0]=3 8637 B14R1.20339 CCCCC=Cc1c(cccc1F)C 271570a_100016275911_100012349962 [1,1,0,0,0,0|2,0,0]=4 8638 B14R1.20339 CCCCC=Cc1c(cccc1F)F 271570a_100016275911_100000693133 [1,1,0,0,0,0|2,0,0]=4 8639 B14R1.20339 CCCCC=Cc1c(cccc1F)N 271570a_100016275911_100011934729 [1,1,0,0,0,0|2,0,0]=4 8640 B14R1.20339 CCCCC=Cc1c(cccc1F)O 271570a_100016275911_100009820682 [1,1,0,0,0,0|1,0,0]=3 8641 B14R1.20339 CCCCC=Cc1c(cccc1N)C 271570a_100016275911_100000684715 [1,1,0,0,0,0|2,0,0]=4 8642 B14R1.20339 CCCCC=Cc1c(cccc1O)C 271570a_100016275911_100000686692 [1,1,0,0,0,0|1,0,0]=3 8643 B14R1.20339 CCCCC=Cc1c(cccc1O)N 271570a_100016275911_100012183704 [1,1,0,0,0,0|1,0,0]=3 8644 B14R1.20339 CCCCC=Cc1c(cccc1O)O 271570a_100016275911_100010205330 [1,1,0,0,0,0|1,0,0]=3 8645 B14R1.20339 CCCCC=Cc1c(ccnc1O)C 271570a_100016275911_100012000493 [1,1,0,0,0,0|2,0,0]=4 8646 B14R1.20339 CCCCC=Cc1c(ccnc1O)O 271570a_100016275911_200009817435 [1,1,0,0,0,0|2,0,0]=4 8647 B14R1.20339 CCCCCNc1c(cccc1Br)O 34a_100011934926_100000718602 [1,1,0,0,0,0|2,0,0]=4 8648 B14R1.20339 CCCCCNc1c(cccc1Cl)O 34a_100012022510_100000718602 [1,1,0,0,0,0|2,0,0]=4 8649 B14R1.20339 CCCCCNc1c(cccc1F)O 34a_100020591140_100000718602 [1,1,0,0,0,0|2,0,0]=4 8650 B14R1.20339 CCCCCNc1c(cccc1O)C 34a_100000743429_100000718602 [1,1,0,0,0,0|2,0,0]=4 8651 B14R1.20339 CCCCCSc1c(cccc1Br)O 62a_100000210326_100010187912 [1,1,0,0,0,0|2,0,0]=4 8652 B14R1.20339 CCCCCSc1c(cccc1Br)O 62a_100010187912_100000210326 [1,1,0,0,0,0|2,0,0]=4 8653 B14R1.20339 CCCCCSc1c(cccc1Cl)O 62a_100000210326_100000050174 [1,1,0,0,0,0|2,0,0]=4 8654 B14R1.20339 CCCCCSc1c(cccc1F)O 62a_100000210326_100009820682 [1,1,0,0,0,0|2,0,0]=4 8655 B14R1.20339 CCCCCSc1c(cccc1F)O 62a_100009820682_100000210326 [1,1,0,0,0,0|2,0,0]=4 8656 B14R1.20339 CCCCCSc1c(cccc1O)C 62a_100000210326_100000686692 [1,1,0,0,0,0|2,0,0]=4 8657 B14R1.20339 CCCCCSc1c(cccc1O)C 62a_100000686692_100000210326 [1,1,0,0,0,0|2,0,0]=4 8658 B14R1.20339 CCCCCSc1c(cccc1O)N 62a_100000210326_100012183704 [1,1,0,0,0,0|2,0,0]=4 8659 B14R1.20339 CCCCCSc1c(cccc1O)N 62a_100012183704_100000210326 [1,1,0,0,0,0|2,0,0]=4 8660 B14R1.20339 CCCCCSc1c(cccc1O)O 62a_100000210326_100010205330 [1,1,0,0,0,0|2,0,0]=4 8661 B14R1.20339 CCCCOCc1c(cccc1Br)Br 34a_100010172814_100000210210 [1,1,0,0,0,0|1,0,1]=4 8662 B14R1.20339 CCCCOCc1c(cccc1Br)Br 7a_100010172814_100000210211 [1,1,0,0,0,0|1,0,1]=4 8663 B14R1.20339 CCCCOCc1c(cccc1Br)C 34a_100000210227_100010146847 [1,1,0,0,0,0|1,0,1]=4 8664 B14R1.20339 CCCCOCc1c(cccc1Br)C 7a_100000210227_100010146847 [1,1,0,0,0,0|1,0,1]=4 8665 B14R1.20339 CCCCOCc1c(cccc1Br)Cl 34a_100000210227_100010138402 [1,1,0,0,0,0|1,0,1]=4 8666 B14R1.20339 CCCCOCc1c(cccc1Br)Cl 7a_100000210227_100010138402 [1,1,0,0,0,0|1,0,1]=4 8667 B14R1.20339 CCCCOCc1c(cccc1Br)F 34a_100000210227_100012145669 [1,1,0,0,0,0|1,0,1]=4 8668 B14R1.20339 CCCCOCc1c(cccc1Br)F 34a_100012355691_100000210210 [1,1,0,0,0,0|1,0,1]=4 8669 B14R1.20339 CCCCOCc1c(cccc1Br)F 7a_100000210227_100000696636 [1,1,0,0,0,0|1,0,1]=4 8670 B14R1.20339 CCCCOCc1c(cccc1Br)F 7a_100012355691_100000210211 [1,1,0,0,0,0|1,0,1]=4 8671 B14R1.20339 CCCCOCc1c(cccc1Br)N 34a_100000747656_100000210210 [1,1,0,0,0,0|1,0,1]=4 8672 B14R1.20339 CCCCOCc1c(cccc1C)C 34a_100000210227_100000758300 [1,1,0,0,0,0|1,0,1]=4 8673 B14R1.20339 CCCCOCc1c(cccc1C)C 34a_100011933981_100000210210 [1,1,0,0,0,0|1,0,1]=4 8674 B14R1.20339 CCCCOCc1c(cccc1C)C 7a_100000210227_100000758300 [1,1,0,0,0,0|1,0,1]=4 8675 B14R1.20339 CCCCOCc1c(cccc1C)C 7a_100011933981_100000210211 [1,1,0,0,0,0|1,0,1]=4 8676 B14R1.20339 CCCCOCc1c(cccc1Cl)C 34a_100000082531_100000210210 [1,1,0,0,0,0|1,0,1]=4 8677 B14R1.20339 CCCCOCc1c(cccc1Cl)C 7a_100000082531_100000210211 [1,1,0,0,0,0|1,0,1]=4 8678 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 34a_100000210227_100000187851 [1,1,0,0,0,0|1,0,1]=4 8679 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 34a_100000215722_100000210210 [1,1,0,0,0,0|1,0,1]=4 8680 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 7a_100000210227_100000187851 [1,1,0,0,0,0|1,0,1]=4 8681 B14R1.20339 CCCCOCc1c(cccc1Cl)Cl 7a_100000215722_100000210211 [1,1,0,0,0,0|1,0,1]=4 8682 B14R1.20339 CCCCOCc1c(cccc1Cl)F 34a_100000210227_100000187852 [1,1,0,0,0,0|1,0,1]=4 8683 B14R1.20339 CCCCOCc1c(cccc1Cl)F 34a_100000215723_100000210210 [1,1,0,0,0,0|1,0,1]=4 8684 B14R1.20339 CCCCOCc1c(cccc1Cl)F 7a_100000210227_100000187852 [1,1,0,0,0,0|1,0,1]=4 8685 B14R1.20339 CCCCOCc1c(cccc1Cl)F 7a_100000215723_100000210211 [1,1,0,0,0,0|1,0,1]=4 8686 B14R1.20339 CCCCOCc1c(cccc1Cl)N 34a_100011916388_100000210210 [1,1,0,0,0,0|1,0,1]=4 8687 B14R1.20339 CCCCOCc1c(cccc1F)C 34a_100000057874_100000210210 [1,1,0,0,0,0|1,0,1]=4 8688 B14R1.20339 CCCCOCc1c(cccc1F)C 34a_100000210227_100009814554 [1,1,0,0,0,0|1,0,1]=4 8689 B14R1.20339 CCCCOCc1c(cccc1F)C 7a_100000057874_100000210211 [1,1,0,0,0,0|1,0,1]=4 8690 B14R1.20339 CCCCOCc1c(cccc1F)C 7a_100000210227_100009814554 [1,1,0,0,0,0|1,0,1]=4 8691 B14R1.20339 CCCCOCc1c(cccc1F)F 34a_100000210227_100000698325 [1,1,0,0,0,0|1,0,1]=4 8692 B14R1.20339 CCCCOCc1c(cccc1F)F 34a_100000698215_100000210210 [1,1,0,0,0,0|1,0,1]=4 8693 B14R1.20339 CCCCOCc1c(cccc1F)F 7a_100000210227_100000698325 [1,1,0,0,0,0|1,0,1]=4 8694 B14R1.20339 CCCCOCc1c(cccc1F)F 7a_100000698215_100000210211 [1,1,0,0,0,0|1,0,1]=4 8695 B14R1.20339 CCCCOCc1c(cccc1F)N 34a_100011846719_100000210210 [1,1,0,0,0,0|1,0,1]=4 8696 B14R1.20339 CCCCOCc1c(cccc1I)Br 34a_100000210227_100010146611 [1,1,0,0,0,0|1,0,1]=4 8697 B14R1.20339 CCCCOCc1c(cccc1I)Br 7a_100000210227_100010146611 [1,1,0,0,0,0|1,0,1]=4 8698 B14R1.20339 CCCCOCc1c(cccc1I)C 34a_100000210227_100010150146 [1,1,0,0,0,0|1,0,1]=4 8699 B14R1.20339 CCCCOCc1c(cccc1I)C 7a_100000210227_100010150146 [1,1,0,0,0,0|1,0,1]=4 8700 B14R1.20339 CCCCOCc1c(cccc1I)F 34a_100000210227_100010149602 [1,1,0,0,0,0|1,0,1]=4 8701 B14R1.20339 CCCCOCc1c(cccc1I)F 34a_100010214973_100000210210 [1,1,0,0,0,0|1,0,1]=4 8702 B14R1.20339 CCCCOCc1c(cccc1I)F 7a_100000210227_100010149602 [1,1,0,0,0,0|1,0,1]=4 8703 B14R1.20339 CCCCOCc1c(cccc1I)F 7a_100010214973_100000210211 [1,1,0,0,0,0|1,0,1]=4 8704 B14R1.20339 CCCNN=Cc1c(cccc1Br)O 4a_100000740057_100009814793 [1,1,0,0,0,0|2,0,0]=4 8705 B14R1.20339 CCCNN=Cc1c(cccc1Cl)O 4a_100000740057_100000741911 [1,1,0,0,0,0|2,0,0]=4 8706 B14R1.20339 CCCNN=Cc1c(cccc1F)O 4a_100000740057_100011217653 [1,1,0,0,0,0|2,0,0]=4 8707 B14R1.20339 CCCNN=Cc1c(cccc1I)O 4a_100000740057_100010193437 [1,1,0,0,0,0|2,0,0]=4 8708 B14R1.20339 CCCNN=Cc1c(cccc1O)C 4a_100000740057_100009858367 [1,1,0,0,0,0|2,0,0]=4 8709 B14R1.20339 CCCNN=Cc1c(cccc1O)O 4a_100000740057_100000050391 [1,1,0,0,0,0|2,0,0]=4 8710 B14R1.16 C#CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000753159 [1,1,0,0,0,0|0,0,2]=4 8711 B14R1.16 C#CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000753159 [1,1,0,0,0,0|0,0,2]=4 8712 B14R1.16 C#CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000753159 [1,1,0,0,0,0|0,0,2]=4 8713 B14R1.16 C#CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000753159 [1,1,0,0,0,0|0,0,2]=4 8714 B14R1.16 C#CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000753159 [1,1,0,0,0,0|0,0,2]=4 8715 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)Br 1458a_100000752940_100102629194 [1,1,0,0,0,0|0,0,2]=4 8716 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)C 1458a_100000183896_100102629194 [1,1,0,0,0,0|0,0,2]=4 8717 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100102629194 [1,1,0,0,0,0|0,0,2]=4 8718 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)F 1458a_100011217230_100102629194 [1,1,0,0,0,0|0,0,2]=4 8719 B14R1.16 C/C=C/CC(=O)c1cccc(c1O)O 1458a_100000690420_100102629194 [1,1,0,0,0,0|0,0,2]=4 8720 B14R1.16 C=CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000754431 [1,1,0,0,0,0|0,0,2]=4 8721 B14R1.16 C=CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000754431 [1,1,0,0,0,0|0,0,2]=4 8722 B14R1.16 C=CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000754431 [1,1,0,0,0,0|0,0,2]=4 8723 B14R1.16 C=CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000754431 [1,1,0,0,0,0|0,0,2]=4 8724 B14R1.16 C=CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000754431 [1,1,0,0,0,0|0,0,2]=4 8725 B14R1.16 CC#CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000748600 [1,1,0,0,0,0|0,0,2]=4 8726 B14R1.16 CC#CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000748600 [1,1,0,0,0,0|0,0,2]=4 8727 B14R1.16 CC#CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000748600 [1,1,0,0,0,0|0,0,2]=4 8728 B14R1.16 CC#CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000748600 [1,1,0,0,0,0|0,0,2]=4 8729 B14R1.16 CC#CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000748600 [1,1,0,0,0,0|0,0,2]=4 8730 B14R1.16 CC=CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000070051 [1,1,0,0,0,0|0,0,2]=4 8731 B14R1.16 CC=CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000070051 [1,1,0,0,0,0|0,0,2]=4 8732 B14R1.16 CC=CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000070051 [1,1,0,0,0,0|0,0,2]=4 8733 B14R1.16 CC=CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000070051 [1,1,0,0,0,0|0,0,2]=4 8734 B14R1.16 CC=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000070051 [1,1,0,0,0,0|0,0,2]=4 8735 B14R1.16 CCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210211 [1,1,0,0,0,0|1,0,0]=3 8736 B14R1.16 CCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210211 [1,1,0,0,0,0|1,0,0]=3 8737 B14R1.16 CCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210211 [1,1,0,0,0,0|1,0,0]=3 8738 B14R1.16 CCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210211 [1,1,0,0,0,0|1,0,0]=3 8739 B14R1.16 CCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210211 [1,1,0,0,0,0|1,0,0]=3 8740 B14R1.16 CCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210211 [1,1,0,0,0,0|1,0,0]=3 8741 B14R1.16 CCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210211 [1,1,0,0,0,0|1,0,0]=3 8742 B14R1.16 CCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210211 [1,1,0,0,0,0|1,0,0]=3 8743 B14R1.16 CCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210211 [1,1,0,0,0,0|1,0,0]=3 8744 B14R1.16 CCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210211 [1,1,0,0,0,0|1,0,0]=3 8745 B14R1.16 CCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210211 [1,1,0,0,0,0|1,0,0]=3 8746 B14R1.16 CCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210211 [1,1,0,0,0,0|1,0,0]=3 8747 B14R1.16 CCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210211 [1,1,0,0,0,0|1,0,0]=3 8748 B14R1.16 CCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210211 [1,1,0,0,0,0|1,0,0]=3 8749 B14R1.16 CCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210211 [1,1,0,0,0,0|1,0,0]=3 8750 B14R1.16 CCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210211 [1,1,0,0,0,0|1,0,0]=3 8751 B14R1.16 CCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210211 [1,1,0,0,0,0|1,0,0]=3 8752 B14R1.16 CCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210211 [1,1,0,0,0,0|1,0,0]=3 8753 B14R1.16 CCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210211 [1,1,0,0,0,0|1,0,0]=3 8754 B14R1.16 CCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210211 [1,1,0,0,0,0|1,0,0]=3 8755 B14R1.16 CCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210211 [1,1,0,0,0,0|1,0,0]=3 8756 B14R1.16 CCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210211 [1,1,0,0,0,0|1,0,0]=3 8757 B14R1.16 CCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210211 [1,1,0,0,0,0|1,0,0]=3 8758 B14R1.16 CCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210211 [1,1,0,0,0,0|1,0,0]=3 8759 B14R1.16 CCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210211 [1,1,0,0,0,0|1,0,0]=3 8760 B14R1.16 CCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210211 [1,1,0,0,0,0|1,0,0]=3 8761 B14R1.16 CCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210211 [1,1,0,0,0,0|1,0,0]=3 8762 B14R1.16 CCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210211 [1,1,0,0,0,0|1,0,0]=3 8763 B14R1.16 CCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210211 [1,1,0,0,0,0|1,0,0]=3 8764 B14R1.16 CCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210211 [1,1,0,0,0,0|0,0,0]=2 8765 B14R1.16 CCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210211 [1,1,0,0,0,0|0,0,0]=2 8766 B14R1.16 CCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210211 [1,1,0,0,0,0|0,0,0]=2 8767 B14R1.16 CCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210211 [1,1,0,0,0,0|0,0,0]=2 8768 B14R1.16 CCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210211 [1,1,0,0,0,0|0,0,0]=2 8769 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 11a_100020643023_100012360534 [1,1,0,0,0,0|2,0,0]=4 8770 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 1626a_100020643023_100012360534 [1,1,0,0,0,0|2,0,0]=4 8771 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 240690a_100020643023_100012360534 [1,1,0,0,0,0|2,0,0]=4 8772 B14R1.16 CCCNC(=O)c1cccc(c1Br)Br 527a_100020643023_100012360534 [1,1,0,0,0,0|2,0,0]=4 8773 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 11a_100020643023_100000692419 [1,1,0,0,0,0|2,0,0]=4 8774 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 1626a_100020643023_100000692419 [1,1,0,0,0,0|2,0,0]=4 8775 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 240690a_100020643023_100000692419 [1,1,0,0,0,0|2,0,0]=4 8776 B14R1.16 CCCNC(=O)c1cccc(c1Br)C 527a_100020643023_100000692419 [1,1,0,0,0,0|2,0,0]=4 8777 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 11a_100020643023_100012339722 [1,1,0,0,0,0|2,0,0]=4 8778 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 1626a_100020643023_100012339722 [1,1,0,0,0,0|2,0,0]=4 8779 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 240690a_100020643023_100012339722 [1,1,0,0,0,0|2,0,0]=4 8780 B14R1.16 CCCNC(=O)c1cccc(c1Br)Cl 527a_100020643023_100012339722 [1,1,0,0,0,0|2,0,0]=4 8781 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 11a_100020643023_100011217547 [1,1,0,0,0,0|2,0,0]=4 8782 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 1626a_100020643023_100011217547 [1,1,0,0,0,0|2,0,0]=4 8783 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 240690a_100020643023_100011217547 [1,1,0,0,0,0|2,0,0]=4 8784 B14R1.16 CCCNC(=O)c1cccc(c1Br)F 527a_100020643023_100011217547 [1,1,0,0,0,0|2,0,0]=4 8785 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 11a_100020643023_100010232522 [1,1,0,0,0,0|2,0,0]=4 8786 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 1626a_100020643023_100010232522 [1,1,0,0,0,0|2,0,0]=4 8787 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 240690a_100020643023_100010232522 [1,1,0,0,0,0|2,0,0]=4 8788 B14R1.16 CCCNC(=O)c1cccc(c1Br)I 527a_100020643023_100010232522 [1,1,0,0,0,0|2,0,0]=4 8789 B14R1.16 CCCNC(=O)c1cccc(c1Br)O 240690a_100020643023_100010230362 [1,1,0,0,0,0|2,0,0]=4 8790 B14R1.16 CCCNC(=O)c1cccc(c1Br)O 527a_100020643023_100010230362 [1,1,0,0,0,0|2,0,0]=4 8791 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 11a_100020643023_100000760464 [1,1,0,0,0,0|2,0,0]=4 8792 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 1626a_100020643023_100000760464 [1,1,0,0,0,0|2,0,0]=4 8793 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 240690a_100020643023_100000760464 [1,1,0,0,0,0|2,0,0]=4 8794 B14R1.16 CCCNC(=O)c1cccc(c1C)Br 527a_100020643023_100000760464 [1,1,0,0,0,0|2,0,0]=4 8795 B14R1.16 CCCNC(=O)c1cccc(c1C)C 11a_100020643023_100000183679 [1,1,0,0,0,0|2,0,0]=4 8796 B14R1.16 CCCNC(=O)c1cccc(c1C)C 1626a_100020643023_100000183679 [1,1,0,0,0,0|2,0,0]=4 8797 B14R1.16 CCCNC(=O)c1cccc(c1C)C 240690a_100020643023_100000183679 [1,1,0,0,0,0|2,0,0]=4 8798 B14R1.16 CCCNC(=O)c1cccc(c1C)C 527a_100020643023_100000183679 [1,1,0,0,0,0|2,0,0]=4 8799 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 11a_100020643023_100000690184 [1,1,0,0,0,0|2,0,0]=4 8800 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 1626a_100020643023_100000690184 [1,1,0,0,0,0|2,0,0]=4 8801 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 240690a_100020643023_100000690184 [1,1,0,0,0,0|2,0,0]=4 8802 B14R1.16 CCCNC(=O)c1cccc(c1C)Cl 527a_100020643023_100000690184 [1,1,0,0,0,0|2,0,0]=4 8803 B14R1.16 CCCNC(=O)c1cccc(c1C)F 11a_100020643023_100011218272 [1,1,0,0,0,0|2,0,0]=4 8804 B14R1.16 CCCNC(=O)c1cccc(c1C)F 1626a_100020643023_100011218272 [1,1,0,0,0,0|2,0,0]=4 8805 B14R1.16 CCCNC(=O)c1cccc(c1C)F 240690a_100020643023_100011218272 [1,1,0,0,0,0|2,0,0]=4 8806 B14R1.16 CCCNC(=O)c1cccc(c1C)F 527a_100020643023_100011218272 [1,1,0,0,0,0|2,0,0]=4 8807 B14R1.16 CCCNC(=O)c1cccc(c1C)I 11a_100020643023_100000751865 [1,1,0,0,0,0|2,0,0]=4 8808 B14R1.16 CCCNC(=O)c1cccc(c1C)I 1626a_100020643023_100000751865 [1,1,0,0,0,0|2,0,0]=4 8809 B14R1.16 CCCNC(=O)c1cccc(c1C)I 240690a_100020643023_100000751865 [1,1,0,0,0,0|2,0,0]=4 8810 B14R1.16 CCCNC(=O)c1cccc(c1C)I 527a_100020643023_100000751865 [1,1,0,0,0,0|2,0,0]=4 8811 B14R1.16 CCCNC(=O)c1cccc(c1C)O 240690a_100020643023_100000766327 [1,1,0,0,0,0|2,0,0]=4 8812 B14R1.16 CCCNC(=O)c1cccc(c1C)O 527a_100020643023_100000766327 [1,1,0,0,0,0|2,0,0]=4 8813 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 11a_100020643023_100000760540 [1,1,0,0,0,0|2,0,0]=4 8814 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 1626a_100020643023_100000760540 [1,1,0,0,0,0|2,0,0]=4 8815 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 240690a_100020643023_100000760540 [1,1,0,0,0,0|2,0,0]=4 8816 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Br 527a_100020643023_100000760540 [1,1,0,0,0,0|2,0,0]=4 8817 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 11a_100020643023_100000693142 [1,1,0,0,0,0|2,0,0]=4 8818 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 1626a_100020643023_100000693142 [1,1,0,0,0,0|2,0,0]=4 8819 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 240690a_100020643023_100000693142 [1,1,0,0,0,0|2,0,0]=4 8820 B14R1.16 CCCNC(=O)c1cccc(c1Cl)C 527a_100020643023_100000693142 [1,1,0,0,0,0|2,0,0]=4 8821 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 11a_100020643023_100000183631 [1,1,0,0,0,0|2,0,0]=4 8822 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 1626a_100020643023_100000183631 [1,1,0,0,0,0|2,0,0]=4 8823 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 240690a_100020643023_100000183631 [1,1,0,0,0,0|2,0,0]=4 8824 B14R1.16 CCCNC(=O)c1cccc(c1Cl)Cl 527a_100020643023_100000183631 [1,1,0,0,0,0|2,0,0]=4 8825 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 11a_100020643023_100000759904 [1,1,0,0,0,0|2,0,0]=4 8826 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 1626a_100020643023_100000759904 [1,1,0,0,0,0|2,0,0]=4 8827 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 240690a_100020643023_100000759904 [1,1,0,0,0,0|2,0,0]=4 8828 B14R1.16 CCCNC(=O)c1cccc(c1Cl)F 527a_100020643023_100000759904 [1,1,0,0,0,0|2,0,0]=4 8829 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 11a_100020643023_100010176783 [1,1,0,0,0,0|2,0,0]=4 8830 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 1626a_100020643023_100010176783 [1,1,0,0,0,0|2,0,0]=4 8831 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 240690a_100020643023_100010176783 [1,1,0,0,0,0|2,0,0]=4 8832 B14R1.16 CCCNC(=O)c1cccc(c1Cl)I 527a_100020643023_100010176783 [1,1,0,0,0,0|2,0,0]=4 8833 B14R1.16 CCCNC(=O)c1cccc(c1Cl)O 240690a_100020643023_100000092362 [1,1,0,0,0,0|2,0,0]=4 8834 B14R1.16 CCCNC(=O)c1cccc(c1Cl)O 527a_100020643023_100000092362 [1,1,0,0,0,0|2,0,0]=4 8835 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 11a_100020643023_100000756403 [1,1,0,0,0,0|2,0,0]=4 8836 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 1626a_100020643023_100000756403 [1,1,0,0,0,0|2,0,0]=4 8837 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 240690a_100020643023_100000756403 [1,1,0,0,0,0|2,0,0]=4 8838 B14R1.16 CCCNC(=O)c1cccc(c1F)Br 527a_100020643023_100000756403 [1,1,0,0,0,0|2,0,0]=4 8839 B14R1.16 CCCNC(=O)c1cccc(c1F)C 11a_100020643023_100000766181 [1,1,0,0,0,0|2,0,0]=4 8840 B14R1.16 CCCNC(=O)c1cccc(c1F)C 1626a_100020643023_100000766181 [1,1,0,0,0,0|2,0,0]=4 8841 B14R1.16 CCCNC(=O)c1cccc(c1F)C 240690a_100020643023_100000766181 [1,1,0,0,0,0|2,0,0]=4 8842 B14R1.16 CCCNC(=O)c1cccc(c1F)C 527a_100020643023_100000766181 [1,1,0,0,0,0|2,0,0]=4 8843 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 11a_100020643023_100000688816 [1,1,0,0,0,0|2,0,0]=4 8844 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 1626a_100020643023_100000688816 [1,1,0,0,0,0|2,0,0]=4 8845 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 240690a_100020643023_100000688816 [1,1,0,0,0,0|2,0,0]=4 8846 B14R1.16 CCCNC(=O)c1cccc(c1F)Cl 527a_100020643023_100000688816 [1,1,0,0,0,0|2,0,0]=4 8847 B14R1.16 CCCNC(=O)c1cccc(c1F)F 11a_100020643023_100000748134 [1,1,0,0,0,0|2,0,0]=4 8848 B14R1.16 CCCNC(=O)c1cccc(c1F)F 1626a_100020643023_100000748134 [1,1,0,0,0,0|2,0,0]=4 8849 B14R1.16 CCCNC(=O)c1cccc(c1F)F 240690a_100020643023_100000748134 [1,1,0,0,0,0|2,0,0]=4 8850 B14R1.16 CCCNC(=O)c1cccc(c1F)F 527a_100020643023_100000748134 [1,1,0,0,0,0|2,0,0]=4 8851 B14R1.16 CCCNC(=O)c1cccc(c1F)I 11a_100020643023_100010185205 [1,1,0,0,0,0|2,0,0]=4 8852 B14R1.16 CCCNC(=O)c1cccc(c1F)I 1626a_100020643023_100010185205 [1,1,0,0,0,0|2,0,0]=4 8853 B14R1.16 CCCNC(=O)c1cccc(c1F)I 240690a_100020643023_100010185205 [1,1,0,0,0,0|2,0,0]=4 8854 B14R1.16 CCCNC(=O)c1cccc(c1F)I 527a_100020643023_100010185205 [1,1,0,0,0,0|2,0,0]=4 8855 B14R1.16 CCCNC(=O)c1cccc(c1F)O 240690a_100020643023_100000037433 [1,1,0,0,0,0|2,0,0]=4 8856 B14R1.16 CCCNC(=O)c1cccc(c1F)O 527a_100020643023_100000037433 [1,1,0,0,0,0|2,0,0]=4 8857 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 11a_100020643023_100000688019 [1,1,0,0,0,0|2,0,0]=4 8858 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 1626a_100020643023_100000688019 [1,1,0,0,0,0|2,0,0]=4 8859 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 240690a_100020643023_100000688019 [1,1,0,0,0,0|2,0,0]=4 8860 B14R1.16 CCCNC(=O)c1cccc(c1I)Br 527a_100020643023_100000688019 [1,1,0,0,0,0|2,0,0]=4 8861 B14R1.16 CCCNC(=O)c1cccc(c1I)C 11a_100020643023_100000739377 [1,1,0,0,0,0|2,0,0]=4 8862 B14R1.16 CCCNC(=O)c1cccc(c1I)C 1626a_100020643023_100000739377 [1,1,0,0,0,0|2,0,0]=4 8863 B14R1.16 CCCNC(=O)c1cccc(c1I)C 240690a_100020643023_100000739377 [1,1,0,0,0,0|2,0,0]=4 8864 B14R1.16 CCCNC(=O)c1cccc(c1I)C 527a_100020643023_100000739377 [1,1,0,0,0,0|2,0,0]=4 8865 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 11a_100020643023_100010176784 [1,1,0,0,0,0|2,0,0]=4 8866 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 1626a_100020643023_100010176784 [1,1,0,0,0,0|2,0,0]=4 8867 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 240690a_100020643023_100010176784 [1,1,0,0,0,0|2,0,0]=4 8868 B14R1.16 CCCNC(=O)c1cccc(c1I)Cl 527a_100020643023_100010176784 [1,1,0,0,0,0|2,0,0]=4 8869 B14R1.16 CCCNC(=O)c1cccc(c1I)F 11a_100020643023_100000690930 [1,1,0,0,0,0|2,0,0]=4 8870 B14R1.16 CCCNC(=O)c1cccc(c1I)F 1626a_100020643023_100000690930 [1,1,0,0,0,0|2,0,0]=4 8871 B14R1.16 CCCNC(=O)c1cccc(c1I)F 240690a_100020643023_100000690930 [1,1,0,0,0,0|2,0,0]=4 8872 B14R1.16 CCCNC(=O)c1cccc(c1I)F 527a_100020643023_100000690930 [1,1,0,0,0,0|2,0,0]=4 8873 B14R1.16 CCCNC(=O)c1cccc(c1I)O 527a_100020643023_100010084636 [1,1,0,0,0,0|2,0,0]=4 8874 B14R1.16 CCCNC(=O)c1cccc(c1O)Br 240690a_100020643023_100000752940 [1,1,0,0,0,0|1,0,0]=3 8875 B14R1.16 CCCNC(=O)c1cccc(c1O)Br 527a_100020643023_100000752940 [1,1,0,0,0,0|1,0,0]=3 8876 B14R1.16 CCCNC(=O)c1cccc(c1O)C 240690a_100020643023_100000183896 [1,1,0,0,0,0|1,0,0]=3 8877 B14R1.16 CCCNC(=O)c1cccc(c1O)C 527a_100020643023_100000183896 [1,1,0,0,0,0|1,0,0]=3 8878 B14R1.16 CCCNC(=O)c1cccc(c1O)Cl 240690a_100020643023_100000742801 [1,1,0,0,0,0|1,0,0]=3 8879 B14R1.16 CCCNC(=O)c1cccc(c1O)Cl 527a_100020643023_100000742801 [1,1,0,0,0,0|1,0,0]=3 8880 B14R1.16 CCCNC(=O)c1cccc(c1O)F 240690a_100020643023_100011217230 [1,1,0,0,0,0|1,0,0]=3 8881 B14R1.16 CCCNC(=O)c1cccc(c1O)F 527a_100020643023_100011217230 [1,1,0,0,0,0|1,0,0]=3 8882 B14R1.16 CCCNC(=O)c1cccc(c1O)O 527a_100020643023_100000690420 [1,1,0,0,0,0|1,0,0]=3 8883 B14R1.16 CCNCC(=O)c1cccc(c1F)Br 2230a_100015525214_100012356374 [1,1,0,0,0,0|2,0,0]=4 8884 B14R1.16 CCNCC(=O)c1cccc(c1F)Cl 2230a_100015525214_200012351890 [1,1,0,0,0,0|2,0,0]=4 8885 B14R1.16 CCNNC(=O)c1cccc(c1O)Br 22a_100000756455_100000752940 [1,1,0,0,0,0|2,0,0]=4 8886 B14R1.16 CCNNC(=O)c1cccc(c1O)C 22a_100000756455_100000183896 [1,1,0,0,0,0|2,0,0]=4 8887 B14R1.16 CCNNC(=O)c1cccc(c1O)Cl 22a_100000756455_100000742801 [1,1,0,0,0,0|2,0,0]=4 8888 B14R1.16 CCNNC(=O)c1cccc(c1O)F 22a_100000756455_100011217230 [1,1,0,0,0,0|2,0,0]=4 8889 B14R1.16 CCNNC(=O)c1cccc(c1O)O 22a_100000756455_100000690420 [1,1,0,0,0,0|2,0,0]=4 8890 B14R1.16 CCOCC(=O)c1cccc(c1C)I 34a_100121572206_100160470822 [1,1,0,0,0,0|2,0,0]=4 8891 B14R1.16 CCOCC(=O)c1cccc(c1F)Br 34a_100121572206_100012356374 [1,1,0,0,0,0|2,0,0]=4 8892 B14R1.16 CCOCC(=O)c1cccc(c1F)Cl 34a_100121572206_200012351890 [1,1,0,0,0,0|2,0,0]=4 8893 B14R1.16 CCSCC(=O)c1cccc(c1C)I 62a_100000210202_100160470822 [1,1,0,0,0,0|2,0,0]=4 8894 B14R1.16 CCSCC(=O)c1cccc(c1C)I 62a_100160470822_100000210202 [1,1,0,0,0,0|2,0,0]=4 8895 B14R1.16 CCSCC(=O)c1cccc(c1F)Br 62a_100000210202_100012356374 [1,1,0,0,0,0|2,0,0]=4 8896 B14R1.16 CCSCC(=O)c1cccc(c1F)Br 62a_100012356374_100000210202 [1,1,0,0,0,0|2,0,0]=4 8897 B14R1.16 CCSCC(=O)c1cccc(c1F)Cl 62a_100000210202_200012351890 [1,1,0,0,0,0|2,0,0]=4 8898 B14R1.16 CCSCC(=O)c1cccc(c1F)Cl 62a_200012351890_100000210202 [1,1,0,0,0,0|2,0,0]=4 8899 B14R1.16 COCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000233755 [1,1,0,0,0,0|2,0,0]=4 8900 B14R1.16 COCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000233755 [1,1,0,0,0,0|2,0,0]=4 8901 B14R1.16 COCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000233755 [1,1,0,0,0,0|2,0,0]=4 8902 B14R1.16 COCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000233755 [1,1,0,0,0,0|2,0,0]=4 8903 B14R1.16 COCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000233755 [1,1,0,0,0,0|2,0,0]=4 8904 B14R1.16 COCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000233755 [1,1,0,0,0,0|2,0,0]=4 8905 B14R1.16 COCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000233755 [1,1,0,0,0,0|2,0,0]=4 8906 B14R1.16 COCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000233755 [1,1,0,0,0,0|2,0,0]=4 8907 B14R1.16 COCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000233755 [1,1,0,0,0,0|2,0,0]=4 8908 B14R1.16 COCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000233755 [1,1,0,0,0,0|2,0,0]=4 8909 B14R1.16 COCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000233755 [1,1,0,0,0,0|2,0,0]=4 8910 B14R1.16 COCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000233755 [1,1,0,0,0,0|2,0,0]=4 8911 B14R1.16 COCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000233755 [1,1,0,0,0,0|2,0,0]=4 8912 B14R1.16 COCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000233755 [1,1,0,0,0,0|2,0,0]=4 8913 B14R1.16 COCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000233755 [1,1,0,0,0,0|2,0,0]=4 8914 B14R1.16 COCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000233755 [1,1,0,0,0,0|2,0,0]=4 8915 B14R1.16 COCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000233755 [1,1,0,0,0,0|2,0,0]=4 8916 B14R1.16 COCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000233755 [1,1,0,0,0,0|2,0,0]=4 8917 B14R1.16 COCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000233755 [1,1,0,0,0,0|2,0,0]=4 8918 B14R1.16 COCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000233755 [1,1,0,0,0,0|2,0,0]=4 8919 B14R1.16 COCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000233755 [1,1,0,0,0,0|2,0,0]=4 8920 B14R1.16 COCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000233755 [1,1,0,0,0,0|2,0,0]=4 8921 B14R1.16 COCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000233755 [1,1,0,0,0,0|2,0,0]=4 8922 B14R1.16 COCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000233755 [1,1,0,0,0,0|2,0,0]=4 8923 B14R1.16 COCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000233755 [1,1,0,0,0,0|2,0,0]=4 8924 B14R1.16 COCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000233755 [1,1,0,0,0,0|2,0,0]=4 8925 B14R1.16 COCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000233755 [1,1,0,0,0,0|2,0,0]=4 8926 B14R1.16 COCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000233755 [1,1,0,0,0,0|2,0,0]=4 8927 B14R1.16 COCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000233755 [1,1,0,0,0,0|2,0,0]=4 8928 B14R1.16 COCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000233755 [1,1,0,0,0,0|1,0,0]=3 8929 B14R1.16 COCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000233755 [1,1,0,0,0,0|1,0,0]=3 8930 B14R1.16 COCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000233755 [1,1,0,0,0,0|1,0,0]=3 8931 B14R1.16 COCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000233755 [1,1,0,0,0,0|1,0,0]=3 8932 B14R1.16 COCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000233755 [1,1,0,0,0,0|1,0,0]=3 8933 B14R1.16 CSCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000751147 [1,1,0,0,0,0|2,0,0]=4 8934 B14R1.16 CSCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000751147 [1,1,0,0,0,0|2,0,0]=4 8935 B14R1.16 CSCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000751147 [1,1,0,0,0,0|2,0,0]=4 8936 B14R1.16 CSCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000751147 [1,1,0,0,0,0|2,0,0]=4 8937 B14R1.16 CSCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000751147 [1,1,0,0,0,0|2,0,0]=4 8938 B14R1.16 CSCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000751147 [1,1,0,0,0,0|2,0,0]=4 8939 B14R1.16 CSCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000751147 [1,1,0,0,0,0|2,0,0]=4 8940 B14R1.16 CSCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000751147 [1,1,0,0,0,0|2,0,0]=4 8941 B14R1.16 CSCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000751147 [1,1,0,0,0,0|2,0,0]=4 8942 B14R1.16 CSCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000751147 [1,1,0,0,0,0|2,0,0]=4 8943 B14R1.16 CSCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000751147 [1,1,0,0,0,0|2,0,0]=4 8944 B14R1.16 CSCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000751147 [1,1,0,0,0,0|2,0,0]=4 8945 B14R1.16 CSCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000751147 [1,1,0,0,0,0|2,0,0]=4 8946 B14R1.16 CSCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000751147 [1,1,0,0,0,0|2,0,0]=4 8947 B14R1.16 CSCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000751147 [1,1,0,0,0,0|2,0,0]=4 8948 B14R1.16 CSCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000751147 [1,1,0,0,0,0|2,0,0]=4 8949 B14R1.16 CSCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000751147 [1,1,0,0,0,0|2,0,0]=4 8950 B14R1.16 CSCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000751147 [1,1,0,0,0,0|2,0,0]=4 8951 B14R1.16 CSCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000751147 [1,1,0,0,0,0|2,0,0]=4 8952 B14R1.16 CSCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000751147 [1,1,0,0,0,0|2,0,0]=4 8953 B14R1.16 CSCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000751147 [1,1,0,0,0,0|2,0,0]=4 8954 B14R1.16 CSCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000751147 [1,1,0,0,0,0|2,0,0]=4 8955 B14R1.16 CSCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000751147 [1,1,0,0,0,0|2,0,0]=4 8956 B14R1.16 CSCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000751147 [1,1,0,0,0,0|2,0,0]=4 8957 B14R1.16 CSCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000751147 [1,1,0,0,0,0|2,0,0]=4 8958 B14R1.16 CSCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000751147 [1,1,0,0,0,0|2,0,0]=4 8959 B14R1.16 CSCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000751147 [1,1,0,0,0,0|2,0,0]=4 8960 B14R1.16 CSCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000751147 [1,1,0,0,0,0|2,0,0]=4 8961 B14R1.16 CSCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000751147 [1,1,0,0,0,0|2,0,0]=4 8962 B14R1.16 CSCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000751147 [1,1,0,0,0,0|1,0,0]=3 8963 B14R1.16 CSCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000751147 [1,1,0,0,0,0|1,0,0]=3 8964 B14R1.16 CSCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000751147 [1,1,0,0,0,0|1,0,0]=3 8965 B14R1.16 CSCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000751147 [1,1,0,0,0,0|1,0,0]=3 8966 B14R1.16 CSCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000751147 [1,1,0,0,0,0|1,0,0]=3 8967 B14R1.16 Cc1c(cccc1C(=O)CCCF)Br 1458a_100000760464_100011934791 [1,1,0,0,0,0|2,0,0]=4 8968 B14R1.16 Cc1c(cccc1C(=O)CCCF)Cl 1458a_100000690184_100011934791 [1,1,0,0,0,0|2,0,0]=4 8969 B14R1.16 Cc1c(cccc1C(=O)CCCF)F 1458a_100011218272_100011934791 [1,1,0,0,0,0|2,0,0]=4 8970 B14R1.16 Cc1c(cccc1C(=O)CCCF)I 1458a_100000751865_100011934791 [1,1,0,0,0,0|2,0,0]=4 8971 B14R1.16 Cc1c(cccc1C(=O)CCCF)O 1458a_100000766327_100011934791 [1,1,0,0,0,0|2,0,0]=4 8972 B14R1.16 Cc1c(cccc1C(=O)CCCO)Br 1458a_100000760464_100011215043 [1,1,0,0,0,0|2,0,0]=4 8973 B14R1.16 Cc1c(cccc1C(=O)CCCO)Cl 1458a_100000690184_100011215043 [1,1,0,0,0,0|2,0,0]=4 8974 B14R1.16 Cc1c(cccc1C(=O)CCCO)F 1458a_100011218272_100011215043 [1,1,0,0,0,0|2,0,0]=4 8975 B14R1.16 Cc1c(cccc1C(=O)CCCO)I 1458a_100000751865_100011215043 [1,1,0,0,0,0|2,0,0]=4 8976 B14R1.16 Cc1c(cccc1C(=O)CCCO)O 1458a_100000766327_100011215043 [1,1,0,0,0,0|2,0,0]=4 8977 B14R1.16 Cc1cccc(c1Br)C(=O)CCCF 1458a_100000692419_100011934791 [1,1,0,0,0,0|2,0,0]=4 8978 B14R1.16 Cc1cccc(c1Br)C(=O)CCCO 1458a_100000692419_100011215043 [1,1,0,0,0,0|2,0,0]=4 8979 B14R1.16 Cc1cccc(c1C)C(=O)CCCF 1458a_100000183679_100011934791 [1,1,0,0,0,0|2,0,0]=4 8980 B14R1.16 Cc1cccc(c1C)C(=O)CCCO 1458a_100000183679_100011215043 [1,1,0,0,0,0|2,0,0]=4 8981 B14R1.16 Cc1cccc(c1Cl)C(=O)CCCF 1458a_100000693142_100011934791 [1,1,0,0,0,0|2,0,0]=4 8982 B14R1.16 Cc1cccc(c1Cl)C(=O)CCCO 1458a_100000693142_100011215043 [1,1,0,0,0,0|2,0,0]=4 8983 B14R1.16 Cc1cccc(c1F)C(=O)CCCF 1458a_100000766181_100011934791 [1,1,0,0,0,0|2,0,0]=4 8984 B14R1.16 Cc1cccc(c1F)C(=O)CCCO 1458a_100000766181_100011215043 [1,1,0,0,0,0|2,0,0]=4 8985 B14R1.16 Cc1cccc(c1I)C(=O)CCCF 1458a_100000739377_100011934791 [1,1,0,0,0,0|2,0,0]=4 8986 B14R1.16 Cc1cccc(c1I)C(=O)CCCO 1458a_100000739377_100011215043 [1,1,0,0,0,0|2,0,0]=4 8987 B14R1.16 Cc1cccc(c1O)C(=O)CCC#N 1458a_100000183896_100011215226 [1,1,0,0,0,0|1,0,1]=4 8988 B14R1.16 Cc1cccc(c1O)C(=O)CCCF 1458a_100000183896_100011934791 [1,1,0,0,0,0|1,0,0]=3 8989 B14R1.16 Cc1cccc(c1O)C(=O)CCCO 1458a_100000183896_100011215043 [1,1,0,0,0,0|1,0,0]=3 8990 B14R1.16 Cc1cccc(c1O)C(=O)NCCF 240690a_100000724931_100000183896 [1,1,0,0,0,0|2,0,0]=4 8991 B14R1.16 Cc1cccc(c1O)C(=O)NCCF 527a_100000724931_100000183896 [1,1,0,0,0,0|2,0,0]=4 8992 B14R1.16 Cc1cccc(c1O)C(=O)NCCO 240690a_100000210304_100000183896 [1,1,0,0,0,0|2,0,0]=4 8993 B14R1.16 Cc1cccc(c1O)C(=O)NCCO 527a_100000210304_100000183896 [1,1,0,0,0,0|2,0,0]=4 8994 B14R1.16 N#CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215226 [1,1,0,0,0,0|1,0,1]=4 8995 B14R1.16 N#CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215226 [1,1,0,0,0,0|1,0,1]=4 8996 B14R1.16 N#CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215226 [1,1,0,0,0,0|1,0,1]=4 8997 B14R1.16 N#CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215226 [1,1,0,0,0,0|1,0,1]=4 8998 B14R1.16 O=C(CCCF)c1cccc(c1Br)Br 1458a_100012360534_100011934791 [1,1,0,0,0,0|2,0,0]=4 8999 B14R1.16 O=C(CCCF)c1cccc(c1Br)Cl 1458a_100012339722_100011934791 [1,1,0,0,0,0|2,0,0]=4 9000 B14R1.16 O=C(CCCF)c1cccc(c1Br)F 1458a_100011217547_100011934791 [1,1,0,0,0,0|2,0,0]=4 9001 B14R1.16 O=C(CCCF)c1cccc(c1Br)I 1458a_100010232522_100011934791 [1,1,0,0,0,0|2,0,0]=4 9002 B14R1.16 O=C(CCCF)c1cccc(c1Br)O 1458a_100010230362_100011934791 [1,1,0,0,0,0|2,0,0]=4 9003 B14R1.16 O=C(CCCF)c1cccc(c1Cl)Br 1458a_100000760540_100011934791 [1,1,0,0,0,0|2,0,0]=4 9004 B14R1.16 O=C(CCCF)c1cccc(c1Cl)Cl 1458a_100000183631_100011934791 [1,1,0,0,0,0|2,0,0]=4 9005 B14R1.16 O=C(CCCF)c1cccc(c1Cl)F 1458a_100000759904_100011934791 [1,1,0,0,0,0|2,0,0]=4 9006 B14R1.16 O=C(CCCF)c1cccc(c1Cl)I 1458a_100010176783_100011934791 [1,1,0,0,0,0|2,0,0]=4 9007 B14R1.16 O=C(CCCF)c1cccc(c1Cl)O 1458a_100000092362_100011934791 [1,1,0,0,0,0|2,0,0]=4 9008 B14R1.16 O=C(CCCF)c1cccc(c1F)Br 1458a_100000756403_100011934791 [1,1,0,0,0,0|2,0,0]=4 9009 B14R1.16 O=C(CCCF)c1cccc(c1F)Cl 1458a_100000688816_100011934791 [1,1,0,0,0,0|2,0,0]=4 9010 B14R1.16 O=C(CCCF)c1cccc(c1F)F 1458a_100000748134_100011934791 [1,1,0,0,0,0|2,0,0]=4 9011 B14R1.16 O=C(CCCF)c1cccc(c1F)I 1458a_100010185205_100011934791 [1,1,0,0,0,0|2,0,0]=4 9012 B14R1.16 O=C(CCCF)c1cccc(c1F)O 1458a_100000037433_100011934791 [1,1,0,0,0,0|2,0,0]=4 9013 B14R1.16 O=C(CCCF)c1cccc(c1I)Br 1458a_100000688019_100011934791 [1,1,0,0,0,0|2,0,0]=4 9014 B14R1.16 O=C(CCCF)c1cccc(c1I)Cl 1458a_100010176784_100011934791 [1,1,0,0,0,0|2,0,0]=4 9015 B14R1.16 O=C(CCCF)c1cccc(c1I)F 1458a_100000690930_100011934791 [1,1,0,0,0,0|2,0,0]=4 9016 B14R1.16 O=C(CCCF)c1cccc(c1I)O 1458a_100010084636_100011934791 [1,1,0,0,0,0|2,0,0]=4 9017 B14R1.16 O=C(CCCF)c1cccc(c1O)Br 1458a_100000752940_100011934791 [1,1,0,0,0,0|1,0,0]=3 9018 B14R1.16 O=C(CCCF)c1cccc(c1O)Cl 1458a_100000742801_100011934791 [1,1,0,0,0,0|1,0,0]=3 9019 B14R1.16 O=C(CCCF)c1cccc(c1O)F 1458a_100011217230_100011934791 [1,1,0,0,0,0|1,0,0]=3 9020 B14R1.16 O=C(CCCF)c1cccc(c1O)O 1458a_100000690420_100011934791 [1,1,0,0,0,0|1,0,0]=3 9021 B14R1.16 O=C(CCCO)c1cccc(c1Br)Br 1458a_100012360534_100011215043 [1,1,0,0,0,0|2,0,0]=4 9022 B14R1.16 O=C(CCCO)c1cccc(c1Br)Cl 1458a_100012339722_100011215043 [1,1,0,0,0,0|2,0,0]=4 9023 B14R1.16 O=C(CCCO)c1cccc(c1Br)F 1458a_100011217547_100011215043 [1,1,0,0,0,0|2,0,0]=4 9024 B14R1.16 O=C(CCCO)c1cccc(c1Br)I 1458a_100010232522_100011215043 [1,1,0,0,0,0|2,0,0]=4 9025 B14R1.16 O=C(CCCO)c1cccc(c1Br)O 1458a_100010230362_100011215043 [1,1,0,0,0,0|2,0,0]=4 9026 B14R1.16 O=C(CCCO)c1cccc(c1Cl)Br 1458a_100000760540_100011215043 [1,1,0,0,0,0|2,0,0]=4 9027 B14R1.16 O=C(CCCO)c1cccc(c1Cl)Cl 1458a_100000183631_100011215043 [1,1,0,0,0,0|2,0,0]=4 9028 B14R1.16 O=C(CCCO)c1cccc(c1Cl)F 1458a_100000759904_100011215043 [1,1,0,0,0,0|2,0,0]=4 9029 B14R1.16 O=C(CCCO)c1cccc(c1Cl)I 1458a_100010176783_100011215043 [1,1,0,0,0,0|2,0,0]=4 9030 B14R1.16 O=C(CCCO)c1cccc(c1Cl)O 1458a_100000092362_100011215043 [1,1,0,0,0,0|2,0,0]=4 9031 B14R1.16 O=C(CCCO)c1cccc(c1F)Br 1458a_100000756403_100011215043 [1,1,0,0,0,0|2,0,0]=4 9032 B14R1.16 O=C(CCCO)c1cccc(c1F)Cl 1458a_100000688816_100011215043 [1,1,0,0,0,0|2,0,0]=4 9033 B14R1.16 O=C(CCCO)c1cccc(c1F)F 1458a_100000748134_100011215043 [1,1,0,0,0,0|2,0,0]=4 9034 B14R1.16 O=C(CCCO)c1cccc(c1F)I 1458a_100010185205_100011215043 [1,1,0,0,0,0|2,0,0]=4 9035 B14R1.16 O=C(CCCO)c1cccc(c1F)O 1458a_100000037433_100011215043 [1,1,0,0,0,0|2,0,0]=4 9036 B14R1.16 O=C(CCCO)c1cccc(c1I)Br 1458a_100000688019_100011215043 [1,1,0,0,0,0|2,0,0]=4 9037 B14R1.16 O=C(CCCO)c1cccc(c1I)Cl 1458a_100010176784_100011215043 [1,1,0,0,0,0|2,0,0]=4 9038 B14R1.16 O=C(CCCO)c1cccc(c1I)F 1458a_100000690930_100011215043 [1,1,0,0,0,0|2,0,0]=4 9039 B14R1.16 O=C(CCCO)c1cccc(c1I)O 1458a_100010084636_100011215043 [1,1,0,0,0,0|2,0,0]=4 9040 B14R1.16 O=C(CCCO)c1cccc(c1O)Br 1458a_100000752940_100011215043 [1,1,0,0,0,0|1,0,0]=3 9041 B14R1.16 O=C(CCCO)c1cccc(c1O)Cl 1458a_100000742801_100011215043 [1,1,0,0,0,0|1,0,0]=3 9042 B14R1.16 O=C(CCCO)c1cccc(c1O)F 1458a_100011217230_100011215043 [1,1,0,0,0,0|1,0,0]=3 9043 B14R1.16 O=C(CCCO)c1cccc(c1O)O 1458a_100000690420_100011215043 [1,1,0,0,0,0|1,0,0]=3 9044 B14R1.16 O=C(NCCF)c1cccc(c1O)Br 240690a_100000724931_100000752940 [1,1,0,0,0,0|2,0,0]=4 9045 B14R1.16 O=C(NCCF)c1cccc(c1O)Br 527a_100000724931_100000752940 [1,1,0,0,0,0|2,0,0]=4 9046 B14R1.16 O=C(NCCF)c1cccc(c1O)Cl 240690a_100000724931_100000742801 [1,1,0,0,0,0|2,0,0]=4 9047 B14R1.16 O=C(NCCF)c1cccc(c1O)Cl 527a_100000724931_100000742801 [1,1,0,0,0,0|2,0,0]=4 9048 B14R1.16 O=C(NCCF)c1cccc(c1O)F 240690a_100000724931_100011217230 [1,1,0,0,0,0|2,0,0]=4 9049 B14R1.16 O=C(NCCF)c1cccc(c1O)F 527a_100000724931_100011217230 [1,1,0,0,0,0|2,0,0]=4 9050 B14R1.16 O=C(NCCF)c1cccc(c1O)O 527a_100000724931_100000690420 [1,1,0,0,0,0|2,0,0]=4 9051 B14R1.16 O=C(NCCO)c1cccc(c1O)Br 240690a_100000210304_100000752940 [1,1,0,0,0,0|2,0,0]=4 9052 B14R1.16 O=C(NCCO)c1cccc(c1O)Br 527a_100000210304_100000752940 [1,1,0,0,0,0|2,0,0]=4 9053 B14R1.16 O=C(NCCO)c1cccc(c1O)Cl 240690a_100000210304_100000742801 [1,1,0,0,0,0|2,0,0]=4 9054 B14R1.16 O=C(NCCO)c1cccc(c1O)Cl 527a_100000210304_100000742801 [1,1,0,0,0,0|2,0,0]=4 9055 B14R1.16 O=C(NCCO)c1cccc(c1O)F 240690a_100000210304_100011217230 [1,1,0,0,0,0|2,0,0]=4 9056 B14R1.16 O=C(NCCO)c1cccc(c1O)F 527a_100000210304_100011217230 [1,1,0,0,0,0|2,0,0]=4 9057 B14R1.16 O=C(NCCO)c1cccc(c1O)O 527a_100000210304_100000690420 [1,1,0,0,0,0|2,0,0]=4 9058 B14R1.160 C=C(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000730704 [1,1,0,0,0,0|1,0,1]=4 9059 B14R1.160 C=C(C)CCC(=O)c1ccccc1C 1458a_100000212026_100000730704 [1,1,0,0,0,0|1,0,1]=4 9060 B14R1.160 C=C(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000730704 [1,1,0,0,0,0|1,0,1]=4 9061 B14R1.160 C=C(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000730704 [1,1,0,0,0,0|1,0,1]=4 9062 B14R1.160 C=C(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000730704 [1,1,0,0,0,0|1,0,1]=4 9063 B14R1.160 C=C(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000730704 [1,1,0,0,0,0|0,0,1]=3 9064 B14R1.160 C=C(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730704 [1,1,0,0,0,0|0,0,2]=4 9065 B14R1.160 C=C(C)CNC(=O)c1ccccc1O 240690a_100000765925_100015234032 [1,1,0,0,0,0|1,0,1]=4 9066 B14R1.160 CC(=CCC(=O)c1ccccc1O)C 1458a_100015234032_100000761012 [1,1,0,0,0,0|0,0,2]=4 9067 B14R1.160 CC(=O)CCC(=O)c1ccccc1F 1458a_100000070787_100000086012 [1,1,0,0,0,0|1,0,1]=4 9068 B14R1.160 CC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200000210301 [1,1,0,0,0,0|1,0,1]=4 9069 B14R1.160 CC(=O)COC(=O)c1ccccc1O 271570a_203496583355_201991511838 [1,1,0,0,0,0|0,0,1]=3 9070 B14R1.160 CC(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000210312 [1,1,0,0,0,0|1,0,0]=3 9071 B14R1.160 CC(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210312 [1,1,0,0,0,0|1,0,0]=3 9072 B14R1.160 CC(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000210312 [1,1,0,0,0,0|1,0,0]=3 9073 B14R1.160 CC(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000210312 [1,1,0,0,0,0|1,0,0]=3 9074 B14R1.160 CC(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000210312 [1,1,0,0,0,0|0,0,0]=2 9075 B14R1.160 CC(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210312 [1,1,0,0,0,0|0,0,1]=3 9076 B14R1.160 CC(C)CCN(C)c1ccccc1O 269982a_100000033821_100000210312 [1,1,0,0,0,0|2,0,0]=4 9077 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 11a_100000210953_100000188424 [1,1,0,0,0,0|2,0,0]=4 9078 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 1626a_100000210953_100000188424 [1,1,0,0,0,0|2,0,0]=4 9079 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 240690a_100000210953_100000188424 [1,1,0,0,0,0|2,0,0]=4 9080 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 527a_100000210953_100000188424 [1,1,0,0,0,0|2,0,0]=4 9081 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 11a_100000210953_100000185844 [1,1,0,0,0,0|2,0,0]=4 9082 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 1626a_100000210953_100000185844 [1,1,0,0,0,0|2,0,0]=4 9083 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 240690a_100000210953_100000185844 [1,1,0,0,0,0|2,0,0]=4 9084 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 527a_100000210953_100000185844 [1,1,0,0,0,0|2,0,0]=4 9085 B14R1.160 CC(C)CNC(=O)c1ccccc1F 11a_100000210953_100000188656 [1,1,0,0,0,0|2,0,0]=4 9086 B14R1.160 CC(C)CNC(=O)c1ccccc1F 1626a_100000210953_100000188656 [1,1,0,0,0,0|2,0,0]=4 9087 B14R1.160 CC(C)CNC(=O)c1ccccc1F 240690a_100000210953_100000188656 [1,1,0,0,0,0|2,0,0]=4 9088 B14R1.160 CC(C)CNC(=O)c1ccccc1F 527a_100000210953_100000188656 [1,1,0,0,0,0|2,0,0]=4 9089 B14R1.160 CC(C)CNC(=O)c1ccccc1I 11a_100000210953_100000187884 [1,1,0,0,0,0|2,0,0]=4 9090 B14R1.160 CC(C)CNC(=O)c1ccccc1I 1626a_100000210953_100000187884 [1,1,0,0,0,0|2,0,0]=4 9091 B14R1.160 CC(C)CNC(=O)c1ccccc1I 240690a_100000210953_100000187884 [1,1,0,0,0,0|2,0,0]=4 9092 B14R1.160 CC(C)CNC(=O)c1ccccc1I 527a_100000210953_100000187884 [1,1,0,0,0,0|2,0,0]=4 9093 B14R1.160 CC(C)CNC(=O)c1ccccc1O 240690a_100000210953_100015234032 [1,1,0,0,0,0|1,0,0]=3 9094 B14R1.160 CC(C)CNC(=O)c1ccccc1O 271570a_203496583355_200000155729 [1,1,0,0,0,0|1,0,0]=3 9095 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 1626a_100000210953_100009911694 [1,1,0,0,0,0|1,0,1]=4 9096 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 240690a_100000210953_100009911694 [1,1,0,0,0,0|1,0,1]=4 9097 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 527a_100000210953_100009911694 [1,1,0,0,0,0|1,0,1]=4 9098 B14R1.160 CC(C)NCC(=O)c1ccccc1Br 34a_100138425928_100000199116 [1,1,0,0,0,0|2,0,0]=4 9099 B14R1.160 CC(C)NCC(=O)c1ccccc1Cl 34a_100138425928_100000211432 [1,1,0,0,0,0|2,0,0]=4 9100 B14R1.160 CC(C)NCC(=O)c1ccccc1F 34a_100138425928_100000204681 [1,1,0,0,0,0|2,0,0]=4 9101 B14R1.160 CC(C)NNC(=O)c1ccccc1O 22a_100000741168_100015234032 [1,1,0,0,0,0|2,0,0]=4 9102 B14R1.160 CC(C)OCC(=O)c1ccccc1Br 34a_100000212225_100000199116 [1,1,0,0,0,0|2,0,0]=4 9103 B14R1.160 CC(C)OCC(=O)c1ccccc1Cl 34a_100000212225_100000211432 [1,1,0,0,0,0|2,0,0]=4 9104 B14R1.160 CC(C)OCC(=O)c1ccccc1F 34a_100000212225_100000204681 [1,1,0,0,0,0|2,0,0]=4 9105 B14R1.160 CC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000210206 [1,1,0,0,0,0|2,0,0]=4 9106 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000210206_100000211432 [1,1,0,0,0,0|2,0,0]=4 9107 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000210206 [1,1,0,0,0,0|2,0,0]=4 9108 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000210206 [1,1,0,0,0,0|2,0,0]=4 9109 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000210206_100000204681 [1,1,0,0,0,0|2,0,0]=4 9110 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000210206 [1,1,0,0,0,0|1,0,0]=3 9111 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000210206_100000188908 [1,1,0,0,0,0|1,0,0]=3 9112 B14R1.160 CC(O)CCC(=O)c1ccccc1Br 1458a_100000188424_100012276601 [1,1,0,0,0,0|1,0,0]=3 9113 B14R1.160 CC(O)CCC(=O)c1ccccc1Cl 1458a_100000185844_100012276601 [1,1,0,0,0,0|1,0,0]=3 9114 B14R1.160 CC(O)CCC(=O)c1ccccc1F 1458a_100000188656_100012276601 [1,1,0,0,0,0|1,0,0]=3 9115 B14R1.160 CC(O)CCC(=O)c1ccccc1I 1458a_100000187884_100012276601 [1,1,0,0,0,0|1,0,0]=3 9116 B14R1.160 CC(O)CCC(=O)c1ccccc1O 1458a_100015234032_100012276601 [1,1,0,0,0,0|0,0,0]=2 9117 B14R1.160 CC(O)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100012276601 [1,1,0,0,0,0|0,0,1]=3 9118 B14R1.160 CC(O)CCN(C)c1ccccc1O 269982a_100000033821_100012276601 [1,1,0,0,0,0|2,0,0]=4 9119 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 11a_100000210904_100000188424 [1,1,0,0,0,0|2,0,0]=4 9120 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 240690a_100000210904_100000188424 [1,1,0,0,0,0|2,0,0]=4 9121 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 527a_100000210904_100000188424 [1,1,0,0,0,0|2,0,0]=4 9122 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 11a_100000210904_100000185844 [1,1,0,0,0,0|2,0,0]=4 9123 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 240690a_100000210904_100000185844 [1,1,0,0,0,0|2,0,0]=4 9124 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 527a_100000210904_100000185844 [1,1,0,0,0,0|2,0,0]=4 9125 B14R1.160 CC(O)CNC(=O)c1ccccc1F 11a_100000210904_100000188656 [1,1,0,0,0,0|2,0,0]=4 9126 B14R1.160 CC(O)CNC(=O)c1ccccc1F 240690a_100000210904_100000188656 [1,1,0,0,0,0|2,0,0]=4 9127 B14R1.160 CC(O)CNC(=O)c1ccccc1F 527a_100000210904_100000188656 [1,1,0,0,0,0|2,0,0]=4 9128 B14R1.160 CC(O)CNC(=O)c1ccccc1I 11a_100000210904_100000187884 [1,1,0,0,0,0|2,0,0]=4 9129 B14R1.160 CC(O)CNC(=O)c1ccccc1I 240690a_100000210904_100000187884 [1,1,0,0,0,0|2,0,0]=4 9130 B14R1.160 CC(O)CNC(=O)c1ccccc1I 527a_100000210904_100000187884 [1,1,0,0,0,0|2,0,0]=4 9131 B14R1.160 CC(O)CNC(=O)c1ccccc1O 240690a_100000210904_100015234032 [1,1,0,0,0,0|1,0,0]=3 9132 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 240690a_100000210904_100009911694 [1,1,0,0,0,0|1,0,1]=4 9133 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 527a_100000210904_100009911694 [1,1,0,0,0,0|1,0,1]=4 9134 B14R1.160 CN(C)CCC(=O)c1ccccc1F 2230a_100102631434_100000086012 [1,1,0,0,0,0|2,0,0]=4 9135 B14R1.160 CN(C)CCC(=O)c1ccccc1F 269982a_100102631434_100000086012 [1,1,0,0,0,0|2,0,0]=4 9136 B14R1.160 CN(C)CCC(=O)c1ccccc1O 269982a_100102631434_100009873196 [1,1,0,0,0,0|1,0,0]=3 9137 B14R1.160 Cc1ccccc1C(=O)CCC(C)C 1458a_100000212026_100000210312 [1,1,0,0,0,0|1,0,0]=3 9138 B14R1.160 Cc1ccccc1C(=O)CCC(C)O 1458a_100000212026_100012276601 [1,1,0,0,0,0|1,0,0]=3 9139 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 2230a_100138425928_100000741374 [1,1,0,0,0,0|2,0,0]=4 9140 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000741374 [1,1,0,0,0,0|2,0,0]=4 9141 B14R1.160 Cc1ccccc1C(=O)COC(C)C 34a_100000212225_100000741374 [1,1,0,0,0,0|2,0,0]=4 9142 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000210206_100000741374 [1,1,0,0,0,0|2,0,0]=4 9143 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000741374_100000210206 [1,1,0,0,0,0|2,0,0]=4 9144 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000212026 [1,1,0,0,0,0|2,0,0]=4 9145 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000212026 [1,1,0,0,0,0|2,0,0]=4 9146 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000212026 [1,1,0,0,0,0|2,0,0]=4 9147 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000212026 [1,1,0,0,0,0|2,0,0]=4 9148 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000212026 [1,1,0,0,0,0|2,0,0]=4 9149 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000212026 [1,1,0,0,0,0|2,0,0]=4 9150 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000212026 [1,1,0,0,0,0|2,0,0]=4 9151 B14R1.160 O=C(NCC(F)F)c1ccccc1O 240690a_100000765723_100015234032 [1,1,0,0,0,0|2,0,0]=4 9152 B14R1.160 [13CH3]C(=O)CNC(=O)c1ccccc1O 1458a_100011193979_200025704644 [1,1,0,0,0,0|1,0,1]=4 9153 B14R1.587 CCC(=O)CC(=O)c1ccccc1Br 1458a_100000188424_100000747405 [1,1,0,0,0,0|1,0,1]=4 9154 B14R1.587 CCC(=O)CC(=O)c1ccccc1Br 1458a_100000210414_100000199116 [1,1,0,0,0,0|1,0,1]=4 9155 B14R1.587 CCC(=O)CC(=O)c1ccccc1C 1458a_100000210414_100000741374 [1,1,0,0,0,0|1,0,1]=4 9156 B14R1.587 CCC(=O)CC(=O)c1ccccc1C 1458a_100000212026_100000747405 [1,1,0,0,0,0|1,0,1]=4 9157 B14R1.587 CCC(=O)CC(=O)c1ccccc1Cl 1458a_100000185844_100000747405 [1,1,0,0,0,0|1,0,1]=4 9158 B14R1.587 CCC(=O)CC(=O)c1ccccc1Cl 1458a_100000210414_100000211432 [1,1,0,0,0,0|1,0,1]=4 9159 B14R1.587 CCC(=O)CC(=O)c1ccccc1F 1458a_100000188656_100000747405 [1,1,0,0,0,0|1,0,1]=4 9160 B14R1.587 CCC(=O)CC(=O)c1ccccc1F 1458a_100000210414_100000204681 [1,1,0,0,0,0|1,0,1]=4 9161 B14R1.587 CCC(=O)CC(=O)c1ccccc1I 1458a_100000187884_100000747405 [1,1,0,0,0,0|1,0,1]=4 9162 B14R1.587 CCC(=O)CC(=O)c1ccccc1O 1458a_100000210414_100000188908 [1,1,0,0,0,0|0,0,1]=3 9163 B14R1.587 CCC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000747405 [1,1,0,0,0,0|0,0,1]=3 9164 B14R1.587 CCC(=O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000747405 [1,1,0,0,0,0|0,0,2]=4 9165 B14R1.587 CCC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000748023 [1,1,0,0,0,0|1,0,0]=3 9166 B14R1.587 CCC(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748023 [1,1,0,0,0,0|1,0,0]=3 9167 B14R1.587 CCC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000748023 [1,1,0,0,0,0|1,0,0]=3 9168 B14R1.587 CCC(C)CC(=O)c1ccccc1F 1458a_100000188656_100000748023 [1,1,0,0,0,0|1,0,0]=3 9169 B14R1.587 CCC(C)CC(=O)c1ccccc1I 1458a_100000187884_100000748023 [1,1,0,0,0,0|1,0,0]=3 9170 B14R1.587 CCC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000748023 [1,1,0,0,0,0|0,0,0]=2 9171 B14R1.587 CCC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000748023 [1,1,0,0,0,0|0,0,1]=3 9172 B14R1.587 CCC(C)CN(C)c1ccccc1O 269982a_100000033821_100000748023 [1,1,0,0,0,0|2,0,0]=4 9173 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 11a_100000209981_100000188424 [1,1,0,0,0,0|2,0,0]=4 9174 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 1626a_100000209981_100000188424 [1,1,0,0,0,0|2,0,0]=4 9175 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 240690a_100000209981_100000188424 [1,1,0,0,0,0|2,0,0]=4 9176 B14R1.587 CCC(C)NC(=O)c1ccccc1Br 527a_100000209981_100000188424 [1,1,0,0,0,0|2,0,0]=4 9177 B14R1.587 CCC(C)NC(=O)c1ccccc1C 11a_100000209981_100000212026 [1,1,0,0,0,0|2,0,0]=4 9178 B14R1.587 CCC(C)NC(=O)c1ccccc1C 1626a_100000209981_100000212026 [1,1,0,0,0,0|2,0,0]=4 9179 B14R1.587 CCC(C)NC(=O)c1ccccc1C 240690a_100000209981_100000212026 [1,1,0,0,0,0|2,0,0]=4 9180 B14R1.587 CCC(C)NC(=O)c1ccccc1C 527a_100000209981_100000212026 [1,1,0,0,0,0|2,0,0]=4 9181 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 11a_100000209981_100000185844 [1,1,0,0,0,0|2,0,0]=4 9182 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 1626a_100000209981_100000185844 [1,1,0,0,0,0|2,0,0]=4 9183 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 240690a_100000209981_100000185844 [1,1,0,0,0,0|2,0,0]=4 9184 B14R1.587 CCC(C)NC(=O)c1ccccc1Cl 527a_100000209981_100000185844 [1,1,0,0,0,0|2,0,0]=4 9185 B14R1.587 CCC(C)NC(=O)c1ccccc1F 11a_100000209981_100000188656 [1,1,0,0,0,0|2,0,0]=4 9186 B14R1.587 CCC(C)NC(=O)c1ccccc1F 1626a_100000209981_100000188656 [1,1,0,0,0,0|2,0,0]=4 9187 B14R1.587 CCC(C)NC(=O)c1ccccc1F 240690a_100000209981_100000188656 [1,1,0,0,0,0|2,0,0]=4 9188 B14R1.587 CCC(C)NC(=O)c1ccccc1F 527a_100000209981_100000188656 [1,1,0,0,0,0|2,0,0]=4 9189 B14R1.587 CCC(C)NC(=O)c1ccccc1I 11a_100000209981_100000187884 [1,1,0,0,0,0|2,0,0]=4 9190 B14R1.587 CCC(C)NC(=O)c1ccccc1I 1626a_100000209981_100000187884 [1,1,0,0,0,0|2,0,0]=4 9191 B14R1.587 CCC(C)NC(=O)c1ccccc1I 240690a_100000209981_100000187884 [1,1,0,0,0,0|2,0,0]=4 9192 B14R1.587 CCC(C)NC(=O)c1ccccc1I 527a_100000209981_100000187884 [1,1,0,0,0,0|2,0,0]=4 9193 B14R1.587 CCC(C)NC(=O)c1ccccc1O 240690a_100000209981_100015234032 [1,1,0,0,0,0|1,0,0]=3 9194 B14R1.587 CCC(C)NC(=O)c1ccccc1O 271570a_203496583355_200000152809 [1,1,0,0,0,0|1,0,0]=3 9195 B14R1.587 CCC(C)NC(=O)c1ccccc1[O-] 1626a_100000209981_100009911694 [1,1,0,0,0,0|1,0,1]=4 9196 B14R1.587 CCC(C)NC(=O)c1ccccc1[O-] 240690a_100000209981_100009911694 [1,1,0,0,0,0|1,0,1]=4 9197 B14R1.587 CCC(C)NC(=O)c1ccccc1[O-] 527a_100000209981_100009911694 [1,1,0,0,0,0|1,0,1]=4 9198 B14R1.587 CCC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218378 [1,1,0,0,0,0|1,0,0]=3 9199 B14R1.587 CCC(O)CC(=O)c1ccccc1C 1458a_100000212026_100011218378 [1,1,0,0,0,0|1,0,0]=3 9200 B14R1.587 CCC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218378 [1,1,0,0,0,0|1,0,0]=3 9201 B14R1.587 CCC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218378 [1,1,0,0,0,0|1,0,0]=3 9202 B14R1.587 CCC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218378 [1,1,0,0,0,0|1,0,0]=3 9203 B14R1.587 CCC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218378 [1,1,0,0,0,0|0,0,0]=2 9204 B14R1.587 CCC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218378 [1,1,0,0,0,0|0,0,1]=3 9205 B14R1.587 CCC(O)CN(C)c1ccccc1O 269982a_100000033821_100011218378 [1,1,0,0,0,0|2,0,0]=4 9206 B14R1.587 CCN(C)CC(=O)c1ccccc1Br 269982a_100000225621_100000199116 [1,1,0,0,0,0|2,0,0]=4 9207 B14R1.587 CCN(C)CC(=O)c1ccccc1C 2230a_100000225621_100000741374 [1,1,0,0,0,0|2,0,0]=4 9208 B14R1.587 CCN(C)CC(=O)c1ccccc1C 269982a_100000225621_100000741374 [1,1,0,0,0,0|2,0,0]=4 9209 B14R1.587 CCN(C)CC(=O)c1ccccc1Cl 269982a_100000225621_100000211432 [1,1,0,0,0,0|2,0,0]=4 9210 B14R1.587 CCN(C)CC(=O)c1ccccc1F 269982a_100000225621_100000204681 [1,1,0,0,0,0|2,0,0]=4 9211 B14R1.587 CCN(C)CC(=O)c1ccccc1O 269982a_100000225621_100000188908 [1,1,0,0,0,0|1,0,0]=3 9212 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1Br 1458a_100000188424_100009816398 [1,1,0,0,0,0|1,0,0]=3 9213 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1C 1458a_100000212026_100009816398 [1,1,0,0,0,0|1,0,0]=3 9214 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1Cl 1458a_100000185844_100009816398 [1,1,0,0,0,0|1,0,0]=3 9215 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1F 1458a_100000188656_100009816398 [1,1,0,0,0,0|1,0,0]=3 9216 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1I 1458a_100000187884_100009816398 [1,1,0,0,0,0|1,0,0]=3 9217 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1O 1458a_100015234032_100009816398 [1,1,0,0,0,0|0,0,0]=2 9218 B14R1.587 CC[C@H](C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100009816398 [1,1,0,0,0,0|0,0,1]=3 9219 B14R1.587 CC[C@H](C)CN(C)c1ccccc1O 269982a_100000033821_100009816398 [1,1,0,0,0,0|2,0,0]=4 9220 B14R1.587 CNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183359 [1,1,0,0,0,0|1,0,1]=4 9221 B14R1.587 COC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000747449 [1,1,0,0,0,0|1,0,1]=4 9222 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1Br 1458a_100000188424_100000059175 [1,1,0,0,0,0|2,0,0]=4 9223 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1Cl 1458a_100000185844_100000059175 [1,1,0,0,0,0|2,0,0]=4 9224 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1F 1458a_100000188656_100000059175 [1,1,0,0,0,0|2,0,0]=4 9225 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1I 1458a_100000187884_100000059175 [1,1,0,0,0,0|2,0,0]=4 9226 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1O 1458a_100015234032_100000059175 [1,1,0,0,0,0|1,0,0]=3 9227 B14R1.587 C[C@@H](CO)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000059175 [1,1,0,0,0,0|1,0,1]=4 9228 B14R1.587 C[C@H](CF)NC(=O)c1ccccc1O 240690a_100102880703_100015234032 [1,1,0,0,0,0|2,0,0]=4 9229 B14R1.587 C[C@H](CO)NC(=O)c1ccccc1O 240690a_100000737577_100015234032 [1,1,0,0,0,0|2,0,0]=4 9230 B14R1.587 Cc1ccccc1C(=O)C[C@@H](C)CO 1458a_100000212026_100000059175 [1,1,0,0,0,0|2,0,0]=4 9231 B14R1.587 O=C(CO)CC(=O)c1ccccc1O 1458a_100000210174_100000188908 [1,1,0,0,0,0|1,0,1]=4 9232 B14R1.918 C#CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000753159 [1,1,0,0,0,0|0,0,2]=4 9233 B14R1.918 C#CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000753159 [1,1,0,0,0,0|0,0,2]=4 9234 B14R1.918 C#CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000753159 [1,1,0,0,0,0|0,0,2]=4 9235 B14R1.918 C#CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000753159 [1,1,0,0,0,0|0,0,2]=4 9236 B14R1.918 C#CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000753159 [1,1,0,0,0,0|0,0,2]=4 9237 B14R1.918 C#CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000753159 [1,1,0,0,0,0|0,0,2]=4 9238 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100102629194 [1,1,0,0,0,0|0,0,2]=4 9239 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)C 1458a_100000229998_100102629194 [1,1,0,0,0,0|0,0,2]=4 9240 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100102629194 [1,1,0,0,0,0|0,0,2]=4 9241 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)F 1458a_100000742286_100102629194 [1,1,0,0,0,0|0,0,2]=4 9242 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)I 1458a_100000212111_100102629194 [1,1,0,0,0,0|0,0,2]=4 9243 B14R1.918 C/C=C/CC(=O)c1cc(ccc1O)O 1458a_100000758025_100102629194 [1,1,0,0,0,0|0,0,2]=4 9244 B14R1.918 C=CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000754431 [1,1,0,0,0,0|0,0,2]=4 9245 B14R1.918 C=CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000754431 [1,1,0,0,0,0|0,0,2]=4 9246 B14R1.918 C=CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000754431 [1,1,0,0,0,0|0,0,2]=4 9247 B14R1.918 C=CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000754431 [1,1,0,0,0,0|0,0,2]=4 9248 B14R1.918 C=CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000754431 [1,1,0,0,0,0|0,0,2]=4 9249 B14R1.918 C=CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000754431 [1,1,0,0,0,0|0,0,2]=4 9250 B14R1.918 CC#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000748600 [1,1,0,0,0,0|0,0,2]=4 9251 B14R1.918 CC#CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000748600 [1,1,0,0,0,0|0,0,2]=4 9252 B14R1.918 CC#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000748600 [1,1,0,0,0,0|0,0,2]=4 9253 B14R1.918 CC#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000748600 [1,1,0,0,0,0|0,0,2]=4 9254 B14R1.918 CC#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000748600 [1,1,0,0,0,0|0,0,2]=4 9255 B14R1.918 CC#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000748600 [1,1,0,0,0,0|0,0,2]=4 9256 B14R1.918 CC=CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000070051 [1,1,0,0,0,0|0,0,2]=4 9257 B14R1.918 CC=CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000070051 [1,1,0,0,0,0|0,0,2]=4 9258 B14R1.918 CC=CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000070051 [1,1,0,0,0,0|0,0,2]=4 9259 B14R1.918 CC=CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000070051 [1,1,0,0,0,0|0,0,2]=4 9260 B14R1.918 CC=CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000070051 [1,1,0,0,0,0|0,0,2]=4 9261 B14R1.918 CC=CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000070051 [1,1,0,0,0,0|0,0,2]=4 9262 B14R1.918 CCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210211 [1,1,0,0,0,0|1,0,0]=3 9263 B14R1.918 CCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210211 [1,1,0,0,0,0|1,0,0]=3 9264 B14R1.918 CCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210211 [1,1,0,0,0,0|1,0,0]=3 9265 B14R1.918 CCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210211 [1,1,0,0,0,0|1,0,0]=3 9266 B14R1.918 CCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210211 [1,1,0,0,0,0|1,0,0]=3 9267 B14R1.918 CCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210211 [1,1,0,0,0,0|1,0,0]=3 9268 B14R1.918 CCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210211 [1,1,0,0,0,0|1,0,0]=3 9269 B14R1.918 CCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210211 [1,1,0,0,0,0|1,0,0]=3 9270 B14R1.918 CCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210211 [1,1,0,0,0,0|1,0,0]=3 9271 B14R1.918 CCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210211 [1,1,0,0,0,0|1,0,0]=3 9272 B14R1.918 CCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210211 [1,1,0,0,0,0|1,0,0]=3 9273 B14R1.918 CCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210211 [1,1,0,0,0,0|1,0,0]=3 9274 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210211 [1,1,0,0,0,0|1,0,0]=3 9275 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210211 [1,1,0,0,0,0|1,0,0]=3 9276 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210211 [1,1,0,0,0,0|1,0,0]=3 9277 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210211 [1,1,0,0,0,0|1,0,0]=3 9278 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210211 [1,1,0,0,0,0|1,0,0]=3 9279 B14R1.918 CCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210211 [1,1,0,0,0,0|1,0,0]=3 9280 B14R1.918 CCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210211 [1,1,0,0,0,0|1,0,0]=3 9281 B14R1.918 CCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210211 [1,1,0,0,0,0|1,0,0]=3 9282 B14R1.918 CCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210211 [1,1,0,0,0,0|1,0,0]=3 9283 B14R1.918 CCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210211 [1,1,0,0,0,0|1,0,0]=3 9284 B14R1.918 CCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210211 [1,1,0,0,0,0|1,0,0]=3 9285 B14R1.918 CCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210211 [1,1,0,0,0,0|1,0,0]=3 9286 B14R1.918 CCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210211 [1,1,0,0,0,0|1,0,0]=3 9287 B14R1.918 CCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210211 [1,1,0,0,0,0|1,0,0]=3 9288 B14R1.918 CCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210211 [1,1,0,0,0,0|1,0,0]=3 9289 B14R1.918 CCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210211 [1,1,0,0,0,0|1,0,0]=3 9290 B14R1.918 CCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210211 [1,1,0,0,0,0|1,0,0]=3 9291 B14R1.918 CCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210211 [1,1,0,0,0,0|1,0,0]=3 9292 B14R1.918 CCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210211 [1,1,0,0,0,0|0,0,0]=2 9293 B14R1.918 CCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210211 [1,1,0,0,0,0|0,0,0]=2 9294 B14R1.918 CCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210211 [1,1,0,0,0,0|0,0,0]=2 9295 B14R1.918 CCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210211 [1,1,0,0,0,0|0,0,0]=2 9296 B14R1.918 CCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210211 [1,1,0,0,0,0|0,0,0]=2 9297 B14R1.918 CCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210211 [1,1,0,0,0,0|0,0,0]=2 9298 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 11a_100020643023_100000690610 [1,1,0,0,0,0|2,0,0]=4 9299 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 1626a_100020643023_100000690610 [1,1,0,0,0,0|2,0,0]=4 9300 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 240690a_100020643023_100000690610 [1,1,0,0,0,0|2,0,0]=4 9301 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Br 527a_100020643023_100000690610 [1,1,0,0,0,0|2,0,0]=4 9302 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 11a_100020643023_100000689033 [1,1,0,0,0,0|2,0,0]=4 9303 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 1626a_100020643023_100000689033 [1,1,0,0,0,0|2,0,0]=4 9304 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 240690a_100020643023_100000689033 [1,1,0,0,0,0|2,0,0]=4 9305 B14R1.918 CCCNC(=O)c1cc(ccc1Br)C 527a_100020643023_100000689033 [1,1,0,0,0,0|2,0,0]=4 9306 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 11a_100020643023_100000736951 [1,1,0,0,0,0|2,0,0]=4 9307 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 1626a_100020643023_100000736951 [1,1,0,0,0,0|2,0,0]=4 9308 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 240690a_100020643023_100000736951 [1,1,0,0,0,0|2,0,0]=4 9309 B14R1.918 CCCNC(=O)c1cc(ccc1Br)Cl 527a_100020643023_100000736951 [1,1,0,0,0,0|2,0,0]=4 9310 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 11a_100020643023_100000212315 [1,1,0,0,0,0|2,0,0]=4 9311 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 1626a_100020643023_100000212315 [1,1,0,0,0,0|2,0,0]=4 9312 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 240690a_100020643023_100000212315 [1,1,0,0,0,0|2,0,0]=4 9313 B14R1.918 CCCNC(=O)c1cc(ccc1Br)F 527a_100020643023_100000212315 [1,1,0,0,0,0|2,0,0]=4 9314 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 11a_100020643023_100000698340 [1,1,0,0,0,0|2,0,0]=4 9315 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 1626a_100020643023_100000698340 [1,1,0,0,0,0|2,0,0]=4 9316 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 240690a_100020643023_100000698340 [1,1,0,0,0,0|2,0,0]=4 9317 B14R1.918 CCCNC(=O)c1cc(ccc1Br)I 527a_100020643023_100000698340 [1,1,0,0,0,0|2,0,0]=4 9318 B14R1.918 CCCNC(=O)c1cc(ccc1Br)O 240690a_100020643023_100012352043 [1,1,0,0,0,0|2,0,0]=4 9319 B14R1.918 CCCNC(=O)c1cc(ccc1Br)O 527a_100020643023_100012352043 [1,1,0,0,0,0|2,0,0]=4 9320 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 11a_100020643023_100000759961 [1,1,0,0,0,0|2,0,0]=4 9321 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 1626a_100020643023_100000759961 [1,1,0,0,0,0|2,0,0]=4 9322 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 240690a_100020643023_100000759961 [1,1,0,0,0,0|2,0,0]=4 9323 B14R1.918 CCCNC(=O)c1cc(ccc1C)Br 527a_100020643023_100000759961 [1,1,0,0,0,0|2,0,0]=4 9324 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 11a_100020643023_100000195421 [1,1,0,0,0,0|2,0,0]=4 9325 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 1626a_100020643023_100000195421 [1,1,0,0,0,0|2,0,0]=4 9326 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 240690a_100020643023_100000195421 [1,1,0,0,0,0|2,0,0]=4 9327 B14R1.918 CCCNC(=O)c1cc(ccc1C)C 527a_100020643023_100000195421 [1,1,0,0,0,0|2,0,0]=4 9328 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 11a_100020643023_100000692595 [1,1,0,0,0,0|2,0,0]=4 9329 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 1626a_100020643023_100000692595 [1,1,0,0,0,0|2,0,0]=4 9330 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 240690a_100020643023_100000692595 [1,1,0,0,0,0|2,0,0]=4 9331 B14R1.918 CCCNC(=O)c1cc(ccc1C)Cl 527a_100020643023_100000692595 [1,1,0,0,0,0|2,0,0]=4 9332 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 11a_100020643023_100000240043 [1,1,0,0,0,0|2,0,0]=4 9333 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 1626a_100020643023_100000240043 [1,1,0,0,0,0|2,0,0]=4 9334 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 240690a_100020643023_100000240043 [1,1,0,0,0,0|2,0,0]=4 9335 B14R1.918 CCCNC(=O)c1cc(ccc1C)F 527a_100020643023_100000240043 [1,1,0,0,0,0|2,0,0]=4 9336 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 11a_100020643023_100000688012 [1,1,0,0,0,0|2,0,0]=4 9337 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 1626a_100020643023_100000688012 [1,1,0,0,0,0|2,0,0]=4 9338 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 240690a_100020643023_100000688012 [1,1,0,0,0,0|2,0,0]=4 9339 B14R1.918 CCCNC(=O)c1cc(ccc1C)I 527a_100020643023_100000688012 [1,1,0,0,0,0|2,0,0]=4 9340 B14R1.918 CCCNC(=O)c1cc(ccc1C)O 240690a_100020643023_100000687834 [1,1,0,0,0,0|2,0,0]=4 9341 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 11a_100020643023_100000211212 [1,1,0,0,0,0|2,0,0]=4 9342 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 1626a_100020643023_100000211212 [1,1,0,0,0,0|2,0,0]=4 9343 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 240690a_100020643023_100000211212 [1,1,0,0,0,0|2,0,0]=4 9344 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Br 527a_100020643023_100000211212 [1,1,0,0,0,0|2,0,0]=4 9345 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 11a_100020643023_100011290873 [1,1,0,0,0,0|2,0,0]=4 9346 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 1626a_100020643023_100011290873 [1,1,0,0,0,0|2,0,0]=4 9347 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 240690a_100020643023_100011290873 [1,1,0,0,0,0|2,0,0]=4 9348 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)C 527a_100020643023_100011290873 [1,1,0,0,0,0|2,0,0]=4 9349 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 11a_100020643023_100000210642 [1,1,0,0,0,0|2,0,0]=4 9350 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100020643023_100000210642 [1,1,0,0,0,0|2,0,0]=4 9351 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100020643023_100000210642 [1,1,0,0,0,0|2,0,0]=4 9352 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)Cl 527a_100020643023_100000210642 [1,1,0,0,0,0|2,0,0]=4 9353 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 11a_100020643023_100011219680 [1,1,0,0,0,0|2,0,0]=4 9354 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 1626a_100020643023_100011219680 [1,1,0,0,0,0|2,0,0]=4 9355 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 240690a_100020643023_100011219680 [1,1,0,0,0,0|2,0,0]=4 9356 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)F 527a_100020643023_100011219680 [1,1,0,0,0,0|2,0,0]=4 9357 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 11a_100020643023_100000688013 [1,1,0,0,0,0|2,0,0]=4 9358 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 1626a_100020643023_100000688013 [1,1,0,0,0,0|2,0,0]=4 9359 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 240690a_100020643023_100000688013 [1,1,0,0,0,0|2,0,0]=4 9360 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)I 527a_100020643023_100000688013 [1,1,0,0,0,0|2,0,0]=4 9361 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)O 240690a_100020643023_100000719527 [1,1,0,0,0,0|2,0,0]=4 9362 B14R1.918 CCCNC(=O)c1cc(ccc1Cl)O 527a_100020643023_100000719527 [1,1,0,0,0,0|2,0,0]=4 9363 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 11a_100020643023_100000212322 [1,1,0,0,0,0|2,0,0]=4 9364 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 1626a_100020643023_100000212322 [1,1,0,0,0,0|2,0,0]=4 9365 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 240690a_100020643023_100000212322 [1,1,0,0,0,0|2,0,0]=4 9366 B14R1.918 CCCNC(=O)c1cc(ccc1F)Br 527a_100020643023_100000212322 [1,1,0,0,0,0|2,0,0]=4 9367 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 11a_100020643023_100000749327 [1,1,0,0,0,0|2,0,0]=4 9368 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 1626a_100020643023_100000749327 [1,1,0,0,0,0|2,0,0]=4 9369 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 240690a_100020643023_100000749327 [1,1,0,0,0,0|2,0,0]=4 9370 B14R1.918 CCCNC(=O)c1cc(ccc1F)C 527a_100020643023_100000749327 [1,1,0,0,0,0|2,0,0]=4 9371 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 11a_100020643023_100000214954 [1,1,0,0,0,0|2,0,0]=4 9372 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 1626a_100020643023_100000214954 [1,1,0,0,0,0|2,0,0]=4 9373 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 240690a_100020643023_100000214954 [1,1,0,0,0,0|2,0,0]=4 9374 B14R1.918 CCCNC(=O)c1cc(ccc1F)Cl 527a_100020643023_100000214954 [1,1,0,0,0,0|2,0,0]=4 9375 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 11a_100020643023_100000198512 [1,1,0,0,0,0|2,0,0]=4 9376 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 1626a_100020643023_100000198512 [1,1,0,0,0,0|2,0,0]=4 9377 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 240690a_100020643023_100000198512 [1,1,0,0,0,0|2,0,0]=4 9378 B14R1.918 CCCNC(=O)c1cc(ccc1F)F 527a_100020643023_100000198512 [1,1,0,0,0,0|2,0,0]=4 9379 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 11a_100020643023_100000688014 [1,1,0,0,0,0|2,0,0]=4 9380 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 1626a_100020643023_100000688014 [1,1,0,0,0,0|2,0,0]=4 9381 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 240690a_100020643023_100000688014 [1,1,0,0,0,0|2,0,0]=4 9382 B14R1.918 CCCNC(=O)c1cc(ccc1F)I 527a_100020643023_100000688014 [1,1,0,0,0,0|2,0,0]=4 9383 B14R1.918 CCCNC(=O)c1cc(ccc1F)O 240690a_100020643023_100000037260 [1,1,0,0,0,0|2,0,0]=4 9384 B14R1.918 CCCNC(=O)c1cc(ccc1F)O 527a_100020643023_100000037260 [1,1,0,0,0,0|2,0,0]=4 9385 B14R1.918 CCCNC(=O)c1cc(ccc1I)Br 11a_100020643023_100000183945 [1,1,0,0,0,0|2,0,0]=4 9386 B14R1.918 CCCNC(=O)c1cc(ccc1I)Br 1626a_100020643023_100000183945 [1,1,0,0,0,0|2,0,0]=4 9387 B14R1.918 CCCNC(=O)c1cc(ccc1I)Br 240690a_100020643023_100000183945 [1,1,0,0,0,0|2,0,0]=4 9388 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 11a_100020643023_100000057929 [1,1,0,0,0,0|2,0,0]=4 9389 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 1626a_100020643023_100000057929 [1,1,0,0,0,0|2,0,0]=4 9390 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 240690a_100020643023_100000057929 [1,1,0,0,0,0|2,0,0]=4 9391 B14R1.918 CCCNC(=O)c1cc(ccc1I)C 527a_100020643023_100000057929 [1,1,0,0,0,0|2,0,0]=4 9392 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 11a_100020643023_100000739379 [1,1,0,0,0,0|2,0,0]=4 9393 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 1626a_100020643023_100000739379 [1,1,0,0,0,0|2,0,0]=4 9394 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 240690a_100020643023_100000739379 [1,1,0,0,0,0|2,0,0]=4 9395 B14R1.918 CCCNC(=O)c1cc(ccc1I)Cl 527a_100020643023_100000739379 [1,1,0,0,0,0|2,0,0]=4 9396 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 11a_100020643023_100000748905 [1,1,0,0,0,0|2,0,0]=4 9397 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 1626a_100020643023_100000748905 [1,1,0,0,0,0|2,0,0]=4 9398 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 240690a_100020643023_100000748905 [1,1,0,0,0,0|2,0,0]=4 9399 B14R1.918 CCCNC(=O)c1cc(ccc1I)F 527a_100020643023_100000748905 [1,1,0,0,0,0|2,0,0]=4 9400 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 11a_100020643023_100000750460 [1,1,0,0,0,0|2,0,0]=4 9401 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 1626a_100020643023_100000750460 [1,1,0,0,0,0|2,0,0]=4 9402 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 240690a_100020643023_100000750460 [1,1,0,0,0,0|2,0,0]=4 9403 B14R1.918 CCCNC(=O)c1cc(ccc1I)I 527a_100020643023_100000750460 [1,1,0,0,0,0|2,0,0]=4 9404 B14R1.918 CCCNC(=O)c1cc(ccc1I)O 1626a_100020643023_200009995701 [1,1,0,0,0,0|2,0,0]=4 9405 B14R1.918 CCCNC(=O)c1cc(ccc1I)O 240690a_100020643023_200009995701 [1,1,0,0,0,0|2,0,0]=4 9406 B14R1.918 CCCNC(=O)c1cc(ccc1I)O 527a_100020643023_200009995701 [1,1,0,0,0,0|2,0,0]=4 9407 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br 1626a_100020643023_100000212140 [1,1,0,0,0,0|1,0,0]=3 9408 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br 240690a_100020643023_100000212140 [1,1,0,0,0,0|1,0,0]=3 9409 B14R1.918 CCCNC(=O)c1cc(ccc1O)Br 527a_100020643023_100000212140 [1,1,0,0,0,0|1,0,0]=3 9410 B14R1.918 CCCNC(=O)c1cc(ccc1O)C 240690a_100020643023_100000229998 [1,1,0,0,0,0|1,0,0]=3 9411 B14R1.918 CCCNC(=O)c1cc(ccc1O)C 527a_100020643023_100000229998 [1,1,0,0,0,0|1,0,0]=3 9412 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 11a_100020643023_100000212143 [1,1,0,0,0,0|1,0,0]=3 9413 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 1626a_100020643023_100000212143 [1,1,0,0,0,0|1,0,0]=3 9414 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 240690a_100020643023_100000212143 [1,1,0,0,0,0|1,0,0]=3 9415 B14R1.918 CCCNC(=O)c1cc(ccc1O)Cl 527a_100020643023_100000212143 [1,1,0,0,0,0|1,0,0]=3 9416 B14R1.918 CCCNC(=O)c1cc(ccc1O)F 240690a_100020643023_100000742286 [1,1,0,0,0,0|1,0,0]=3 9417 B14R1.918 CCCNC(=O)c1cc(ccc1O)F 527a_100020643023_100000742286 [1,1,0,0,0,0|1,0,0]=3 9418 B14R1.918 CCCNC(=O)c1cc(ccc1O)I 240690a_100020643023_100000212111 [1,1,0,0,0,0|1,0,0]=3 9419 B14R1.918 CCCNC(=O)c1cc(ccc1O)I 527a_100020643023_100000212111 [1,1,0,0,0,0|1,0,0]=3 9420 B14R1.918 CCNCC(=O)c1cc(ccc1Br)Cl 2230a_100015525214_100012361344 [1,1,0,0,0,0|2,0,0]=4 9421 B14R1.918 CCNCC(=O)c1cc(ccc1C)C 2230a_100015525214_100000183774 [1,1,0,0,0,0|2,0,0]=4 9422 B14R1.918 CCNCC(=O)c1cc(ccc1Cl)Cl 2230a_100015525214_100000183120 [1,1,0,0,0,0|2,0,0]=4 9423 B14R1.918 CCNNC(=O)c1cc(ccc1O)Br 22a_100000756455_100000212140 [1,1,0,0,0,0|2,0,0]=4 9424 B14R1.918 CCNNC(=O)c1cc(ccc1O)C 22a_100000756455_100000229998 [1,1,0,0,0,0|2,0,0]=4 9425 B14R1.918 CCNNC(=O)c1cc(ccc1O)Cl 22a_100000756455_100000212143 [1,1,0,0,0,0|2,0,0]=4 9426 B14R1.918 CCNNC(=O)c1cc(ccc1O)F 22a_100000756455_100000742286 [1,1,0,0,0,0|2,0,0]=4 9427 B14R1.918 CCNNC(=O)c1cc(ccc1O)I 22a_100000756455_100000212111 [1,1,0,0,0,0|2,0,0]=4 9428 B14R1.918 CCOCC(=O)c1cc(ccc1Br)Cl 34a_100121572206_100012361344 [1,1,0,0,0,0|2,0,0]=4 9429 B14R1.918 CCOCC(=O)c1cc(ccc1C)C 34a_100121572206_100000183774 [1,1,0,0,0,0|2,0,0]=4 9430 B14R1.918 CCOCC(=O)c1cc(ccc1Cl)F 34a_100121572206_200010187420 [1,1,0,0,0,0|2,0,0]=4 9431 B14R1.918 CCOCC(=O)c1cc(ccc1F)F 34a_100121572206_100000211571 [1,1,0,0,0,0|2,0,0]=4 9432 B14R1.918 CCOCC(=O)c1cc(ccc1O)Br 34a_100121572206_200009828000 [1,1,0,0,0,0|1,0,0]=3 9433 B14R1.918 CCOCC(=O)c1cc(ccc1O)F 34a_100121572206_100009814381 [1,1,0,0,0,0|1,0,0]=3 9434 B14R1.918 CCOCC(=O)c1cc(ccc1O)O 34a_100121572206_100009814097 [1,1,0,0,0,0|1,0,0]=3 9435 B14R1.918 CCSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100000210202 [1,1,0,0,0,0|2,0,0]=4 9436 B14R1.918 CCSCC(=O)c1cc(ccc1C)C 62a_100000183774_100000210202 [1,1,0,0,0,0|2,0,0]=4 9437 B14R1.918 CCSCC(=O)c1cc(ccc1C)C 62a_100000210202_100000183774 [1,1,0,0,0,0|2,0,0]=4 9438 B14R1.918 CCSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100000210202 [1,1,0,0,0,0|2,0,0]=4 9439 B14R1.918 CCSCC(=O)c1cc(ccc1Cl)F 62a_100000210202_200010187420 [1,1,0,0,0,0|2,0,0]=4 9440 B14R1.918 CCSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100000210202 [1,1,0,0,0,0|2,0,0]=4 9441 B14R1.918 CCSCC(=O)c1cc(ccc1F)F 62a_100000210202_100000211571 [1,1,0,0,0,0|2,0,0]=4 9442 B14R1.918 CCSCC(=O)c1cc(ccc1F)F 62a_100000211571_100000210202 [1,1,0,0,0,0|2,0,0]=4 9443 B14R1.918 CCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000210202 [1,1,0,0,0,0|1,0,0]=3 9444 B14R1.918 CCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000210202 [1,1,0,0,0,0|1,0,0]=3 9445 B14R1.918 CCSCC(=O)c1cc(ccc1O)F 62a_100000210202_100009814381 [1,1,0,0,0,0|1,0,0]=3 9446 B14R1.918 CCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000210202 [1,1,0,0,0,0|1,0,0]=3 9447 B14R1.918 CCSCC(=O)c1cc(ccc1O)O 62a_100000210202_100009814097 [1,1,0,0,0,0|1,0,0]=3 9448 B14R1.918 CCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000210202 [1,1,0,0,0,0|1,0,0]=3 9449 B14R1.918 COCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000233755 [1,1,0,0,0,0|2,0,0]=4 9450 B14R1.918 COCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000233755 [1,1,0,0,0,0|2,0,0]=4 9451 B14R1.918 COCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000233755 [1,1,0,0,0,0|2,0,0]=4 9452 B14R1.918 COCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000233755 [1,1,0,0,0,0|2,0,0]=4 9453 B14R1.918 COCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000233755 [1,1,0,0,0,0|2,0,0]=4 9454 B14R1.918 COCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000233755 [1,1,0,0,0,0|2,0,0]=4 9455 B14R1.918 COCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000233755 [1,1,0,0,0,0|2,0,0]=4 9456 B14R1.918 COCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000233755 [1,1,0,0,0,0|2,0,0]=4 9457 B14R1.918 COCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000233755 [1,1,0,0,0,0|2,0,0]=4 9458 B14R1.918 COCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000233755 [1,1,0,0,0,0|2,0,0]=4 9459 B14R1.918 COCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000233755 [1,1,0,0,0,0|2,0,0]=4 9460 B14R1.918 COCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000233755 [1,1,0,0,0,0|2,0,0]=4 9461 B14R1.918 COCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000233755 [1,1,0,0,0,0|2,0,0]=4 9462 B14R1.918 COCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000233755 [1,1,0,0,0,0|2,0,0]=4 9463 B14R1.918 COCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000233755 [1,1,0,0,0,0|2,0,0]=4 9464 B14R1.918 COCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000233755 [1,1,0,0,0,0|2,0,0]=4 9465 B14R1.918 COCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000233755 [1,1,0,0,0,0|2,0,0]=4 9466 B14R1.918 COCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000233755 [1,1,0,0,0,0|2,0,0]=4 9467 B14R1.918 COCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000233755 [1,1,0,0,0,0|2,0,0]=4 9468 B14R1.918 COCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000233755 [1,1,0,0,0,0|2,0,0]=4 9469 B14R1.918 COCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000233755 [1,1,0,0,0,0|2,0,0]=4 9470 B14R1.918 COCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000233755 [1,1,0,0,0,0|2,0,0]=4 9471 B14R1.918 COCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000233755 [1,1,0,0,0,0|2,0,0]=4 9472 B14R1.918 COCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000233755 [1,1,0,0,0,0|2,0,0]=4 9473 B14R1.918 COCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000233755 [1,1,0,0,0,0|2,0,0]=4 9474 B14R1.918 COCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000233755 [1,1,0,0,0,0|2,0,0]=4 9475 B14R1.918 COCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000233755 [1,1,0,0,0,0|2,0,0]=4 9476 B14R1.918 COCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000233755 [1,1,0,0,0,0|2,0,0]=4 9477 B14R1.918 COCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000233755 [1,1,0,0,0,0|2,0,0]=4 9478 B14R1.918 COCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000233755 [1,1,0,0,0,0|2,0,0]=4 9479 B14R1.918 COCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000233755 [1,1,0,0,0,0|1,0,0]=3 9480 B14R1.918 COCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000233755 [1,1,0,0,0,0|1,0,0]=3 9481 B14R1.918 COCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000233755 [1,1,0,0,0,0|1,0,0]=3 9482 B14R1.918 COCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000233755 [1,1,0,0,0,0|1,0,0]=3 9483 B14R1.918 COCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000233755 [1,1,0,0,0,0|1,0,0]=3 9484 B14R1.918 COCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000233755 [1,1,0,0,0,0|1,0,0]=3 9485 B14R1.918 CSCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000751147 [1,1,0,0,0,0|2,0,0]=4 9486 B14R1.918 CSCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000751147 [1,1,0,0,0,0|2,0,0]=4 9487 B14R1.918 CSCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000751147 [1,1,0,0,0,0|2,0,0]=4 9488 B14R1.918 CSCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000751147 [1,1,0,0,0,0|2,0,0]=4 9489 B14R1.918 CSCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000751147 [1,1,0,0,0,0|2,0,0]=4 9490 B14R1.918 CSCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000751147 [1,1,0,0,0,0|2,0,0]=4 9491 B14R1.918 CSCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000751147 [1,1,0,0,0,0|2,0,0]=4 9492 B14R1.918 CSCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000751147 [1,1,0,0,0,0|2,0,0]=4 9493 B14R1.918 CSCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000751147 [1,1,0,0,0,0|2,0,0]=4 9494 B14R1.918 CSCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000751147 [1,1,0,0,0,0|2,0,0]=4 9495 B14R1.918 CSCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000751147 [1,1,0,0,0,0|2,0,0]=4 9496 B14R1.918 CSCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000751147 [1,1,0,0,0,0|2,0,0]=4 9497 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000751147 [1,1,0,0,0,0|2,0,0]=4 9498 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000751147 [1,1,0,0,0,0|2,0,0]=4 9499 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000751147 [1,1,0,0,0,0|2,0,0]=4 9500 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000751147 [1,1,0,0,0,0|2,0,0]=4 9501 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000751147 [1,1,0,0,0,0|2,0,0]=4 9502 B14R1.918 CSCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000751147 [1,1,0,0,0,0|2,0,0]=4 9503 B14R1.918 CSCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000751147 [1,1,0,0,0,0|2,0,0]=4 9504 B14R1.918 CSCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000751147 [1,1,0,0,0,0|2,0,0]=4 9505 B14R1.918 CSCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000751147 [1,1,0,0,0,0|2,0,0]=4 9506 B14R1.918 CSCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000751147 [1,1,0,0,0,0|2,0,0]=4 9507 B14R1.918 CSCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000751147 [1,1,0,0,0,0|2,0,0]=4 9508 B14R1.918 CSCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000751147 [1,1,0,0,0,0|2,0,0]=4 9509 B14R1.918 CSCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000751147 [1,1,0,0,0,0|2,0,0]=4 9510 B14R1.918 CSCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000751147 [1,1,0,0,0,0|2,0,0]=4 9511 B14R1.918 CSCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000751147 [1,1,0,0,0,0|2,0,0]=4 9512 B14R1.918 CSCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000751147 [1,1,0,0,0,0|2,0,0]=4 9513 B14R1.918 CSCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000751147 [1,1,0,0,0,0|2,0,0]=4 9514 B14R1.918 CSCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000751147 [1,1,0,0,0,0|2,0,0]=4 9515 B14R1.918 CSCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000751147 [1,1,0,0,0,0|1,0,0]=3 9516 B14R1.918 CSCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000751147 [1,1,0,0,0,0|1,0,0]=3 9517 B14R1.918 CSCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000751147 [1,1,0,0,0,0|1,0,0]=3 9518 B14R1.918 CSCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000751147 [1,1,0,0,0,0|1,0,0]=3 9519 B14R1.918 CSCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000751147 [1,1,0,0,0,0|1,0,0]=3 9520 B14R1.918 CSCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000751147 [1,1,0,0,0,0|1,0,0]=3 9521 B14R1.918 Cc1ccc(c(c1)C(=O)CCC#N)O 1458a_100000229998_100011215226 [1,1,0,0,0,0|1,0,1]=4 9522 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)Br 1458a_100000689033_100011934791 [1,1,0,0,0,0|2,0,0]=4 9523 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)C 1458a_100000195421_100011934791 [1,1,0,0,0,0|2,0,0]=4 9524 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)Cl 1458a_100011290873_100011934791 [1,1,0,0,0,0|2,0,0]=4 9525 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)F 1458a_100000749327_100011934791 [1,1,0,0,0,0|2,0,0]=4 9526 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)I 1458a_100000057929_100011934791 [1,1,0,0,0,0|2,0,0]=4 9527 B14R1.918 Cc1ccc(c(c1)C(=O)CCCF)O 1458a_100000229998_100011934791 [1,1,0,0,0,0|1,0,0]=3 9528 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)Br 1458a_100000689033_100011215043 [1,1,0,0,0,0|2,0,0]=4 9529 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)C 1458a_100000195421_100011215043 [1,1,0,0,0,0|2,0,0]=4 9530 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)Cl 1458a_100011290873_100011215043 [1,1,0,0,0,0|2,0,0]=4 9531 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)F 1458a_100000749327_100011215043 [1,1,0,0,0,0|2,0,0]=4 9532 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)I 1458a_100000057929_100011215043 [1,1,0,0,0,0|2,0,0]=4 9533 B14R1.918 Cc1ccc(c(c1)C(=O)CCCO)O 1458a_100000229998_100011215043 [1,1,0,0,0,0|1,0,0]=3 9534 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)O 240690a_100000724931_100000229998 [1,1,0,0,0,0|2,0,0]=4 9535 B14R1.918 Cc1ccc(c(c1)C(=O)NCCF)O 527a_100000724931_100000229998 [1,1,0,0,0,0|2,0,0]=4 9536 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)O 240690a_100000210304_100000229998 [1,1,0,0,0,0|2,0,0]=4 9537 B14R1.918 Cc1ccc(c(c1)C(=O)NCCO)O 527a_100000210304_100000229998 [1,1,0,0,0,0|2,0,0]=4 9538 B14R1.918 Cc1ccc(cc1C(=O)CCCF)Br 1458a_100000759961_100011934791 [1,1,0,0,0,0|2,0,0]=4 9539 B14R1.918 Cc1ccc(cc1C(=O)CCCF)Cl 1458a_100000692595_100011934791 [1,1,0,0,0,0|2,0,0]=4 9540 B14R1.918 Cc1ccc(cc1C(=O)CCCF)F 1458a_100000240043_100011934791 [1,1,0,0,0,0|2,0,0]=4 9541 B14R1.918 Cc1ccc(cc1C(=O)CCCF)I 1458a_100000688012_100011934791 [1,1,0,0,0,0|2,0,0]=4 9542 B14R1.918 Cc1ccc(cc1C(=O)CCCF)O 1458a_100000687834_100011934791 [1,1,0,0,0,0|2,0,0]=4 9543 B14R1.918 Cc1ccc(cc1C(=O)CCCO)Br 1458a_100000759961_100011215043 [1,1,0,0,0,0|2,0,0]=4 9544 B14R1.918 Cc1ccc(cc1C(=O)CCCO)Cl 1458a_100000692595_100011215043 [1,1,0,0,0,0|2,0,0]=4 9545 B14R1.918 Cc1ccc(cc1C(=O)CCCO)F 1458a_100000240043_100011215043 [1,1,0,0,0,0|2,0,0]=4 9546 B14R1.918 Cc1ccc(cc1C(=O)CCCO)I 1458a_100000688012_100011215043 [1,1,0,0,0,0|2,0,0]=4 9547 B14R1.918 Cc1ccc(cc1C(=O)CCCO)O 1458a_100000687834_100011215043 [1,1,0,0,0,0|2,0,0]=4 9548 B14R1.918 N#CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215226 [1,1,0,0,0,0|1,0,1]=4 9549 B14R1.918 N#CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215226 [1,1,0,0,0,0|1,0,1]=4 9550 B14R1.918 N#CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215226 [1,1,0,0,0,0|1,0,1]=4 9551 B14R1.918 N#CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215226 [1,1,0,0,0,0|1,0,1]=4 9552 B14R1.918 N#CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215226 [1,1,0,0,0,0|1,0,1]=4 9553 B14R1.918 O=C(CCCF)c1cc(ccc1Br)Br 1458a_100000690610_100011934791 [1,1,0,0,0,0|2,0,0]=4 9554 B14R1.918 O=C(CCCF)c1cc(ccc1Br)Cl 1458a_100000736951_100011934791 [1,1,0,0,0,0|2,0,0]=4 9555 B14R1.918 O=C(CCCF)c1cc(ccc1Br)F 1458a_100000212315_100011934791 [1,1,0,0,0,0|2,0,0]=4 9556 B14R1.918 O=C(CCCF)c1cc(ccc1Br)I 1458a_100000698340_100011934791 [1,1,0,0,0,0|2,0,0]=4 9557 B14R1.918 O=C(CCCF)c1cc(ccc1Br)O 1458a_100012352043_100011934791 [1,1,0,0,0,0|2,0,0]=4 9558 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)Br 1458a_100000211212_100011934791 [1,1,0,0,0,0|2,0,0]=4 9559 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100011934791 [1,1,0,0,0,0|2,0,0]=4 9560 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)F 1458a_100011219680_100011934791 [1,1,0,0,0,0|2,0,0]=4 9561 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)I 1458a_100000688013_100011934791 [1,1,0,0,0,0|2,0,0]=4 9562 B14R1.918 O=C(CCCF)c1cc(ccc1Cl)O 1458a_100000719527_100011934791 [1,1,0,0,0,0|2,0,0]=4 9563 B14R1.918 O=C(CCCF)c1cc(ccc1F)Br 1458a_100000212322_100011934791 [1,1,0,0,0,0|2,0,0]=4 9564 B14R1.918 O=C(CCCF)c1cc(ccc1F)Cl 1458a_100000214954_100011934791 [1,1,0,0,0,0|2,0,0]=4 9565 B14R1.918 O=C(CCCF)c1cc(ccc1F)F 1458a_100000198512_100011934791 [1,1,0,0,0,0|2,0,0]=4 9566 B14R1.918 O=C(CCCF)c1cc(ccc1F)I 1458a_100000688014_100011934791 [1,1,0,0,0,0|2,0,0]=4 9567 B14R1.918 O=C(CCCF)c1cc(ccc1F)O 1458a_100000037260_100011934791 [1,1,0,0,0,0|2,0,0]=4 9568 B14R1.918 O=C(CCCF)c1cc(ccc1I)Br 1458a_100000183945_100011934791 [1,1,0,0,0,0|2,0,0]=4 9569 B14R1.918 O=C(CCCF)c1cc(ccc1I)Cl 1458a_100000739379_100011934791 [1,1,0,0,0,0|2,0,0]=4 9570 B14R1.918 O=C(CCCF)c1cc(ccc1I)F 1458a_100000748905_100011934791 [1,1,0,0,0,0|2,0,0]=4 9571 B14R1.918 O=C(CCCF)c1cc(ccc1I)I 1458a_100000750460_100011934791 [1,1,0,0,0,0|2,0,0]=4 9572 B14R1.918 O=C(CCCF)c1cc(ccc1I)O 1458a_200009995701_100011934791 [1,1,0,0,0,0|2,0,0]=4 9573 B14R1.918 O=C(CCCF)c1cc(ccc1O)Br 1458a_100000212140_100011934791 [1,1,0,0,0,0|1,0,0]=3 9574 B14R1.918 O=C(CCCF)c1cc(ccc1O)Cl 1458a_100000212143_100011934791 [1,1,0,0,0,0|1,0,0]=3 9575 B14R1.918 O=C(CCCF)c1cc(ccc1O)F 1458a_100000742286_100011934791 [1,1,0,0,0,0|1,0,0]=3 9576 B14R1.918 O=C(CCCF)c1cc(ccc1O)I 1458a_100000212111_100011934791 [1,1,0,0,0,0|1,0,0]=3 9577 B14R1.918 O=C(CCCF)c1cc(ccc1O)O 1458a_100000758025_100011934791 [1,1,0,0,0,0|1,0,0]=3 9578 B14R1.918 O=C(CCCO)c1cc(ccc1Br)Br 1458a_100000690610_100011215043 [1,1,0,0,0,0|2,0,0]=4 9579 B14R1.918 O=C(CCCO)c1cc(ccc1Br)Cl 1458a_100000736951_100011215043 [1,1,0,0,0,0|2,0,0]=4 9580 B14R1.918 O=C(CCCO)c1cc(ccc1Br)F 1458a_100000212315_100011215043 [1,1,0,0,0,0|2,0,0]=4 9581 B14R1.918 O=C(CCCO)c1cc(ccc1Br)I 1458a_100000698340_100011215043 [1,1,0,0,0,0|2,0,0]=4 9582 B14R1.918 O=C(CCCO)c1cc(ccc1Br)O 1458a_100012352043_100011215043 [1,1,0,0,0,0|2,0,0]=4 9583 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)Br 1458a_100000211212_100011215043 [1,1,0,0,0,0|2,0,0]=4 9584 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100011215043 [1,1,0,0,0,0|2,0,0]=4 9585 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)F 1458a_100011219680_100011215043 [1,1,0,0,0,0|2,0,0]=4 9586 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)I 1458a_100000688013_100011215043 [1,1,0,0,0,0|2,0,0]=4 9587 B14R1.918 O=C(CCCO)c1cc(ccc1Cl)O 1458a_100000719527_100011215043 [1,1,0,0,0,0|2,0,0]=4 9588 B14R1.918 O=C(CCCO)c1cc(ccc1F)Br 1458a_100000212322_100011215043 [1,1,0,0,0,0|2,0,0]=4 9589 B14R1.918 O=C(CCCO)c1cc(ccc1F)Cl 1458a_100000214954_100011215043 [1,1,0,0,0,0|2,0,0]=4 9590 B14R1.918 O=C(CCCO)c1cc(ccc1F)F 1458a_100000198512_100011215043 [1,1,0,0,0,0|2,0,0]=4 9591 B14R1.918 O=C(CCCO)c1cc(ccc1F)I 1458a_100000688014_100011215043 [1,1,0,0,0,0|2,0,0]=4 9592 B14R1.918 O=C(CCCO)c1cc(ccc1F)O 1458a_100000037260_100011215043 [1,1,0,0,0,0|2,0,0]=4 9593 B14R1.918 O=C(CCCO)c1cc(ccc1I)Br 1458a_100000183945_100011215043 [1,1,0,0,0,0|2,0,0]=4 9594 B14R1.918 O=C(CCCO)c1cc(ccc1I)Cl 1458a_100000739379_100011215043 [1,1,0,0,0,0|2,0,0]=4 9595 B14R1.918 O=C(CCCO)c1cc(ccc1I)F 1458a_100000748905_100011215043 [1,1,0,0,0,0|2,0,0]=4 9596 B14R1.918 O=C(CCCO)c1cc(ccc1I)I 1458a_100000750460_100011215043 [1,1,0,0,0,0|2,0,0]=4 9597 B14R1.918 O=C(CCCO)c1cc(ccc1I)O 1458a_200009995701_100011215043 [1,1,0,0,0,0|2,0,0]=4 9598 B14R1.918 O=C(CCCO)c1cc(ccc1O)Br 1458a_100000212140_100011215043 [1,1,0,0,0,0|1,0,0]=3 9599 B14R1.918 O=C(CCCO)c1cc(ccc1O)Cl 1458a_100000212143_100011215043 [1,1,0,0,0,0|1,0,0]=3 9600 B14R1.918 O=C(CCCO)c1cc(ccc1O)F 1458a_100000742286_100011215043 [1,1,0,0,0,0|1,0,0]=3 9601 B14R1.918 O=C(CCCO)c1cc(ccc1O)I 1458a_100000212111_100011215043 [1,1,0,0,0,0|1,0,0]=3 9602 B14R1.918 O=C(CCCO)c1cc(ccc1O)O 1458a_100000758025_100011215043 [1,1,0,0,0,0|1,0,0]=3 9603 B14R1.918 O=C(CSCF)c1cc(ccc1O)Br 62a_200009828000_100015361967 [1,1,0,0,0,0|2,0,0]=4 9604 B14R1.918 O=C(CSCF)c1cc(ccc1O)Cl 62a_200009816716_100015361967 [1,1,0,0,0,0|2,0,0]=4 9605 B14R1.918 O=C(CSCF)c1cc(ccc1O)F 62a_100009814381_100015361967 [1,1,0,0,0,0|2,0,0]=4 9606 B14R1.918 O=C(CSCF)c1cc(ccc1O)F 62a_100015361967_100009814381 [1,1,0,0,0,0|2,0,0]=4 9607 B14R1.918 O=C(CSCF)c1cc(ccc1O)O 62a_100009814097_100015361967 [1,1,0,0,0,0|2,0,0]=4 9608 B14R1.918 O=C(CSCF)c1cc(ccc1O)O 62a_100015361967_100009814097 [1,1,0,0,0,0|2,0,0]=4 9609 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br 1626a_100000724931_100000212140 [1,1,0,0,0,0|2,0,0]=4 9610 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br 240690a_100000724931_100000212140 [1,1,0,0,0,0|2,0,0]=4 9611 B14R1.918 O=C(NCCF)c1cc(ccc1O)Br 527a_100000724931_100000212140 [1,1,0,0,0,0|2,0,0]=4 9612 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 11a_100000724931_100000212143 [1,1,0,0,0,0|2,0,0]=4 9613 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 1626a_100000724931_100000212143 [1,1,0,0,0,0|2,0,0]=4 9614 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 240690a_100000724931_100000212143 [1,1,0,0,0,0|2,0,0]=4 9615 B14R1.918 O=C(NCCF)c1cc(ccc1O)Cl 527a_100000724931_100000212143 [1,1,0,0,0,0|2,0,0]=4 9616 B14R1.918 O=C(NCCF)c1cc(ccc1O)F 240690a_100000724931_100000742286 [1,1,0,0,0,0|2,0,0]=4 9617 B14R1.918 O=C(NCCF)c1cc(ccc1O)F 527a_100000724931_100000742286 [1,1,0,0,0,0|2,0,0]=4 9618 B14R1.918 O=C(NCCF)c1cc(ccc1O)I 240690a_100000724931_100000212111 [1,1,0,0,0,0|2,0,0]=4 9619 B14R1.918 O=C(NCCF)c1cc(ccc1O)I 527a_100000724931_100000212111 [1,1,0,0,0,0|2,0,0]=4 9620 B14R1.918 O=C(NCCO)c1cc(ccc1O)Br 240690a_100000210304_100000212140 [1,1,0,0,0,0|2,0,0]=4 9621 B14R1.918 O=C(NCCO)c1cc(ccc1O)Br 527a_100000210304_100000212140 [1,1,0,0,0,0|2,0,0]=4 9622 B14R1.918 O=C(NCCO)c1cc(ccc1O)Cl 240690a_100000210304_100000212143 [1,1,0,0,0,0|2,0,0]=4 9623 B14R1.918 O=C(NCCO)c1cc(ccc1O)Cl 527a_100000210304_100000212143 [1,1,0,0,0,0|2,0,0]=4 9624 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 240690a_100000210304_100000742286 [1,1,0,0,0,0|2,0,0]=4 9625 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 271570a_203496583355_200000206141 [1,1,0,0,0,0|2,0,0]=4 9626 B14R1.918 O=C(NCCO)c1cc(ccc1O)F 527a_100000210304_100000742286 [1,1,0,0,0,0|2,0,0]=4 9627 B14R1.918 O=C(NCCO)c1cc(ccc1O)I 240690a_100000210304_100000212111 [1,1,0,0,0,0|2,0,0]=4 9628 B14R1.918 O=C(NCCO)c1cc(ccc1O)I 527a_100000210304_100000212111 [1,1,0,0,0,0|2,0,0]=4 9629 B14R1.939 C#CCCC(=O)c1ccccc1CO 1458a_100011301526_100000753159 [1,1,0,0,0,0|0,0,2]=4 9630 B14R1.939 C#CCCC(=O)c1ccccc1OC 1458a_100000185835_100000753159 [1,1,0,0,0,0|0,0,2]=4 9631 B14R1.939 C#Cc1ccccc1C(=O)CCCC 1458a_100011243808_100000210211 [1,1,0,0,0,0|1,0,0]=3 9632 B14R1.939 C#Cc1ccccc1C(=O)CCCF 1458a_100011243808_100011934791 [1,1,0,0,0,0|2,0,0]=4 9633 B14R1.939 C#Cc1ccccc1C(=O)CCCO 1458a_100011243808_100011215043 [1,1,0,0,0,0|2,0,0]=4 9634 B14R1.939 C#Cc1ccccc1C(=O)CCOC 1458a_100011243808_100000233755 [1,1,0,0,0,0|2,0,0]=4 9635 B14R1.939 C#Cc1ccccc1C(=O)CCSC 1458a_100011243808_100000751147 [1,1,0,0,0,0|2,0,0]=4 9636 B14R1.939 C#Cc1ccccc1C(=O)NCCC 527a_100020643023_100011243808 [1,1,0,0,0,0|2,0,0]=4 9637 B14R1.939 C/C=C/CC(=O)c1ccccc1CO 1458a_100011301526_100102629194 [1,1,0,0,0,0|0,0,2]=4 9638 B14R1.939 C/C=C/CC(=O)c1ccccc1OC 1458a_100000185835_100102629194 [1,1,0,0,0,0|0,0,2]=4 9639 B14R1.939 C=CCCC(=O)c1ccccc1CO 1458a_100011301526_100000754431 [1,1,0,0,0,0|0,0,2]=4 9640 B14R1.939 C=CCCC(=O)c1ccccc1OC 1458a_100000185835_100000754431 [1,1,0,0,0,0|0,0,2]=4 9641 B14R1.939 C=Cc1ccccc1C(=O)CCCC 1458a_100011830265_100000210211 [1,1,0,0,0,0|1,0,0]=3 9642 B14R1.939 C=Cc1ccccc1C(=O)CCCF 1458a_100011830265_100011934791 [1,1,0,0,0,0|2,0,0]=4 9643 B14R1.939 C=Cc1ccccc1C(=O)CCCO 1458a_100011830265_100011215043 [1,1,0,0,0,0|2,0,0]=4 9644 B14R1.939 C=Cc1ccccc1C(=O)CCOC 1458a_100011830265_100000233755 [1,1,0,0,0,0|2,0,0]=4 9645 B14R1.939 C=Cc1ccccc1C(=O)CCSC 1458a_100011830265_100000751147 [1,1,0,0,0,0|2,0,0]=4 9646 B14R1.939 C=Cc1ccccc1C(=O)NCCC 1626a_100020643023_100011830265 [1,1,0,0,0,0|2,0,0]=4 9647 B14R1.939 C=Cc1ccccc1C(=O)NCCC 271570a_100011290941_200000152266 [1,1,0,0,0,0|2,0,0]=4 9648 B14R1.939 CC#CCC(=O)c1ccccc1CO 1458a_100011301526_100000748600 [1,1,0,0,0,0|0,0,2]=4 9649 B14R1.939 CC#CCC(=O)c1ccccc1OC 1458a_100000185835_100000748600 [1,1,0,0,0,0|0,0,2]=4 9650 B14R1.939 CC=CCC(=O)c1ccccc1CO 1458a_100011301526_100000070051 [1,1,0,0,0,0|0,0,2]=4 9651 B14R1.939 CC=CCC(=O)c1ccccc1OC 1458a_100000185835_100000070051 [1,1,0,0,0,0|0,0,2]=4 9652 B14R1.939 CCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210211 [1,1,0,0,0,0|1,0,0]=3 9653 B14R1.939 CCCCC(=O)c1ccccc1CC 1458a_100000689120_100000210211 [1,1,0,0,0,0|1,0,0]=3 9654 B14R1.939 CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000210211 [1,1,0,0,0,0|0,0,0]=2 9655 B14R1.939 CCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210211 [1,1,0,0,0,0|0,0,1]=3 9656 B14R1.939 CCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210211 [1,1,0,0,0,0|0,0,0]=2 9657 B14R1.939 CCCCC(=O)c1ccccc1SC 1458a_100000183967_100000210211 [1,1,0,0,0,0|0,1,0]=3 9658 B14R1.939 CCCCN(C)c1ccccc1OC 2230a_100000219746_100000210211 [1,1,0,0,0,0|2,0,0]=4 9659 B14R1.939 CCCCN(C)c1ccccc1OC 269982a_100000219746_100000210211 [1,1,0,0,0,0|2,0,0]=4 9660 B14R1.939 CCCCN(C)c1ccccc1OC 34a_100000219746_100000210210 [1,1,0,0,0,0|2,0,0]=4 9661 B14R1.939 CCCNC(=O)c1ccccc1C#N 11a_100020643023_100000742908 [1,1,0,0,0,0|2,0,0]=4 9662 B14R1.939 CCCNC(=O)c1ccccc1C#N 1626a_100020643023_100000742908 [1,1,0,0,0,0|2,0,0]=4 9663 B14R1.939 CCCNC(=O)c1ccccc1C#N 527a_100020643023_100000742908 [1,1,0,0,0,0|2,0,0]=4 9664 B14R1.939 CCCNC(=O)c1ccccc1CC 11a_100020643023_100000689120 [1,1,0,0,0,0|2,0,0]=4 9665 B14R1.939 CCCNC(=O)c1ccccc1CC 1626a_100020643023_100000689120 [1,1,0,0,0,0|2,0,0]=4 9666 B14R1.939 CCCNC(=O)c1ccccc1CC 240690a_100020643023_100000689120 [1,1,0,0,0,0|2,0,0]=4 9667 B14R1.939 CCCNC(=O)c1ccccc1CC 527a_100020643023_100000689120 [1,1,0,0,0,0|2,0,0]=4 9668 B14R1.939 CCCNC(=O)c1ccccc1I=O 1626a_100020643023_100000032414 [1,1,0,0,0,0|1,0,1]=4 9669 B14R1.939 CCCNC(=O)c1ccccc1I=O 240690a_100020643023_100000032414 [1,1,0,0,0,0|1,0,1]=4 9670 B14R1.939 CCCNC(=O)c1ccccc1I=O 527a_100020643023_100000032414 [1,1,0,0,0,0|1,0,1]=4 9671 B14R1.939 CCCNC(=O)c1ccccc1NC 27a_100102657272_200000152266 [1,1,0,0,0,0|2,0,0]=4 9672 B14R1.939 CCCNC(=O)c1ccccc1NC 34a_100000181257_200000210301 [1,1,0,0,0,0|2,0,0]=4 9673 B14R1.939 CCCNC(=O)c1ccccc1N[13CH3] 34a_100000181257_200025704644 [1,1,0,0,0,0|2,0,0]=4 9674 B14R1.939 CCCNC(=O)c1ccccc1OC 11a_100020643023_100000185835 [1,1,0,0,0,0|1,0,0]=3 9675 B14R1.939 CCCNC(=O)c1ccccc1OC 1626a_100020643023_100000185835 [1,1,0,0,0,0|1,0,0]=3 9676 B14R1.939 CCCNC(=O)c1ccccc1OC 240690a_100020643023_100000185835 [1,1,0,0,0,0|1,0,0]=3 9677 B14R1.939 CCCNC(=O)c1ccccc1OC 527a_100020643023_100000185835 [1,1,0,0,0,0|1,0,0]=3 9678 B14R1.939 CCCNC(=O)c1ccccc1SC 11a_100020643023_100000183967 [1,1,0,0,0,0|1,1,0]=4 9679 B14R1.939 CCCNC(=O)c1ccccc1SC 1626a_100020643023_100000183967 [1,1,0,0,0,0|1,1,0]=4 9680 B14R1.939 CCCNC(=O)c1ccccc1SC 240690a_100020643023_100000183967 [1,1,0,0,0,0|1,1,0]=4 9681 B14R1.939 CCCNC(=O)c1ccccc1SC 527a_100020643023_100000183967 [1,1,0,0,0,0|1,1,0]=4 9682 B14R1.939 CCCNC(=O)c1ccccc1SC 62a_200000152266_200000210301 [1,1,0,0,0,0|1,1,0]=4 9683 B14R1.939 CCCNC(=O)c1ccccc1SC 62a_200000210301_200000152266 [1,1,0,0,0,0|1,1,0]=4 9684 B14R1.939 CCCNC(=O)c1ccccc1S[13CH3] 62a_200000152266_200025704644 [1,1,0,0,0,0|1,1,0]=4 9685 B14R1.939 CCCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152266 [1,1,0,0,0,0|1,1,0]=4 9686 B14R1.939 CCCOC(=O)c1ccccc1OC 7a_100000169924_200000210301 [1,1,0,0,0,0|0,0,0]=2 9687 B14R1.939 CCCOC(=O)c1ccccc1O[13CH3] 7a_100000169924_200025704644 [1,1,0,0,0,0|0,0,0]=2 9688 B14R1.939 CCCOC(C)c1ccccc1OC 7a_100000742714_100000210303 [1,1,0,0,0,0|1,0,1]=4 9689 B14R1.939 CCNNC(=O)c1ccccc1OC 22a_100000756455_100000185835 [1,1,0,0,0,0|2,0,0]=4 9690 B14R1.939 CCOCC(=O)c1ccccc1OC 34a_100121572206_100000195505 [1,1,0,0,0,0|1,0,0]=3 9691 B14R1.939 CCSCC(=O)c1ccccc1OC 62a_100000195505_100000210202 [1,1,0,0,0,0|1,0,0]=3 9692 B14R1.939 CCc1ccccc1C(=O)CCCF 1458a_100000689120_100011934791 [1,1,0,0,0,0|2,0,0]=4 9693 B14R1.939 CCc1ccccc1C(=O)CCCO 1458a_100000689120_100011215043 [1,1,0,0,0,0|2,0,0]=4 9694 B14R1.939 CCc1ccccc1C(=O)CCOC 1458a_100000689120_100000233755 [1,1,0,0,0,0|2,0,0]=4 9695 B14R1.939 CCc1ccccc1C(=O)CCSC 1458a_100000689120_100000751147 [1,1,0,0,0,0|2,0,0]=4 9696 B14R1.939 COCCC(=O)c1ccccc1C#N 1458a_100000742908_100000233755 [1,1,0,0,0,0|2,0,0]=4 9697 B14R1.939 COCCC(=O)c1ccccc1CO 1458a_100011301526_100000233755 [1,1,0,0,0,0|1,0,0]=3 9698 B14R1.939 COCCC(=O)c1ccccc1I=O 1458a_100000032414_100000233755 [1,1,0,0,0,0|1,0,1]=4 9699 B14R1.939 COCCC(=O)c1ccccc1OC 1458a_100000185835_100000233755 [1,1,0,0,0,0|1,0,0]=3 9700 B14R1.939 COCCC(=O)c1ccccc1SC 1458a_100000183967_100000233755 [1,1,0,0,0,0|1,1,0]=4 9701 B14R1.939 COc1ccccc1C(=O)CCC#N 1458a_100000185835_100011215226 [1,1,0,0,0,0|1,0,1]=4 9702 B14R1.939 COc1ccccc1C(=O)CCCF 1458a_100000185835_100011934791 [1,1,0,0,0,0|1,0,0]=3 9703 B14R1.939 COc1ccccc1C(=O)CCCO 1458a_100000185835_100011215043 [1,1,0,0,0,0|1,0,0]=3 9704 B14R1.939 COc1ccccc1C(=O)CCSC 1458a_100000185835_100000751147 [1,1,0,0,0,0|1,0,0]=3 9705 B14R1.939 COc1ccccc1C(=O)CSCF 62a_100000195505_100015361967 [1,1,0,0,0,0|2,0,0]=4 9706 B14R1.939 COc1ccccc1C(=O)NCCF 11a_100000724931_100000185835 [1,1,0,0,0,0|2,0,0]=4 9707 B14R1.939 COc1ccccc1C(=O)NCCF 1626a_100000724931_100000185835 [1,1,0,0,0,0|2,0,0]=4 9708 B14R1.939 COc1ccccc1C(=O)NCCF 240690a_100000724931_100000185835 [1,1,0,0,0,0|2,0,0]=4 9709 B14R1.939 COc1ccccc1C(=O)NCCF 527a_100000724931_100000185835 [1,1,0,0,0,0|2,0,0]=4 9710 B14R1.939 COc1ccccc1C(=O)NCCO 240690a_100000210304_100000185835 [1,1,0,0,0,0|2,0,0]=4 9711 B14R1.939 COc1ccccc1C(=O)NCCO 527a_100000210304_100000185835 [1,1,0,0,0,0|2,0,0]=4 9712 B14R1.939 COc1ccccc1C(=O)OCCO 7a_100000229999_200000210301 [1,1,0,0,0,0|1,0,0]=3 9713 B14R1.939 CSCCC(=O)c1ccccc1C#N 1458a_100000742908_100000751147 [1,1,0,0,0,0|2,0,0]=4 9714 B14R1.939 CSCCC(=O)c1ccccc1CO 1458a_100011301526_100000751147 [1,1,0,0,0,0|1,0,0]=3 9715 B14R1.939 CSCCC(=O)c1ccccc1I=O 1458a_100000032414_100000751147 [1,1,0,0,0,0|1,0,1]=4 9716 B14R1.939 CSCCC(=O)c1ccccc1SC 1458a_100000183967_100000751147 [1,1,0,0,0,0|1,1,0]=4 9717 B14R1.939 CSc1ccccc1C(=O)CCCF 1458a_100000183967_100011934791 [1,1,0,0,0,0|1,1,0]=4 9718 B14R1.939 CSc1ccccc1C(=O)CCCO 1458a_100000183967_100011215043 [1,1,0,0,0,0|1,1,0]=4 9719 B14R1.939 N#CCCC(=O)c1ccccc1CO 1458a_100011301526_100011215226 [1,1,0,0,0,0|1,0,1]=4 9720 B14R1.939 N#Cc1ccccc1C(=O)CCCF 1458a_100000742908_100011934791 [1,1,0,0,0,0|2,0,0]=4 9721 B14R1.939 N#Cc1ccccc1C(=O)CCCO 1458a_100000742908_100011215043 [1,1,0,0,0,0|2,0,0]=4 9722 B14R1.939 O=C(CCCF)c1ccccc1CO 1458a_100011301526_100011934791 [1,1,0,0,0,0|1,0,0]=3 9723 B14R1.939 O=C(CCCO)c1ccccc1CO 1458a_100011301526_100011215043 [1,1,0,0,0,0|1,0,0]=3 9724 B14R1.939 O=Ic1ccccc1C(=O)CCCF 1458a_100000032414_100011934791 [1,1,0,0,0,0|1,0,1]=4 9725 B14R1.939 O=Ic1ccccc1C(=O)CCCO 1458a_100000032414_100011215043 [1,1,0,0,0,0|1,0,1]=4 9726 B14R1.939 [13CH3]Oc1ccccc1C(=O)OCCO 7a_100000229999_200025704644 [1,1,0,0,0,0|1,0,0]=3 9727 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000753159 [1,1,0,0,0,0|0,0,2]=4 9728 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000753159 [1,1,0,0,0,0|0,0,2]=4 9729 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000753159 [1,1,0,0,0,0|0,0,2]=4 9730 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000753159 [1,1,0,0,0,0|0,0,2]=4 9731 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000753159 [1,1,0,0,0,0|0,0,2]=4 9732 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000753159 [1,1,0,0,0,0|0,0,2]=4 9733 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100102629194 [1,1,0,0,0,0|0,0,2]=4 9734 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)C 1458a_100000212137_100102629194 [1,1,0,0,0,0|0,0,2]=4 9735 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100102629194 [1,1,0,0,0,0|0,0,2]=4 9736 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)F 1458a_100000746061_100102629194 [1,1,0,0,0,0|0,0,2]=4 9737 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)I 1458a_100000091984_100102629194 [1,1,0,0,0,0|0,0,2]=4 9738 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)O 1458a_100000212172_100102629194 [1,1,0,0,0,0|0,0,2]=4 9739 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000754431 [1,1,0,0,0,0|0,0,2]=4 9740 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000754431 [1,1,0,0,0,0|0,0,2]=4 9741 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000754431 [1,1,0,0,0,0|0,0,2]=4 9742 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000754431 [1,1,0,0,0,0|0,0,2]=4 9743 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000754431 [1,1,0,0,0,0|0,0,2]=4 9744 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000754431 [1,1,0,0,0,0|0,0,2]=4 9745 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000748600 [1,1,0,0,0,0|0,0,2]=4 9746 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000748600 [1,1,0,0,0,0|0,0,2]=4 9747 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000748600 [1,1,0,0,0,0|0,0,2]=4 9748 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000748600 [1,1,0,0,0,0|0,0,2]=4 9749 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000748600 [1,1,0,0,0,0|0,0,2]=4 9750 B14R1.2523 CC#CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000748600 [1,1,0,0,0,0|0,0,2]=4 9751 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000070051 [1,1,0,0,0,0|0,0,2]=4 9752 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000070051 [1,1,0,0,0,0|0,0,2]=4 9753 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000070051 [1,1,0,0,0,0|0,0,2]=4 9754 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000070051 [1,1,0,0,0,0|0,0,2]=4 9755 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000070051 [1,1,0,0,0,0|0,0,2]=4 9756 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000070051 [1,1,0,0,0,0|0,0,2]=4 9757 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210211 [1,1,0,0,0,0|1,0,0]=3 9758 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210211 [1,1,0,0,0,0|1,0,0]=3 9759 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210211 [1,1,0,0,0,0|1,0,0]=3 9760 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210211 [1,1,0,0,0,0|1,0,0]=3 9761 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210211 [1,1,0,0,0,0|1,0,0]=3 9762 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210211 [1,1,0,0,0,0|1,0,0]=3 9763 B14R1.2523 CCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210211 [1,1,0,0,0,0|1,0,0]=3 9764 B14R1.2523 CCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210211 [1,1,0,0,0,0|1,0,0]=3 9765 B14R1.2523 CCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210211 [1,1,0,0,0,0|1,0,0]=3 9766 B14R1.2523 CCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210211 [1,1,0,0,0,0|1,0,0]=3 9767 B14R1.2523 CCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210211 [1,1,0,0,0,0|1,0,0]=3 9768 B14R1.2523 CCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210211 [1,1,0,0,0,0|1,0,0]=3 9769 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210211 [1,1,0,0,0,0|1,0,0]=3 9770 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210211 [1,1,0,0,0,0|1,0,0]=3 9771 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210211 [1,1,0,0,0,0|1,0,0]=3 9772 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210211 [1,1,0,0,0,0|1,0,0]=3 9773 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210211 [1,1,0,0,0,0|1,0,0]=3 9774 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210211 [1,1,0,0,0,0|1,0,0]=3 9775 B14R1.2523 CCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210211 [1,1,0,0,0,0|1,0,0]=3 9776 B14R1.2523 CCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210211 [1,1,0,0,0,0|1,0,0]=3 9777 B14R1.2523 CCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210211 [1,1,0,0,0,0|1,0,0]=3 9778 B14R1.2523 CCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210211 [1,1,0,0,0,0|1,0,0]=3 9779 B14R1.2523 CCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210211 [1,1,0,0,0,0|1,0,0]=3 9780 B14R1.2523 CCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210211 [1,1,0,0,0,0|1,0,0]=3 9781 B14R1.2523 CCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210211 [1,1,0,0,0,0|1,0,0]=3 9782 B14R1.2523 CCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210211 [1,1,0,0,0,0|1,0,0]=3 9783 B14R1.2523 CCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210211 [1,1,0,0,0,0|1,0,0]=3 9784 B14R1.2523 CCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210211 [1,1,0,0,0,0|1,0,0]=3 9785 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210211 [1,1,0,0,0,0|0,0,0]=2 9786 B14R1.2523 CCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210211 [1,1,0,0,0,0|0,0,0]=2 9787 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210211 [1,1,0,0,0,0|0,0,0]=2 9788 B14R1.2523 CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210211 [1,1,0,0,0,0|0,0,0]=2 9789 B14R1.2523 CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210211 [1,1,0,0,0,0|0,0,0]=2 9790 B14R1.2523 CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210211 [1,1,0,0,0,0|0,0,0]=2 9791 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 11a_100020643023_100000762965 [1,1,0,0,0,0|2,0,0]=4 9792 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 1626a_100020643023_100000762965 [1,1,0,0,0,0|2,0,0]=4 9793 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 240690a_100020643023_100000762965 [1,1,0,0,0,0|2,0,0]=4 9794 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 527a_100020643023_100000762965 [1,1,0,0,0,0|2,0,0]=4 9795 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 11a_100020643023_100000685072 [1,1,0,0,0,0|2,0,0]=4 9796 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 1626a_100020643023_100000685072 [1,1,0,0,0,0|2,0,0]=4 9797 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 240690a_100020643023_100000685072 [1,1,0,0,0,0|2,0,0]=4 9798 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 527a_100020643023_100000685072 [1,1,0,0,0,0|2,0,0]=4 9799 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 11a_100020643023_100000766353 [1,1,0,0,0,0|2,0,0]=4 9800 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 1626a_100020643023_100000766353 [1,1,0,0,0,0|2,0,0]=4 9801 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 240690a_100020643023_100000766353 [1,1,0,0,0,0|2,0,0]=4 9802 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 527a_100020643023_100000766353 [1,1,0,0,0,0|2,0,0]=4 9803 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 11a_100020643023_100000212304 [1,1,0,0,0,0|2,0,0]=4 9804 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 1626a_100020643023_100000212304 [1,1,0,0,0,0|2,0,0]=4 9805 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 240690a_100020643023_100000212304 [1,1,0,0,0,0|2,0,0]=4 9806 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 527a_100020643023_100000212304 [1,1,0,0,0,0|2,0,0]=4 9807 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 11a_100020643023_100012360512 [1,1,0,0,0,0|2,0,0]=4 9808 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 1626a_100020643023_100012360512 [1,1,0,0,0,0|2,0,0]=4 9809 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 240690a_100020643023_100012360512 [1,1,0,0,0,0|2,0,0]=4 9810 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 527a_100020643023_100012360512 [1,1,0,0,0,0|2,0,0]=4 9811 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)O 240690a_100020643023_100012344906 [1,1,0,0,0,0|2,0,0]=4 9812 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)O 527a_100020643023_100012344906 [1,1,0,0,0,0|2,0,0]=4 9813 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 11a_100020643023_100000741311 [1,1,0,0,0,0|2,0,0]=4 9814 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 1626a_100020643023_100000741311 [1,1,0,0,0,0|2,0,0]=4 9815 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 240690a_100020643023_100000741311 [1,1,0,0,0,0|2,0,0]=4 9816 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 527a_100020643023_100000741311 [1,1,0,0,0,0|2,0,0]=4 9817 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 11a_100020643023_100000211164 [1,1,0,0,0,0|2,0,0]=4 9818 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 1626a_100020643023_100000211164 [1,1,0,0,0,0|2,0,0]=4 9819 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 240690a_100020643023_100000211164 [1,1,0,0,0,0|2,0,0]=4 9820 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 527a_100020643023_100000211164 [1,1,0,0,0,0|2,0,0]=4 9821 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 11a_100020643023_100000688705 [1,1,0,0,0,0|2,0,0]=4 9822 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 1626a_100020643023_100000688705 [1,1,0,0,0,0|2,0,0]=4 9823 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 240690a_100020643023_100000688705 [1,1,0,0,0,0|2,0,0]=4 9824 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 527a_100020643023_100000688705 [1,1,0,0,0,0|2,0,0]=4 9825 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 11a_100020643023_100000686989 [1,1,0,0,0,0|2,0,0]=4 9826 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 1626a_100020643023_100000686989 [1,1,0,0,0,0|2,0,0]=4 9827 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 240690a_100020643023_100000686989 [1,1,0,0,0,0|2,0,0]=4 9828 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 527a_100020643023_100000686989 [1,1,0,0,0,0|2,0,0]=4 9829 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 11a_100020643023_100010189873 [1,1,0,0,0,0|2,0,0]=4 9830 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 1626a_100020643023_100010189873 [1,1,0,0,0,0|2,0,0]=4 9831 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 240690a_100020643023_100010189873 [1,1,0,0,0,0|2,0,0]=4 9832 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 527a_100020643023_100010189873 [1,1,0,0,0,0|2,0,0]=4 9833 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O 240690a_100020643023_100000692822 [1,1,0,0,0,0|2,0,0]=4 9834 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O 527a_100020643023_100000692822 [1,1,0,0,0,0|2,0,0]=4 9835 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 11a_100020643023_100000741628 [1,1,0,0,0,0|2,0,0]=4 9836 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 1626a_100020643023_100000741628 [1,1,0,0,0,0|2,0,0]=4 9837 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 240690a_100020643023_100000741628 [1,1,0,0,0,0|2,0,0]=4 9838 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 527a_100020643023_100000741628 [1,1,0,0,0,0|2,0,0]=4 9839 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 11a_100020643023_100000766932 [1,1,0,0,0,0|2,0,0]=4 9840 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 1626a_100020643023_100000766932 [1,1,0,0,0,0|2,0,0]=4 9841 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 240690a_100020643023_100000766932 [1,1,0,0,0,0|2,0,0]=4 9842 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 527a_100020643023_100000766932 [1,1,0,0,0,0|2,0,0]=4 9843 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 11a_100020643023_100000185840 [1,1,0,0,0,0|2,0,0]=4 9844 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100020643023_100000185840 [1,1,0,0,0,0|2,0,0]=4 9845 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100020643023_100000185840 [1,1,0,0,0,0|2,0,0]=4 9846 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 527a_100020643023_100000185840 [1,1,0,0,0,0|2,0,0]=4 9847 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 11a_100020643023_100000211397 [1,1,0,0,0,0|2,0,0]=4 9848 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 1626a_100020643023_100000211397 [1,1,0,0,0,0|2,0,0]=4 9849 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 240690a_100020643023_100000211397 [1,1,0,0,0,0|2,0,0]=4 9850 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 527a_100020643023_100000211397 [1,1,0,0,0,0|2,0,0]=4 9851 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 11a_100020643023_100000751301 [1,1,0,0,0,0|2,0,0]=4 9852 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 1626a_100020643023_100000751301 [1,1,0,0,0,0|2,0,0]=4 9853 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 240690a_100020643023_100000751301 [1,1,0,0,0,0|2,0,0]=4 9854 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 527a_100020643023_100000751301 [1,1,0,0,0,0|2,0,0]=4 9855 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)O 240690a_100020643023_100000702456 [1,1,0,0,0,0|2,0,0]=4 9856 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)O 527a_100020643023_100000702456 [1,1,0,0,0,0|2,0,0]=4 9857 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 11a_100020643023_100000214689 [1,1,0,0,0,0|2,0,0]=4 9858 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 1626a_100020643023_100000214689 [1,1,0,0,0,0|2,0,0]=4 9859 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 240690a_100020643023_100000214689 [1,1,0,0,0,0|2,0,0]=4 9860 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 527a_100020643023_100000214689 [1,1,0,0,0,0|2,0,0]=4 9861 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 11a_100020643023_100000766033 [1,1,0,0,0,0|2,0,0]=4 9862 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 1626a_100020643023_100000766033 [1,1,0,0,0,0|2,0,0]=4 9863 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 240690a_100020643023_100000766033 [1,1,0,0,0,0|2,0,0]=4 9864 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 527a_100020643023_100000766033 [1,1,0,0,0,0|2,0,0]=4 9865 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 11a_100020643023_100000212326 [1,1,0,0,0,0|2,0,0]=4 9866 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 1626a_100020643023_100000212326 [1,1,0,0,0,0|2,0,0]=4 9867 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 240690a_100020643023_100000212326 [1,1,0,0,0,0|2,0,0]=4 9868 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 527a_100020643023_100000212326 [1,1,0,0,0,0|2,0,0]=4 9869 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 11a_100020643023_100000211022 [1,1,0,0,0,0|2,0,0]=4 9870 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 1626a_100020643023_100000211022 [1,1,0,0,0,0|2,0,0]=4 9871 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 240690a_100020643023_100000211022 [1,1,0,0,0,0|2,0,0]=4 9872 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 527a_100020643023_100000211022 [1,1,0,0,0,0|2,0,0]=4 9873 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 11a_100020643023_100000037189 [1,1,0,0,0,0|2,0,0]=4 9874 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 1626a_100020643023_100000037189 [1,1,0,0,0,0|2,0,0]=4 9875 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 240690a_100020643023_100000037189 [1,1,0,0,0,0|2,0,0]=4 9876 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 527a_100020643023_100000037189 [1,1,0,0,0,0|2,0,0]=4 9877 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 240690a_100020643023_100000689029 [1,1,0,0,0,0|2,0,0]=4 9878 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215516 [1,1,0,0,0,0|2,0,0]=4 9879 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 527a_100020643023_100000689029 [1,1,0,0,0,0|2,0,0]=4 9880 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 11a_100020643023_100000751167 [1,1,0,0,0,0|2,0,0]=4 9881 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 1626a_100020643023_100000751167 [1,1,0,0,0,0|2,0,0]=4 9882 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 240690a_100020643023_100000751167 [1,1,0,0,0,0|2,0,0]=4 9883 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 527a_100020643023_100000751167 [1,1,0,0,0,0|2,0,0]=4 9884 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 11a_100020643023_100009999607 [1,1,0,0,0,0|2,0,0]=4 9885 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 1626a_100020643023_100009999607 [1,1,0,0,0,0|2,0,0]=4 9886 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 240690a_100020643023_100009999607 [1,1,0,0,0,0|2,0,0]=4 9887 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 527a_100020643023_100009999607 [1,1,0,0,0,0|2,0,0]=4 9888 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 11a_100020643023_100000739380 [1,1,0,0,0,0|2,0,0]=4 9889 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 1626a_100020643023_100000739380 [1,1,0,0,0,0|2,0,0]=4 9890 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 240690a_100020643023_100000739380 [1,1,0,0,0,0|2,0,0]=4 9891 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 527a_100020643023_100000739380 [1,1,0,0,0,0|2,0,0]=4 9892 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 11a_100020643023_100000739341 [1,1,0,0,0,0|2,0,0]=4 9893 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 1626a_100020643023_100000739341 [1,1,0,0,0,0|2,0,0]=4 9894 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 240690a_100020643023_100000739341 [1,1,0,0,0,0|2,0,0]=4 9895 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 527a_100020643023_100000739341 [1,1,0,0,0,0|2,0,0]=4 9896 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br 240690a_100020643023_100000744433 [1,1,0,0,0,0|1,0,0]=3 9897 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br 527a_100020643023_100000744433 [1,1,0,0,0,0|1,0,0]=3 9898 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 1626a_100020643023_100000212137 [1,1,0,0,0,0|1,0,0]=3 9899 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 240690a_100020643023_100000212137 [1,1,0,0,0,0|1,0,0]=3 9900 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 527a_100020643023_100000212137 [1,1,0,0,0,0|1,0,0]=3 9901 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 11a_100020643023_100000188622 [1,1,0,0,0,0|1,0,0]=3 9902 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 240690a_100020643023_100000188622 [1,1,0,0,0,0|1,0,0]=3 9903 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 527a_100020643023_100000188622 [1,1,0,0,0,0|1,0,0]=3 9904 B14R1.2523 CCCNC(=O)c1ccc(cc1O)F 240690a_100020643023_100000746061 [1,1,0,0,0,0|1,0,0]=3 9905 B14R1.2523 CCCNC(=O)c1ccc(cc1O)F 527a_100020643023_100000746061 [1,1,0,0,0,0|1,0,0]=3 9906 B14R1.2523 CCCNC(=O)c1ccc(cc1O)I 240690a_100020643023_100000091984 [1,1,0,0,0,0|1,0,0]=3 9907 B14R1.2523 CCCNC(=O)c1ccc(cc1O)I 527a_100020643023_100000091984 [1,1,0,0,0,0|1,0,0]=3 9908 B14R1.2523 CCNCC(=O)c1ccc(cc1C)C 2230a_100015525214_100000229959 [1,1,0,0,0,0|2,0,0]=4 9909 B14R1.2523 CCNCC(=O)c1ccc(cc1Cl)Cl 2230a_100015525214_100011218845 [1,1,0,0,0,0|2,0,0]=4 9910 B14R1.2523 CCNCC(=O)c1ccc(cc1Cl)F 2230a_100015525214_100012056422 [1,1,0,0,0,0|2,0,0]=4 9911 B14R1.2523 CCNNC(=O)c1ccc(cc1O)Br 22a_100000756455_100000744433 [1,1,0,0,0,0|2,0,0]=4 9912 B14R1.2523 CCNNC(=O)c1ccc(cc1O)C 22a_100000756455_100000212137 [1,1,0,0,0,0|2,0,0]=4 9913 B14R1.2523 CCNNC(=O)c1ccc(cc1O)Cl 22a_100000756455_100000188622 [1,1,0,0,0,0|2,0,0]=4 9914 B14R1.2523 CCNNC(=O)c1ccc(cc1O)F 22a_100000756455_100000746061 [1,1,0,0,0,0|2,0,0]=4 9915 B14R1.2523 CCNNC(=O)c1ccc(cc1O)I 22a_100000756455_100000091984 [1,1,0,0,0,0|2,0,0]=4 9916 B14R1.2523 CCNNC(=O)c1ccc(cc1O)O 22a_100000756455_100000212172 [1,1,0,0,0,0|2,0,0]=4 9917 B14R1.2523 CCOCC(=O)c1ccc(cc1Br)F 34a_100121572206_100012361341 [1,1,0,0,0,0|2,0,0]=4 9918 B14R1.2523 CCOCC(=O)c1ccc(cc1C)C 34a_100121572206_100000229959 [1,1,0,0,0,0|2,0,0]=4 9919 B14R1.2523 CCOCC(=O)c1ccc(cc1Cl)F 34a_100121572206_100012056422 [1,1,0,0,0,0|2,0,0]=4 9920 B14R1.2523 CCOCC(=O)c1ccc(cc1F)Br 34a_100121572206_200012361339 [1,1,0,0,0,0|2,0,0]=4 9921 B14R1.2523 CCOCC(=O)c1ccc(cc1F)Cl 34a_100121572206_100012351891 [1,1,0,0,0,0|2,0,0]=4 9922 B14R1.2523 CCOCC(=O)c1ccc(cc1F)F 34a_100121572206_100000229962 [1,1,0,0,0,0|2,0,0]=4 9923 B14R1.2523 CCOCC(=O)c1ccc(cc1O)F 34a_100121572206_100009817053 [1,1,0,0,0,0|1,0,0]=3 9924 B14R1.2523 CCOCC(=O)c1ccc(cc1O)O 34a_100121572206_100009814262 [1,1,0,0,0,0|1,0,0]=3 9925 B14R1.2523 CCSCC(=O)c1ccc(cc1Br)F 62a_100012361341_100000210202 [1,1,0,0,0,0|2,0,0]=4 9926 B14R1.2523 CCSCC(=O)c1ccc(cc1C)C 62a_100000210202_100000229959 [1,1,0,0,0,0|2,0,0]=4 9927 B14R1.2523 CCSCC(=O)c1ccc(cc1C)C 62a_100000229959_100000210202 [1,1,0,0,0,0|2,0,0]=4 9928 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210202 [1,1,0,0,0,0|2,0,0]=4 9929 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)F 62a_100000210202_100012056422 [1,1,0,0,0,0|2,0,0]=4 9930 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100000210202 [1,1,0,0,0,0|2,0,0]=4 9931 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Br 62a_200012361339_100000210202 [1,1,0,0,0,0|2,0,0]=4 9932 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Cl 62a_100000210202_100012351891 [1,1,0,0,0,0|2,0,0]=4 9933 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210202 [1,1,0,0,0,0|2,0,0]=4 9934 B14R1.2523 CCSCC(=O)c1ccc(cc1F)F 62a_100000210202_100000229962 [1,1,0,0,0,0|2,0,0]=4 9935 B14R1.2523 CCSCC(=O)c1ccc(cc1F)F 62a_100000229962_100000210202 [1,1,0,0,0,0|2,0,0]=4 9936 B14R1.2523 CCSCC(=O)c1ccc(cc1O)F 62a_100000210202_100009817053 [1,1,0,0,0,0|1,0,0]=3 9937 B14R1.2523 CCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000210202 [1,1,0,0,0,0|1,0,0]=3 9938 B14R1.2523 CCSCC(=O)c1ccc(cc1O)O 62a_100000210202_100009814262 [1,1,0,0,0,0|1,0,0]=3 9939 B14R1.2523 CCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000210202 [1,1,0,0,0,0|1,0,0]=3 9940 B14R1.2523 CNCCC(=O)c1ccc(cc1F)Br 2230a_106832991635_100010339771 [1,1,0,0,0,0|2,0,0]=4 9941 B14R1.2523 CNCCC(=O)c1ccc(cc1F)Br 34a_100102657272_100010339771 [1,1,0,0,0,0|2,0,0]=4 9942 B14R1.2523 CNCCC(=O)c1ccc(cc1F)Br 7a_106832991635_100010339771 [1,1,0,0,0,0|2,0,0]=4 9943 B14R1.2523 CNCOC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100010978946 [1,1,0,0,0,0|2,0,0]=4 9944 B14R1.2523 COCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000233755 [1,1,0,0,0,0|2,0,0]=4 9945 B14R1.2523 COCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000233755 [1,1,0,0,0,0|2,0,0]=4 9946 B14R1.2523 COCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000233755 [1,1,0,0,0,0|2,0,0]=4 9947 B14R1.2523 COCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000233755 [1,1,0,0,0,0|2,0,0]=4 9948 B14R1.2523 COCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000233755 [1,1,0,0,0,0|2,0,0]=4 9949 B14R1.2523 COCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000233755 [1,1,0,0,0,0|2,0,0]=4 9950 B14R1.2523 COCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000233755 [1,1,0,0,0,0|2,0,0]=4 9951 B14R1.2523 COCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000233755 [1,1,0,0,0,0|2,0,0]=4 9952 B14R1.2523 COCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000233755 [1,1,0,0,0,0|2,0,0]=4 9953 B14R1.2523 COCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000233755 [1,1,0,0,0,0|2,0,0]=4 9954 B14R1.2523 COCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000233755 [1,1,0,0,0,0|2,0,0]=4 9955 B14R1.2523 COCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000233755 [1,1,0,0,0,0|2,0,0]=4 9956 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000233755 [1,1,0,0,0,0|2,0,0]=4 9957 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000233755 [1,1,0,0,0,0|2,0,0]=4 9958 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000233755 [1,1,0,0,0,0|2,0,0]=4 9959 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000233755 [1,1,0,0,0,0|2,0,0]=4 9960 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000233755 [1,1,0,0,0,0|2,0,0]=4 9961 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000233755 [1,1,0,0,0,0|2,0,0]=4 9962 B14R1.2523 COCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000233755 [1,1,0,0,0,0|2,0,0]=4 9963 B14R1.2523 COCCC(=O)c1ccc(cc1F)Br 34a_100138415774_100010339771 [1,1,0,0,0,0|2,0,0]=4 9964 B14R1.2523 COCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000233755 [1,1,0,0,0,0|2,0,0]=4 9965 B14R1.2523 COCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000233755 [1,1,0,0,0,0|2,0,0]=4 9966 B14R1.2523 COCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000233755 [1,1,0,0,0,0|2,0,0]=4 9967 B14R1.2523 COCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000233755 [1,1,0,0,0,0|2,0,0]=4 9968 B14R1.2523 COCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000233755 [1,1,0,0,0,0|2,0,0]=4 9969 B14R1.2523 COCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000233755 [1,1,0,0,0,0|2,0,0]=4 9970 B14R1.2523 COCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000233755 [1,1,0,0,0,0|2,0,0]=4 9971 B14R1.2523 COCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000233755 [1,1,0,0,0,0|2,0,0]=4 9972 B14R1.2523 COCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000233755 [1,1,0,0,0,0|2,0,0]=4 9973 B14R1.2523 COCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000233755 [1,1,0,0,0,0|1,0,0]=3 9974 B14R1.2523 COCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000233755 [1,1,0,0,0,0|1,0,0]=3 9975 B14R1.2523 COCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000233755 [1,1,0,0,0,0|1,0,0]=3 9976 B14R1.2523 COCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000233755 [1,1,0,0,0,0|1,0,0]=3 9977 B14R1.2523 COCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000233755 [1,1,0,0,0,0|1,0,0]=3 9978 B14R1.2523 COCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000233755 [1,1,0,0,0,0|1,0,0]=3 9979 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000751147 [1,1,0,0,0,0|2,0,0]=4 9980 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000751147 [1,1,0,0,0,0|2,0,0]=4 9981 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000751147 [1,1,0,0,0,0|2,0,0]=4 9982 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000751147 [1,1,0,0,0,0|2,0,0]=4 9983 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000751147 [1,1,0,0,0,0|2,0,0]=4 9984 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000751147 [1,1,0,0,0,0|2,0,0]=4 9985 B14R1.2523 CSCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000751147 [1,1,0,0,0,0|2,0,0]=4 9986 B14R1.2523 CSCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000751147 [1,1,0,0,0,0|2,0,0]=4 9987 B14R1.2523 CSCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000751147 [1,1,0,0,0,0|2,0,0]=4 9988 B14R1.2523 CSCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000751147 [1,1,0,0,0,0|2,0,0]=4 9989 B14R1.2523 CSCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000751147 [1,1,0,0,0,0|2,0,0]=4 9990 B14R1.2523 CSCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000751147 [1,1,0,0,0,0|2,0,0]=4 9991 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000751147 [1,1,0,0,0,0|2,0,0]=4 9992 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000751147 [1,1,0,0,0,0|2,0,0]=4 9993 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000751147 [1,1,0,0,0,0|2,0,0]=4 9994 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000751147 [1,1,0,0,0,0|2,0,0]=4 9995 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000751147 [1,1,0,0,0,0|2,0,0]=4 9996 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000751147 [1,1,0,0,0,0|2,0,0]=4 9997 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000751147 [1,1,0,0,0,0|2,0,0]=4 9998 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Br 62a_100010339771_200000210301 [1,1,0,0,0,0|2,0,0]=4 9999 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Br 62a_200000210301_100010339771 [1,1,0,0,0,0|2,0,0]=4 10000 B14R1.2523 CSCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000751147 [1,1,0,0,0,0|2,0,0]=4 10001 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000751147 [1,1,0,0,0,0|2,0,0]=4 10002 B14R1.2523 CSCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000751147 [1,1,0,0,0,0|2,0,0]=4 10003 B14R1.2523 CSCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000751147 [1,1,0,0,0,0|2,0,0]=4 10004 B14R1.2523 CSCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000751147 [1,1,0,0,0,0|2,0,0]=4 10005 B14R1.2523 CSCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000751147 [1,1,0,0,0,0|2,0,0]=4 10006 B14R1.2523 CSCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000751147 [1,1,0,0,0,0|2,0,0]=4 10007 B14R1.2523 CSCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000751147 [1,1,0,0,0,0|2,0,0]=4 10008 B14R1.2523 CSCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000751147 [1,1,0,0,0,0|2,0,0]=4 10009 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000751147 [1,1,0,0,0,0|1,0,0]=3 10010 B14R1.2523 CSCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000751147 [1,1,0,0,0,0|1,0,0]=3 10011 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000751147 [1,1,0,0,0,0|1,0,0]=3 10012 B14R1.2523 CSCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000751147 [1,1,0,0,0,0|1,0,0]=3 10013 B14R1.2523 CSCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000751147 [1,1,0,0,0,0|1,0,0]=3 10014 B14R1.2523 CSCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000751147 [1,1,0,0,0,0|1,0,0]=3 10015 B14R1.2523 CSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_200000210301 [1,1,0,0,0,0|2,0,0]=4 10016 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)Br 1458a_100000741311_100011934791 [1,1,0,0,0,0|2,0,0]=4 10017 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)Cl 1458a_100000688705_100011934791 [1,1,0,0,0,0|2,0,0]=4 10018 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)F 1458a_100000686989_100011934791 [1,1,0,0,0,0|2,0,0]=4 10019 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)I 1458a_100010189873_100011934791 [1,1,0,0,0,0|2,0,0]=4 10020 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)O 1458a_100000692822_100011934791 [1,1,0,0,0,0|2,0,0]=4 10021 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Br 1458a_100000741311_100011215043 [1,1,0,0,0,0|2,0,0]=4 10022 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Cl 1458a_100000688705_100011215043 [1,1,0,0,0,0|2,0,0]=4 10023 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)F 1458a_100000686989_100011215043 [1,1,0,0,0,0|2,0,0]=4 10024 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)I 1458a_100010189873_100011215043 [1,1,0,0,0,0|2,0,0]=4 10025 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)O 1458a_100000692822_100011215043 [1,1,0,0,0,0|2,0,0]=4 10026 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCF 1458a_100000685072_100011934791 [1,1,0,0,0,0|2,0,0]=4 10027 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCO 1458a_100000685072_100011215043 [1,1,0,0,0,0|2,0,0]=4 10028 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCF 1458a_100000211164_100011934791 [1,1,0,0,0,0|2,0,0]=4 10029 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCO 1458a_100000211164_100011215043 [1,1,0,0,0,0|2,0,0]=4 10030 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCF 1458a_100000766932_100011934791 [1,1,0,0,0,0|2,0,0]=4 10031 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100000766932_100011215043 [1,1,0,0,0,0|2,0,0]=4 10032 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCF 1458a_100000766033_100011934791 [1,1,0,0,0,0|2,0,0]=4 10033 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCO 1458a_100000766033_100011215043 [1,1,0,0,0,0|2,0,0]=4 10034 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCF 1458a_100009999607_100011934791 [1,1,0,0,0,0|2,0,0]=4 10035 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCO 1458a_100009999607_100011215043 [1,1,0,0,0,0|2,0,0]=4 10036 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCC#N 1458a_100000212137_100011215226 [1,1,0,0,0,0|1,0,1]=4 10037 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCF 1458a_100000212137_100011934791 [1,1,0,0,0,0|1,0,0]=3 10038 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCO 1458a_100000212137_100011215043 [1,1,0,0,0,0|1,0,0]=3 10039 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 1626a_100000724931_100000212137 [1,1,0,0,0,0|2,0,0]=4 10040 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 240690a_100000724931_100000212137 [1,1,0,0,0,0|2,0,0]=4 10041 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 527a_100000724931_100000212137 [1,1,0,0,0,0|2,0,0]=4 10042 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 240690a_100000210304_100000212137 [1,1,0,0,0,0|2,0,0]=4 10043 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 527a_100000210304_100000212137 [1,1,0,0,0,0|2,0,0]=4 10044 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215226 [1,1,0,0,0,0|1,0,1]=4 10045 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215226 [1,1,0,0,0,0|1,0,1]=4 10046 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215226 [1,1,0,0,0,0|1,0,1]=4 10047 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215226 [1,1,0,0,0,0|1,0,1]=4 10048 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215226 [1,1,0,0,0,0|1,0,1]=4 10049 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)Br 1458a_100000762965_100011934791 [1,1,0,0,0,0|2,0,0]=4 10050 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011934791 [1,1,0,0,0,0|2,0,0]=4 10051 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)F 1458a_100000212304_100011934791 [1,1,0,0,0,0|2,0,0]=4 10052 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)I 1458a_100012360512_100011934791 [1,1,0,0,0,0|2,0,0]=4 10053 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)O 1458a_100012344906_100011934791 [1,1,0,0,0,0|2,0,0]=4 10054 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011934791 [1,1,0,0,0,0|2,0,0]=4 10055 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011934791 [1,1,0,0,0,0|2,0,0]=4 10056 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)F 1458a_100000211397_100011934791 [1,1,0,0,0,0|2,0,0]=4 10057 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)I 1458a_100000751301_100011934791 [1,1,0,0,0,0|2,0,0]=4 10058 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)O 1458a_100000702456_100011934791 [1,1,0,0,0,0|2,0,0]=4 10059 B14R1.2523 O=C(CCCF)c1ccc(cc1F)Br 1458a_100000214689_100011934791 [1,1,0,0,0,0|2,0,0]=4 10060 B14R1.2523 O=C(CCCF)c1ccc(cc1F)Cl 1458a_100000212326_100011934791 [1,1,0,0,0,0|2,0,0]=4 10061 B14R1.2523 O=C(CCCF)c1ccc(cc1F)F 1458a_100000211022_100011934791 [1,1,0,0,0,0|2,0,0]=4 10062 B14R1.2523 O=C(CCCF)c1ccc(cc1F)I 1458a_100000037189_100011934791 [1,1,0,0,0,0|2,0,0]=4 10063 B14R1.2523 O=C(CCCF)c1ccc(cc1F)O 1458a_100000689029_100011934791 [1,1,0,0,0,0|2,0,0]=4 10064 B14R1.2523 O=C(CCCF)c1ccc(cc1I)Br 1458a_100000751167_100011934791 [1,1,0,0,0,0|2,0,0]=4 10065 B14R1.2523 O=C(CCCF)c1ccc(cc1I)Cl 1458a_100000739380_100011934791 [1,1,0,0,0,0|2,0,0]=4 10066 B14R1.2523 O=C(CCCF)c1ccc(cc1I)F 1458a_100000739341_100011934791 [1,1,0,0,0,0|2,0,0]=4 10067 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Br 1458a_100000744433_100011934791 [1,1,0,0,0,0|1,0,0]=3 10068 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Cl 1458a_100000188622_100011934791 [1,1,0,0,0,0|1,0,0]=3 10069 B14R1.2523 O=C(CCCF)c1ccc(cc1O)F 1458a_100000746061_100011934791 [1,1,0,0,0,0|1,0,0]=3 10070 B14R1.2523 O=C(CCCF)c1ccc(cc1O)I 1458a_100000091984_100011934791 [1,1,0,0,0,0|1,0,0]=3 10071 B14R1.2523 O=C(CCCF)c1ccc(cc1O)O 1458a_100000212172_100011934791 [1,1,0,0,0,0|1,0,0]=3 10072 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Br 1458a_100000762965_100011215043 [1,1,0,0,0,0|2,0,0]=4 10073 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100011215043 [1,1,0,0,0,0|2,0,0]=4 10074 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)F 1458a_100000212304_100011215043 [1,1,0,0,0,0|2,0,0]=4 10075 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)I 1458a_100012360512_100011215043 [1,1,0,0,0,0|2,0,0]=4 10076 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)O 1458a_100012344906_100011215043 [1,1,0,0,0,0|2,0,0]=4 10077 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100011215043 [1,1,0,0,0,0|2,0,0]=4 10078 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215043 [1,1,0,0,0,0|2,0,0]=4 10079 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)F 1458a_100000211397_100011215043 [1,1,0,0,0,0|2,0,0]=4 10080 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)I 1458a_100000751301_100011215043 [1,1,0,0,0,0|2,0,0]=4 10081 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)O 1458a_100000702456_100011215043 [1,1,0,0,0,0|2,0,0]=4 10082 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Br 1458a_100000214689_100011215043 [1,1,0,0,0,0|2,0,0]=4 10083 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Cl 1458a_100000212326_100011215043 [1,1,0,0,0,0|2,0,0]=4 10084 B14R1.2523 O=C(CCCO)c1ccc(cc1F)F 1458a_100000211022_100011215043 [1,1,0,0,0,0|2,0,0]=4 10085 B14R1.2523 O=C(CCCO)c1ccc(cc1F)I 1458a_100000037189_100011215043 [1,1,0,0,0,0|2,0,0]=4 10086 B14R1.2523 O=C(CCCO)c1ccc(cc1F)O 1458a_100000689029_100011215043 [1,1,0,0,0,0|2,0,0]=4 10087 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Br 1458a_100000751167_100011215043 [1,1,0,0,0,0|2,0,0]=4 10088 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Cl 1458a_100000739380_100011215043 [1,1,0,0,0,0|2,0,0]=4 10089 B14R1.2523 O=C(CCCO)c1ccc(cc1I)F 1458a_100000739341_100011215043 [1,1,0,0,0,0|2,0,0]=4 10090 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Br 1458a_100000744433_100011215043 [1,1,0,0,0,0|1,0,0]=3 10091 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Cl 1458a_100000188622_100011215043 [1,1,0,0,0,0|1,0,0]=3 10092 B14R1.2523 O=C(CCCO)c1ccc(cc1O)F 1458a_100000746061_100011215043 [1,1,0,0,0,0|1,0,0]=3 10093 B14R1.2523 O=C(CCCO)c1ccc(cc1O)I 1458a_100000091984_100011215043 [1,1,0,0,0,0|1,0,0]=3 10094 B14R1.2523 O=C(CCCO)c1ccc(cc1O)O 1458a_100000212172_100011215043 [1,1,0,0,0,0|1,0,0]=3 10095 B14R1.2523 O=C(CSCF)c1ccc(cc1O)F 62a_100009817053_100015361967 [1,1,0,0,0,0|2,0,0]=4 10096 B14R1.2523 O=C(CSCF)c1ccc(cc1O)F 62a_100015361967_100009817053 [1,1,0,0,0,0|2,0,0]=4 10097 B14R1.2523 O=C(CSCF)c1ccc(cc1O)O 62a_100009814262_100015361967 [1,1,0,0,0,0|2,0,0]=4 10098 B14R1.2523 O=C(CSCF)c1ccc(cc1O)O 62a_100015361967_100009814262 [1,1,0,0,0,0|2,0,0]=4 10099 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Br 240690a_100000724931_100000744433 [1,1,0,0,0,0|2,0,0]=4 10100 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Br 527a_100000724931_100000744433 [1,1,0,0,0,0|2,0,0]=4 10101 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 11a_100000724931_100000188622 [1,1,0,0,0,0|2,0,0]=4 10102 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 240690a_100000724931_100000188622 [1,1,0,0,0,0|2,0,0]=4 10103 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 527a_100000724931_100000188622 [1,1,0,0,0,0|2,0,0]=4 10104 B14R1.2523 O=C(NCCF)c1ccc(cc1O)F 240690a_100000724931_100000746061 [1,1,0,0,0,0|2,0,0]=4 10105 B14R1.2523 O=C(NCCF)c1ccc(cc1O)F 527a_100000724931_100000746061 [1,1,0,0,0,0|2,0,0]=4 10106 B14R1.2523 O=C(NCCF)c1ccc(cc1O)I 240690a_100000724931_100000091984 [1,1,0,0,0,0|2,0,0]=4 10107 B14R1.2523 O=C(NCCF)c1ccc(cc1O)I 527a_100000724931_100000091984 [1,1,0,0,0,0|2,0,0]=4 10108 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 240690a_100000210304_100000744433 [1,1,0,0,0,0|2,0,0]=4 10109 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 527a_100000210304_100000744433 [1,1,0,0,0,0|2,0,0]=4 10110 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 240690a_100000210304_100000188622 [1,1,0,0,0,0|2,0,0]=4 10111 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 527a_100000210304_100000188622 [1,1,0,0,0,0|2,0,0]=4 10112 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 240690a_100000210304_100000746061 [1,1,0,0,0,0|2,0,0]=4 10113 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 527a_100000210304_100000746061 [1,1,0,0,0,0|2,0,0]=4 10114 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 240690a_100000210304_100000091984 [1,1,0,0,0,0|2,0,0]=4 10115 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 527a_100000210304_100000091984 [1,1,0,0,0,0|2,0,0]=4 10116 B14R1.2523 [13CH3]SCCC(=O)c1ccc(cc1F)Br 62a_100010339771_200025704644 [1,1,0,0,0,0|2,0,0]=4 10117 B14R1.2523 [13CH3]SCCC(=O)c1ccc(cc1F)Br 62a_200025704644_100010339771 [1,1,0,0,0,0|2,0,0]=4 10118 B14R1.2523 [13CH3]SCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_200025704644 [1,1,0,0,0,0|2,0,0]=4 10119 B14R1.3111 CCCCN(CC)c1ccccc1O 269982a_103624766699_100000210211 [1,1,0,0,0,0|2,0,0]=4 10120 B14R1.3348 CC(CC#N)C(=O)c1ccccc1O 1458a_100015234032_100009813641 [1,1,0,0,0,0|1,0,1]=4 10121 B14R1.3348 CC(CCO)C(=O)c1ccccc1Br 1458a_100000188424_100009893172 [1,1,0,0,0,0|2,0,0]=4 10122 B14R1.3348 CC(CCO)C(=O)c1ccccc1Cl 1458a_100000185844_100009893172 [1,1,0,0,0,0|2,0,0]=4 10123 B14R1.3348 CC(CCO)C(=O)c1ccccc1F 1458a_100000188656_100009893172 [1,1,0,0,0,0|2,0,0]=4 10124 B14R1.3348 CC(CCO)C(=O)c1ccccc1I 1458a_100000187884_100009893172 [1,1,0,0,0,0|2,0,0]=4 10125 B14R1.3348 CC(CCO)C(=O)c1ccccc1O 1458a_100015234032_100009893172 [1,1,0,0,0,0|1,0,0]=3 10126 B14R1.3348 CC(CCO)C(=O)c1ccccc1[O-] 1458a_100009911694_100009893172 [1,1,0,0,0,0|1,0,1]=4 10127 B14R1.3348 CCCC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000766640 [1,1,0,0,0,0|1,0,0]=3 10128 B14R1.3348 CCCC(C)C(=O)c1ccccc1C 1458a_100000212026_100000766640 [1,1,0,0,0,0|1,0,0]=3 10129 B14R1.3348 CCCC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000766640 [1,1,0,0,0,0|1,0,0]=3 10130 B14R1.3348 CCCC(C)C(=O)c1ccccc1F 1458a_100000188656_100000766640 [1,1,0,0,0,0|1,0,0]=3 10131 B14R1.3348 CCCC(C)C(=O)c1ccccc1I 1458a_100000187884_100000766640 [1,1,0,0,0,0|1,0,0]=3 10132 B14R1.3348 CCCC(C)C(=O)c1ccccc1O 1458a_100015234032_100000766640 [1,1,0,0,0,0|0,0,0]=2 10133 B14R1.3348 CCCC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000766640 [1,1,0,0,0,0|0,0,1]=3 10134 B14R1.3348 CCCC(C)N(C)c1ccccc1O 269982a_100000033821_100000766640 [1,1,0,0,0,0|2,0,0]=4 10135 B14R1.3348 CCCN(C)C(=O)c1ccccc1Br 11a_100000747261_100000188424 [1,1,0,0,0,0|2,0,0]=4 10136 B14R1.3348 CCCN(C)C(=O)c1ccccc1Br 1626a_100000747261_100000188424 [1,1,0,0,0,0|2,0,0]=4 10137 B14R1.3348 CCCN(C)C(=O)c1ccccc1Br 240690a_100000747261_100000188424 [1,1,0,0,0,0|2,0,0]=4 10138 B14R1.3348 CCCN(C)C(=O)c1ccccc1Br 527a_100000747261_100000188424 [1,1,0,0,0,0|2,0,0]=4 10139 B14R1.3348 CCCN(C)C(=O)c1ccccc1C 11a_100000747261_100000212026 [1,1,0,0,0,0|2,0,0]=4 10140 B14R1.3348 CCCN(C)C(=O)c1ccccc1C 1626a_100000747261_100000212026 [1,1,0,0,0,0|2,0,0]=4 10141 B14R1.3348 CCCN(C)C(=O)c1ccccc1C 240690a_100000747261_100000212026 [1,1,0,0,0,0|2,0,0]=4 10142 B14R1.3348 CCCN(C)C(=O)c1ccccc1C 527a_100000747261_100000212026 [1,1,0,0,0,0|2,0,0]=4 10143 B14R1.3348 CCCN(C)C(=O)c1ccccc1Cl 11a_100000747261_100000185844 [1,1,0,0,0,0|2,0,0]=4 10144 B14R1.3348 CCCN(C)C(=O)c1ccccc1Cl 1626a_100000747261_100000185844 [1,1,0,0,0,0|2,0,0]=4 10145 B14R1.3348 CCCN(C)C(=O)c1ccccc1Cl 240690a_100000747261_100000185844 [1,1,0,0,0,0|2,0,0]=4 10146 B14R1.3348 CCCN(C)C(=O)c1ccccc1Cl 527a_100000747261_100000185844 [1,1,0,0,0,0|2,0,0]=4 10147 B14R1.3348 CCCN(C)C(=O)c1ccccc1F 11a_100000747261_100000188656 [1,1,0,0,0,0|2,0,0]=4 10148 B14R1.3348 CCCN(C)C(=O)c1ccccc1F 1626a_100000747261_100000188656 [1,1,0,0,0,0|2,0,0]=4 10149 B14R1.3348 CCCN(C)C(=O)c1ccccc1F 240690a_100000747261_100000188656 [1,1,0,0,0,0|2,0,0]=4 10150 B14R1.3348 CCCN(C)C(=O)c1ccccc1F 527a_100000747261_100000188656 [1,1,0,0,0,0|2,0,0]=4 10151 B14R1.3348 CCCN(C)C(=O)c1ccccc1I 11a_100000747261_100000187884 [1,1,0,0,0,0|2,0,0]=4 10152 B14R1.3348 CCCN(C)C(=O)c1ccccc1I 1626a_100000747261_100000187884 [1,1,0,0,0,0|2,0,0]=4 10153 B14R1.3348 CCCN(C)C(=O)c1ccccc1I 240690a_100000747261_100000187884 [1,1,0,0,0,0|2,0,0]=4 10154 B14R1.3348 CCCN(C)C(=O)c1ccccc1I 527a_100000747261_100000187884 [1,1,0,0,0,0|2,0,0]=4 10155 B14R1.3348 CCCN(C)C(=O)c1ccccc1O 240690a_100000747261_100015234032 [1,1,0,0,0,0|1,0,0]=3 10156 B14R1.3348 CCCN(C)C(=O)c1ccccc1[O-] 1626a_100000747261_100009911694 [1,1,0,0,0,0|1,0,1]=4 10157 B14R1.3348 CCCN(C)C(=O)c1ccccc1[O-] 240690a_100000747261_100009911694 [1,1,0,0,0,0|1,0,1]=4 10158 B14R1.3348 CCCN(C)C(=O)c1ccccc1[O-] 527a_100000747261_100009911694 [1,1,0,0,0,0|1,0,1]=4 10159 B14R1.3348 CCNC(C)C(=O)c1ccccc1Cl 2230a_100015525214_100010255250 [1,1,0,0,0,0|2,0,0]=4 10160 B14R1.3348 CCSC(C)C(=O)c1ccccc1Cl 62a_100000210202_100010255250 [1,1,0,0,0,0|2,0,0]=4 10161 B14R1.3348 CCSC(C)C(=O)c1ccccc1Cl 62a_100010255250_100000210202 [1,1,0,0,0,0|2,0,0]=4 10162 B14R1.3348 CN(CCO)C(=O)c1ccccc1O 240690a_100000210263_100015234032 [1,1,0,0,0,0|2,0,0]=4 10163 B14R1.3348 COCC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000765312 [1,1,0,0,0,0|2,0,0]=4 10164 B14R1.3348 COCC(C)C(=O)c1ccccc1C 1458a_100000212026_100000765312 [1,1,0,0,0,0|2,0,0]=4 10165 B14R1.3348 COCC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000765312 [1,1,0,0,0,0|2,0,0]=4 10166 B14R1.3348 COCC(C)C(=O)c1ccccc1F 1458a_100000188656_100000765312 [1,1,0,0,0,0|2,0,0]=4 10167 B14R1.3348 COCC(C)C(=O)c1ccccc1I 1458a_100000187884_100000765312 [1,1,0,0,0,0|2,0,0]=4 10168 B14R1.3348 COCC(C)C(=O)c1ccccc1O 1458a_100015234032_100000765312 [1,1,0,0,0,0|1,0,0]=3 10169 B14R1.3348 COCC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000765312 [1,1,0,0,0,0|1,0,1]=4 10170 B14R1.3348 Cc1ccccc1C(=O)C(C)CCO 1458a_100000212026_100009893172 [1,1,0,0,0,0|2,0,0]=4 10171 B14R1.4230 CCCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165487 [1,1,0,0,0,0|2,0,0]=4 10172 B14R1.8282 C#CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000753159 [1,1,0,0,0,0|0,0,2]=4 10173 B14R1.8282 C#CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000753159 [1,1,0,0,0,0|0,0,2]=4 10174 B14R1.8282 C#CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000753159 [1,1,0,0,0,0|0,0,2]=4 10175 B14R1.8282 C#CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000753159 [1,1,0,0,0,0|0,0,2]=4 10176 B14R1.8282 C#CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000753159 [1,1,0,0,0,0|0,0,2]=4 10177 B14R1.8282 C/C=C/CC(=O)c1c(cccc1Br)O 1458a_100011935254_100102629194 [1,1,0,0,0,0|0,0,2]=4 10178 B14R1.8282 C/C=C/CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100102629194 [1,1,0,0,0,0|0,0,2]=4 10179 B14R1.8282 C/C=C/CC(=O)c1c(cccc1F)O 1458a_100000763259_100102629194 [1,1,0,0,0,0|0,0,2]=4 10180 B14R1.8282 C/C=C/CC(=O)c1c(cccc1O)C 1458a_100011934116_100102629194 [1,1,0,0,0,0|0,0,2]=4 10181 B14R1.8282 C/C=C/CC(=O)c1c(cccc1O)O 1458a_100000755285_100102629194 [1,1,0,0,0,0|0,0,2]=4 10182 B14R1.8282 C=CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000754431 [1,1,0,0,0,0|0,0,2]=4 10183 B14R1.8282 C=CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000754431 [1,1,0,0,0,0|0,0,2]=4 10184 B14R1.8282 C=CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000754431 [1,1,0,0,0,0|0,0,2]=4 10185 B14R1.8282 C=CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000754431 [1,1,0,0,0,0|0,0,2]=4 10186 B14R1.8282 C=CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000754431 [1,1,0,0,0,0|0,0,2]=4 10187 B14R1.8282 CC#CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000748600 [1,1,0,0,0,0|0,0,2]=4 10188 B14R1.8282 CC#CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000748600 [1,1,0,0,0,0|0,0,2]=4 10189 B14R1.8282 CC#CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000748600 [1,1,0,0,0,0|0,0,2]=4 10190 B14R1.8282 CC#CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000748600 [1,1,0,0,0,0|0,0,2]=4 10191 B14R1.8282 CC#CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000748600 [1,1,0,0,0,0|0,0,2]=4 10192 B14R1.8282 CC=CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000070051 [1,1,0,0,0,0|0,0,2]=4 10193 B14R1.8282 CC=CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000070051 [1,1,0,0,0,0|0,0,2]=4 10194 B14R1.8282 CC=CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000070051 [1,1,0,0,0,0|0,0,2]=4 10195 B14R1.8282 CC=CCC(=O)c1c(cccc1O)C 1458a_100011934116_100000070051 [1,1,0,0,0,0|0,0,2]=4 10196 B14R1.8282 CC=CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000070051 [1,1,0,0,0,0|0,0,2]=4 10197 B14R1.8282 CCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210211 [1,1,0,0,0,0|1,0,0]=3 10198 B14R1.8282 CCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210211 [1,1,0,0,0,0|1,0,0]=3 10199 B14R1.8282 CCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210211 [1,1,0,0,0,0|1,0,0]=3 10200 B14R1.8282 CCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210211 [1,1,0,0,0,0|1,0,0]=3 10201 B14R1.8282 CCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210211 [1,1,0,0,0,0|0,0,0]=2 10202 B14R1.8282 CCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210211 [1,1,0,0,0,0|1,0,0]=3 10203 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210211 [1,1,0,0,0,0|1,0,0]=3 10204 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210211 [1,1,0,0,0,0|1,0,0]=3 10205 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210211 [1,1,0,0,0,0|1,0,0]=3 10206 B14R1.8282 CCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210211 [1,1,0,0,0,0|0,0,0]=2 10207 B14R1.8282 CCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210211 [1,1,0,0,0,0|1,0,0]=3 10208 B14R1.8282 CCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210211 [1,1,0,0,0,0|1,0,0]=3 10209 B14R1.8282 CCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210211 [1,1,0,0,0,0|0,0,0]=2 10210 B14R1.8282 CCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210211 [1,1,0,0,0,0|1,0,0]=3 10211 B14R1.8282 CCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210211 [1,1,0,0,0,0|1,0,0]=3 10212 B14R1.8282 CCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210211 [1,1,0,0,0,0|1,0,0]=3 10213 B14R1.8282 CCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210211 [1,1,0,0,0,0|1,0,0]=3 10214 B14R1.8282 CCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210211 [1,1,0,0,0,0|0,0,0]=2 10215 B14R1.8282 CCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210211 [1,1,0,0,0,0|0,0,0]=2 10216 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 11a_100020643023_100000690891 [1,1,0,0,0,0|2,0,0]=4 10217 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 1626a_100020643023_100000690891 [1,1,0,0,0,0|2,0,0]=4 10218 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 240690a_100020643023_100000690891 [1,1,0,0,0,0|2,0,0]=4 10219 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Br 527a_100020643023_100000690891 [1,1,0,0,0,0|2,0,0]=4 10220 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 11a_100020643023_100000701904 [1,1,0,0,0,0|2,0,0]=4 10221 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 1626a_100020643023_100000701904 [1,1,0,0,0,0|2,0,0]=4 10222 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 240690a_100020643023_100000701904 [1,1,0,0,0,0|2,0,0]=4 10223 B14R1.8282 CCCNC(=O)c1c(cccc1Br)C 527a_100020643023_100000701904 [1,1,0,0,0,0|2,0,0]=4 10224 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 11a_100020643023_100011253703 [1,1,0,0,0,0|2,0,0]=4 10225 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 1626a_100020643023_100011253703 [1,1,0,0,0,0|2,0,0]=4 10226 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 240690a_100020643023_100011253703 [1,1,0,0,0,0|2,0,0]=4 10227 B14R1.8282 CCCNC(=O)c1c(cccc1Br)Cl 527a_100020643023_100011253703 [1,1,0,0,0,0|2,0,0]=4 10228 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 11a_100020643023_100000752694 [1,1,0,0,0,0|2,0,0]=4 10229 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 1626a_100020643023_100000752694 [1,1,0,0,0,0|2,0,0]=4 10230 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 240690a_100020643023_100000752694 [1,1,0,0,0,0|2,0,0]=4 10231 B14R1.8282 CCCNC(=O)c1c(cccc1Br)F 527a_100020643023_100000752694 [1,1,0,0,0,0|2,0,0]=4 10232 B14R1.8282 CCCNC(=O)c1c(cccc1Br)O 240690a_100020643023_100011935254 [1,1,0,0,0,0|1,0,0]=3 10233 B14R1.8282 CCCNC(=O)c1c(cccc1Br)O 527a_100020643023_100011935254 [1,1,0,0,0,0|1,0,0]=3 10234 B14R1.8282 CCCNC(=O)c1c(cccc1C)C 11a_100020643023_100000758298 [1,1,0,0,0,0|2,0,0]=4 10235 B14R1.8282 CCCNC(=O)c1c(cccc1C)C 1626a_100020643023_100000758298 [1,1,0,0,0,0|2,0,0]=4 10236 B14R1.8282 CCCNC(=O)c1c(cccc1C)C 240690a_100020643023_100000758298 [1,1,0,0,0,0|2,0,0]=4 10237 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)C 11a_100020643023_100000692601 [1,1,0,0,0,0|2,0,0]=4 10238 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)C 1626a_100020643023_100000692601 [1,1,0,0,0,0|2,0,0]=4 10239 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)C 240690a_100020643023_100000692601 [1,1,0,0,0,0|2,0,0]=4 10240 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)Cl 11a_100020643023_100000210656 [1,1,0,0,0,0|2,0,0]=4 10241 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)Cl 1626a_100020643023_100000210656 [1,1,0,0,0,0|2,0,0]=4 10242 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)Cl 240690a_100020643023_100000210656 [1,1,0,0,0,0|2,0,0]=4 10243 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 11a_100020643023_100000210369 [1,1,0,0,0,0|2,0,0]=4 10244 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 1626a_100020643023_100000210369 [1,1,0,0,0,0|2,0,0]=4 10245 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 240690a_100020643023_100000210369 [1,1,0,0,0,0|2,0,0]=4 10246 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)F 527a_100020643023_100000210369 [1,1,0,0,0,0|2,0,0]=4 10247 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)O 240690a_100020643023_100000745519 [1,1,0,0,0,0|1,0,0]=3 10248 B14R1.8282 CCCNC(=O)c1c(cccc1Cl)O 527a_100020643023_100000745519 [1,1,0,0,0,0|1,0,0]=3 10249 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 11a_100020643023_100000762013 [1,1,0,0,0,0|2,0,0]=4 10250 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 1626a_100020643023_100000762013 [1,1,0,0,0,0|2,0,0]=4 10251 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 240690a_100020643023_100000762013 [1,1,0,0,0,0|2,0,0]=4 10252 B14R1.8282 CCCNC(=O)c1c(cccc1F)C 527a_100020643023_100000762013 [1,1,0,0,0,0|2,0,0]=4 10253 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 11a_100020643023_100000210804 [1,1,0,0,0,0|2,0,0]=4 10254 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 1626a_100020643023_100000210804 [1,1,0,0,0,0|2,0,0]=4 10255 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 240690a_100020643023_100000210804 [1,1,0,0,0,0|2,0,0]=4 10256 B14R1.8282 CCCNC(=O)c1c(cccc1F)F 527a_100020643023_100000210804 [1,1,0,0,0,0|2,0,0]=4 10257 B14R1.8282 CCCNC(=O)c1c(cccc1F)O 527a_100020643023_100000763259 [1,1,0,0,0,0|1,0,0]=3 10258 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 11a_100020643023_100010232521 [1,1,0,0,0,0|2,0,0]=4 10259 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 1626a_100020643023_100010232521 [1,1,0,0,0,0|2,0,0]=4 10260 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 240690a_100020643023_100010232521 [1,1,0,0,0,0|2,0,0]=4 10261 B14R1.8282 CCCNC(=O)c1c(cccc1I)Br 527a_100020643023_100010232521 [1,1,0,0,0,0|2,0,0]=4 10262 B14R1.8282 CCCNC(=O)c1c(cccc1I)C 11a_100020643023_100000688020 [1,1,0,0,0,0|2,0,0]=4 10263 B14R1.8282 CCCNC(=O)c1c(cccc1I)C 1626a_100020643023_100000688020 [1,1,0,0,0,0|2,0,0]=4 10264 B14R1.8282 CCCNC(=O)c1c(cccc1I)C 240690a_100020643023_100000688020 [1,1,0,0,0,0|2,0,0]=4 10265 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 11a_100020643023_100000702859 [1,1,0,0,0,0|2,0,0]=4 10266 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 1626a_100020643023_100000702859 [1,1,0,0,0,0|2,0,0]=4 10267 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 240690a_100020643023_100000702859 [1,1,0,0,0,0|2,0,0]=4 10268 B14R1.8282 CCCNC(=O)c1c(cccc1I)Cl 527a_100020643023_100000702859 [1,1,0,0,0,0|2,0,0]=4 10269 B14R1.8282 CCCNC(=O)c1c(cccc1I)F 11a_100020643023_100000023732 [1,1,0,0,0,0|2,0,0]=4 10270 B14R1.8282 CCCNC(=O)c1c(cccc1I)F 1626a_100020643023_100000023732 [1,1,0,0,0,0|2,0,0]=4 10271 B14R1.8282 CCCNC(=O)c1c(cccc1I)F 240690a_100020643023_100000023732 [1,1,0,0,0,0|2,0,0]=4 10272 B14R1.8282 CCCNC(=O)c1c(cccc1O)O 527a_100020643023_100000755285 [1,1,0,0,0,0|1,0,0]=3 10273 B14R1.8282 CCNCC(=O)c1c(cccc1Cl)Cl 2230a_100015525214_100012340516 [1,1,0,0,0,0|2,0,0]=4 10274 B14R1.8282 CCNCC(=O)c1c(cccc1Cl)F 2230a_100015525214_100011219195 [1,1,0,0,0,0|2,0,0]=4 10275 B14R1.8282 CCNNC(=O)c1c(cccc1Br)O 22a_100000756455_100011935254 [1,1,0,0,0,0|2,0,0]=4 10276 B14R1.8282 CCNNC(=O)c1c(cccc1Cl)O 22a_100000756455_100000745519 [1,1,0,0,0,0|2,0,0]=4 10277 B14R1.8282 CCNNC(=O)c1c(cccc1F)O 22a_100000756455_100000763259 [1,1,0,0,0,0|2,0,0]=4 10278 B14R1.8282 CCNNC(=O)c1c(cccc1O)C 22a_100000756455_100011934116 [1,1,0,0,0,0|2,0,0]=4 10279 B14R1.8282 CCOCC(=O)c1c(cccc1Cl)Cl 34a_100121572206_100012340516 [1,1,0,0,0,0|2,0,0]=4 10280 B14R1.8282 CCOCC(=O)c1c(cccc1Cl)F 34a_100121572206_100011219195 [1,1,0,0,0,0|2,0,0]=4 10281 B14R1.8282 CCOCC(=O)c1c(cccc1F)F 34a_100121572206_100000199083 [1,1,0,0,0,0|2,0,0]=4 10282 B14R1.8282 CCSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100000210202 [1,1,0,0,0,0|2,0,0]=4 10283 B14R1.8282 CCSCC(=O)c1c(cccc1Cl)F 62a_100000210202_100011219195 [1,1,0,0,0,0|2,0,0]=4 10284 B14R1.8282 CCSCC(=O)c1c(cccc1Cl)F 62a_100011219195_100000210202 [1,1,0,0,0,0|2,0,0]=4 10285 B14R1.8282 CCSCC(=O)c1c(cccc1F)F 62a_100000199083_100000210202 [1,1,0,0,0,0|2,0,0]=4 10286 B14R1.8282 CCSCC(=O)c1c(cccc1F)F 62a_100000210202_100000199083 [1,1,0,0,0,0|2,0,0]=4 10287 B14R1.8282 COCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000233755 [1,1,0,0,0,0|2,0,0]=4 10288 B14R1.8282 COCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000233755 [1,1,0,0,0,0|2,0,0]=4 10289 B14R1.8282 COCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000233755 [1,1,0,0,0,0|2,0,0]=4 10290 B14R1.8282 COCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000233755 [1,1,0,0,0,0|2,0,0]=4 10291 B14R1.8282 COCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000233755 [1,1,0,0,0,0|1,0,0]=3 10292 B14R1.8282 COCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000233755 [1,1,0,0,0,0|2,0,0]=4 10293 B14R1.8282 COCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000233755 [1,1,0,0,0,0|2,0,0]=4 10294 B14R1.8282 COCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000233755 [1,1,0,0,0,0|2,0,0]=4 10295 B14R1.8282 COCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000233755 [1,1,0,0,0,0|2,0,0]=4 10296 B14R1.8282 COCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000233755 [1,1,0,0,0,0|1,0,0]=3 10297 B14R1.8282 COCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000233755 [1,1,0,0,0,0|2,0,0]=4 10298 B14R1.8282 COCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000233755 [1,1,0,0,0,0|2,0,0]=4 10299 B14R1.8282 COCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000233755 [1,1,0,0,0,0|1,0,0]=3 10300 B14R1.8282 COCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000233755 [1,1,0,0,0,0|2,0,0]=4 10301 B14R1.8282 COCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000233755 [1,1,0,0,0,0|2,0,0]=4 10302 B14R1.8282 COCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000233755 [1,1,0,0,0,0|2,0,0]=4 10303 B14R1.8282 COCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000233755 [1,1,0,0,0,0|2,0,0]=4 10304 B14R1.8282 COCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000233755 [1,1,0,0,0,0|1,0,0]=3 10305 B14R1.8282 COCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000233755 [1,1,0,0,0,0|1,0,0]=3 10306 B14R1.8282 CSCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000751147 [1,1,0,0,0,0|2,0,0]=4 10307 B14R1.8282 CSCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000751147 [1,1,0,0,0,0|2,0,0]=4 10308 B14R1.8282 CSCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000751147 [1,1,0,0,0,0|2,0,0]=4 10309 B14R1.8282 CSCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000751147 [1,1,0,0,0,0|2,0,0]=4 10310 B14R1.8282 CSCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000751147 [1,1,0,0,0,0|1,0,0]=3 10311 B14R1.8282 CSCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000751147 [1,1,0,0,0,0|2,0,0]=4 10312 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000751147 [1,1,0,0,0,0|2,0,0]=4 10313 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000751147 [1,1,0,0,0,0|2,0,0]=4 10314 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000751147 [1,1,0,0,0,0|2,0,0]=4 10315 B14R1.8282 CSCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000751147 [1,1,0,0,0,0|1,0,0]=3 10316 B14R1.8282 CSCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000751147 [1,1,0,0,0,0|2,0,0]=4 10317 B14R1.8282 CSCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000751147 [1,1,0,0,0,0|2,0,0]=4 10318 B14R1.8282 CSCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000751147 [1,1,0,0,0,0|1,0,0]=3 10319 B14R1.8282 CSCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000751147 [1,1,0,0,0,0|2,0,0]=4 10320 B14R1.8282 CSCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000751147 [1,1,0,0,0,0|2,0,0]=4 10321 B14R1.8282 CSCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000751147 [1,1,0,0,0,0|2,0,0]=4 10322 B14R1.8282 CSCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000751147 [1,1,0,0,0,0|2,0,0]=4 10323 B14R1.8282 CSCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000751147 [1,1,0,0,0,0|1,0,0]=3 10324 B14R1.8282 CSCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000751147 [1,1,0,0,0,0|1,0,0]=3 10325 B14R1.8282 Cc1cccc(c1C(=O)CCC#N)O 1458a_100011934116_100011215226 [1,1,0,0,0,0|1,0,1]=4 10326 B14R1.8282 Cc1cccc(c1C(=O)CCCF)Br 1458a_100000701904_100011934791 [1,1,0,0,0,0|2,0,0]=4 10327 B14R1.8282 Cc1cccc(c1C(=O)CCCF)C 1458a_100000758298_100011934791 [1,1,0,0,0,0|2,0,0]=4 10328 B14R1.8282 Cc1cccc(c1C(=O)CCCF)Cl 1458a_100000692601_100011934791 [1,1,0,0,0,0|2,0,0]=4 10329 B14R1.8282 Cc1cccc(c1C(=O)CCCF)F 1458a_100000762013_100011934791 [1,1,0,0,0,0|2,0,0]=4 10330 B14R1.8282 Cc1cccc(c1C(=O)CCCF)I 1458a_100000688020_100011934791 [1,1,0,0,0,0|2,0,0]=4 10331 B14R1.8282 Cc1cccc(c1C(=O)CCCF)O 1458a_100011934116_100011934791 [1,1,0,0,0,0|1,0,0]=3 10332 B14R1.8282 Cc1cccc(c1C(=O)CCCO)Br 1458a_100000701904_100011215043 [1,1,0,0,0,0|2,0,0]=4 10333 B14R1.8282 Cc1cccc(c1C(=O)CCCO)C 1458a_100000758298_100011215043 [1,1,0,0,0,0|2,0,0]=4 10334 B14R1.8282 Cc1cccc(c1C(=O)CCCO)Cl 1458a_100000692601_100011215043 [1,1,0,0,0,0|2,0,0]=4 10335 B14R1.8282 Cc1cccc(c1C(=O)CCCO)F 1458a_100000762013_100011215043 [1,1,0,0,0,0|2,0,0]=4 10336 B14R1.8282 Cc1cccc(c1C(=O)CCCO)I 1458a_100000688020_100011215043 [1,1,0,0,0,0|2,0,0]=4 10337 B14R1.8282 Cc1cccc(c1C(=O)CCCO)O 1458a_100011934116_100011215043 [1,1,0,0,0,0|1,0,0]=3 10338 B14R1.8282 N#CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215226 [1,1,0,0,0,0|1,0,1]=4 10339 B14R1.8282 N#CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215226 [1,1,0,0,0,0|1,0,1]=4 10340 B14R1.8282 N#CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215226 [1,1,0,0,0,0|1,0,1]=4 10341 B14R1.8282 N#CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215226 [1,1,0,0,0,0|1,0,1]=4 10342 B14R1.8282 O=C(CCCF)c1c(cccc1Br)Br 1458a_100000690891_100011934791 [1,1,0,0,0,0|2,0,0]=4 10343 B14R1.8282 O=C(CCCF)c1c(cccc1Br)Cl 1458a_100011253703_100011934791 [1,1,0,0,0,0|2,0,0]=4 10344 B14R1.8282 O=C(CCCF)c1c(cccc1Br)F 1458a_100000752694_100011934791 [1,1,0,0,0,0|2,0,0]=4 10345 B14R1.8282 O=C(CCCF)c1c(cccc1Br)O 1458a_100011935254_100011934791 [1,1,0,0,0,0|1,0,0]=3 10346 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)Cl 1458a_100000210656_100011934791 [1,1,0,0,0,0|2,0,0]=4 10347 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)F 1458a_100000210369_100011934791 [1,1,0,0,0,0|2,0,0]=4 10348 B14R1.8282 O=C(CCCF)c1c(cccc1Cl)O 1458a_100000745519_100011934791 [1,1,0,0,0,0|1,0,0]=3 10349 B14R1.8282 O=C(CCCF)c1c(cccc1F)F 1458a_100000210804_100011934791 [1,1,0,0,0,0|2,0,0]=4 10350 B14R1.8282 O=C(CCCF)c1c(cccc1F)O 1458a_100000763259_100011934791 [1,1,0,0,0,0|1,0,0]=3 10351 B14R1.8282 O=C(CCCF)c1c(cccc1I)Br 1458a_100010232521_100011934791 [1,1,0,0,0,0|2,0,0]=4 10352 B14R1.8282 O=C(CCCF)c1c(cccc1I)Cl 1458a_100000702859_100011934791 [1,1,0,0,0,0|2,0,0]=4 10353 B14R1.8282 O=C(CCCF)c1c(cccc1I)F 1458a_100000023732_100011934791 [1,1,0,0,0,0|2,0,0]=4 10354 B14R1.8282 O=C(CCCF)c1c(cccc1O)O 1458a_100000755285_100011934791 [1,1,0,0,0,0|1,0,0]=3 10355 B14R1.8282 O=C(CCCO)c1c(cccc1Br)Br 1458a_100000690891_100011215043 [1,1,0,0,0,0|2,0,0]=4 10356 B14R1.8282 O=C(CCCO)c1c(cccc1Br)Cl 1458a_100011253703_100011215043 [1,1,0,0,0,0|2,0,0]=4 10357 B14R1.8282 O=C(CCCO)c1c(cccc1Br)F 1458a_100000752694_100011215043 [1,1,0,0,0,0|2,0,0]=4 10358 B14R1.8282 O=C(CCCO)c1c(cccc1Br)O 1458a_100011935254_100011215043 [1,1,0,0,0,0|1,0,0]=3 10359 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)Cl 1458a_100000210656_100011215043 [1,1,0,0,0,0|2,0,0]=4 10360 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)F 1458a_100000210369_100011215043 [1,1,0,0,0,0|2,0,0]=4 10361 B14R1.8282 O=C(CCCO)c1c(cccc1Cl)O 1458a_100000745519_100011215043 [1,1,0,0,0,0|1,0,0]=3 10362 B14R1.8282 O=C(CCCO)c1c(cccc1F)F 1458a_100000210804_100011215043 [1,1,0,0,0,0|2,0,0]=4 10363 B14R1.8282 O=C(CCCO)c1c(cccc1F)O 1458a_100000763259_100011215043 [1,1,0,0,0,0|1,0,0]=3 10364 B14R1.8282 O=C(CCCO)c1c(cccc1I)Br 1458a_100010232521_100011215043 [1,1,0,0,0,0|2,0,0]=4 10365 B14R1.8282 O=C(CCCO)c1c(cccc1I)Cl 1458a_100000702859_100011215043 [1,1,0,0,0,0|2,0,0]=4 10366 B14R1.8282 O=C(CCCO)c1c(cccc1I)F 1458a_100000023732_100011215043 [1,1,0,0,0,0|2,0,0]=4 10367 B14R1.8282 O=C(CCCO)c1c(cccc1O)O 1458a_100000755285_100011215043 [1,1,0,0,0,0|1,0,0]=3 10368 B14R1.8282 O=C(NCCF)c1c(cccc1Br)O 240690a_100000724931_100011935254 [1,1,0,0,0,0|2,0,0]=4 10369 B14R1.8282 O=C(NCCF)c1c(cccc1Br)O 527a_100000724931_100011935254 [1,1,0,0,0,0|2,0,0]=4 10370 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)O 240690a_100000724931_100000745519 [1,1,0,0,0,0|2,0,0]=4 10371 B14R1.8282 O=C(NCCF)c1c(cccc1Cl)O 527a_100000724931_100000745519 [1,1,0,0,0,0|2,0,0]=4 10372 B14R1.8282 O=C(NCCF)c1c(cccc1F)O 527a_100000724931_100000763259 [1,1,0,0,0,0|2,0,0]=4 10373 B14R1.8282 O=C(NCCF)c1c(cccc1O)O 527a_100000724931_100000755285 [1,1,0,0,0,0|2,0,0]=4 10374 B14R1.8282 O=C(NCCO)c1c(cccc1Br)O 240690a_100000210304_100011935254 [1,1,0,0,0,0|2,0,0]=4 10375 B14R1.8282 O=C(NCCO)c1c(cccc1Br)O 527a_100000210304_100011935254 [1,1,0,0,0,0|2,0,0]=4 10376 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)O 240690a_100000210304_100000745519 [1,1,0,0,0,0|2,0,0]=4 10377 B14R1.8282 O=C(NCCO)c1c(cccc1Cl)O 527a_100000210304_100000745519 [1,1,0,0,0,0|2,0,0]=4 10378 B14R1.8282 O=C(NCCO)c1c(cccc1F)O 527a_100000210304_100000763259 [1,1,0,0,0,0|2,0,0]=4 10379 B14R1.8282 O=C(NCCO)c1c(cccc1O)O 527a_100000210304_100000755285 [1,1,0,0,0,0|2,0,0]=4 10380 B14R1.3360 CCCCOCC(=O)c1cccn1C 34a_100000210227_200011262399 [0,1,0,0,1,0|2,0,0]=4 10381 B14R1.3360 CCCCOCC(=O)c1cccn1C 7a_100000210227_200011262399 [0,1,0,0,1,0|2,0,0]=4 10382 B14R1.3360 CCCCOCC(=O)c1sccc1Br 34a_100000210227_100000740827 [0,1,0,0,1,0|2,0,0]=4 10383 B14R1.3360 CCCCOCC(=O)c1sccc1Br 7a_100000210227_100000740827 [0,1,0,0,1,0|2,0,0]=4 10384 B16R1.88 CCCC#CC(=O)Nc1cccc(c1O)Br 22a_100011934915_200011218047 [0,1,0,0,0,1|1,0,1]=4 10385 B16R1.88 CCCC#CC(=O)Nc1cccc(c1O)C 22a_100000756359_200011218047 [0,1,0,0,0,1|1,0,1]=4 10386 B16R1.88 CCCC#CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_200011218047 [0,1,0,0,0,1|1,0,1]=4 10387 B16R1.88 CCCC#CC(=O)Nc1cccc(c1O)F 22a_100011934987_200011218047 [0,1,0,0,0,1|1,0,1]=4 10388 B16R1.88 CCCC#CC(=O)Nc1cccc(c1O)I 22a_100010084371_200011218047 [0,1,0,0,0,1|1,0,1]=4 10389 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000212230 [0,1,0,0,0,1|1,0,1]=4 10390 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)C 11a_100000756359_100000212230 [0,1,0,0,0,1|1,0,1]=4 10391 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000212230 [0,1,0,0,0,1|1,0,1]=4 10392 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000212230 [0,1,0,0,0,1|1,0,1]=4 10393 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000212230 [0,1,0,0,0,1|1,0,1]=4 10394 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000212230 [0,1,0,0,0,1|1,0,1]=4 10395 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000212230 [0,1,0,0,0,1|1,0,1]=4 10396 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000212230 [0,1,0,0,0,1|1,0,1]=4 10397 B16R1.88 CCCC=CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000212230 [0,1,0,0,0,1|1,0,1]=4 10398 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)C 1458a_100000212188_200012349612 [0,1,0,0,0,1|2,0,0]=4 10399 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210326 [0,1,0,0,0,1|2,0,0]=4 10400 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000212188_100010145525 [0,1,0,0,0,1|2,0,0]=4 10401 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210326 [0,1,0,0,0,1|2,0,0]=4 10402 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)F 1458a_100000212188_100012351116 [0,1,0,0,0,1|2,0,0]=4 10403 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000210326 [0,1,0,0,0,1|2,0,0]=4 10404 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)I 1458a_100000212188_100010254545 [0,1,0,0,0,1|2,0,0]=4 10405 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)Br 1458a_100000212188_100000694682 [0,1,0,0,0,1|2,0,0]=4 10406 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)C 1458a_100000212188_100011515928 [0,1,0,0,0,1|2,0,0]=4 10407 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210326 [0,1,0,0,0,1|2,0,0]=4 10408 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)Cl 1458a_100000212188_100012186920 [0,1,0,0,0,1|2,0,0]=4 10409 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000210326 [0,1,0,0,0,1|2,0,0]=4 10410 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)F 1458a_100000212188_100009813626 [0,1,0,0,0,1|2,0,0]=4 10411 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)I 1458a_100000212188_100010150147 [0,1,0,0,0,1|2,0,0]=4 10412 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000212188_100012349491 [0,1,0,0,0,1|2,0,0]=4 10413 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210326 [0,1,0,0,0,1|2,0,0]=4 10414 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000212188_100000720918 [0,1,0,0,0,1|2,0,0]=4 10415 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210326 [0,1,0,0,0,1|2,0,0]=4 10416 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)F 1458a_100000212188_100000696688 [0,1,0,0,0,1|2,0,0]=4 10417 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000210326 [0,1,0,0,0,1|2,0,0]=4 10418 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Br 1458a_100000212188_100012356507 [0,1,0,0,0,1|2,0,0]=4 10419 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000210326 [0,1,0,0,0,1|2,0,0]=4 10420 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)C 1458a_100000212188_100011216058 [0,1,0,0,0,1|2,0,0]=4 10421 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000212188_100000716733 [0,1,0,0,0,1|2,0,0]=4 10422 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000210326 [0,1,0,0,0,1|2,0,0]=4 10423 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)F 1458a_100000212188_100000217499 [0,1,0,0,0,1|2,0,0]=4 10424 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000210326 [0,1,0,0,0,1|2,0,0]=4 10425 B16R1.88 CCCCCC(=O)Cc1cccc(c1I)F 1458a_100000212188_100010149603 [0,1,0,0,0,1|2,0,0]=4 10426 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)C 11a_100000684715_100000212188 [0,1,0,0,0,1|2,0,0]=4 10427 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100000212188 [0,1,0,0,0,1|2,0,0]=4 10428 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000212188 [0,1,0,0,0,1|2,0,0]=4 10429 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100000212188 [0,1,0,0,0,1|2,0,0]=4 10430 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100000212188 [0,1,0,0,0,1|2,0,0]=4 10431 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)F 11a_100011934729_100000212188 [0,1,0,0,0,1|2,0,0]=4 10432 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100000212188 [0,1,0,0,0,1|2,0,0]=4 10433 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000212188 [0,1,0,0,0,1|2,0,0]=4 10434 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 11a_100000750434_100000212188 [0,1,0,0,0,1|2,0,0]=4 10435 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100000212188 [0,1,0,0,0,1|2,0,0]=4 10436 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000212188 [0,1,0,0,0,1|2,0,0]=4 10437 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 527a_100000750434_100000212188 [0,1,0,0,0,1|2,0,0]=4 10438 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 11a_100000210026_100000212188 [0,1,0,0,0,1|2,0,0]=4 10439 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 1626a_100000210026_100000212188 [0,1,0,0,0,1|2,0,0]=4 10440 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 22a_100000210026_100000212188 [0,1,0,0,0,1|2,0,0]=4 10441 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 527a_100000210026_100000212188 [0,1,0,0,0,1|2,0,0]=4 10442 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100000212188 [0,1,0,0,0,1|2,0,0]=4 10443 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100000212188 [0,1,0,0,0,1|2,0,0]=4 10444 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000212188 [0,1,0,0,0,1|2,0,0]=4 10445 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100000212188 [0,1,0,0,0,1|2,0,0]=4 10446 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 11a_100000745574_100000212188 [0,1,0,0,0,1|2,0,0]=4 10447 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 1626a_100000745574_100000212188 [0,1,0,0,0,1|2,0,0]=4 10448 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 22a_100000745574_100000212188 [0,1,0,0,0,1|2,0,0]=4 10449 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 527a_100000745574_100000212188 [0,1,0,0,0,1|2,0,0]=4 10450 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 11a_100000761887_100000212188 [0,1,0,0,0,1|2,0,0]=4 10451 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 1626a_100000761887_100000212188 [0,1,0,0,0,1|2,0,0]=4 10452 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 22a_100000761887_100000212188 [0,1,0,0,0,1|2,0,0]=4 10453 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 527a_100000761887_100000212188 [0,1,0,0,0,1|2,0,0]=4 10454 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)O 11a_100011216573_100000212188 [0,1,0,0,0,1|2,0,0]=4 10455 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)O 22a_100011216573_100000212188 [0,1,0,0,0,1|2,0,0]=4 10456 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)O 527a_100011216573_100000212188 [0,1,0,0,0,1|2,0,0]=4 10457 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100000212188 [0,1,0,0,0,1|2,0,0]=4 10458 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100000212188 [0,1,0,0,0,1|2,0,0]=4 10459 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100000212188 [0,1,0,0,0,1|2,0,0]=4 10460 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100000212188 [0,1,0,0,0,1|2,0,0]=4 10461 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100000212188 [0,1,0,0,0,1|2,0,0]=4 10462 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000212188 [0,1,0,0,0,1|2,0,0]=4 10463 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100000212188 [0,1,0,0,0,1|2,0,0]=4 10464 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100000212188 [0,1,0,0,0,1|2,0,0]=4 10465 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100000212188 [0,1,0,0,0,1|2,0,0]=4 10466 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100000212188 [0,1,0,0,0,1|2,0,0]=4 10467 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000212188 [0,1,0,0,0,1|2,0,0]=4 10468 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000212188 [0,1,0,0,0,1|2,0,0]=4 10469 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 11a_100011935091_100000212188 [0,1,0,0,0,1|2,0,0]=4 10470 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100000212188 [0,1,0,0,0,1|2,0,0]=4 10471 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000212188 [0,1,0,0,0,1|2,0,0]=4 10472 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 527a_100011935091_100000212188 [0,1,0,0,0,1|2,0,0]=4 10473 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)C 11a_100000697159_100000212188 [0,1,0,0,0,1|2,0,0]=4 10474 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)C 1626a_100000697159_100000212188 [0,1,0,0,0,1|2,0,0]=4 10475 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)C 527a_100000697159_100000212188 [0,1,0,0,0,1|2,0,0]=4 10476 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100000212188 [0,1,0,0,0,1|2,0,0]=4 10477 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100000212188 [0,1,0,0,0,1|2,0,0]=4 10478 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000212188 [0,1,0,0,0,1|2,0,0]=4 10479 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)F 11a_100000743855_100000212188 [0,1,0,0,0,1|2,0,0]=4 10480 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)F 1626a_100000743855_100000212188 [0,1,0,0,0,1|2,0,0]=4 10481 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)F 22a_100000743855_100000212188 [0,1,0,0,0,1|2,0,0]=4 10482 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Br 11a_100020590159_100000212188 [0,1,0,0,0,1|2,0,0]=4 10483 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100000212188 [0,1,0,0,0,1|2,0,0]=4 10484 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)C 11a_100000761888_100000212188 [0,1,0,0,0,1|2,0,0]=4 10485 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)C 1626a_100000761888_100000212188 [0,1,0,0,0,1|2,0,0]=4 10486 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100000212188 [0,1,0,0,0,1|2,0,0]=4 10487 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100000212188 [0,1,0,0,0,1|2,0,0]=4 10488 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)F 11a_100000690935_100000212188 [0,1,0,0,0,1|2,0,0]=4 10489 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)F 1626a_100000690935_100000212188 [0,1,0,0,0,1|2,0,0]=4 10490 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000212188 [0,1,0,0,0,1|1,0,0]=3 10491 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000212188 [0,1,0,0,0,1|1,0,0]=3 10492 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000212188 [0,1,0,0,0,1|1,0,0]=3 10493 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000212188 [0,1,0,0,0,1|1,0,0]=3 10494 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000212188 [0,1,0,0,0,1|1,0,0]=3 10495 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000212188 [0,1,0,0,0,1|1,0,0]=3 10496 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000212188 [0,1,0,0,0,1|1,0,0]=3 10497 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000212188 [0,1,0,0,0,1|1,0,0]=3 10498 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000212188 [0,1,0,0,0,1|1,0,0]=3 10499 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000212188 [0,1,0,0,0,1|1,0,0]=3 10500 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000212188 [0,1,0,0,0,1|1,0,0]=3 10501 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000212188 [0,1,0,0,0,1|1,0,0]=3 10502 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000212188 [0,1,0,0,0,1|1,0,0]=3 10503 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000212188 [0,1,0,0,0,1|1,0,0]=3 10504 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 11a_100000102301_100010147021 [0,1,0,0,0,1|2,0,0]=4 10505 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 1626a_100000102301_100010147021 [0,1,0,0,0,1|2,0,0]=4 10506 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 240690a_100000102301_100010147021 [0,1,0,0,0,1|2,0,0]=4 10507 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 527a_100000102301_100010147021 [0,1,0,0,0,1|2,0,0]=4 10508 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 11a_100000102301_100010145769 [0,1,0,0,0,1|2,0,0]=4 10509 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 1626a_100000102301_100010145769 [0,1,0,0,0,1|2,0,0]=4 10510 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 240690a_100000102301_100010145769 [0,1,0,0,0,1|2,0,0]=4 10511 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 527a_100000102301_100010145769 [0,1,0,0,0,1|2,0,0]=4 10512 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 11a_100000102301_100012356664 [0,1,0,0,0,1|2,0,0]=4 10513 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 1626a_100000102301_100012356664 [0,1,0,0,0,1|2,0,0]=4 10514 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 240690a_100000102301_100012356664 [0,1,0,0,0,1|2,0,0]=4 10515 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 527a_100000102301_100012356664 [0,1,0,0,0,1|2,0,0]=4 10516 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 11a_100000102301_100011698479 [0,1,0,0,0,1|2,0,0]=4 10517 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 1626a_100000102301_100011698479 [0,1,0,0,0,1|2,0,0]=4 10518 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 240690a_100000102301_100011698479 [0,1,0,0,0,1|2,0,0]=4 10519 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 527a_100000102301_100011698479 [0,1,0,0,0,1|2,0,0]=4 10520 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 11a_100000102301_100000035905 [0,1,0,0,0,1|2,0,0]=4 10521 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 1626a_100000102301_100000035905 [0,1,0,0,0,1|2,0,0]=4 10522 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 240690a_100000102301_100000035905 [0,1,0,0,0,1|2,0,0]=4 10523 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 527a_100000102301_100000035905 [0,1,0,0,0,1|2,0,0]=4 10524 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 11a_100000102301_100010145770 [0,1,0,0,0,1|2,0,0]=4 10525 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 1626a_100000102301_100010145770 [0,1,0,0,0,1|2,0,0]=4 10526 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 240690a_100000102301_100010145770 [0,1,0,0,0,1|2,0,0]=4 10527 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 527a_100000102301_100010145770 [0,1,0,0,0,1|2,0,0]=4 10528 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 11a_100000102301_100000759314 [0,1,0,0,0,1|2,0,0]=4 10529 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 1626a_100000102301_100000759314 [0,1,0,0,0,1|2,0,0]=4 10530 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 240690a_100000102301_100000759314 [0,1,0,0,0,1|2,0,0]=4 10531 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 527a_100000102301_100000759314 [0,1,0,0,0,1|2,0,0]=4 10532 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 11a_100000102301_100012001123 [0,1,0,0,0,1|2,0,0]=4 10533 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 1626a_100000102301_100012001123 [0,1,0,0,0,1|2,0,0]=4 10534 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 240690a_100000102301_100012001123 [0,1,0,0,0,1|2,0,0]=4 10535 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 527a_100000102301_100012001123 [0,1,0,0,0,1|2,0,0]=4 10536 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 11a_100000102301_100011935088 [0,1,0,0,0,1|2,0,0]=4 10537 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 1626a_100000102301_100011935088 [0,1,0,0,0,1|2,0,0]=4 10538 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 240690a_100000102301_100011935088 [0,1,0,0,0,1|2,0,0]=4 10539 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 527a_100000102301_100011935088 [0,1,0,0,0,1|2,0,0]=4 10540 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 11a_100000102301_100000709823 [0,1,0,0,0,1|2,0,0]=4 10541 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 1626a_100000102301_100000709823 [0,1,0,0,0,1|2,0,0]=4 10542 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 240690a_100000102301_100000709823 [0,1,0,0,0,1|2,0,0]=4 10543 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 527a_100000102301_100000709823 [0,1,0,0,0,1|2,0,0]=4 10544 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 11a_100000102301_100000684727 [0,1,0,0,0,1|2,0,0]=4 10545 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 1626a_100000102301_100000684727 [0,1,0,0,0,1|2,0,0]=4 10546 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 240690a_100000102301_100000684727 [0,1,0,0,0,1|2,0,0]=4 10547 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 527a_100000102301_100000684727 [0,1,0,0,0,1|2,0,0]=4 10548 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)C 2430a_100000684715_100000102301 [0,1,0,0,0,1|2,0,0]=4 10549 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)Cl 2430a_100000687072_100000102301 [0,1,0,0,0,1|2,0,0]=4 10550 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)F 2430a_100011934729_100000102301 [0,1,0,0,0,1|2,0,0]=4 10551 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)O 2430a_100012183704_100000102301 [0,1,0,0,0,1|2,0,0]=4 10552 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)Br 2430a_100000750434_100000102301 [0,1,0,0,0,1|2,0,0]=4 10553 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)C 2430a_100000210026_100000102301 [0,1,0,0,0,1|2,0,0]=4 10554 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)Cl 2430a_100000210441_100000102301 [0,1,0,0,0,1|2,0,0]=4 10555 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)F 2430a_100000745574_100000102301 [0,1,0,0,0,1|2,0,0]=4 10556 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)I 2430a_100000761887_100000102301 [0,1,0,0,0,1|2,0,0]=4 10557 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)O 2430a_100011216573_100000102301 [0,1,0,0,0,1|2,0,0]=4 10558 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)Br 2430a_100000687075_100000102301 [0,1,0,0,0,1|2,0,0]=4 10559 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)C 2430a_100000765562_100000102301 [0,1,0,0,0,1|2,0,0]=4 10560 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)Cl 2430a_100000185733_100000102301 [0,1,0,0,0,1|2,0,0]=4 10561 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)F 2430a_100000692321_100000102301 [0,1,0,0,0,1|2,0,0]=4 10562 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)O 2430a_100012002038_100000102301 [0,1,0,0,0,1|2,0,0]=4 10563 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Br 2430a_100011935091_100000102301 [0,1,0,0,0,1|2,0,0]=4 10564 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Br 512a_100011935091_100000102301 [0,1,0,0,0,1|2,0,0]=4 10565 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)C 2430a_100000697159_100000102301 [0,1,0,0,0,1|2,0,0]=4 10566 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)C 512a_100000697159_100000102301 [0,1,0,0,0,1|2,0,0]=4 10567 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Cl 2430a_100000199060_100000102301 [0,1,0,0,0,1|2,0,0]=4 10568 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)F 2430a_100000743855_100000102301 [0,1,0,0,0,1|2,0,0]=4 10569 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)F 512a_100000743855_100000102301 [0,1,0,0,0,1|2,0,0]=4 10570 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)Br 2430a_100020590159_100000102301 [0,1,0,0,0,1|2,0,0]=4 10571 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)Br 512a_100020590159_100000102301 [0,1,0,0,0,1|2,0,0]=4 10572 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)C 2430a_100000761888_100000102301 [0,1,0,0,0,1|2,0,0]=4 10573 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)Cl 2430a_100000049713_100000102301 [0,1,0,0,0,1|2,0,0]=4 10574 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)F 512a_100000690935_100000102301 [0,1,0,0,0,1|2,0,0]=4 10575 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100000102301 [0,1,0,0,0,1|1,0,0]=3 10576 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100000102301 [0,1,0,0,0,1|1,0,0]=3 10577 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100000102301 [0,1,0,0,0,1|1,0,0]=3 10578 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100000102301 [0,1,0,0,0,1|1,0,0]=3 10579 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100000102301 [0,1,0,0,0,1|1,0,0]=3 10580 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000745993 [0,1,0,0,0,1|2,0,0]=4 10581 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000745993 [0,1,0,0,0,1|2,0,0]=4 10582 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000745993 [0,1,0,0,0,1|2,0,0]=4 10583 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000745993 [0,1,0,0,0,1|2,0,0]=4 10584 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000745993 [0,1,0,0,0,1|2,0,0]=4 10585 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000745993 [0,1,0,0,0,1|2,0,0]=4 10586 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000745993 [0,1,0,0,0,1|2,0,0]=4 10587 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000745993 [0,1,0,0,0,1|2,0,0]=4 10588 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000745993 [0,1,0,0,0,1|2,0,0]=4 10589 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000745993 [0,1,0,0,0,1|2,0,0]=4 10590 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000745993 [0,1,0,0,0,1|2,0,0]=4 10591 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000745993 [0,1,0,0,0,1|2,0,0]=4 10592 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000745993 [0,1,0,0,0,1|2,0,0]=4 10593 B16R1.88 CCCOCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000745993 [0,1,0,0,0,1|2,0,0]=4 10594 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000217233 [0,1,0,0,0,1|2,0,0]=4 10595 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000217233 [0,1,0,0,0,1|2,0,0]=4 10596 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000217233 [0,1,0,0,0,1|2,0,0]=4 10597 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000217233 [0,1,0,0,0,1|2,0,0]=4 10598 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000217233 [0,1,0,0,0,1|2,0,0]=4 10599 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000217233 [0,1,0,0,0,1|2,0,0]=4 10600 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000217233 [0,1,0,0,0,1|2,0,0]=4 10601 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000217233 [0,1,0,0,0,1|2,0,0]=4 10602 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000217233 [0,1,0,0,0,1|2,0,0]=4 10603 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000217233 [0,1,0,0,0,1|2,0,0]=4 10604 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000217233 [0,1,0,0,0,1|2,0,0]=4 10605 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000217233 [0,1,0,0,0,1|2,0,0]=4 10606 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000217233 [0,1,0,0,0,1|2,0,0]=4 10607 B16R1.88 CCCSCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000217233 [0,1,0,0,0,1|2,0,0]=4 10608 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000749530 [0,1,0,0,0,1|2,0,0]=4 10609 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000749530 [0,1,0,0,0,1|2,0,0]=4 10610 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000749530 [0,1,0,0,0,1|2,0,0]=4 10611 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000749530 [0,1,0,0,0,1|2,0,0]=4 10612 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000749530 [0,1,0,0,0,1|2,0,0]=4 10613 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000749530 [0,1,0,0,0,1|2,0,0]=4 10614 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000749530 [0,1,0,0,0,1|2,0,0]=4 10615 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000749530 [0,1,0,0,0,1|2,0,0]=4 10616 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000749530 [0,1,0,0,0,1|2,0,0]=4 10617 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000749530 [0,1,0,0,0,1|2,0,0]=4 10618 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000749530 [0,1,0,0,0,1|2,0,0]=4 10619 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000749530 [0,1,0,0,0,1|2,0,0]=4 10620 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000749530 [0,1,0,0,0,1|2,0,0]=4 10621 B16R1.88 CCOCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000749530 [0,1,0,0,0,1|2,0,0]=4 10622 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000230768 [0,1,0,0,0,1|2,0,0]=4 10623 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000230768 [0,1,0,0,0,1|2,0,0]=4 10624 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000230768 [0,1,0,0,0,1|2,0,0]=4 10625 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000230768 [0,1,0,0,0,1|2,0,0]=4 10626 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000230768 [0,1,0,0,0,1|2,0,0]=4 10627 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000230768 [0,1,0,0,0,1|2,0,0]=4 10628 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000230768 [0,1,0,0,0,1|2,0,0]=4 10629 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000230768 [0,1,0,0,0,1|2,0,0]=4 10630 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000230768 [0,1,0,0,0,1|2,0,0]=4 10631 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000230768 [0,1,0,0,0,1|2,0,0]=4 10632 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000230768 [0,1,0,0,0,1|2,0,0]=4 10633 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000230768 [0,1,0,0,0,1|2,0,0]=4 10634 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000230768 [0,1,0,0,0,1|2,0,0]=4 10635 B16R1.88 CCSCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000230768 [0,1,0,0,0,1|2,0,0]=4 10636 B16R1.88 COCCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000741012 [0,1,0,0,0,1|2,0,0]=4 10637 B16R1.88 COCCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000741012 [0,1,0,0,0,1|2,0,0]=4 10638 B16R1.88 COCCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000741012 [0,1,0,0,0,1|2,0,0]=4 10639 B16R1.88 COCCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000741012 [0,1,0,0,0,1|2,0,0]=4 10640 B16R1.88 COCCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000741012 [0,1,0,0,0,1|2,0,0]=4 10641 B16R1.88 COCCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000741012 [0,1,0,0,0,1|2,0,0]=4 10642 B16R1.88 COCCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000741012 [0,1,0,0,0,1|2,0,0]=4 10643 B16R1.88 COCCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000741012 [0,1,0,0,0,1|2,0,0]=4 10644 B16R1.88 COCCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000741012 [0,1,0,0,0,1|2,0,0]=4 10645 B16R1.88 COCCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000741012 [0,1,0,0,0,1|2,0,0]=4 10646 B16R1.88 COCCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000741012 [0,1,0,0,0,1|2,0,0]=4 10647 B16R1.88 COCCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000741012 [0,1,0,0,0,1|2,0,0]=4 10648 B16R1.88 COCCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000741012 [0,1,0,0,0,1|2,0,0]=4 10649 B16R1.88 COCCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000741012 [0,1,0,0,0,1|2,0,0]=4 10650 B16R1.88 COCCNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100000209980 [0,1,0,0,0,1|2,0,0]=4 10651 B16R1.88 COCCNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100000209980 [0,1,0,0,0,1|2,0,0]=4 10652 B16R1.88 COCCNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100000209980 [0,1,0,0,0,1|2,0,0]=4 10653 B16R1.88 COCCNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100000209980 [0,1,0,0,0,1|2,0,0]=4 10654 B16R1.88 COCCNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100000209980 [0,1,0,0,0,1|2,0,0]=4 10655 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000173376 [0,1,0,0,0,1|2,0,0]=4 10656 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000173376 [0,1,0,0,0,1|2,0,0]=4 10657 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000173376 [0,1,0,0,0,1|2,0,0]=4 10658 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000173376 [0,1,0,0,0,1|2,0,0]=4 10659 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000173376 [0,1,0,0,0,1|2,0,0]=4 10660 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000173376 [0,1,0,0,0,1|2,0,0]=4 10661 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000173376 [0,1,0,0,0,1|2,0,0]=4 10662 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000173376 [0,1,0,0,0,1|2,0,0]=4 10663 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000173376 [0,1,0,0,0,1|2,0,0]=4 10664 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000173376 [0,1,0,0,0,1|2,0,0]=4 10665 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000173376 [0,1,0,0,0,1|2,0,0]=4 10666 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000173376 [0,1,0,0,0,1|2,0,0]=4 10667 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000173376 [0,1,0,0,0,1|2,0,0]=4 10668 B16R1.88 CSCCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000173376 [0,1,0,0,0,1|2,0,0]=4 10669 B16R1.88 CSCCNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100020590264 [0,1,0,0,0,1|2,0,0]=4 10670 B16R1.88 CSCCNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100020590264 [0,1,0,0,0,1|2,0,0]=4 10671 B16R1.88 CSCCNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100020590264 [0,1,0,0,0,1|2,0,0]=4 10672 B16R1.88 CSCCNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100020590264 [0,1,0,0,0,1|2,0,0]=4 10673 B16R1.88 CSCCNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100020590264 [0,1,0,0,0,1|2,0,0]=4 10674 B16R1.88 Cc1cccc(c1O)NC(=O)CCCCO 1626a_100000756359_100000695505 [0,1,0,0,0,1|2,0,0]=4 10675 B16R1.88 Cc1cccc(c1O)NC(=O)NCCCF 2430a_100000756359_100015189416 [0,1,0,0,0,1|2,0,0]=4 10676 B16R1.88 Cc1cccc(c1O)NC(=O)NCCCO 2430a_100000756359_100000182051 [0,1,0,0,0,1|2,0,0]=4 10677 B16R1.88 O=C(CCCCO)Nc1cccc(c1O)F 1626a_100011934987_100000695505 [0,1,0,0,0,1|2,0,0]=4 10678 B16R1.88 O=C(CCCCO)Nc1cccc(c1O)I 1626a_100010084371_100000695505 [0,1,0,0,0,1|2,0,0]=4 10679 B16R1.88 O=C(NCCCF)Nc1cccc(c1O)Br 2430a_100011934915_100015189416 [0,1,0,0,0,1|2,0,0]=4 10680 B16R1.88 O=C(NCCCF)Nc1cccc(c1O)Cl 2430a_100000754742_100015189416 [0,1,0,0,0,1|2,0,0]=4 10681 B16R1.88 O=C(NCCCF)Nc1cccc(c1O)F 2430a_100011934987_100015189416 [0,1,0,0,0,1|2,0,0]=4 10682 B16R1.88 O=C(NCCCF)Nc1cccc(c1O)I 2430a_100010084371_100015189416 [0,1,0,0,0,1|2,0,0]=4 10683 B16R1.88 O=C(NCCCO)Nc1cccc(c1O)Br 2430a_100011934915_100000182051 [0,1,0,0,0,1|2,0,0]=4 10684 B16R1.88 O=C(NCCCO)Nc1cccc(c1O)Cl 2430a_100000754742_100000182051 [0,1,0,0,0,1|2,0,0]=4 10685 B16R1.88 O=C(NCCCO)Nc1cccc(c1O)F 2430a_100011934987_100000182051 [0,1,0,0,0,1|2,0,0]=4 10686 B16R1.88 O=C(NCCCO)Nc1cccc(c1O)I 2430a_100010084371_100000182051 [0,1,0,0,0,1|2,0,0]=4 10687 B16R1.4235 C=C(CCC)CC(=O)Nc1ccccc1O 22a_100000185747_100000138376 [0,1,0,0,0,1|1,0,1]=4 10688 B16R1.4235 C=C(CCC)CC(=O)Nc1ccccc1O 527a_100000185747_100000138376 [0,1,0,0,0,1|1,0,1]=4 10689 B16R1.4235 CCCC(=CC(=O)Nc1ccccc1O)C 22a_100000185747_100020676950 [0,1,0,0,0,1|1,0,1]=4 10690 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1O 1458a_100000743006_100000747444 [0,1,0,0,0,1|1,0,1]=4 10691 B16R1.4235 CCCC(=O)CC(=O)Nc1ccccc1O 1458a_100000211992_100000014494 [0,1,0,0,0,1|1,0,1]=4 10692 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Br 1458a_100000748435_100000184730 [0,1,0,0,0,1|2,0,0]=4 10693 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Br 1458a_100000751119_100011216630 [0,1,0,0,0,1|2,0,0]=4 10694 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1C 1458a_100000212180_100011216630 [0,1,0,0,0,1|2,0,0]=4 10695 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1C 1458a_100000748435_100000211839 [0,1,0,0,0,1|2,0,0]=4 10696 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Cl 1458a_100000183793_100011216630 [0,1,0,0,0,1|2,0,0]=4 10697 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Cl 1458a_100000748435_100000187162 [0,1,0,0,0,1|2,0,0]=4 10698 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1F 1458a_100000212012_100011216630 [0,1,0,0,0,1|2,0,0]=4 10699 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1F 1458a_100000748435_100000187165 [0,1,0,0,0,1|2,0,0]=4 10700 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1I 1458a_100000036491_100011216630 [0,1,0,0,0,1|2,0,0]=4 10701 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1I 1458a_100000748435_100011216222 [0,1,0,0,0,1|2,0,0]=4 10702 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1O 1458a_100000743006_100011216630 [0,1,0,0,0,1|1,0,0]=3 10703 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1O 1458a_100000748435_200020655725 [0,1,0,0,0,1|2,0,0]=4 10704 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Br 11a_100000210017_100000748435 [0,1,0,0,0,1|2,0,0]=4 10705 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Br 1626a_100000210017_100000748435 [0,1,0,0,0,1|2,0,0]=4 10706 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 11a_100015192222_100000748435 [0,1,0,0,0,1|2,0,0]=4 10707 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 1626a_100015192222_100000748435 [0,1,0,0,0,1|2,0,0]=4 10708 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 22a_100015192222_100000748435 [0,1,0,0,0,1|2,0,0]=4 10709 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 527a_100015192222_100000748435 [0,1,0,0,0,1|2,0,0]=4 10710 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 11a_100000185783_100000748435 [0,1,0,0,0,1|2,0,0]=4 10711 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000748435 [0,1,0,0,0,1|2,0,0]=4 10712 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 22a_100000185783_100000748435 [0,1,0,0,0,1|2,0,0]=4 10713 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 527a_100000185783_100000748435 [0,1,0,0,0,1|2,0,0]=4 10714 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 11a_100000210422_100000748435 [0,1,0,0,0,1|2,0,0]=4 10715 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 1626a_100000210422_100000748435 [0,1,0,0,0,1|2,0,0]=4 10716 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 22a_100000210422_100000748435 [0,1,0,0,0,1|2,0,0]=4 10717 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 527a_100000210422_100000748435 [0,1,0,0,0,1|2,0,0]=4 10718 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1I 11a_100000210053_100000748435 [0,1,0,0,0,1|2,0,0]=4 10719 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1I 1626a_100000210053_100000748435 [0,1,0,0,0,1|2,0,0]=4 10720 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1O 22a_100000185747_100000748435 [0,1,0,0,0,1|1,0,0]=3 10721 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1O 527a_100000185747_100000748435 [0,1,0,0,0,1|1,0,0]=3 10722 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Br 11a_100000741246_100000751119 [0,1,0,0,0,1|2,0,0]=4 10723 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Br 240690a_100000741246_100000751119 [0,1,0,0,0,1|2,0,0]=4 10724 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Br 527a_100000741246_100000751119 [0,1,0,0,0,1|2,0,0]=4 10725 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 11a_100000741246_100000212180 [0,1,0,0,0,1|2,0,0]=4 10726 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 1626a_100000741246_100000212180 [0,1,0,0,0,1|2,0,0]=4 10727 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 240690a_100000741246_100000212180 [0,1,0,0,0,1|2,0,0]=4 10728 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 527a_100000741246_100000212180 [0,1,0,0,0,1|2,0,0]=4 10729 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 11a_100000741246_100000183793 [0,1,0,0,0,1|2,0,0]=4 10730 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 1626a_100000741246_100000183793 [0,1,0,0,0,1|2,0,0]=4 10731 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 240690a_100000741246_100000183793 [0,1,0,0,0,1|2,0,0]=4 10732 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 527a_100000741246_100000183793 [0,1,0,0,0,1|2,0,0]=4 10733 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 11a_100000741246_100000212012 [0,1,0,0,0,1|2,0,0]=4 10734 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 1626a_100000741246_100000212012 [0,1,0,0,0,1|2,0,0]=4 10735 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 240690a_100000741246_100000212012 [0,1,0,0,0,1|2,0,0]=4 10736 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 527a_100000741246_100000212012 [0,1,0,0,0,1|2,0,0]=4 10737 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 11a_100000741246_100000036491 [0,1,0,0,0,1|2,0,0]=4 10738 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 1626a_100000741246_100000036491 [0,1,0,0,0,1|2,0,0]=4 10739 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 240690a_100000741246_100000036491 [0,1,0,0,0,1|2,0,0]=4 10740 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 527a_100000741246_100000036491 [0,1,0,0,0,1|2,0,0]=4 10741 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1O 240690a_100000741246_100000743006 [0,1,0,0,0,1|1,0,0]=3 10742 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1O 527a_100000741246_100000743006 [0,1,0,0,0,1|1,0,0]=3 10743 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1Br 2430a_100000210017_100000741246 [0,1,0,0,0,1|2,0,0]=4 10744 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1C 2430a_100015192222_100000741246 [0,1,0,0,0,1|2,0,0]=4 10745 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1Cl 2430a_100000185783_100000741246 [0,1,0,0,0,1|2,0,0]=4 10746 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1F 2430a_100000210422_100000741246 [0,1,0,0,0,1|2,0,0]=4 10747 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1I 2430a_100000210053_100000741246 [0,1,0,0,0,1|2,0,0]=4 10748 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1O 2430a_100000185747_100000741246 [0,1,0,0,0,1|1,0,0]=3 10749 B16R1.4235 CCCN(C)CC(=O)Nc1ccccc1O 269982a_100000747261_100000014494 [0,1,0,0,0,1|2,0,0]=4 10750 B16R1.4235 CCCS(=O)CC(=O)Nc1ccccc1O 22a_100000185747_100011387404 [0,1,0,0,0,1|2,0,0]=4 10751 B16R1.4235 CCCS(=O)CC(=O)Nc1ccccc1O 527a_100000185747_100011387404 [0,1,0,0,0,1|2,0,0]=4 10752 B16R1.4235 CCSC(C)CC(=O)Nc1ccccc1O 22a_100000185747_200011311441 [0,1,0,0,0,1|2,0,0]=4 10753 B16R1.4235 CCSC(C)CC(=O)Nc1ccccc1O 527a_100000185747_200011311441 [0,1,0,0,0,1|2,0,0]=4 10754 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1O 240690a_100000764878_100000743006 [0,1,0,0,0,1|2,0,0]=4 10755 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1O 527a_100000764878_100000743006 [0,1,0,0,0,1|2,0,0]=4 10756 B16R1.4235 COC[C@@H](C)NC(=O)Nc1ccccc1O 2430a_100000185747_100000764878 [0,1,0,0,0,1|2,0,0]=4 10757 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1O 240690a_100000706166_100000743006 [0,1,0,0,0,1|2,0,0]=4 10758 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1O 527a_100000706166_100000743006 [0,1,0,0,0,1|2,0,0]=4 10759 B16R1.4235 C[C@H](CCO)NC(=O)Nc1ccccc1O 2430a_100000185747_100000706166 [0,1,0,0,0,1|2,0,0]=4 10760 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100010269958 [0,1,0,0,0,1|1,0,1]=4 10761 B16R1.4621 C#CCCCCC(=O)Nc1ccccc1O 22a_100000185747_100000696528 [0,1,0,0,0,1|1,0,1]=4 10762 B16R1.4621 C#CCCCCC(=O)Nc1ccccc1O 527a_100000185747_100000696528 [0,1,0,0,0,1|1,0,1]=4 10763 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1O 240690a_100000718082_100000743006 [0,1,0,0,0,1|1,0,1]=4 10764 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1O 527a_100000718082_100000743006 [0,1,0,0,0,1|1,0,1]=4 10765 B16R1.4621 C#CCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000718082 [0,1,0,0,0,1|1,0,1]=4 10766 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215482 [0,1,0,0,0,1|1,0,1]=4 10767 B16R1.4621 C=CCCCCC(=O)Nc1ccccc1O 22a_100000185747_100011215552 [0,1,0,0,0,1|1,0,1]=4 10768 B16R1.4621 C=CCCCCC(=O)Nc1ccccc1O 527a_100000185747_100011215552 [0,1,0,0,0,1|1,0,1]=4 10769 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1O 240690a_100000700776_100000743006 [0,1,0,0,0,1|1,0,1]=4 10770 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1O 527a_100000700776_100000743006 [0,1,0,0,0,1|1,0,1]=4 10771 B16R1.4621 C=CCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000700776 [0,1,0,0,0,1|1,0,1]=4 10772 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1O 1458a_100000743006_100015370543 [0,1,0,0,0,1|1,0,1]=4 10773 B16R1.4621 CCC/C=C/CC(=O)Nc1ccccc1O 22a_100000185747_200016266809 [0,1,0,0,0,1|1,0,1]=4 10774 B16R1.4621 CCC/C=C/CC(=O)Nc1ccccc1O 527a_100000185747_200016266809 [0,1,0,0,0,1|1,0,1]=4 10775 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1Br 1458a_100016266645_100000184730 [0,1,0,0,0,1|2,0,0]=4 10776 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1C 1458a_100016266645_100000211839 [0,1,0,0,0,1|2,0,0]=4 10777 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1Cl 1458a_100016266645_100000187162 [0,1,0,0,0,1|2,0,0]=4 10778 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1F 1458a_100016266645_100000187165 [0,1,0,0,0,1|2,0,0]=4 10779 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1I 1458a_100016266645_100011216222 [0,1,0,0,0,1|2,0,0]=4 10780 B16R1.4621 CCCCC=CC(=O)Cc1ncccc1O 1458a_100016266645_200020655725 [0,1,0,0,0,1|2,0,0]=4 10781 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Br 11a_100000210017_100016266645 [0,1,0,0,0,1|2,0,0]=4 10782 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100016266645 [0,1,0,0,0,1|2,0,0]=4 10783 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1C 11a_100015192222_100016266645 [0,1,0,0,0,1|2,0,0]=4 10784 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1C 1626a_100015192222_100016266645 [0,1,0,0,0,1|2,0,0]=4 10785 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1C 22a_100015192222_100016266645 [0,1,0,0,0,1|2,0,0]=4 10786 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100016266645 [0,1,0,0,0,1|2,0,0]=4 10787 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100016266645 [0,1,0,0,0,1|2,0,0]=4 10788 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100016266645 [0,1,0,0,0,1|2,0,0]=4 10789 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1F 11a_100000210422_100016266645 [0,1,0,0,0,1|2,0,0]=4 10790 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1F 1626a_100000210422_100016266645 [0,1,0,0,0,1|2,0,0]=4 10791 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1F 22a_100000210422_100016266645 [0,1,0,0,0,1|2,0,0]=4 10792 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1I 11a_100000210053_100016266645 [0,1,0,0,0,1|2,0,0]=4 10793 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1I 1626a_100000210053_100016266645 [0,1,0,0,0,1|2,0,0]=4 10794 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1O 22a_100000185747_100016266645 [0,1,0,0,0,1|1,0,0]=3 10795 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210757 [0,1,0,0,0,1|2,0,0]=4 10796 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Br 1458a_100102632555_100000184730 [0,1,0,0,0,1|2,0,0]=4 10797 B16R1.4621 CCCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210757 [0,1,0,0,0,1|2,0,0]=4 10798 B16R1.4621 CCCCCCC(=O)Cc1ccccc1C 1458a_100102632555_100000211839 [0,1,0,0,0,1|2,0,0]=4 10799 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210757 [0,1,0,0,0,1|2,0,0]=4 10800 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Cl 1458a_100102632555_100000187162 [0,1,0,0,0,1|2,0,0]=4 10801 B16R1.4621 CCCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210757 [0,1,0,0,0,1|2,0,0]=4 10802 B16R1.4621 CCCCCCC(=O)Cc1ccccc1F 1458a_100102632555_100000187165 [0,1,0,0,0,1|2,0,0]=4 10803 B16R1.4621 CCCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210757 [0,1,0,0,0,1|2,0,0]=4 10804 B16R1.4621 CCCCCCC(=O)Cc1ccccc1I 1458a_100102632555_100011216222 [0,1,0,0,0,1|2,0,0]=4 10805 B16R1.4621 CCCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210757 [0,1,0,0,0,1|1,0,0]=3 10806 B16R1.4621 CCCCCCC(=O)Cc1ncccc1O 1458a_100102632555_200020655725 [0,1,0,0,0,1|2,0,0]=4 10807 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Br 11a_100000210017_100102632555 [0,1,0,0,0,1|2,0,0]=4 10808 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100102632555 [0,1,0,0,0,1|2,0,0]=4 10809 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 11a_100015192222_100102632555 [0,1,0,0,0,1|2,0,0]=4 10810 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 1626a_100015192222_100102632555 [0,1,0,0,0,1|2,0,0]=4 10811 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 22a_100015192222_100102632555 [0,1,0,0,0,1|2,0,0]=4 10812 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 527a_100015192222_100102632555 [0,1,0,0,0,1|2,0,0]=4 10813 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100102632555 [0,1,0,0,0,1|2,0,0]=4 10814 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100102632555 [0,1,0,0,0,1|2,0,0]=4 10815 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100102632555 [0,1,0,0,0,1|2,0,0]=4 10816 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100102632555 [0,1,0,0,0,1|2,0,0]=4 10817 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 11a_100000210422_100102632555 [0,1,0,0,0,1|2,0,0]=4 10818 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 1626a_100000210422_100102632555 [0,1,0,0,0,1|2,0,0]=4 10819 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 22a_100000210422_100102632555 [0,1,0,0,0,1|2,0,0]=4 10820 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 527a_100000210422_100102632555 [0,1,0,0,0,1|2,0,0]=4 10821 B16R1.4621 CCCCCCC(=O)Nc1ccccc1I 11a_100000210053_100102632555 [0,1,0,0,0,1|2,0,0]=4 10822 B16R1.4621 CCCCCCC(=O)Nc1ccccc1I 1626a_100000210053_100102632555 [0,1,0,0,0,1|2,0,0]=4 10823 B16R1.4621 CCCCCCC(=O)Nc1ccccc1O 22a_100000185747_100102632555 [0,1,0,0,0,1|1,0,0]=3 10824 B16R1.4621 CCCCCCC(=O)Nc1ccccc1O 527a_100000185747_100102632555 [0,1,0,0,0,1|1,0,0]=3 10825 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br 11a_100000209983_100000751119 [0,1,0,0,0,1|2,0,0]=4 10826 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br 240690a_100000209983_100000751119 [0,1,0,0,0,1|2,0,0]=4 10827 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br 527a_100000209983_100000751119 [0,1,0,0,0,1|2,0,0]=4 10828 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 11a_100000209983_100000212180 [0,1,0,0,0,1|2,0,0]=4 10829 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 1626a_100000209983_100000212180 [0,1,0,0,0,1|2,0,0]=4 10830 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 240690a_100000209983_100000212180 [0,1,0,0,0,1|2,0,0]=4 10831 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 527a_100000209983_100000212180 [0,1,0,0,0,1|2,0,0]=4 10832 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 11a_100000209983_100000183793 [0,1,0,0,0,1|2,0,0]=4 10833 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 1626a_100000209983_100000183793 [0,1,0,0,0,1|2,0,0]=4 10834 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 240690a_100000209983_100000183793 [0,1,0,0,0,1|2,0,0]=4 10835 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 527a_100000209983_100000183793 [0,1,0,0,0,1|2,0,0]=4 10836 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 11a_100000209983_100000212012 [0,1,0,0,0,1|2,0,0]=4 10837 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 1626a_100000209983_100000212012 [0,1,0,0,0,1|2,0,0]=4 10838 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 240690a_100000209983_100000212012 [0,1,0,0,0,1|2,0,0]=4 10839 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 527a_100000209983_100000212012 [0,1,0,0,0,1|2,0,0]=4 10840 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 11a_100000209983_100000036491 [0,1,0,0,0,1|2,0,0]=4 10841 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 1626a_100000209983_100000036491 [0,1,0,0,0,1|2,0,0]=4 10842 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 240690a_100000209983_100000036491 [0,1,0,0,0,1|2,0,0]=4 10843 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 527a_100000209983_100000036491 [0,1,0,0,0,1|2,0,0]=4 10844 B16R1.4621 CCCCCNC(=O)Cc1ccccc1O 240690a_100000209983_100000743006 [0,1,0,0,0,1|1,0,0]=3 10845 B16R1.4621 CCCCCNC(=O)Cc1ccccc1O 527a_100000209983_100000743006 [0,1,0,0,0,1|1,0,0]=3 10846 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000209983 [0,1,0,0,0,1|2,0,0]=4 10847 B16R1.4621 CCCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000209983 [0,1,0,0,0,1|2,0,0]=4 10848 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000209983 [0,1,0,0,0,1|2,0,0]=4 10849 B16R1.4621 CCCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000209983 [0,1,0,0,0,1|2,0,0]=4 10850 B16R1.4621 CCCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000209983 [0,1,0,0,0,1|2,0,0]=4 10851 B16R1.4621 CCCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000209983 [0,1,0,0,0,1|1,0,0]=3 10852 B16R1.4621 CCCCNCC(=O)Cc1ccccc1Br 2230a_100000102301_100000700504 [0,1,0,0,0,1|2,0,0]=4 10853 B16R1.4621 CCCCNCC(=O)Cc1ccccc1Br 7a_106832991798_100000700504 [0,1,0,0,0,1|2,0,0]=4 10854 B16R1.4621 CCCCNCC(=O)Cc1ccccc1C 2230a_100000102301_100011223134 [0,1,0,0,0,1|2,0,0]=4 10855 B16R1.4621 CCCCNCC(=O)Cc1ccccc1C 7a_106832991798_100011223134 [0,1,0,0,0,1|2,0,0]=4 10856 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Br 2230a_100000102301_100000182372 [0,1,0,0,0,1|2,0,0]=4 10857 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210211 [0,1,0,0,0,1|2,0,0]=4 10858 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Br 7a_106832991798_100000182372 [0,1,0,0,0,1|2,0,0]=4 10859 B16R1.4621 CCCCNCC(=O)Nc1ccccc1C 2230a_100000102301_100000183529 [0,1,0,0,0,1|2,0,0]=4 10860 B16R1.4621 CCCCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210211 [0,1,0,0,0,1|2,0,0]=4 10861 B16R1.4621 CCCCNCC(=O)Nc1ccccc1C 7a_106832991798_100000183529 [0,1,0,0,0,1|2,0,0]=4 10862 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Cl 2230a_100000102301_100000182448 [0,1,0,0,0,1|2,0,0]=4 10863 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Cl 7a_106832991798_100000182448 [0,1,0,0,0,1|2,0,0]=4 10864 B16R1.4621 CCCCNCC(=O)Nc1ccccc1F 2230a_100000102301_100000182988 [0,1,0,0,0,1|2,0,0]=4 10865 B16R1.4621 CCCCNCC(=O)Nc1ccccc1F 7a_106832991798_100000182988 [0,1,0,0,0,1|2,0,0]=4 10866 B16R1.4621 CCCCNCC(=O)Nc1ccccc1I 2230a_100000102301_100000180142 [0,1,0,0,0,1|2,0,0]=4 10867 B16R1.4621 CCCCNCC(=O)Nc1ccccc1I 7a_106832991798_100000180142 [0,1,0,0,0,1|2,0,0]=4 10868 B16R1.4621 CCCCNCC(=O)Nc1ccccc1O 7a_106832991798_100000014494 [0,1,0,0,0,1|1,0,0]=3 10869 B16R1.4621 CCCCNNC(=O)Cc1ccccc1Br 22a_100025702795_100000751119 [0,1,0,0,0,1|2,0,0]=4 10870 B16R1.4621 CCCCNNC(=O)Cc1ccccc1C 22a_100025702795_100000212180 [0,1,0,0,0,1|2,0,0]=4 10871 B16R1.4621 CCCCNNC(=O)Cc1ccccc1Cl 22a_100025702795_100000183793 [0,1,0,0,0,1|2,0,0]=4 10872 B16R1.4621 CCCCNNC(=O)Cc1ccccc1F 22a_100025702795_100000212012 [0,1,0,0,0,1|2,0,0]=4 10873 B16R1.4621 CCCCNNC(=O)Cc1ccccc1I 22a_100025702795_100000036491 [0,1,0,0,0,1|2,0,0]=4 10874 B16R1.4621 CCCCNNC(=O)Cc1ccccc1O 22a_100025702795_100000743006 [0,1,0,0,0,1|1,0,0]=3 10875 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 1458a_100000751119_100011995733 [0,1,0,0,0,1|1,0,0]=3 10876 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 1458a_100000757543_100000184730 [0,1,0,0,0,1|1,0,0]=3 10877 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 34a_100000210227_100000700504 [0,1,0,0,0,1|1,0,0]=3 10878 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 7a_100000210227_100000700504 [0,1,0,0,0,1|1,0,0]=3 10879 B16R1.4621 CCCCOCC(=O)Cc1ccccc1C 1458a_100000212180_100011995733 [0,1,0,0,0,1|1,0,0]=3 10880 B16R1.4621 CCCCOCC(=O)Cc1ccccc1C 1458a_100000757543_100000211839 [0,1,0,0,0,1|1,0,0]=3 10881 B16R1.4621 CCCCOCC(=O)Cc1ccccc1C 7a_100000210227_100011223134 [0,1,0,0,0,1|1,0,0]=3 10882 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011995733 [0,1,0,0,0,1|1,0,0]=3 10883 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Cl 1458a_100000757543_100000187162 [0,1,0,0,0,1|1,0,0]=3 10884 B16R1.4621 CCCCOCC(=O)Cc1ccccc1F 1458a_100000212012_100011995733 [0,1,0,0,0,1|1,0,0]=3 10885 B16R1.4621 CCCCOCC(=O)Cc1ccccc1F 1458a_100000757543_100000187165 [0,1,0,0,0,1|1,0,0]=3 10886 B16R1.4621 CCCCOCC(=O)Cc1ccccc1I 1458a_100000036491_100011995733 [0,1,0,0,0,1|1,0,0]=3 10887 B16R1.4621 CCCCOCC(=O)Cc1ccccc1I 1458a_100000757543_100011216222 [0,1,0,0,0,1|1,0,0]=3 10888 B16R1.4621 CCCCOCC(=O)Cc1ccccc1O 1458a_100000743006_100011995733 [0,1,0,0,0,1|0,0,0]=2 10889 B16R1.4621 CCCCOCC(=O)Cc1cccnc1Br 1458a_100000757543_100010140945 [0,1,0,0,0,1|2,0,0]=4 10890 B16R1.4621 CCCCOCC(=O)Cc1cccnc1C 1458a_100000757543_100000732876 [0,1,0,0,0,1|2,0,0]=4 10891 B16R1.4621 CCCCOCC(=O)Cc1cccnc1Cl 1458a_100000093521_100011995733 [0,1,0,0,0,1|2,0,0]=4 10892 B16R1.4621 CCCCOCC(=O)Cc1cccnc1Cl 1458a_100000757543_100000045678 [0,1,0,0,0,1|2,0,0]=4 10893 B16R1.4621 CCCCOCC(=O)Cc1cccnc1F 1458a_100000757543_100000099810 [0,1,0,0,0,1|2,0,0]=4 10894 B16R1.4621 CCCCOCC(=O)Cc1ccncc1C 1458a_100000757543_100020672808 [0,1,0,0,0,1|2,0,0]=4 10895 B16R1.4621 CCCCOCC(=O)Cc1ccncc1Cl 1458a_100000757543_100000763264 [0,1,0,0,0,1|2,0,0]=4 10896 B16R1.4621 CCCCOCC(=O)Cc1cnccc1C 1458a_100000757543_100000690890 [0,1,0,0,0,1|2,0,0]=4 10897 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Br 1458a_100000757543_100025702911 [0,1,0,0,0,1|2,0,0]=4 10898 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Br 1458a_200012357574_100011995733 [0,1,0,0,0,1|2,0,0]=4 10899 B16R1.4621 CCCCOCC(=O)Cc1ncccc1C 1458a_100000757543_100000696600 [0,1,0,0,0,1|2,0,0]=4 10900 B16R1.4621 CCCCOCC(=O)Cc1ncccc1C 1458a_200000722269_100011995733 [0,1,0,0,0,1|2,0,0]=4 10901 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Cl 1458a_100000757543_100000099807 [0,1,0,0,0,1|2,0,0]=4 10902 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Cl 1458a_100011998755_100011995733 [0,1,0,0,0,1|2,0,0]=4 10903 B16R1.4621 CCCCOCC(=O)Cc1ncccc1F 1458a_100000757543_100000104219 [0,1,0,0,0,1|2,0,0]=4 10904 B16R1.4621 CCCCOCC(=O)Cc1ncccc1O 1458a_100000757543_200020655725 [0,1,0,0,0,1|1,0,0]=3 10905 B16R1.4621 CCCCOCC(=O)Cn1ccccc1=O 1458a_100000189665_100011995733 [0,1,0,0,0,1|1,0,1]=4 10906 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000757543 [0,1,0,0,0,1|1,0,0]=3 10907 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000757543 [0,1,0,0,0,1|1,0,0]=3 10908 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Br 7a_100000210227_100000182372 [0,1,0,0,0,1|1,0,0]=3 10909 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000757543 [0,1,0,0,0,1|1,0,0]=3 10910 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000757543 [0,1,0,0,0,1|1,0,0]=3 10911 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000757543 [0,1,0,0,0,1|1,0,0]=3 10912 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 34a_100000210227_100000183529 [0,1,0,0,0,1|1,0,0]=3 10913 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000757543 [0,1,0,0,0,1|1,0,0]=3 10914 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 7a_100000210227_100000183529 [0,1,0,0,0,1|1,0,0]=3 10915 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000757543 [0,1,0,0,0,1|1,0,0]=3 10916 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000757543 [0,1,0,0,0,1|1,0,0]=3 10917 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000757543 [0,1,0,0,0,1|1,0,0]=3 10918 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 34a_100000210227_100000182448 [0,1,0,0,0,1|1,0,0]=3 10919 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000757543 [0,1,0,0,0,1|1,0,0]=3 10920 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 7a_100000210227_100000182448 [0,1,0,0,0,1|1,0,0]=3 10921 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000757543 [0,1,0,0,0,1|1,0,0]=3 10922 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000757543 [0,1,0,0,0,1|1,0,0]=3 10923 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000757543 [0,1,0,0,0,1|1,0,0]=3 10924 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 34a_100000210227_100000243840 [0,1,0,0,0,1|1,0,0]=3 10925 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000757543 [0,1,0,0,0,1|1,0,0]=3 10926 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 7a_100000210227_100000182988 [0,1,0,0,0,1|1,0,0]=3 10927 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000757543 [0,1,0,0,0,1|1,0,0]=3 10928 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000757543 [0,1,0,0,0,1|1,0,0]=3 10929 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 34a_100000210227_100000180142 [0,1,0,0,0,1|1,0,0]=3 10930 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 7a_100000210227_100000180142 [0,1,0,0,0,1|1,0,0]=3 10931 B16R1.4621 CCCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000757543 [0,1,0,0,0,1|0,0,0]=2 10932 B16R1.4621 CCCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000757543 [0,1,0,0,0,1|0,0,0]=2 10933 B16R1.4621 CCCCOCC(=O)Nc1ccccc1O 7a_100000210227_100000014494 [0,1,0,0,0,1|0,0,0]=2 10934 B16R1.4621 CCCCOCN(C)Cc1ccccc1O 2230a_100015189988_100011995733 [0,1,0,0,0,1|2,0,0]=4 10935 B16R1.4621 CCCCOCN(C)Cc1ccccc1O 269982a_100015189988_100011995733 [0,1,0,0,0,1|2,0,0]=4 10936 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Br 1458a_100000191162_100000184730 [0,1,0,0,0,1|1,1,0]=4 10937 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Br 62a_100000210211_100000700504 [0,1,0,0,0,1|1,1,0]=4 10938 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210210 [0,1,0,0,0,1|1,1,0]=4 10939 B16R1.4621 CCCCSCC(=O)Cc1ccccc1C 1458a_100000191162_100000211839 [0,1,0,0,0,1|1,1,0]=4 10940 B16R1.4621 CCCCSCC(=O)Cc1ccccc1C 62a_100000210211_100011223134 [0,1,0,0,0,1|1,1,0]=4 10941 B16R1.4621 CCCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210210 [0,1,0,0,0,1|1,1,0]=4 10942 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Cl 1458a_100000191162_100000187162 [0,1,0,0,0,1|1,1,0]=4 10943 B16R1.4621 CCCCSCC(=O)Cc1ccccc1F 1458a_100000191162_100000187165 [0,1,0,0,0,1|1,1,0]=4 10944 B16R1.4621 CCCCSCC(=O)Cc1ccccc1I 1458a_100000191162_100011216222 [0,1,0,0,0,1|1,1,0]=4 10945 B16R1.4621 CCCCSCC(=O)Cc1ncccc1O 1458a_100000191162_200020655725 [0,1,0,0,0,1|1,1,0]=4 10946 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000191162 [0,1,0,0,0,1|1,1,0]=4 10947 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000191162 [0,1,0,0,0,1|1,1,0]=4 10948 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210210 [0,1,0,0,0,1|1,1,0]=4 10949 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 62a_100000210211_100000182372 [0,1,0,0,0,1|1,1,0]=4 10950 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 11a_100015192222_100000191162 [0,1,0,0,0,1|1,1,0]=4 10951 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000191162 [0,1,0,0,0,1|1,1,0]=4 10952 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 22a_100015192222_100000191162 [0,1,0,0,0,1|1,1,0]=4 10953 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 527a_100015192222_100000191162 [0,1,0,0,0,1|1,1,0]=4 10954 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 62a_100000210211_100000183529 [0,1,0,0,0,1|1,1,0]=4 10955 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000191162 [0,1,0,0,0,1|1,1,0]=4 10956 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000191162 [0,1,0,0,0,1|1,1,0]=4 10957 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000191162 [0,1,0,0,0,1|1,1,0]=4 10958 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000191162 [0,1,0,0,0,1|1,1,0]=4 10959 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 62a_100000210211_100000182448 [0,1,0,0,0,1|1,1,0]=4 10960 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210210 [0,1,0,0,0,1|1,1,0]=4 10961 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 11a_100000210422_100000191162 [0,1,0,0,0,1|1,1,0]=4 10962 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000191162 [0,1,0,0,0,1|1,1,0]=4 10963 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 22a_100000210422_100000191162 [0,1,0,0,0,1|1,1,0]=4 10964 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 527a_100000210422_100000191162 [0,1,0,0,0,1|1,1,0]=4 10965 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210210 [0,1,0,0,0,1|1,1,0]=4 10966 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 62a_100000210211_100000182988 [0,1,0,0,0,1|1,1,0]=4 10967 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 11a_100000210053_100000191162 [0,1,0,0,0,1|1,1,0]=4 10968 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000191162 [0,1,0,0,0,1|1,1,0]=4 10969 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210210 [0,1,0,0,0,1|1,1,0]=4 10970 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 62a_100000210211_100000180142 [0,1,0,0,0,1|1,1,0]=4 10971 B16R1.4621 CCCCSCC(=O)Nc1ccccc1O 22a_100000185747_100000191162 [0,1,0,0,0,1|0,1,0]=3 10972 B16R1.4621 CCCCSCC(=O)Nc1ccccc1O 527a_100000185747_100000191162 [0,1,0,0,0,1|0,1,0]=3 10973 B16R1.4621 CCCCSCC(=O)Nc1ccccc1O 62a_100000210211_100000014494 [0,1,0,0,0,1|0,1,0]=3 10974 B16R1.4621 CCCNCCC(=O)Nc1ccccc1C 2230a_200015185780_100000210303 [0,1,0,0,0,1|2,0,0]=4 10975 B16R1.4621 CCCNCCC(=O)Nc1ccccc1C 34a_200015185780_100000210303 [0,1,0,0,0,1|2,0,0]=4 10976 B16R1.4621 CCCNCCC(=O)Nc1ccccc1F 2230a_100015185137_100000210303 [0,1,0,0,0,1|2,0,0]=4 10977 B16R1.4621 CCCNCCC(=O)Nc1ccccc1F 34a_100015185137_100000210303 [0,1,0,0,0,1|2,0,0]=4 10978 B16R1.4621 CCCOCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215938 [0,1,0,0,0,1|2,0,0]=4 10979 B16R1.4621 CCCOCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215938 [0,1,0,0,0,1|2,0,0]=4 10980 B16R1.4621 CCCOCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215938 [0,1,0,0,0,1|2,0,0]=4 10981 B16R1.4621 CCCOCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215938 [0,1,0,0,0,1|2,0,0]=4 10982 B16R1.4621 CCCOCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215938 [0,1,0,0,0,1|2,0,0]=4 10983 B16R1.4621 CCCOCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215938 [0,1,0,0,0,1|1,0,0]=3 10984 B16R1.4621 CCCSCCC(=O)Nc1ccccc1Br 62a_100000181489_100000210303 [0,1,0,0,0,1|2,0,0]=4 10985 B16R1.4621 CCCSCCC(=O)Nc1ccccc1Br 62a_100000210303_100000181489 [0,1,0,0,0,1|2,0,0]=4 10986 B16R1.4621 CCCSCCC(=O)Nc1ccccc1C 62a_100000210303_200011206476 [0,1,0,0,0,1|2,0,0]=4 10987 B16R1.4621 CCCSCCC(=O)Nc1ccccc1Cl 62a_100000210303_100000242055 [0,1,0,0,0,1|2,0,0]=4 10988 B16R1.4621 CCCSCCC(=O)Nc1ccccc1F 62a_100000210303_100000242066 [0,1,0,0,0,1|2,0,0]=4 10989 B16R1.4621 CCCSCCC(=O)Nc1ccccc1F 62a_100011216740_100000210303 [0,1,0,0,0,1|2,0,0]=4 10990 B16R1.4621 CCOCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100012232248 [0,1,0,0,0,1|2,0,0]=4 10991 B16R1.4621 CCOCCCC(=O)Cc1ccccc1C 1458a_100000212180_100012232248 [0,1,0,0,0,1|2,0,0]=4 10992 B16R1.4621 CCOCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100012232248 [0,1,0,0,0,1|2,0,0]=4 10993 B16R1.4621 CCOCCCC(=O)Cc1ccccc1F 1458a_100000212012_100012232248 [0,1,0,0,0,1|2,0,0]=4 10994 B16R1.4621 CCOCCCC(=O)Cc1ccccc1I 1458a_100000036491_100012232248 [0,1,0,0,0,1|2,0,0]=4 10995 B16R1.4621 CCOCCCC(=O)Cc1ccccc1O 1458a_100000743006_100012232248 [0,1,0,0,0,1|1,0,0]=3 10996 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Br 11a_100011200944_100000751119 [0,1,0,0,0,1|2,0,0]=4 10997 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Br 240690a_100011200944_100000751119 [0,1,0,0,0,1|2,0,0]=4 10998 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Br 527a_100011200944_100000751119 [0,1,0,0,0,1|2,0,0]=4 10999 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 11a_100011200944_100000212180 [0,1,0,0,0,1|2,0,0]=4 11000 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 1626a_102516460346_100000212180 [0,1,0,0,0,1|2,0,0]=4 11001 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 240690a_100011200944_100000212180 [0,1,0,0,0,1|2,0,0]=4 11002 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 527a_100011200944_100000212180 [0,1,0,0,0,1|2,0,0]=4 11003 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 11a_100011200944_100000183793 [0,1,0,0,0,1|2,0,0]=4 11004 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 1626a_102516460346_100000183793 [0,1,0,0,0,1|2,0,0]=4 11005 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 240690a_100011200944_100000183793 [0,1,0,0,0,1|2,0,0]=4 11006 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 527a_100011200944_100000183793 [0,1,0,0,0,1|2,0,0]=4 11007 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 11a_100011200944_100000212012 [0,1,0,0,0,1|2,0,0]=4 11008 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 1626a_102516460346_100000212012 [0,1,0,0,0,1|2,0,0]=4 11009 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 240690a_100011200944_100000212012 [0,1,0,0,0,1|2,0,0]=4 11010 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 527a_100011200944_100000212012 [0,1,0,0,0,1|2,0,0]=4 11011 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 11a_100011200944_100000036491 [0,1,0,0,0,1|2,0,0]=4 11012 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 1626a_102516460346_100000036491 [0,1,0,0,0,1|2,0,0]=4 11013 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 240690a_100011200944_100000036491 [0,1,0,0,0,1|2,0,0]=4 11014 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 527a_100011200944_100000036491 [0,1,0,0,0,1|2,0,0]=4 11015 B16R1.4621 CCOCCNC(=O)Cc1ccccc1O 240690a_100011200944_100000743006 [0,1,0,0,0,1|1,0,0]=3 11016 B16R1.4621 CCOCCNC(=O)Cc1ccccc1O 527a_100011200944_100000743006 [0,1,0,0,0,1|1,0,0]=3 11017 B16R1.4621 CCOCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100011200944 [0,1,0,0,0,1|2,0,0]=4 11018 B16R1.4621 CCOCCNC(=O)Nc1ccccc1C 2430a_100015192222_100011200944 [0,1,0,0,0,1|2,0,0]=4 11019 B16R1.4621 CCOCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100011200944 [0,1,0,0,0,1|2,0,0]=4 11020 B16R1.4621 CCOCCNC(=O)Nc1ccccc1F 2430a_100000210422_100011200944 [0,1,0,0,0,1|2,0,0]=4 11021 B16R1.4621 CCOCCNC(=O)Nc1ccccc1I 2430a_100000210053_100011200944 [0,1,0,0,0,1|2,0,0]=4 11022 B16R1.4621 CCOCCNC(=O)Nc1ccccc1O 2430a_100000185747_100011200944 [0,1,0,0,0,1|1,0,0]=3 11023 B16R1.4621 CCOCCOC(=O)Nc1ccccc1Br 34a_100121572206_100020589338 [0,1,0,0,0,1|1,0,0]=3 11024 B16R1.4621 CCOCCOC(=O)Nc1ccccc1Cl 34a_100121572206_200000178450 [0,1,0,0,0,1|1,0,0]=3 11025 B16R1.4621 CCOCSCC(=O)Nc1ccccc1O 62a_100000739092_100000014494 [0,1,0,0,0,1|1,1,0]=4 11026 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br 11a_100000106463_100000751119 [0,1,0,0,0,1|2,0,0]=4 11027 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br 240690a_100000106463_100000751119 [0,1,0,0,0,1|2,0,0]=4 11028 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br 527a_100000106463_100000751119 [0,1,0,0,0,1|2,0,0]=4 11029 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 11a_100000106463_100000212180 [0,1,0,0,0,1|2,0,0]=4 11030 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 1626a_100000106463_100000212180 [0,1,0,0,0,1|2,0,0]=4 11031 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 240690a_100000106463_100000212180 [0,1,0,0,0,1|2,0,0]=4 11032 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 527a_100000106463_100000212180 [0,1,0,0,0,1|2,0,0]=4 11033 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 11a_100000106463_100000183793 [0,1,0,0,0,1|2,0,0]=4 11034 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 1626a_100000106463_100000183793 [0,1,0,0,0,1|2,0,0]=4 11035 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 240690a_100000106463_100000183793 [0,1,0,0,0,1|2,0,0]=4 11036 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 527a_100000106463_100000183793 [0,1,0,0,0,1|2,0,0]=4 11037 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 11a_100000106463_100000212012 [0,1,0,0,0,1|2,0,0]=4 11038 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 1626a_100000106463_100000212012 [0,1,0,0,0,1|2,0,0]=4 11039 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 240690a_100000106463_100000212012 [0,1,0,0,0,1|2,0,0]=4 11040 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 527a_100000106463_100000212012 [0,1,0,0,0,1|2,0,0]=4 11041 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 11a_100000106463_100000036491 [0,1,0,0,0,1|2,0,0]=4 11042 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 1626a_100000106463_100000036491 [0,1,0,0,0,1|2,0,0]=4 11043 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 240690a_100000106463_100000036491 [0,1,0,0,0,1|2,0,0]=4 11044 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 527a_100000106463_100000036491 [0,1,0,0,0,1|2,0,0]=4 11045 B16R1.4621 CCSCCNC(=O)Cc1ccccc1O 240690a_100000106463_100000743006 [0,1,0,0,0,1|1,0,0]=3 11046 B16R1.4621 CCSCCNC(=O)Cc1ccccc1O 527a_100000106463_100000743006 [0,1,0,0,0,1|1,0,0]=3 11047 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000106463 [0,1,0,0,0,1|2,0,0]=4 11048 B16R1.4621 CCSCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000106463 [0,1,0,0,0,1|2,0,0]=4 11049 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000106463 [0,1,0,0,0,1|2,0,0]=4 11050 B16R1.4621 CCSCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000106463 [0,1,0,0,0,1|2,0,0]=4 11051 B16R1.4621 CCSCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000106463 [0,1,0,0,0,1|2,0,0]=4 11052 B16R1.4621 CCSCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000106463 [0,1,0,0,0,1|1,0,0]=3 11053 B16R1.4621 CCSCCOC(=O)Nc1ccccc1Br 62a_100000210202_100020589338 [0,1,0,0,0,1|1,0,0]=3 11054 B16R1.4621 CCSCCOC(=O)Nc1ccccc1Br 62a_100020589338_100000210202 [0,1,0,0,0,1|1,0,0]=3 11055 B16R1.4621 CCSCCOC(=O)Nc1ccccc1Cl 62a_100000210202_200000178450 [0,1,0,0,0,1|1,0,0]=3 11056 B16R1.4621 COCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000755781 [0,1,0,0,0,1|2,0,0]=4 11057 B16R1.4621 COCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000755781 [0,1,0,0,0,1|2,0,0]=4 11058 B16R1.4621 COCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000755781 [0,1,0,0,0,1|2,0,0]=4 11059 B16R1.4621 COCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000755781 [0,1,0,0,0,1|2,0,0]=4 11060 B16R1.4621 COCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000755781 [0,1,0,0,0,1|2,0,0]=4 11061 B16R1.4621 COCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000755781 [0,1,0,0,0,1|1,0,0]=3 11062 B16R1.4621 COCCCNC(=O)Cc1ccccc1Br 240690a_100150723488_100000751119 [0,1,0,0,0,1|2,0,0]=4 11063 B16R1.4621 COCCCNC(=O)Cc1ccccc1Br 527a_100150723488_100000751119 [0,1,0,0,0,1|2,0,0]=4 11064 B16R1.4621 COCCCNC(=O)Cc1ccccc1C 1626a_100150723488_100000212180 [0,1,0,0,0,1|2,0,0]=4 11065 B16R1.4621 COCCCNC(=O)Cc1ccccc1C 240690a_100150723488_100000212180 [0,1,0,0,0,1|2,0,0]=4 11066 B16R1.4621 COCCCNC(=O)Cc1ccccc1C 527a_100150723488_100000212180 [0,1,0,0,0,1|2,0,0]=4 11067 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl 1626a_100150723488_100000183793 [0,1,0,0,0,1|2,0,0]=4 11068 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl 240690a_100150723488_100000183793 [0,1,0,0,0,1|2,0,0]=4 11069 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl 527a_100150723488_100000183793 [0,1,0,0,0,1|2,0,0]=4 11070 B16R1.4621 COCCCNC(=O)Cc1ccccc1F 1626a_100150723488_100000212012 [0,1,0,0,0,1|2,0,0]=4 11071 B16R1.4621 COCCCNC(=O)Cc1ccccc1F 240690a_100150723488_100000212012 [0,1,0,0,0,1|2,0,0]=4 11072 B16R1.4621 COCCCNC(=O)Cc1ccccc1F 527a_100150723488_100000212012 [0,1,0,0,0,1|2,0,0]=4 11073 B16R1.4621 COCCCNC(=O)Cc1ccccc1I 1626a_100150723488_100000036491 [0,1,0,0,0,1|2,0,0]=4 11074 B16R1.4621 COCCCNC(=O)Cc1ccccc1I 240690a_100150723488_100000036491 [0,1,0,0,0,1|2,0,0]=4 11075 B16R1.4621 COCCCNC(=O)Cc1ccccc1I 527a_100150723488_100000036491 [0,1,0,0,0,1|2,0,0]=4 11076 B16R1.4621 COCCCNC(=O)Cc1ccccc1O 240690a_100150723488_100000743006 [0,1,0,0,0,1|1,0,0]=3 11077 B16R1.4621 COCCCNC(=O)Cc1ccccc1O 527a_100150723488_100000743006 [0,1,0,0,0,1|1,0,0]=3 11078 B16R1.4621 COCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100150723488 [0,1,0,0,0,1|2,0,0]=4 11079 B16R1.4621 COCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100150723488 [0,1,0,0,0,1|2,0,0]=4 11080 B16R1.4621 COCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100150723488 [0,1,0,0,0,1|2,0,0]=4 11081 B16R1.4621 COCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100150723488 [0,1,0,0,0,1|2,0,0]=4 11082 B16R1.4621 COCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100150723488 [0,1,0,0,0,1|2,0,0]=4 11083 B16R1.4621 COCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100150723488 [0,1,0,0,0,1|1,0,0]=3 11084 B16R1.4621 COCCNNC(=O)Cc1ccccc1O 22a_100000741390_100000743006 [0,1,0,0,0,1|2,0,0]=4 11085 B16R1.4621 COCCOCC(=O)Cc1ccccc1Br 1458a_100000211095_100000184730 [0,1,0,0,0,1|2,0,0]=4 11086 B16R1.4621 COCCOCC(=O)Cc1ccccc1Br 34a_100000210237_100000700504 [0,1,0,0,0,1|2,0,0]=4 11087 B16R1.4621 COCCOCC(=O)Cc1ccccc1C 1458a_100000211095_100000211839 [0,1,0,0,0,1|2,0,0]=4 11088 B16R1.4621 COCCOCC(=O)Cc1ccccc1Cl 1458a_100000211095_100000187162 [0,1,0,0,0,1|2,0,0]=4 11089 B16R1.4621 COCCOCC(=O)Cc1ccccc1F 1458a_100000211095_100000187165 [0,1,0,0,0,1|2,0,0]=4 11090 B16R1.4621 COCCOCC(=O)Cc1ccccc1I 1458a_100000211095_100011216222 [0,1,0,0,0,1|2,0,0]=4 11091 B16R1.4621 COCCOCC(=O)Cc1ncccc1O 1458a_100000211095_200020655725 [0,1,0,0,0,1|2,0,0]=4 11092 B16R1.4621 COCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000211095 [0,1,0,0,0,1|2,0,0]=4 11093 B16R1.4621 COCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000211095 [0,1,0,0,0,1|2,0,0]=4 11094 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000211095 [0,1,0,0,0,1|2,0,0]=4 11095 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000211095 [0,1,0,0,0,1|2,0,0]=4 11096 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000211095 [0,1,0,0,0,1|2,0,0]=4 11097 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 34a_100000210237_100000183529 [0,1,0,0,0,1|2,0,0]=4 11098 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000211095 [0,1,0,0,0,1|2,0,0]=4 11099 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211095 [0,1,0,0,0,1|2,0,0]=4 11100 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211095 [0,1,0,0,0,1|2,0,0]=4 11101 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211095 [0,1,0,0,0,1|2,0,0]=4 11102 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 34a_100000210237_100000182448 [0,1,0,0,0,1|2,0,0]=4 11103 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211095 [0,1,0,0,0,1|2,0,0]=4 11104 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000211095 [0,1,0,0,0,1|2,0,0]=4 11105 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000211095 [0,1,0,0,0,1|2,0,0]=4 11106 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000211095 [0,1,0,0,0,1|2,0,0]=4 11107 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 34a_100000210237_100000243840 [0,1,0,0,0,1|2,0,0]=4 11108 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000211095 [0,1,0,0,0,1|2,0,0]=4 11109 B16R1.4621 COCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000211095 [0,1,0,0,0,1|2,0,0]=4 11110 B16R1.4621 COCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000211095 [0,1,0,0,0,1|2,0,0]=4 11111 B16R1.4621 COCCOCC(=O)Nc1ccccc1I 34a_100000210237_100000180142 [0,1,0,0,0,1|2,0,0]=4 11112 B16R1.4621 COCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000211095 [0,1,0,0,0,1|1,0,0]=3 11113 B16R1.4621 COCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000211095 [0,1,0,0,0,1|1,0,0]=3 11114 B16R1.4621 COCCSCC(=O)Nc1ccccc1O 62a_100000233755_100000014494 [0,1,0,0,0,1|1,1,0]=4 11115 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br 11a_100000749238_100000751119 [0,1,0,0,0,1|2,0,0]=4 11116 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br 240690a_100000749238_100000751119 [0,1,0,0,0,1|2,0,0]=4 11117 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br 527a_100000749238_100000751119 [0,1,0,0,0,1|2,0,0]=4 11118 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 11a_100000749238_100000212180 [0,1,0,0,0,1|2,0,0]=4 11119 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 1626a_100000749238_100000212180 [0,1,0,0,0,1|2,0,0]=4 11120 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 240690a_100000749238_100000212180 [0,1,0,0,0,1|2,0,0]=4 11121 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 527a_100000749238_100000212180 [0,1,0,0,0,1|2,0,0]=4 11122 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 11a_100000749238_100000183793 [0,1,0,0,0,1|2,0,0]=4 11123 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 1626a_100000749238_100000183793 [0,1,0,0,0,1|2,0,0]=4 11124 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 240690a_100000749238_100000183793 [0,1,0,0,0,1|2,0,0]=4 11125 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 527a_100000749238_100000183793 [0,1,0,0,0,1|2,0,0]=4 11126 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 11a_100000749238_100000212012 [0,1,0,0,0,1|2,0,0]=4 11127 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 1626a_100000749238_100000212012 [0,1,0,0,0,1|2,0,0]=4 11128 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 240690a_100000749238_100000212012 [0,1,0,0,0,1|2,0,0]=4 11129 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 527a_100000749238_100000212012 [0,1,0,0,0,1|2,0,0]=4 11130 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 11a_100000749238_100000036491 [0,1,0,0,0,1|2,0,0]=4 11131 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 1626a_100000749238_100000036491 [0,1,0,0,0,1|2,0,0]=4 11132 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 240690a_100000749238_100000036491 [0,1,0,0,0,1|2,0,0]=4 11133 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 527a_100000749238_100000036491 [0,1,0,0,0,1|2,0,0]=4 11134 B16R1.4621 CSCCCNC(=O)Cc1ccccc1O 240690a_100000749238_100000743006 [0,1,0,0,0,1|1,0,0]=3 11135 B16R1.4621 CSCCCNC(=O)Cc1ccccc1O 527a_100000749238_100000743006 [0,1,0,0,0,1|1,0,0]=3 11136 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000749238 [0,1,0,0,0,1|2,0,0]=4 11137 B16R1.4621 CSCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000749238 [0,1,0,0,0,1|2,0,0]=4 11138 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000749238 [0,1,0,0,0,1|2,0,0]=4 11139 B16R1.4621 CSCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000749238 [0,1,0,0,0,1|2,0,0]=4 11140 B16R1.4621 CSCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000749238 [0,1,0,0,0,1|2,0,0]=4 11141 B16R1.4621 CSCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000749238 [0,1,0,0,0,1|1,0,0]=3 11142 B16R1.4621 CSCCOCC(=O)Cc1ccccc1Br 34a_100000230434_100000700504 [0,1,0,0,0,1|2,0,0]=4 11143 B16R1.4621 CSCCOCC(=O)Cc1ccccc1Br 7a_100000230434_100000700504 [0,1,0,0,0,1|2,0,0]=4 11144 B16R1.4621 CSCCOCC(=O)Cc1ccccc1C 7a_100000230434_100011223134 [0,1,0,0,0,1|2,0,0]=4 11145 B16R1.4621 CSCCOCC(=O)Nc1ccccc1Br 7a_100000230434_100000182372 [0,1,0,0,0,1|2,0,0]=4 11146 B16R1.4621 CSCCOCC(=O)Nc1ccccc1C 34a_100000230434_100000183529 [0,1,0,0,0,1|2,0,0]=4 11147 B16R1.4621 CSCCOCC(=O)Nc1ccccc1C 7a_100000230434_100000183529 [0,1,0,0,0,1|2,0,0]=4 11148 B16R1.4621 CSCCOCC(=O)Nc1ccccc1Cl 34a_100000230434_100000182448 [0,1,0,0,0,1|2,0,0]=4 11149 B16R1.4621 CSCCOCC(=O)Nc1ccccc1Cl 7a_100000230434_100000182448 [0,1,0,0,0,1|2,0,0]=4 11150 B16R1.4621 CSCCOCC(=O)Nc1ccccc1F 34a_100000230434_100000243840 [0,1,0,0,0,1|2,0,0]=4 11151 B16R1.4621 CSCCOCC(=O)Nc1ccccc1F 7a_100000230434_100000182988 [0,1,0,0,0,1|2,0,0]=4 11152 B16R1.4621 CSCCOCC(=O)Nc1ccccc1I 34a_100000230434_100000180142 [0,1,0,0,0,1|2,0,0]=4 11153 B16R1.4621 CSCCOCC(=O)Nc1ccccc1I 7a_100000230434_100000180142 [0,1,0,0,0,1|2,0,0]=4 11154 B16R1.4621 CSCCOCC(=O)Nc1ccccc1O 7a_100000230434_100000014494 [0,1,0,0,0,1|1,0,0]=3 11155 B16R1.4621 CSCCSCC(=O)Nc1ccccc1O 62a_100000212216_100000014494 [0,1,0,0,0,1|1,1,0]=4 11156 B16R1.4621 Cc1ccccc1CC(=O)CCCCCF 1458a_100000212180_100000729378 [0,1,0,0,0,1|2,0,0]=4 11157 B16R1.4621 Cc1ccccc1CC(=O)CCCCCO 1458a_100000212180_100000746330 [0,1,0,0,0,1|2,0,0]=4 11158 B16R1.4621 Cc1ccccc1CC(=O)CCCCCO 1458a_100102619762_100000211839 [0,1,0,0,0,1|2,0,0]=4 11159 B16R1.4621 Cc1ccccc1CC(=O)NCCCCO 240690a_100000750430_100000212180 [0,1,0,0,0,1|2,0,0]=4 11160 B16R1.4621 Cc1ccccc1CC(=O)NCCCCO 527a_100000750430_100000212180 [0,1,0,0,0,1|2,0,0]=4 11161 B16R1.4621 Cc1ccccc1NC(=O)CCCCCO 22a_100015192222_100102619762 [0,1,0,0,0,1|2,0,0]=4 11162 B16R1.4621 Cc1ccccc1NC(=O)COCCCBr 34a_100011217188_100000183529 [0,1,0,0,0,1|2,0,0]=4 11163 B16R1.4621 Cc1ccccc1NC(=O)COCCCCl 34a_100000230001_100000183529 [0,1,0,0,0,1|2,0,0]=4 11164 B16R1.4621 Cc1ccccc1NC(=O)COCCCF 34a_100000759539_100000183529 [0,1,0,0,0,1|2,0,0]=4 11165 B16R1.4621 Cc1ccccc1NC(=O)COCCCN 34a_100000182051_100000183529 [0,1,0,0,0,1|2,0,0]=4 11166 B16R1.4621 Cc1ccccc1NC(=O)NCCCCO 2430a_100015192222_100000750430 [0,1,0,0,0,1|2,0,0]=4 11167 B16R1.4621 N#CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000211819 [0,1,0,0,0,1|1,0,1]=4 11168 B16R1.4621 NCCCOCC(=O)Cc1ccccc1Br 34a_100000182051_100000700504 [0,1,0,0,0,1|2,0,0]=4 11169 B16R1.4621 NCCCOCC(=O)Nc1ccccc1Cl 34a_100000182051_100000182448 [0,1,0,0,0,1|2,0,0]=4 11170 B16R1.4621 NCCCOCC(=O)Nc1ccccc1F 34a_100000182051_100000243840 [0,1,0,0,0,1|2,0,0]=4 11171 B16R1.4621 NCCCOCC(=O)Nc1ccccc1I 34a_100000182051_100000180142 [0,1,0,0,0,1|2,0,0]=4 11172 B16R1.4621 O=C(CCCCCF)Cc1ccccc1Br 1458a_100000751119_100000729378 [0,1,0,0,0,1|2,0,0]=4 11173 B16R1.4621 O=C(CCCCCF)Cc1ccccc1Cl 1458a_100000183793_100000729378 [0,1,0,0,0,1|2,0,0]=4 11174 B16R1.4621 O=C(CCCCCF)Cc1ccccc1F 1458a_100000212012_100000729378 [0,1,0,0,0,1|2,0,0]=4 11175 B16R1.4621 O=C(CCCCCF)Cc1ccccc1I 1458a_100000036491_100000729378 [0,1,0,0,0,1|2,0,0]=4 11176 B16R1.4621 O=C(CCCCCF)Cc1ccccc1O 1458a_100000743006_100000729378 [0,1,0,0,0,1|1,0,0]=3 11177 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Br 1458a_100000751119_100000746330 [0,1,0,0,0,1|2,0,0]=4 11178 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Br 1458a_100102619762_100000184730 [0,1,0,0,0,1|2,0,0]=4 11179 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Cl 1458a_100000183793_100000746330 [0,1,0,0,0,1|2,0,0]=4 11180 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Cl 1458a_100102619762_100000187162 [0,1,0,0,0,1|2,0,0]=4 11181 B16R1.4621 O=C(CCCCCO)Cc1ccccc1F 1458a_100000212012_100000746330 [0,1,0,0,0,1|2,0,0]=4 11182 B16R1.4621 O=C(CCCCCO)Cc1ccccc1F 1458a_100102619762_100000187165 [0,1,0,0,0,1|2,0,0]=4 11183 B16R1.4621 O=C(CCCCCO)Cc1ccccc1I 1458a_100000036491_100000746330 [0,1,0,0,0,1|2,0,0]=4 11184 B16R1.4621 O=C(CCCCCO)Cc1ccccc1I 1458a_100102619762_100011216222 [0,1,0,0,0,1|2,0,0]=4 11185 B16R1.4621 O=C(CCCCCO)Cc1ccccc1O 1458a_100000743006_100000746330 [0,1,0,0,0,1|1,0,0]=3 11186 B16R1.4621 O=C(CCCCCO)Cc1ncccc1O 1458a_100102619762_200020655725 [0,1,0,0,0,1|2,0,0]=4 11187 B16R1.4621 O=C(CCCCCO)Nc1ccccc1Cl 22a_100000185783_100102619762 [0,1,0,0,0,1|2,0,0]=4 11188 B16R1.4621 O=C(CCCCCO)Nc1ccccc1F 22a_100000210422_100102619762 [0,1,0,0,0,1|2,0,0]=4 11189 B16R1.4621 O=C(CCCCCO)Nc1ccccc1O 22a_100000185747_100102619762 [0,1,0,0,0,1|1,0,0]=3 11190 B16R1.4621 O=C(CCOCCO)Cc1ccccc1O 1458a_100000743006_100011215305 [0,1,0,0,0,1|2,0,0]=4 11191 B16R1.4621 O=C(CCOCCO)Nc1ccccc1O 22a_100000185747_100011229844 [0,1,0,0,0,1|2,0,0]=4 11192 B16R1.4621 O=C(COCCCBr)Cc1ccccc1Br 34a_100011217188_100000700504 [0,1,0,0,0,1|2,0,0]=4 11193 B16R1.4621 O=C(COCCCBr)Nc1ccccc1Cl 34a_100011217188_100000182448 [0,1,0,0,0,1|2,0,0]=4 11194 B16R1.4621 O=C(COCCCBr)Nc1ccccc1F 34a_100011217188_100000243840 [0,1,0,0,0,1|2,0,0]=4 11195 B16R1.4621 O=C(COCCCBr)Nc1ccccc1I 34a_100011217188_100000180142 [0,1,0,0,0,1|2,0,0]=4 11196 B16R1.4621 O=C(COCCCCl)Cc1ccccc1Br 34a_100000230001_100000700504 [0,1,0,0,0,1|2,0,0]=4 11197 B16R1.4621 O=C(COCCCCl)Nc1ccccc1Cl 34a_100000230001_100000182448 [0,1,0,0,0,1|2,0,0]=4 11198 B16R1.4621 O=C(COCCCCl)Nc1ccccc1F 34a_100000230001_100000243840 [0,1,0,0,0,1|2,0,0]=4 11199 B16R1.4621 O=C(COCCCCl)Nc1ccccc1I 34a_100000230001_100000180142 [0,1,0,0,0,1|2,0,0]=4 11200 B16R1.4621 O=C(COCCCF)Cc1ccccc1Br 34a_100000759539_100000700504 [0,1,0,0,0,1|2,0,0]=4 11201 B16R1.4621 O=C(COCCCF)Nc1ccccc1Cl 34a_100000759539_100000182448 [0,1,0,0,0,1|2,0,0]=4 11202 B16R1.4621 O=C(COCCCF)Nc1ccccc1F 34a_100000759539_100000243840 [0,1,0,0,0,1|2,0,0]=4 11203 B16R1.4621 O=C(COCCCF)Nc1ccccc1I 34a_100000759539_100000180142 [0,1,0,0,0,1|2,0,0]=4 11204 B16R1.4621 O=C(CSCCCF)Nc1ccccc1O 62a_100011934791_100000014494 [0,1,0,0,0,1|1,1,0]=4 11205 B16R1.4621 O=C(CSCCCO)Nc1ccccc1O 62a_100011215043_100000014494 [0,1,0,0,0,1|1,1,0]=4 11206 B16R1.4621 O=C(Cc1ccccc1Br)NCCCCO 240690a_100000750430_100000751119 [0,1,0,0,0,1|2,0,0]=4 11207 B16R1.4621 O=C(Cc1ccccc1Br)NCCCCO 527a_100000750430_100000751119 [0,1,0,0,0,1|2,0,0]=4 11208 B16R1.4621 O=C(Cc1ccccc1Cl)NCCCCO 240690a_100000750430_100000183793 [0,1,0,0,0,1|2,0,0]=4 11209 B16R1.4621 O=C(Cc1ccccc1Cl)NCCCCO 527a_100000750430_100000183793 [0,1,0,0,0,1|2,0,0]=4 11210 B16R1.4621 O=C(Cc1ccccc1F)NCCCCO 240690a_100000750430_100000212012 [0,1,0,0,0,1|2,0,0]=4 11211 B16R1.4621 O=C(Cc1ccccc1F)NCCCCO 527a_100000750430_100000212012 [0,1,0,0,0,1|2,0,0]=4 11212 B16R1.4621 O=C(Cc1ccccc1I)NCCCCO 240690a_100000750430_100000036491 [0,1,0,0,0,1|2,0,0]=4 11213 B16R1.4621 O=C(Cc1ccccc1I)NCCCCO 527a_100000750430_100000036491 [0,1,0,0,0,1|2,0,0]=4 11214 B16R1.4621 O=C(Cc1ccccc1O)NCCCCO 240690a_100000750430_100000743006 [0,1,0,0,0,1|1,0,0]=3 11215 B16R1.4621 O=C(Cc1ccccc1O)NCCCCO 527a_100000750430_100000743006 [0,1,0,0,0,1|1,0,0]=3 11216 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Br 2430a_100000210017_100000750430 [0,1,0,0,0,1|2,0,0]=4 11217 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Cl 2430a_100000185783_100000750430 [0,1,0,0,0,1|2,0,0]=4 11218 B16R1.4621 O=C(NCCCCO)Nc1ccccc1F 2430a_100000210422_100000750430 [0,1,0,0,0,1|2,0,0]=4 11219 B16R1.4621 O=C(NCCCCO)Nc1ccccc1I 2430a_100000210053_100000750430 [0,1,0,0,0,1|2,0,0]=4 11220 B16R1.4621 O=C(NCCCCO)Nc1ccccc1O 2430a_100000185747_100000750430 [0,1,0,0,0,1|1,0,0]=3 11221 B16R1.4621 O=C(Nc1ccccc1Br)OCCSCF 62a_100015361967_100020589338 [0,1,0,0,0,1|2,0,0]=4 11222 B16R1.4621 O=C(Nc1ccccc1Br)OCCSCF 62a_100020589338_100015361967 [0,1,0,0,0,1|2,0,0]=4 11223 B16R1.4621 O=C(Nc1ccccc1Cl)OCCSCF 62a_100015361967_200000178450 [0,1,0,0,0,1|2,0,0]=4 11224 B16R1.4818 CCCCCS(=O)(=O)Nc1ccccc1O 20a_100000185747_100000753860 [0,1,0,0,0,1|2,0,0]=4 11225 B16R1.5684 CCCC#CC(=O)N(C)c1ccccc1O 22a_100000033821_200011218047 [0,1,0,0,0,1|1,0,1]=4 11226 B16R1.5684 CCCC=CC(=O)N(C)c1ccccc1O 22a_100000033821_100000212230 [0,1,0,0,0,1|1,0,1]=4 11227 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210326 [0,1,0,0,0,1|2,0,0]=4 11228 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1Cl 1458a_100000212188_100000181259 [0,1,0,0,0,1|2,0,0]=4 11229 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210326 [0,1,0,0,0,1|2,0,0]=4 11230 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1F 1458a_100000212188_200000741388 [0,1,0,0,0,1|2,0,0]=4 11231 B16R1.5684 CCCCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210326 [0,1,0,0,0,1|2,0,0]=4 11232 B16R1.5684 CCCCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210326 [0,1,0,0,0,1|2,0,0]=4 11233 B16R1.5684 CCCCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210326 [0,1,0,0,0,1|2,0,0]=4 11234 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000212188 [0,1,0,0,0,1|2,0,0]=4 11235 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000212188 [0,1,0,0,0,1|2,0,0]=4 11236 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000212188 [0,1,0,0,0,1|2,0,0]=4 11237 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000212188 [0,1,0,0,0,1|2,0,0]=4 11238 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000212188 [0,1,0,0,0,1|2,0,0]=4 11239 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000212188 [0,1,0,0,0,1|2,0,0]=4 11240 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000212188 [0,1,0,0,0,1|2,0,0]=4 11241 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000212188 [0,1,0,0,0,1|2,0,0]=4 11242 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000212188 [0,1,0,0,0,1|2,0,0]=4 11243 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000212188 [0,1,0,0,0,1|2,0,0]=4 11244 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000212188 [0,1,0,0,0,1|1,0,0]=3 11245 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000212188 [0,1,0,0,0,1|1,0,0]=3 11246 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 11a_100000102301_100012359601 [0,1,0,0,0,1|2,0,0]=4 11247 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 1626a_100000102301_100012359601 [0,1,0,0,0,1|2,0,0]=4 11248 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 240690a_100000102301_100012359601 [0,1,0,0,0,1|2,0,0]=4 11249 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 527a_100000102301_100012359601 [0,1,0,0,0,1|2,0,0]=4 11250 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 11a_100000102301_100011667492 [0,1,0,0,0,1|2,0,0]=4 11251 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 1626a_100000102301_100011667492 [0,1,0,0,0,1|2,0,0]=4 11252 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 240690a_100000102301_100011667492 [0,1,0,0,0,1|2,0,0]=4 11253 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 527a_100000102301_100011667492 [0,1,0,0,0,1|2,0,0]=4 11254 B16R1.5684 CCCCNC(=O)C(O)c1ccccc1Br 240690a_100000102301_200011356456 [0,1,0,0,0,1|2,0,0]=4 11255 B16R1.5684 CCCCNC(=O)C(O)c1ccccc1Cl 240690a_100000102301_100011217820 [0,1,0,0,0,1|2,0,0]=4 11256 B16R1.5684 CCCCNC(=O)C(O)c1ccccc1F 240690a_100000102301_100011219519 [0,1,0,0,0,1|2,0,0]=4 11257 B16R1.5684 CCCCNC(=O)N(C)c1ccccc1Br 512a_100000102301_100020606079 [0,1,0,0,0,1|2,0,0]=4 11258 B16R1.5684 CCCCNC(=O)N(C)c1ccccc1C 512a_100000102301_100000219699 [0,1,0,0,0,1|2,0,0]=4 11259 B16R1.5684 CCCCNC(=O)N(C)c1ccccc1Cl 512a_100000102301_100000219374 [0,1,0,0,0,1|2,0,0]=4 11260 B16R1.5684 CCCOCC(=O)N(C)c1ccccc1O 22a_100000033821_100000745993 [0,1,0,0,0,1|2,0,0]=4 11261 B16R1.5684 CCCOCC(=O)N(C)c1ccccc1O 527a_100000033821_100000745993 [0,1,0,0,0,1|2,0,0]=4 11262 B16R1.5684 CCCSCC(=O)N(C)c1ccccc1O 22a_100000033821_100000217233 [0,1,0,0,0,1|2,0,0]=4 11263 B16R1.5684 CCCSCC(=O)N(C)c1ccccc1O 527a_100000033821_100000217233 [0,1,0,0,0,1|2,0,0]=4 11264 B16R1.5684 CCOCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000749530 [0,1,0,0,0,1|2,0,0]=4 11265 B16R1.5684 CCOCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000749530 [0,1,0,0,0,1|2,0,0]=4 11266 B16R1.5684 CCSCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000230768 [0,1,0,0,0,1|2,0,0]=4 11267 B16R1.5684 CCSCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000230768 [0,1,0,0,0,1|2,0,0]=4 11268 B16R1.5684 COCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000741012 [0,1,0,0,0,1|2,0,0]=4 11269 B16R1.5684 COCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000741012 [0,1,0,0,0,1|2,0,0]=4 11270 B16R1.5684 CSCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000173376 [0,1,0,0,0,1|2,0,0]=4 11271 B16R1.5684 CSCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000173376 [0,1,0,0,0,1|2,0,0]=4 11272 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1O)F 1458a_200011218047_100010161318 [0,1,0,0,0,1|1,0,1]=4 11273 B16R1.7379 CCCC#CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_200011218047 [0,1,0,0,0,1|1,0,1]=4 11274 B16R1.7379 CCCC#CC(=O)Nc1cc(ccc1O)C 22a_100011215204_200011218047 [0,1,0,0,0,1|1,0,1]=4 11275 B16R1.7379 CCCC#CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_200011218047 [0,1,0,0,0,1|1,0,1]=4 11276 B16R1.7379 CCCC#CC(=O)Nc1cc(ccc1O)F 22a_100000759472_200011218047 [0,1,0,0,0,1|1,0,1]=4 11277 B16R1.7379 CCCC#CC(=O)Nc1cc(ccc1O)I 22a_100000753495_200011218047 [0,1,0,0,0,1|1,0,1]=4 11278 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1O)F 1458a_100000212230_100010161318 [0,1,0,0,0,1|1,0,1]=4 11279 B16R1.7379 CCCC=CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000212230 [0,1,0,0,0,1|1,0,1]=4 11280 B16R1.7379 CCCC=CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000212230 [0,1,0,0,0,1|1,0,1]=4 11281 B16R1.7379 CCCC=CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000212230 [0,1,0,0,0,1|1,0,1]=4 11282 B16R1.7379 CCCC=CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000212230 [0,1,0,0,0,1|1,0,1]=4 11283 B16R1.7379 CCCC=CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000212230 [0,1,0,0,0,1|1,0,1]=4 11284 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000212188_100011982794 [0,1,0,0,0,1|2,0,0]=4 11285 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210326 [0,1,0,0,0,1|2,0,0]=4 11286 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210326 [0,1,0,0,0,1|2,0,0]=4 11287 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000212188_100000733903 [0,1,0,0,0,1|2,0,0]=4 11288 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210326 [0,1,0,0,0,1|2,0,0]=4 11289 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000212188_100000736370 [0,1,0,0,0,1|2,0,0]=4 11290 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210326 [0,1,0,0,0,1|2,0,0]=4 11291 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)I 1458a_100000212188_100012355412 [0,1,0,0,0,1|2,0,0]=4 11292 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210326 [0,1,0,0,0,1|2,0,0]=4 11293 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)C 1458a_100000212188_100000184699 [0,1,0,0,0,1|2,0,0]=4 11294 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210326 [0,1,0,0,0,1|2,0,0]=4 11295 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000212188_100012186985 [0,1,0,0,0,1|2,0,0]=4 11296 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)F 1458a_100000212188_100000709795 [0,1,0,0,0,1|2,0,0]=4 11297 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210326 [0,1,0,0,0,1|2,0,0]=4 11298 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000212188_100000763347 [0,1,0,0,0,1|2,0,0]=4 11299 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210326 [0,1,0,0,0,1|2,0,0]=4 11300 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000212188_100009871730 [0,1,0,0,0,1|2,0,0]=4 11301 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000212188_100000754809 [0,1,0,0,0,1|2,0,0]=4 11302 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210326 [0,1,0,0,0,1|2,0,0]=4 11303 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000212188_100000709952 [0,1,0,0,0,1|2,0,0]=4 11304 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210326 [0,1,0,0,0,1|2,0,0]=4 11305 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000212188_100010188191 [0,1,0,0,0,1|2,0,0]=4 11306 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000212188_100000736399 [0,1,0,0,0,1|2,0,0]=4 11307 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210326 [0,1,0,0,0,1|2,0,0]=4 11308 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)C 1458a_100000212188_100011260760 [0,1,0,0,0,1|2,0,0]=4 11309 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210326 [0,1,0,0,0,1|2,0,0]=4 11310 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000212188_100000716957 [0,1,0,0,0,1|2,0,0]=4 11311 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210326 [0,1,0,0,0,1|2,0,0]=4 11312 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)F 1458a_100000212188_100000741279 [0,1,0,0,0,1|2,0,0]=4 11313 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210326 [0,1,0,0,0,1|2,0,0]=4 11314 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)I 1458a_100000212188_200010149601 [0,1,0,0,0,1|2,0,0]=4 11315 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1I)Br 1458a_100000212188_100012362523 [0,1,0,0,0,1|2,0,0]=4 11316 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000212188_100012348826 [0,1,0,0,0,1|2,0,0]=4 11317 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1I)F 1458a_100000212188_100010149606 [0,1,0,0,0,1|2,0,0]=4 11318 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210326 [0,1,0,0,0,1|1,0,0]=3 11319 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1O)F 1458a_100000212188_100010161318 [0,1,0,0,0,1|1,0,0]=3 11320 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210326 [0,1,0,0,0,1|1,0,0]=3 11321 B16R1.7379 CCCCCC(=O)Cc1nc(ccc1O)C 1458a_100000212188_100020630696 [0,1,0,0,0,1|2,0,0]=4 11322 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100000212188 [0,1,0,0,0,1|2,0,0]=4 11323 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100000212188 [0,1,0,0,0,1|2,0,0]=4 11324 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100000212188 [0,1,0,0,0,1|2,0,0]=4 11325 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000212188 [0,1,0,0,0,1|2,0,0]=4 11326 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100000212188 [0,1,0,0,0,1|2,0,0]=4 11327 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100000212188 [0,1,0,0,0,1|2,0,0]=4 11328 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100000212188 [0,1,0,0,0,1|2,0,0]=4 11329 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100000212188 [0,1,0,0,0,1|2,0,0]=4 11330 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100000212188 [0,1,0,0,0,1|2,0,0]=4 11331 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100000212188 [0,1,0,0,0,1|2,0,0]=4 11332 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000212188 [0,1,0,0,0,1|2,0,0]=4 11333 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100000212188 [0,1,0,0,0,1|2,0,0]=4 11334 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100000212188 [0,1,0,0,0,1|2,0,0]=4 11335 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100000212188 [0,1,0,0,0,1|2,0,0]=4 11336 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000212188 [0,1,0,0,0,1|2,0,0]=4 11337 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100000212188 [0,1,0,0,0,1|2,0,0]=4 11338 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)C 11a_100000185781_100000212188 [0,1,0,0,0,1|2,0,0]=4 11339 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000212188 [0,1,0,0,0,1|2,0,0]=4 11340 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000212188 [0,1,0,0,0,1|2,0,0]=4 11341 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100000212188 [0,1,0,0,0,1|2,0,0]=4 11342 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100000212188 [0,1,0,0,0,1|2,0,0]=4 11343 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000212188 [0,1,0,0,0,1|2,0,0]=4 11344 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100000212188 [0,1,0,0,0,1|2,0,0]=4 11345 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)F 11a_100000211107_100000212188 [0,1,0,0,0,1|2,0,0]=4 11346 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100000212188 [0,1,0,0,0,1|2,0,0]=4 11347 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000212188 [0,1,0,0,0,1|2,0,0]=4 11348 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 11a_100000761890_100000212188 [0,1,0,0,0,1|2,0,0]=4 11349 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100000212188 [0,1,0,0,0,1|2,0,0]=4 11350 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000212188 [0,1,0,0,0,1|2,0,0]=4 11351 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 527a_100000761890_100000212188 [0,1,0,0,0,1|2,0,0]=4 11352 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000212188 [0,1,0,0,0,1|2,0,0]=4 11353 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)O 527a_100011216113_100000212188 [0,1,0,0,0,1|2,0,0]=4 11354 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100000212188 [0,1,0,0,0,1|2,0,0]=4 11355 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100000212188 [0,1,0,0,0,1|2,0,0]=4 11356 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100000212188 [0,1,0,0,0,1|2,0,0]=4 11357 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000212188 [0,1,0,0,0,1|2,0,0]=4 11358 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000212188 [0,1,0,0,0,1|2,0,0]=4 11359 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100000212188 [0,1,0,0,0,1|2,0,0]=4 11360 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100000212188 [0,1,0,0,0,1|2,0,0]=4 11361 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100000212188 [0,1,0,0,0,1|2,0,0]=4 11362 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100000212188 [0,1,0,0,0,1|2,0,0]=4 11363 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100000212188 [0,1,0,0,0,1|2,0,0]=4 11364 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100000212188 [0,1,0,0,0,1|2,0,0]=4 11365 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100000212188 [0,1,0,0,0,1|2,0,0]=4 11366 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100000212188 [0,1,0,0,0,1|2,0,0]=4 11367 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100000212188 [0,1,0,0,0,1|2,0,0]=4 11368 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000212188 [0,1,0,0,0,1|2,0,0]=4 11369 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 11a_100000211285_100000212188 [0,1,0,0,0,1|2,0,0]=4 11370 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000212188 [0,1,0,0,0,1|2,0,0]=4 11371 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000212188 [0,1,0,0,0,1|2,0,0]=4 11372 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 527a_100000211285_100000212188 [0,1,0,0,0,1|2,0,0]=4 11373 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100000212188 [0,1,0,0,0,1|2,0,0]=4 11374 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100000212188 [0,1,0,0,0,1|2,0,0]=4 11375 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)F 11a_100000210742_100000212188 [0,1,0,0,0,1|2,0,0]=4 11376 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100000212188 [0,1,0,0,0,1|2,0,0]=4 11377 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000212188 [0,1,0,0,0,1|2,0,0]=4 11378 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)I 11a_100011464823_100000212188 [0,1,0,0,0,1|2,0,0]=4 11379 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100000212188 [0,1,0,0,0,1|2,0,0]=4 11380 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000212188 [0,1,0,0,0,1|2,0,0]=4 11381 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000212188 [0,1,0,0,0,1|2,0,0]=4 11382 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100000212188 [0,1,0,0,0,1|2,0,0]=4 11383 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100000212188 [0,1,0,0,0,1|2,0,0]=4 11384 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100000212188 [0,1,0,0,0,1|2,0,0]=4 11385 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)C 11a_100011216686_100000212188 [0,1,0,0,0,1|2,0,0]=4 11386 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000212188 [0,1,0,0,0,1|2,0,0]=4 11387 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100000212188 [0,1,0,0,0,1|2,0,0]=4 11388 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100000212188 [0,1,0,0,0,1|2,0,0]=4 11389 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000212188 [0,1,0,0,0,1|2,0,0]=4 11390 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)F 11a_100011218093_100000212188 [0,1,0,0,0,1|2,0,0]=4 11391 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100000212188 [0,1,0,0,0,1|2,0,0]=4 11392 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000212188 [0,1,0,0,0,1|1,0,0]=3 11393 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000212188 [0,1,0,0,0,1|1,0,0]=3 11394 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000212188 [0,1,0,0,0,1|1,0,0]=3 11395 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000212188 [0,1,0,0,0,1|1,0,0]=3 11396 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000212188 [0,1,0,0,0,1|1,0,0]=3 11397 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000212188 [0,1,0,0,0,1|1,0,0]=3 11398 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000212188 [0,1,0,0,0,1|1,0,0]=3 11399 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000212188 [0,1,0,0,0,1|1,0,0]=3 11400 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000212188 [0,1,0,0,0,1|1,0,0]=3 11401 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000212188 [0,1,0,0,0,1|1,0,0]=3 11402 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br 11a_100000102301_100010004897 [0,1,0,0,0,1|2,0,0]=4 11403 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br 240690a_100000102301_100010004897 [0,1,0,0,0,1|2,0,0]=4 11404 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br 527a_100000102301_100010004897 [0,1,0,0,0,1|2,0,0]=4 11405 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 11a_100000102301_100010004923 [0,1,0,0,0,1|2,0,0]=4 11406 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 1626a_100000102301_100010004923 [0,1,0,0,0,1|2,0,0]=4 11407 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 240690a_100000102301_100010004923 [0,1,0,0,0,1|2,0,0]=4 11408 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 527a_100000102301_100010004923 [0,1,0,0,0,1|2,0,0]=4 11409 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 11a_100000102301_100000690875 [0,1,0,0,0,1|2,0,0]=4 11410 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 1626a_100000102301_100000690875 [0,1,0,0,0,1|2,0,0]=4 11411 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 240690a_100000102301_100000690875 [0,1,0,0,0,1|2,0,0]=4 11412 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 527a_100000102301_100000690875 [0,1,0,0,0,1|2,0,0]=4 11413 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 11a_100000102301_100000690878 [0,1,0,0,0,1|2,0,0]=4 11414 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 1626a_100000102301_100000690878 [0,1,0,0,0,1|2,0,0]=4 11415 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 240690a_100000102301_100000690878 [0,1,0,0,0,1|2,0,0]=4 11416 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 527a_100000102301_100000690878 [0,1,0,0,0,1|2,0,0]=4 11417 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 11a_100000102301_100010244045 [0,1,0,0,0,1|2,0,0]=4 11418 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 1626a_100000102301_100010244045 [0,1,0,0,0,1|2,0,0]=4 11419 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 240690a_100000102301_100010244045 [0,1,0,0,0,1|2,0,0]=4 11420 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 527a_100000102301_100010244045 [0,1,0,0,0,1|2,0,0]=4 11421 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 11a_100000102301_100000749331 [0,1,0,0,0,1|2,0,0]=4 11422 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 1626a_100000102301_100000749331 [0,1,0,0,0,1|2,0,0]=4 11423 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 240690a_100000102301_100000749331 [0,1,0,0,0,1|2,0,0]=4 11424 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 527a_100000102301_100000749331 [0,1,0,0,0,1|2,0,0]=4 11425 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 11a_100000102301_100011219217 [0,1,0,0,0,1|2,0,0]=4 11426 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 1626a_100000102301_100011219217 [0,1,0,0,0,1|2,0,0]=4 11427 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 240690a_100000102301_100011219217 [0,1,0,0,0,1|2,0,0]=4 11428 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 527a_100000102301_100011219217 [0,1,0,0,0,1|2,0,0]=4 11429 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 11a_100000102301_100011600618 [0,1,0,0,0,1|2,0,0]=4 11430 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 1626a_100000102301_100011600618 [0,1,0,0,0,1|2,0,0]=4 11431 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 240690a_100000102301_100011600618 [0,1,0,0,0,1|2,0,0]=4 11432 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 527a_100000102301_100011600618 [0,1,0,0,0,1|2,0,0]=4 11433 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 11a_100000102301_100000748246 [0,1,0,0,0,1|2,0,0]=4 11434 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100000102301_100000748246 [0,1,0,0,0,1|2,0,0]=4 11435 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100000102301_100000748246 [0,1,0,0,0,1|2,0,0]=4 11436 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 527a_100000102301_100000748246 [0,1,0,0,0,1|2,0,0]=4 11437 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 11a_100000102301_100011830335 [0,1,0,0,0,1|2,0,0]=4 11438 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 1626a_100000102301_100011830335 [0,1,0,0,0,1|2,0,0]=4 11439 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 240690a_100000102301_100011830335 [0,1,0,0,0,1|2,0,0]=4 11440 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 527a_100000102301_100011830335 [0,1,0,0,0,1|2,0,0]=4 11441 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 11a_100000102301_100000690877 [0,1,0,0,0,1|2,0,0]=4 11442 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 1626a_100000102301_100000690877 [0,1,0,0,0,1|2,0,0]=4 11443 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 240690a_100000102301_100000690877 [0,1,0,0,0,1|2,0,0]=4 11444 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 527a_100000102301_100000690877 [0,1,0,0,0,1|2,0,0]=4 11445 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 11a_100000102301_100011667363 [0,1,0,0,0,1|2,0,0]=4 11446 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 1626a_100000102301_100011667363 [0,1,0,0,0,1|2,0,0]=4 11447 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 240690a_100000102301_100011667363 [0,1,0,0,0,1|2,0,0]=4 11448 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 527a_100000102301_100011667363 [0,1,0,0,0,1|2,0,0]=4 11449 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 11a_100000102301_100011217548 [0,1,0,0,0,1|2,0,0]=4 11450 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 1626a_100000102301_100011217548 [0,1,0,0,0,1|2,0,0]=4 11451 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 240690a_100000102301_100011217548 [0,1,0,0,0,1|2,0,0]=4 11452 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 527a_100000102301_100011217548 [0,1,0,0,0,1|2,0,0]=4 11453 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 11a_100000102301_100000762760 [0,1,0,0,0,1|2,0,0]=4 11454 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 1626a_100000102301_100000762760 [0,1,0,0,0,1|2,0,0]=4 11455 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 240690a_100000102301_100000762760 [0,1,0,0,0,1|2,0,0]=4 11456 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 527a_100000102301_100000762760 [0,1,0,0,0,1|2,0,0]=4 11457 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1O)Br 240690a_100000102301_100010072483 [0,1,0,0,0,1|1,0,0]=3 11458 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)Br 2430a_100000737762_100000102301 [0,1,0,0,0,1|2,0,0]=4 11459 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)C 2430a_100000745044_100000102301 [0,1,0,0,0,1|2,0,0]=4 11460 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)F 2430a_100000687223_100000102301 [0,1,0,0,0,1|2,0,0]=4 11461 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)I 2430a_100000750456_100000102301 [0,1,0,0,0,1|2,0,0]=4 11462 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)I 512a_100000750456_100000102301 [0,1,0,0,0,1|2,0,0]=4 11463 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)O 2430a_100011999798_100000102301 [0,1,0,0,0,1|2,0,0]=4 11464 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Br 2430a_100000741167_100000102301 [0,1,0,0,0,1|2,0,0]=4 11465 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Br 512a_100000741167_100000102301 [0,1,0,0,0,1|2,0,0]=4 11466 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)C 2430a_100000185781_100000102301 [0,1,0,0,0,1|2,0,0]=4 11467 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Cl 2430a_100000211374_100000102301 [0,1,0,0,0,1|2,0,0]=4 11468 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)F 2430a_100000211107_100000102301 [0,1,0,0,0,1|2,0,0]=4 11469 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)I 2430a_100000761890_100000102301 [0,1,0,0,0,1|2,0,0]=4 11470 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)I 512a_100000761890_100000102301 [0,1,0,0,0,1|2,0,0]=4 11471 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)O 2430a_100011216113_100000102301 [0,1,0,0,0,1|2,0,0]=4 11472 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)C 2430a_100011215360_100000102301 [0,1,0,0,0,1|2,0,0]=4 11473 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)Cl 2430a_100000184485_100000102301 [0,1,0,0,0,1|2,0,0]=4 11474 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)F 2430a_100000751338_100000102301 [0,1,0,0,0,1|2,0,0]=4 11475 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)I 2430a_200000761891_100000102301 [0,1,0,0,0,1|2,0,0]=4 11476 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)O 2430a_100011934297_100000102301 [0,1,0,0,0,1|2,0,0]=4 11477 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)Br 2430a_100000740924_100000102301 [0,1,0,0,0,1|2,0,0]=4 11478 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)Br 512a_100000740924_100000102301 [0,1,0,0,0,1|2,0,0]=4 11479 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)C 2430a_100000211285_100000102301 [0,1,0,0,0,1|2,0,0]=4 11480 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)Cl 2430a_100000212115_100000102301 [0,1,0,0,0,1|2,0,0]=4 11481 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)F 2430a_100000210742_100000102301 [0,1,0,0,0,1|2,0,0]=4 11482 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)I 2430a_100011464823_100000102301 [0,1,0,0,0,1|2,0,0]=4 11483 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)I 512a_100011464823_100000102301 [0,1,0,0,0,1|2,0,0]=4 11484 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)O 2430a_100012017239_100000102301 [0,1,0,0,0,1|2,0,0]=4 11485 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)Br 512a_100000743836_100000102301 [0,1,0,0,0,1|2,0,0]=4 11486 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)C 2430a_100011216686_100000102301 [0,1,0,0,0,1|2,0,0]=4 11487 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)F 2430a_100011218093_100000102301 [0,1,0,0,0,1|2,0,0]=4 11488 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)F 512a_100011218093_100000102301 [0,1,0,0,0,1|2,0,0]=4 11489 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100000102301 [0,1,0,0,0,1|1,0,0]=3 11490 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100000102301 [0,1,0,0,0,1|1,0,0]=3 11491 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100000102301 [0,1,0,0,0,1|1,0,0]=3 11492 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100000102301 [0,1,0,0,0,1|1,0,0]=3 11493 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100000102301 [0,1,0,0,0,1|1,0,0]=3 11494 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1O)Br 22a_100000740057_100010072483 [0,1,0,0,0,1|2,0,0]=4 11495 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1O)O 22a_100000740057_100000038496 [0,1,0,0,0,1|2,0,0]=4 11496 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1O)F 1458a_100000745993_100010161318 [0,1,0,0,0,1|2,0,0]=4 11497 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000745993 [0,1,0,0,0,1|2,0,0]=4 11498 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000745993 [0,1,0,0,0,1|2,0,0]=4 11499 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000745993 [0,1,0,0,0,1|2,0,0]=4 11500 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000745993 [0,1,0,0,0,1|2,0,0]=4 11501 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000745993 [0,1,0,0,0,1|2,0,0]=4 11502 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000745993 [0,1,0,0,0,1|2,0,0]=4 11503 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000745993 [0,1,0,0,0,1|2,0,0]=4 11504 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000745993 [0,1,0,0,0,1|2,0,0]=4 11505 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000745993 [0,1,0,0,0,1|2,0,0]=4 11506 B16R1.7379 CCCOCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000745993 [0,1,0,0,0,1|2,0,0]=4 11507 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1O)F 1458a_100000217233_100010161318 [0,1,0,0,0,1|2,0,0]=4 11508 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000217233 [0,1,0,0,0,1|2,0,0]=4 11509 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000217233 [0,1,0,0,0,1|2,0,0]=4 11510 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000217233 [0,1,0,0,0,1|2,0,0]=4 11511 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000217233 [0,1,0,0,0,1|2,0,0]=4 11512 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000217233 [0,1,0,0,0,1|2,0,0]=4 11513 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000217233 [0,1,0,0,0,1|2,0,0]=4 11514 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)Cl 62a_100000210303_200000014493 [0,1,0,0,0,1|2,0,0]=4 11515 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000217233 [0,1,0,0,0,1|2,0,0]=4 11516 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000217233 [0,1,0,0,0,1|2,0,0]=4 11517 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000217233 [0,1,0,0,0,1|2,0,0]=4 11518 B16R1.7379 CCCSCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000217233 [0,1,0,0,0,1|2,0,0]=4 11519 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100011215890 [0,1,0,0,0,1|2,0,0]=4 11520 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1O)F 1458a_100000749530_100010161318 [0,1,0,0,0,1|2,0,0]=4 11521 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100011215890 [0,1,0,0,0,1|2,0,0]=4 11522 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000749530 [0,1,0,0,0,1|2,0,0]=4 11523 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000749530 [0,1,0,0,0,1|2,0,0]=4 11524 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000749530 [0,1,0,0,0,1|2,0,0]=4 11525 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000749530 [0,1,0,0,0,1|2,0,0]=4 11526 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000749530 [0,1,0,0,0,1|2,0,0]=4 11527 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000749530 [0,1,0,0,0,1|2,0,0]=4 11528 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000749530 [0,1,0,0,0,1|2,0,0]=4 11529 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000749530 [0,1,0,0,0,1|2,0,0]=4 11530 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000749530 [0,1,0,0,0,1|2,0,0]=4 11531 B16R1.7379 CCOCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000749530 [0,1,0,0,0,1|2,0,0]=4 11532 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000757381 [0,1,0,0,0,1|2,0,0]=4 11533 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1O)F 1458a_100000230768_100010161318 [0,1,0,0,0,1|2,0,0]=4 11534 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000757381 [0,1,0,0,0,1|2,0,0]=4 11535 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000230768 [0,1,0,0,0,1|2,0,0]=4 11536 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000230768 [0,1,0,0,0,1|2,0,0]=4 11537 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000230768 [0,1,0,0,0,1|2,0,0]=4 11538 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000230768 [0,1,0,0,0,1|2,0,0]=4 11539 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000230768 [0,1,0,0,0,1|2,0,0]=4 11540 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000230768 [0,1,0,0,0,1|2,0,0]=4 11541 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000230768 [0,1,0,0,0,1|2,0,0]=4 11542 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000230768 [0,1,0,0,0,1|2,0,0]=4 11543 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000230768 [0,1,0,0,0,1|2,0,0]=4 11544 B16R1.7379 CCSCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000230768 [0,1,0,0,0,1|2,0,0]=4 11545 B16R1.7379 CNCCOC(=O)Nc1cc(ccc1Cl)Cl 34a_100102657272_200000190521 [0,1,0,0,0,1|2,0,0]=4 11546 B16R1.7379 CNCCOC(=O)Nc1cc(ccc1Cl)Cl 7a_106832991635_200000190521 [0,1,0,0,0,1|2,0,0]=4 11547 B16R1.7379 COCCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000740836 [0,1,0,0,0,1|2,0,0]=4 11548 B16R1.7379 COCCCC(=O)Cc1cc(ccc1O)F 1458a_100000741012_100010161318 [0,1,0,0,0,1|2,0,0]=4 11549 B16R1.7379 COCCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000740836 [0,1,0,0,0,1|2,0,0]=4 11550 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000741012 [0,1,0,0,0,1|2,0,0]=4 11551 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000741012 [0,1,0,0,0,1|2,0,0]=4 11552 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000741012 [0,1,0,0,0,1|2,0,0]=4 11553 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000741012 [0,1,0,0,0,1|2,0,0]=4 11554 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000741012 [0,1,0,0,0,1|2,0,0]=4 11555 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000741012 [0,1,0,0,0,1|2,0,0]=4 11556 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000741012 [0,1,0,0,0,1|2,0,0]=4 11557 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000741012 [0,1,0,0,0,1|2,0,0]=4 11558 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000741012 [0,1,0,0,0,1|2,0,0]=4 11559 B16R1.7379 COCCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000741012 [0,1,0,0,0,1|2,0,0]=4 11560 B16R1.7379 COCCNC(=O)Cc1cc(ccc1O)Br 240690a_100000209980_100010072483 [0,1,0,0,0,1|2,0,0]=4 11561 B16R1.7379 COCCNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100000209980 [0,1,0,0,0,1|2,0,0]=4 11562 B16R1.7379 COCCNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100000209980 [0,1,0,0,0,1|2,0,0]=4 11563 B16R1.7379 COCCNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100000209980 [0,1,0,0,0,1|2,0,0]=4 11564 B16R1.7379 COCCNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100000209980 [0,1,0,0,0,1|2,0,0]=4 11565 B16R1.7379 COCCNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100000209980 [0,1,0,0,0,1|2,0,0]=4 11566 B16R1.7379 COCCOC(=O)Nc1cc(ccc1Cl)Cl 34a_100138415774_200000190521 [0,1,0,0,0,1|2,0,0]=4 11567 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1O)F 1458a_100000173376_100010161318 [0,1,0,0,0,1|2,0,0]=4 11568 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000173376 [0,1,0,0,0,1|2,0,0]=4 11569 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000173376 [0,1,0,0,0,1|2,0,0]=4 11570 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000173376 [0,1,0,0,0,1|2,0,0]=4 11571 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000173376 [0,1,0,0,0,1|2,0,0]=4 11572 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000173376 [0,1,0,0,0,1|2,0,0]=4 11573 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000173376 [0,1,0,0,0,1|2,0,0]=4 11574 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000173376 [0,1,0,0,0,1|2,0,0]=4 11575 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000173376 [0,1,0,0,0,1|2,0,0]=4 11576 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000173376 [0,1,0,0,0,1|2,0,0]=4 11577 B16R1.7379 CSCCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000173376 [0,1,0,0,0,1|2,0,0]=4 11578 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1O)Br 240690a_100020590264_100010072483 [0,1,0,0,0,1|2,0,0]=4 11579 B16R1.7379 CSCCNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100020590264 [0,1,0,0,0,1|2,0,0]=4 11580 B16R1.7379 CSCCNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100020590264 [0,1,0,0,0,1|2,0,0]=4 11581 B16R1.7379 CSCCNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100020590264 [0,1,0,0,0,1|2,0,0]=4 11582 B16R1.7379 CSCCNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100020590264 [0,1,0,0,0,1|2,0,0]=4 11583 B16R1.7379 CSCCNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100020590264 [0,1,0,0,0,1|2,0,0]=4 11584 B16R1.7379 CSCCOC(=O)Nc1cc(ccc1Cl)Cl 62a_200000210301_200000190521 [0,1,0,0,0,1|2,0,0]=4 11585 B16R1.7379 Cc1ccc(c(c1)NC(=O)NCCCF)O 2430a_100011215204_100015189416 [0,1,0,0,0,1|2,0,0]=4 11586 B16R1.7379 Cc1ccc(c(c1)NC(=O)NCCCO)O 2430a_100011215204_100000182051 [0,1,0,0,0,1|2,0,0]=4 11587 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1O)Br 1458a_100010072483_100000729493 [0,1,0,0,0,1|2,0,0]=4 11588 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1O)O 1458a_100000038496_100000729493 [0,1,0,0,0,1|2,0,0]=4 11589 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1O)Br 1458a_100010072483_100000210776 [0,1,0,0,0,1|2,0,0]=4 11590 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1O)F 1458a_100000695505_100010161318 [0,1,0,0,0,1|2,0,0]=4 11591 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1O)O 1458a_100000038496_100000210776 [0,1,0,0,0,1|2,0,0]=4 11592 B16R1.7379 O=C(Cc1cc(ccc1O)Br)NCCCF 240690a_100015189416_100010072483 [0,1,0,0,0,1|2,0,0]=4 11593 B16R1.7379 O=C(Cc1cc(ccc1O)Br)NCCCO 240690a_100000182051_100010072483 [0,1,0,0,0,1|2,0,0]=4 11594 B16R1.7379 O=C(NCCCF)Nc1cc(ccc1O)Br 2430a_100000752626_100015189416 [0,1,0,0,0,1|2,0,0]=4 11595 B16R1.7379 O=C(NCCCF)Nc1cc(ccc1O)Cl 2430a_100000210500_100015189416 [0,1,0,0,0,1|2,0,0]=4 11596 B16R1.7379 O=C(NCCCF)Nc1cc(ccc1O)F 2430a_100000759472_100015189416 [0,1,0,0,0,1|2,0,0]=4 11597 B16R1.7379 O=C(NCCCF)Nc1cc(ccc1O)I 2430a_100000753495_100015189416 [0,1,0,0,0,1|2,0,0]=4 11598 B16R1.7379 O=C(NCCCO)Nc1cc(ccc1O)Br 2430a_100000752626_100000182051 [0,1,0,0,0,1|2,0,0]=4 11599 B16R1.7379 O=C(NCCCO)Nc1cc(ccc1O)Cl 2430a_100000210500_100000182051 [0,1,0,0,0,1|2,0,0]=4 11600 B16R1.7379 O=C(NCCCO)Nc1cc(ccc1O)F 2430a_100000759472_100000182051 [0,1,0,0,0,1|2,0,0]=4 11601 B16R1.7379 O=C(NCCCO)Nc1cc(ccc1O)I 2430a_100000753495_100000182051 [0,1,0,0,0,1|2,0,0]=4 11602 B16R1.7379 [13CH3]SCCOC(=O)Nc1cc(ccc1Cl)Cl 62a_200025704644_200000190521 [0,1,0,0,0,1|2,0,0]=4 11603 B16R1.7391 C#Cc1ccccc1NC(=O)CCCCC 11a_100011470550_100000212188 [0,1,0,0,0,1|2,0,0]=4 11604 B16R1.7391 C#Cc1ccccc1NC(=O)CCCCC 1626a_100011470550_100000212188 [0,1,0,0,0,1|2,0,0]=4 11605 B16R1.7391 C#Cc1ccccc1NC(=O)CCCCC 22a_100011470550_100000212188 [0,1,0,0,0,1|2,0,0]=4 11606 B16R1.7391 C#Cc1ccccc1NC(=O)NCCCC 2430a_100011470550_100000102301 [0,1,0,0,0,1|2,0,0]=4 11607 B16R1.7391 C=Cc1ccccc1NC(=O)CCCCC 11a_100012022501_100000212188 [0,1,0,0,0,1|2,0,0]=4 11608 B16R1.7391 C=Cc1ccccc1NC(=O)CCCCC 1626a_100012022501_100000212188 [0,1,0,0,0,1|2,0,0]=4 11609 B16R1.7391 C=Cc1ccccc1NC(=O)CCCCC 22a_100012022501_100000212188 [0,1,0,0,0,1|2,0,0]=4 11610 B16R1.7391 C=Cc1ccccc1NC(=O)NCCCC 2430a_100012022501_100000102301 [0,1,0,0,0,1|2,0,0]=4 11611 B16R1.7391 CCCC#CC(=O)Cc1ccccc1CO 1458a_200011218047_100009816955 [0,1,0,0,0,1|1,0,1]=4 11612 B16R1.7391 CCCC#CC(=O)Cc1ccccc1OC 1458a_200011218047_100000210004 [0,1,0,0,0,1|1,0,1]=4 11613 B16R1.7391 CCCC#CC(=O)Nc1ccccc1CO 22a_100000212039_200011218047 [0,1,0,0,0,1|1,0,1]=4 11614 B16R1.7391 CCCC#CC(=O)Nc1ccccc1OC 22a_100000210025_200011218047 [0,1,0,0,0,1|1,0,1]=4 11615 B16R1.7391 CCCC=CC(=O)Cc1ccccc1CO 1458a_100000212230_100009816955 [0,1,0,0,0,1|1,0,1]=4 11616 B16R1.7391 CCCC=CC(=O)Cc1ccccc1OC 1458a_100000212230_100000210004 [0,1,0,0,0,1|1,0,1]=4 11617 B16R1.7391 CCCC=CC(=O)Nc1ccccc1CO 22a_100000212039_100000212230 [0,1,0,0,0,1|1,0,1]=4 11618 B16R1.7391 CCCC=CC(=O)Nc1ccccc1OC 11a_100000210025_100000212230 [0,1,0,0,0,1|1,0,1]=4 11619 B16R1.7391 CCCC=CC(=O)Nc1ccccc1OC 1626a_100000210025_100000212230 [0,1,0,0,0,1|1,0,1]=4 11620 B16R1.7391 CCCC=CC(=O)Nc1ccccc1OC 22a_100000210025_100000212230 [0,1,0,0,0,1|1,0,1]=4 11621 B16R1.7391 CCCCCC(=O)Cc1ccccc1C#N 1458a_100000212188_100000181865 [0,1,0,0,0,1|2,0,0]=4 11622 B16R1.7391 CCCCCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000210326 [0,1,0,0,0,1|2,0,0]=4 11623 B16R1.7391 CCCCCC(=O)Cc1ccccc1C=O 1458a_100000212188_200009853537 [0,1,0,0,0,1|1,0,1]=4 11624 B16R1.7391 CCCCCC(=O)Cc1ccccc1CO 1458a_100000212188_100009816955 [0,1,0,0,0,1|1,0,0]=3 11625 B16R1.7391 CCCCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000210326 [0,1,0,0,0,1|1,0,0]=3 11626 B16R1.7391 CCCCCC(=O)Cc1ccccc1OC 1458a_100000212188_100000210004 [0,1,0,0,0,1|1,0,0]=3 11627 B16R1.7391 CCCCCC(=O)Cc1ccccc1SC 1458a_100000212188_100000699184 [0,1,0,0,0,1|1,1,0]=4 11628 B16R1.7391 CCCCCC(=O)Cc1cccnc1OC 1458a_100000212188_100020631285 [0,1,0,0,0,1|2,0,0]=4 11629 B16R1.7391 CCCCCC(=O)Cc1ccncc1OC 1458a_100000212188_100020635607 [0,1,0,0,0,1|2,0,0]=4 11630 B16R1.7391 CCCCCC(=O)Nc1ccccc1C#N 11a_100000211148_100000212188 [0,1,0,0,0,1|2,0,0]=4 11631 B16R1.7391 CCCCCC(=O)Nc1ccccc1C#N 1626a_100000211148_100000212188 [0,1,0,0,0,1|2,0,0]=4 11632 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 11a_100000212081_100000212188 [0,1,0,0,0,1|2,0,0]=4 11633 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 1626a_100000212081_100000212188 [0,1,0,0,0,1|2,0,0]=4 11634 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 22a_100000212081_100000212188 [0,1,0,0,0,1|2,0,0]=4 11635 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 527a_100000212081_100000212188 [0,1,0,0,0,1|2,0,0]=4 11636 B16R1.7391 CCCCCC(=O)Nc1ccccc1CO 22a_100000212039_100000212188 [0,1,0,0,0,1|1,0,0]=3 11637 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 11a_100000210025_100000212188 [0,1,0,0,0,1|1,0,0]=3 11638 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000212188 [0,1,0,0,0,1|1,0,0]=3 11639 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 22a_100000210025_100000212188 [0,1,0,0,0,1|1,0,0]=3 11640 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 527a_100000210025_100000212188 [0,1,0,0,0,1|1,0,0]=3 11641 B16R1.7391 CCCCCC(=O)Nc1ccccc1SC 11a_100000211160_100000212188 [0,1,0,0,0,1|1,1,0]=4 11642 B16R1.7391 CCCCCC(=O)Nc1ccccc1SC 22a_100000211160_100000212188 [0,1,0,0,0,1|1,1,0]=4 11643 B16R1.7391 CCCCNC(=O)Cc1ccccc1C#N 11a_100000102301_100000238613 [0,1,0,0,0,1|2,0,0]=4 11644 B16R1.7391 CCCCNC(=O)Cc1ccccc1C#N 527a_100000102301_100000238613 [0,1,0,0,0,1|2,0,0]=4 11645 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 11a_100000102301_100000211604 [0,1,0,0,0,1|1,0,0]=3 11646 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 1626a_100000102301_100000211604 [0,1,0,0,0,1|1,0,0]=3 11647 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 240690a_100000102301_100000211604 [0,1,0,0,0,1|1,0,0]=3 11648 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 527a_100000102301_100000211604 [0,1,0,0,0,1|1,0,0]=3 11649 B16R1.7391 CCCCNC(=O)Nc1ccccc1C#N 2430a_100000211148_100000102301 [0,1,0,0,0,1|2,0,0]=4 11650 B16R1.7391 CCCCNC(=O)Nc1ccccc1CC 2430a_100000212081_100000102301 [0,1,0,0,0,1|2,0,0]=4 11651 B16R1.7391 CCCCNC(=O)Nc1ccccc1OC 2430a_100000210025_100000102301 [0,1,0,0,0,1|1,0,0]=3 11652 B16R1.7391 CCCCNC(=O)Nc1ccccc1SC 2430a_100000211160_100000102301 [0,1,0,0,0,1|1,1,0]=4 11653 B16R1.7391 CCCCNC(=O)Nc1ccccc1SC 512a_100000211160_100000102301 [0,1,0,0,0,1|1,1,0]=4 11654 B16R1.7391 CCCCOC(C)Cc1ccccc1OC 7a_100000691916_100000210211 [0,1,0,0,0,1|1,0,1]=4 11655 B16R1.7391 CCCNNC(=O)Cc1ccccc1OC 22a_100000740057_100000211604 [0,1,0,0,0,1|2,0,0]=4 11656 B16R1.7391 CCCOCC(=O)Cc1ccccc1CO 1458a_100000745993_100009816955 [0,1,0,0,0,1|2,0,0]=4 11657 B16R1.7391 CCCOCC(=O)Cc1ccccc1OC 1458a_100000745993_100000210004 [0,1,0,0,0,1|2,0,0]=4 11658 B16R1.7391 CCCOCC(=O)Nc1ccccc1CO 22a_100000212039_100000745993 [0,1,0,0,0,1|2,0,0]=4 11659 B16R1.7391 CCCOCC(=O)Nc1ccccc1OC 11a_100000210025_100000745993 [0,1,0,0,0,1|2,0,0]=4 11660 B16R1.7391 CCCOCC(=O)Nc1ccccc1OC 1626a_100000210025_100000745993 [0,1,0,0,0,1|2,0,0]=4 11661 B16R1.7391 CCCOCC(=O)Nc1ccccc1OC 22a_100000210025_100000745993 [0,1,0,0,0,1|2,0,0]=4 11662 B16R1.7391 CCCOCC(=O)Nc1ccccc1OC 34a_100000210258_100000182883 [0,1,0,0,0,1|2,0,0]=4 11663 B16R1.7391 CCCOCC(=O)Nc1ccccc1OC 527a_100000210025_100000745993 [0,1,0,0,0,1|2,0,0]=4 11664 B16R1.7391 CCCSCC(=O)Cc1ccccc1CO 1458a_100000217233_100009816955 [0,1,0,0,0,1|2,0,0]=4 11665 B16R1.7391 CCCSCC(=O)Cc1ccccc1OC 1458a_100000217233_100000210004 [0,1,0,0,0,1|2,0,0]=4 11666 B16R1.7391 CCCSCC(=O)Nc1ccccc1CO 22a_100000212039_100000217233 [0,1,0,0,0,1|2,0,0]=4 11667 B16R1.7391 CCCSCC(=O)Nc1ccccc1OC 11a_100000210025_100000217233 [0,1,0,0,0,1|2,0,0]=4 11668 B16R1.7391 CCCSCC(=O)Nc1ccccc1OC 1626a_100000210025_100000217233 [0,1,0,0,0,1|2,0,0]=4 11669 B16R1.7391 CCCSCC(=O)Nc1ccccc1OC 22a_100000210025_100000217233 [0,1,0,0,0,1|2,0,0]=4 11670 B16R1.7391 CCCSCC(=O)Nc1ccccc1OC 527a_100000210025_100000217233 [0,1,0,0,0,1|2,0,0]=4 11671 B16R1.7391 CCCSCC(=O)Nc1ccccc1OC 62a_100000210303_100000182883 [0,1,0,0,0,1|2,0,0]=4 11672 B16R1.7391 CCCSCC(=O)Nc1ccccc1OC 62a_200000243729_100000210303 [0,1,0,0,0,1|2,0,0]=4 11673 B16R1.7391 CCNCCC(=O)Nc1ccccc1OC 2230a_100015185781_100000210202 [0,1,0,0,0,1|2,0,0]=4 11674 B16R1.7391 CCNCCC(=O)Nc1ccccc1OC 2230a_100015525214_100000242059 [0,1,0,0,0,1|2,0,0]=4 11675 B16R1.7391 CCNCCC(=O)Nc1ccccc1OC 34a_100015185781_100000210202 [0,1,0,0,0,1|2,0,0]=4 11676 B16R1.7391 CCOCCC(=O)Cc1ccccc1CO 1458a_100000749530_100009816955 [0,1,0,0,0,1|2,0,0]=4 11677 B16R1.7391 CCOCCC(=O)Cc1ccccc1OC 1458a_100000211604_100011215890 [0,1,0,0,0,1|2,0,0]=4 11678 B16R1.7391 CCOCCC(=O)Cc1ccccc1OC 1458a_100000749530_100000210004 [0,1,0,0,0,1|2,0,0]=4 11679 B16R1.7391 CCOCCC(=O)Nc1ccccc1CO 22a_100000212039_100000749530 [0,1,0,0,0,1|2,0,0]=4 11680 B16R1.7391 CCOCCC(=O)Nc1ccccc1OC 11a_100000210025_100000749530 [0,1,0,0,0,1|2,0,0]=4 11681 B16R1.7391 CCOCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000749530 [0,1,0,0,0,1|2,0,0]=4 11682 B16R1.7391 CCOCCC(=O)Nc1ccccc1OC 22a_100000210025_100000749530 [0,1,0,0,0,1|2,0,0]=4 11683 B16R1.7391 CCOCCC(=O)Nc1ccccc1OC 527a_100000210025_100000749530 [0,1,0,0,0,1|2,0,0]=4 11684 B16R1.7391 CCSCCC(=O)Cc1ccccc1CO 1458a_100000230768_100009816955 [0,1,0,0,0,1|2,0,0]=4 11685 B16R1.7391 CCSCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000757381 [0,1,0,0,0,1|2,0,0]=4 11686 B16R1.7391 CCSCCC(=O)Cc1ccccc1OC 1458a_100000230768_100000210004 [0,1,0,0,0,1|2,0,0]=4 11687 B16R1.7391 CCSCCC(=O)Nc1ccccc1CO 22a_100000212039_100000230768 [0,1,0,0,0,1|2,0,0]=4 11688 B16R1.7391 CCSCCC(=O)Nc1ccccc1OC 11a_100000210025_100000230768 [0,1,0,0,0,1|2,0,0]=4 11689 B16R1.7391 CCSCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000230768 [0,1,0,0,0,1|2,0,0]=4 11690 B16R1.7391 CCSCCC(=O)Nc1ccccc1OC 22a_100000210025_100000230768 [0,1,0,0,0,1|2,0,0]=4 11691 B16R1.7391 CCSCCC(=O)Nc1ccccc1OC 527a_100000210025_100000230768 [0,1,0,0,0,1|2,0,0]=4 11692 B16R1.7391 CCSCCC(=O)Nc1ccccc1OC 62a_100000210202_100000242059 [0,1,0,0,0,1|2,0,0]=4 11693 B16R1.7391 COCCCC(=O)Cc1ccccc1CO 1458a_100000741012_100009816955 [0,1,0,0,0,1|2,0,0]=4 11694 B16R1.7391 COCCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000740836 [0,1,0,0,0,1|2,0,0]=4 11695 B16R1.7391 COCCCC(=O)Cc1ccccc1OC 1458a_100000741012_100000210004 [0,1,0,0,0,1|2,0,0]=4 11696 B16R1.7391 COCCCC(=O)Nc1ccccc1CO 22a_100000212039_100000741012 [0,1,0,0,0,1|2,0,0]=4 11697 B16R1.7391 COCCCC(=O)Nc1ccccc1OC 11a_100000210025_100000741012 [0,1,0,0,0,1|2,0,0]=4 11698 B16R1.7391 COCCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000741012 [0,1,0,0,0,1|2,0,0]=4 11699 B16R1.7391 COCCCC(=O)Nc1ccccc1OC 22a_100000210025_100000741012 [0,1,0,0,0,1|2,0,0]=4 11700 B16R1.7391 COCCCC(=O)Nc1ccccc1OC 527a_100000210025_100000741012 [0,1,0,0,0,1|2,0,0]=4 11701 B16R1.7391 COCCNC(=O)Cc1ccccc1OC 1626a_100000209980_100000211604 [0,1,0,0,0,1|2,0,0]=4 11702 B16R1.7391 COCCNC(=O)Cc1ccccc1OC 240690a_100000209980_100000211604 [0,1,0,0,0,1|2,0,0]=4 11703 B16R1.7391 COCCNC(=O)Cc1ccccc1OC 527a_100000209980_100000211604 [0,1,0,0,0,1|2,0,0]=4 11704 B16R1.7391 COCCNC(=O)Nc1ccccc1OC 2430a_100000210025_100000209980 [0,1,0,0,0,1|2,0,0]=4 11705 B16R1.7391 COc1ccccc1CC(=O)CCCCF 1458a_100000211604_100000729493 [0,1,0,0,0,1|2,0,0]=4 11706 B16R1.7391 COc1ccccc1CC(=O)CCCCO 1458a_100000211604_100000210776 [0,1,0,0,0,1|2,0,0]=4 11707 B16R1.7391 COc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000210004 [0,1,0,0,0,1|2,0,0]=4 11708 B16R1.7391 COc1ccccc1CC(=O)CCCSC 1458a_100000173376_100000210004 [0,1,0,0,0,1|2,0,0]=4 11709 B16R1.7391 COc1ccccc1CC(=O)NCCCF 11a_100015189416_100000211604 [0,1,0,0,0,1|2,0,0]=4 11710 B16R1.7391 COc1ccccc1CC(=O)NCCCF 1626a_100015189416_100000211604 [0,1,0,0,0,1|2,0,0]=4 11711 B16R1.7391 COc1ccccc1CC(=O)NCCCF 240690a_100015189416_100000211604 [0,1,0,0,0,1|2,0,0]=4 11712 B16R1.7391 COc1ccccc1CC(=O)NCCCF 527a_100015189416_100000211604 [0,1,0,0,0,1|2,0,0]=4 11713 B16R1.7391 COc1ccccc1CC(=O)NCCCO 240690a_100000182051_100000211604 [0,1,0,0,0,1|2,0,0]=4 11714 B16R1.7391 COc1ccccc1CC(=O)NCCCO 527a_100000182051_100000211604 [0,1,0,0,0,1|2,0,0]=4 11715 B16R1.7391 COc1ccccc1CC(=O)NCCSC 11a_100020590264_100000211604 [0,1,0,0,0,1|2,0,0]=4 11716 B16R1.7391 COc1ccccc1CC(=O)NCCSC 1626a_100020590264_100000211604 [0,1,0,0,0,1|2,0,0]=4 11717 B16R1.7391 COc1ccccc1CC(=O)NCCSC 240690a_100020590264_100000211604 [0,1,0,0,0,1|2,0,0]=4 11718 B16R1.7391 COc1ccccc1CC(=O)NCCSC 527a_100020590264_100000211604 [0,1,0,0,0,1|2,0,0]=4 11719 B16R1.7391 COc1ccccc1NC(=O)CCCCO 1626a_100000210025_100000695505 [0,1,0,0,0,1|2,0,0]=4 11720 B16R1.7391 COc1ccccc1NC(=O)CCCSC 11a_100000210025_100000173376 [0,1,0,0,0,1|2,0,0]=4 11721 B16R1.7391 COc1ccccc1NC(=O)CCCSC 1626a_100000210025_100000173376 [0,1,0,0,0,1|2,0,0]=4 11722 B16R1.7391 COc1ccccc1NC(=O)CCCSC 22a_100000210025_100000173376 [0,1,0,0,0,1|2,0,0]=4 11723 B16R1.7391 COc1ccccc1NC(=O)CCCSC 527a_100000210025_100000173376 [0,1,0,0,0,1|2,0,0]=4 11724 B16R1.7391 COc1ccccc1NC(=O)NCCCF 2430a_100000210025_100015189416 [0,1,0,0,0,1|2,0,0]=4 11725 B16R1.7391 COc1ccccc1NC(=O)NCCCO 2430a_100000210025_100000182051 [0,1,0,0,0,1|2,0,0]=4 11726 B16R1.7391 COc1ccccc1NC(=O)NCCSC 2430a_100000210025_100020590264 [0,1,0,0,0,1|2,0,0]=4 11727 B16R1.7391 CSCCCC(=O)Cc1ccccc1CO 1458a_100000173376_100009816955 [0,1,0,0,0,1|2,0,0]=4 11728 B16R1.7391 CSCCCC(=O)Nc1ccccc1CO 22a_100000212039_100000173376 [0,1,0,0,0,1|2,0,0]=4 11729 B16R1.7391 O=C(CCCCO)Cc1ccccc1CO 1458a_100000695505_100009816955 [0,1,0,0,0,1|2,0,0]=4 11730 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215641 [0,1,0,0,0,1|1,0,1]=4 11731 B16R1.7414 CC(=O)CCOC(=O)Nc1ccccc1Br 1458a_100000070787_100020589338 [0,1,0,0,0,1|1,0,1]=4 11732 B16R1.7414 CC(=O)CCOC(=O)Nc1ccccc1Cl 1458a_100000070787_200000178450 [0,1,0,0,0,1|1,0,1]=4 11733 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011214892 [0,1,0,0,0,1|2,0,0]=4 11734 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Br 1458a_100011216857_100000184730 [0,1,0,0,0,1|2,0,0]=4 11735 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011214892 [0,1,0,0,0,1|2,0,0]=4 11736 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Cl 1458a_100011216857_100000187162 [0,1,0,0,0,1|2,0,0]=4 11737 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1F 1458a_100000212012_100011214892 [0,1,0,0,0,1|2,0,0]=4 11738 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1F 1458a_100011216857_100000187165 [0,1,0,0,0,1|2,0,0]=4 11739 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1I 1458a_100000036491_100011214892 [0,1,0,0,0,1|2,0,0]=4 11740 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1I 1458a_100011216857_100011216222 [0,1,0,0,0,1|2,0,0]=4 11741 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011214892 [0,1,0,0,0,1|1,0,0]=3 11742 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1O 1458a_100011216857_200020655725 [0,1,0,0,0,1|2,0,0]=4 11743 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Br 11a_100000210017_100011216857 [0,1,0,0,0,1|2,0,0]=4 11744 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100011216857 [0,1,0,0,0,1|2,0,0]=4 11745 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100011216857 [0,1,0,0,0,1|2,0,0]=4 11746 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100011216857 [0,1,0,0,0,1|2,0,0]=4 11747 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100011216857 [0,1,0,0,0,1|2,0,0]=4 11748 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100011216857 [0,1,0,0,0,1|2,0,0]=4 11749 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 11a_100000210422_100011216857 [0,1,0,0,0,1|2,0,0]=4 11750 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 1626a_100000210422_100011216857 [0,1,0,0,0,1|2,0,0]=4 11751 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 22a_100000210422_100011216857 [0,1,0,0,0,1|2,0,0]=4 11752 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 527a_100000210422_100011216857 [0,1,0,0,0,1|2,0,0]=4 11753 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I 11a_100000210053_100011216857 [0,1,0,0,0,1|2,0,0]=4 11754 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I 1626a_100000210053_100011216857 [0,1,0,0,0,1|2,0,0]=4 11755 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1O 22a_100000185747_100011216857 [0,1,0,0,0,1|1,0,0]=3 11756 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1O 527a_100000185747_100011216857 [0,1,0,0,0,1|1,0,0]=3 11757 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br 11a_100000210545_100000751119 [0,1,0,0,0,1|2,0,0]=4 11758 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br 240690a_100000210545_100000751119 [0,1,0,0,0,1|2,0,0]=4 11759 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br 527a_100000210545_100000751119 [0,1,0,0,0,1|2,0,0]=4 11760 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 11a_100000210545_100000183793 [0,1,0,0,0,1|2,0,0]=4 11761 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 1626a_100000210545_100000183793 [0,1,0,0,0,1|2,0,0]=4 11762 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 240690a_100000210545_100000183793 [0,1,0,0,0,1|2,0,0]=4 11763 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 527a_100000210545_100000183793 [0,1,0,0,0,1|2,0,0]=4 11764 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 11a_100000210545_100000212012 [0,1,0,0,0,1|2,0,0]=4 11765 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 1626a_100000210545_100000212012 [0,1,0,0,0,1|2,0,0]=4 11766 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 240690a_100000210545_100000212012 [0,1,0,0,0,1|2,0,0]=4 11767 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 527a_100000210545_100000212012 [0,1,0,0,0,1|2,0,0]=4 11768 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 11a_100000210545_100000036491 [0,1,0,0,0,1|2,0,0]=4 11769 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 1626a_100000210545_100000036491 [0,1,0,0,0,1|2,0,0]=4 11770 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 240690a_100000210545_100000036491 [0,1,0,0,0,1|2,0,0]=4 11771 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 527a_100000210545_100000036491 [0,1,0,0,0,1|2,0,0]=4 11772 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1O 240690a_100000210545_100000743006 [0,1,0,0,0,1|1,0,0]=3 11773 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1O 527a_100000210545_100000743006 [0,1,0,0,0,1|1,0,0]=3 11774 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000210545 [0,1,0,0,0,1|2,0,0]=4 11775 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000210545 [0,1,0,0,0,1|2,0,0]=4 11776 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1F 2430a_100000210422_100000210545 [0,1,0,0,0,1|2,0,0]=4 11777 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1I 2430a_100000210053_100000210545 [0,1,0,0,0,1|2,0,0]=4 11778 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000210545 [0,1,0,0,0,1|1,0,0]=3 11779 B16R1.7414 CC(C)CNNC(=O)Cc1ccccc1O 22a_100000696102_100000743006 [0,1,0,0,0,1|2,0,0]=4 11780 B16R1.7414 CC(C)COCC(=O)Nc1ccccc1O 22a_100000185747_100011223364 [0,1,0,0,0,1|2,0,0]=4 11781 B16R1.7414 CC(C)COCC(=O)Nc1ccccc1O 527a_100000185747_100011223364 [0,1,0,0,0,1|2,0,0]=4 11782 B16R1.7414 CC(C)CSCC(=O)Nc1ccccc1O 62a_100000210624_100000014494 [0,1,0,0,0,1|2,0,0]=4 11783 B16R1.7414 CC(C)OCCC(=O)Cc1ccccc1O 1458a_100000743006_100000211751 [0,1,0,0,0,1|2,0,0]=4 11784 B16R1.7414 CC(C)SCCC(=O)Cc1ccccc1O 1458a_100000743006_100000730970 [0,1,0,0,0,1|2,0,0]=4 11785 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_200000718107 [0,1,0,0,0,1|2,0,0]=4 11786 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_200000718107 [0,1,0,0,0,1|2,0,0]=4 11787 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1F 1458a_100000212012_200000718107 [0,1,0,0,0,1|2,0,0]=4 11788 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1I 1458a_100000036491_200000718107 [0,1,0,0,0,1|2,0,0]=4 11789 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_200000718107 [0,1,0,0,0,1|1,0,0]=3 11790 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000761597 [0,1,0,0,0,1|2,0,0]=4 11791 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000761597 [0,1,0,0,0,1|2,0,0]=4 11792 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000761597 [0,1,0,0,0,1|2,0,0]=4 11793 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000761597 [0,1,0,0,0,1|2,0,0]=4 11794 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1F 1626a_100000210422_100000761597 [0,1,0,0,0,1|2,0,0]=4 11795 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1F 22a_100000210422_100000761597 [0,1,0,0,0,1|2,0,0]=4 11796 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1F 527a_100000210422_100000761597 [0,1,0,0,0,1|2,0,0]=4 11797 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1I 1626a_100000210053_100000761597 [0,1,0,0,0,1|2,0,0]=4 11798 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1O 22a_100000185747_100000761597 [0,1,0,0,0,1|1,0,0]=3 11799 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1O 527a_100000185747_100000761597 [0,1,0,0,0,1|1,0,0]=3 11800 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Br 240690a_200000755665_100000751119 [0,1,0,0,0,1|2,0,0]=4 11801 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Br 527a_200000755665_100000751119 [0,1,0,0,0,1|2,0,0]=4 11802 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Cl 240690a_200000755665_100000183793 [0,1,0,0,0,1|2,0,0]=4 11803 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Cl 527a_200000755665_100000183793 [0,1,0,0,0,1|2,0,0]=4 11804 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1F 240690a_200000755665_100000212012 [0,1,0,0,0,1|2,0,0]=4 11805 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1F 527a_200000755665_100000212012 [0,1,0,0,0,1|2,0,0]=4 11806 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1I 240690a_200000755665_100000036491 [0,1,0,0,0,1|2,0,0]=4 11807 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1I 527a_200000755665_100000036491 [0,1,0,0,0,1|2,0,0]=4 11808 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1O 240690a_200000755665_100000743006 [0,1,0,0,0,1|1,0,0]=3 11809 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1O 527a_200000755665_100000743006 [0,1,0,0,0,1|1,0,0]=3 11810 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1Br 2430a_100000210017_200000755665 [0,1,0,0,0,1|2,0,0]=4 11811 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_200000755665 [0,1,0,0,0,1|2,0,0]=4 11812 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1F 2430a_100000210422_200000755665 [0,1,0,0,0,1|2,0,0]=4 11813 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1I 2430a_100000210053_200000755665 [0,1,0,0,0,1|2,0,0]=4 11814 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1O 2430a_100000185747_200000755665 [0,1,0,0,0,1|1,0,0]=3 11815 B16R1.7414 CC(O)CNNC(=O)Cc1ccccc1O 22a_200000730056_100000743006 [0,1,0,0,0,1|2,0,0]=4 11816 B16R1.7414 CC(O)CSCC(=O)Nc1ccccc1O 62a_100011218427_100000014494 [0,1,0,0,0,1|2,0,0]=4 11817 B16R1.7414 CN(C)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000695564 [0,1,0,0,0,1|2,0,0]=4 11818 B16R1.7414 CN(C)CCCC(=O)Nc1ccccc1O 22a_100000185747_100000740757 [0,1,0,0,0,1|2,0,0]=4 11819 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O 240690a_100000210585_100000743006 [0,1,0,0,0,1|2,0,0]=4 11820 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O 527a_100000210585_100000743006 [0,1,0,0,0,1|2,0,0]=4 11821 B16R1.7414 CN(C)CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000210585 [0,1,0,0,0,1|2,0,0]=4 11822 B16R1.7414 CN(C)CCOC(=O)Nc1ccccc1Br 269982a_100102631434_100020589338 [0,1,0,0,0,1|2,0,0]=4 11823 B16R1.7414 CN(C)CCOC(=O)Nc1ccccc1Cl 269982a_100102631434_200000178450 [0,1,0,0,0,1|2,0,0]=4 11824 B16R1.7414 C[C@@H](O)CSCC(=O)Nc1ccccc1O 62a_100009817552_100000014494 [0,1,0,0,0,1|2,0,0]=4 11825 B16R1.7414 Cc1ccccc1CC(=O)CCCC(C)C 1458a_100000212180_100011214892 [0,1,0,0,0,1|2,0,0]=4 11826 B16R1.7414 Cc1ccccc1CC(=O)CCCC(C)C 1458a_100011216857_100000211839 [0,1,0,0,0,1|2,0,0]=4 11827 B16R1.7414 Cc1ccccc1CC(=O)CCCC(C)O 1458a_100000212180_200000718107 [0,1,0,0,0,1|2,0,0]=4 11828 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 11a_100000210545_100000212180 [0,1,0,0,0,1|2,0,0]=4 11829 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 1626a_100000210545_100000212180 [0,1,0,0,0,1|2,0,0]=4 11830 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 240690a_100000210545_100000212180 [0,1,0,0,0,1|2,0,0]=4 11831 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 527a_100000210545_100000212180 [0,1,0,0,0,1|2,0,0]=4 11832 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)O 240690a_200000755665_100000212180 [0,1,0,0,0,1|2,0,0]=4 11833 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)O 527a_200000755665_100000212180 [0,1,0,0,0,1|2,0,0]=4 11834 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 11a_100015192222_100011216857 [0,1,0,0,0,1|2,0,0]=4 11835 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 1626a_100015192222_100011216857 [0,1,0,0,0,1|2,0,0]=4 11836 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 22a_100015192222_100011216857 [0,1,0,0,0,1|2,0,0]=4 11837 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 527a_100015192222_100011216857 [0,1,0,0,0,1|2,0,0]=4 11838 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)O 1626a_100015192222_100000761597 [0,1,0,0,0,1|2,0,0]=4 11839 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)O 22a_100015192222_100000761597 [0,1,0,0,0,1|2,0,0]=4 11840 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)O 527a_100015192222_100000761597 [0,1,0,0,0,1|2,0,0]=4 11841 B16R1.7414 Cc1ccccc1NC(=O)NCCC(C)C 2430a_100015192222_100000210545 [0,1,0,0,0,1|2,0,0]=4 11842 B16R1.7414 Cc1ccccc1NC(=O)NCCC(C)O 2430a_100015192222_200000755665 [0,1,0,0,0,1|2,0,0]=4 11843 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1O 240690a_100000744482_100000743006 [0,1,0,0,0,1|2,0,0]=4 11844 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1O 527a_100000744482_100000743006 [0,1,0,0,0,1|2,0,0]=4 11845 B16R1.7458 CC(CO)CNC(=O)Nc1ccccc1O 2430a_100000185747_100000744482 [0,1,0,0,0,1|2,0,0]=4 11846 B16R1.7458 CCC(=O)CCC(=O)Nc1ccccc1O 1458a_100000011731_100000210202 [0,1,0,0,0,1|1,0,1]=4 11847 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1Br 1458a_100000701222_100000184730 [0,1,0,0,0,1|2,0,0]=4 11848 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1C 1458a_100000701222_100000211839 [0,1,0,0,0,1|2,0,0]=4 11849 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1Cl 1458a_100000701222_100000187162 [0,1,0,0,0,1|2,0,0]=4 11850 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1F 1458a_100000701222_100000187165 [0,1,0,0,0,1|2,0,0]=4 11851 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1I 1458a_100000701222_100011216222 [0,1,0,0,0,1|2,0,0]=4 11852 B16R1.7458 CCC(C)CCC(=O)Cc1ncccc1O 1458a_100000701222_200020655725 [0,1,0,0,0,1|2,0,0]=4 11853 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Br 11a_100000210017_100000701222 [0,1,0,0,0,1|2,0,0]=4 11854 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000701222 [0,1,0,0,0,1|2,0,0]=4 11855 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 11a_100015192222_100000701222 [0,1,0,0,0,1|2,0,0]=4 11856 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 1626a_100015192222_100000701222 [0,1,0,0,0,1|2,0,0]=4 11857 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 22a_100015192222_100000701222 [0,1,0,0,0,1|2,0,0]=4 11858 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 527a_100015192222_100000701222 [0,1,0,0,0,1|2,0,0]=4 11859 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000701222 [0,1,0,0,0,1|2,0,0]=4 11860 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000701222 [0,1,0,0,0,1|2,0,0]=4 11861 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000701222 [0,1,0,0,0,1|2,0,0]=4 11862 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000701222 [0,1,0,0,0,1|2,0,0]=4 11863 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 11a_100000210422_100000701222 [0,1,0,0,0,1|2,0,0]=4 11864 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 1626a_100000210422_100000701222 [0,1,0,0,0,1|2,0,0]=4 11865 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 22a_100000210422_100000701222 [0,1,0,0,0,1|2,0,0]=4 11866 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 527a_100000210422_100000701222 [0,1,0,0,0,1|2,0,0]=4 11867 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1I 11a_100000210053_100000701222 [0,1,0,0,0,1|2,0,0]=4 11868 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1I 1626a_100000210053_100000701222 [0,1,0,0,0,1|2,0,0]=4 11869 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000701222 [0,1,0,0,0,1|1,0,0]=3 11870 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1O 527a_100000185747_100000701222 [0,1,0,0,0,1|1,0,0]=3 11871 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br 11a_100020588543_100000751119 [0,1,0,0,0,1|2,0,0]=4 11872 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br 240690a_100020588543_100000751119 [0,1,0,0,0,1|2,0,0]=4 11873 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br 527a_100020588543_100000751119 [0,1,0,0,0,1|2,0,0]=4 11874 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 11a_100020588543_100000212180 [0,1,0,0,0,1|2,0,0]=4 11875 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 1626a_100020588543_100000212180 [0,1,0,0,0,1|2,0,0]=4 11876 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 240690a_100020588543_100000212180 [0,1,0,0,0,1|2,0,0]=4 11877 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 527a_100020588543_100000212180 [0,1,0,0,0,1|2,0,0]=4 11878 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 11a_100020588543_100000183793 [0,1,0,0,0,1|2,0,0]=4 11879 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 1626a_100020588543_100000183793 [0,1,0,0,0,1|2,0,0]=4 11880 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 240690a_100020588543_100000183793 [0,1,0,0,0,1|2,0,0]=4 11881 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 527a_100020588543_100000183793 [0,1,0,0,0,1|2,0,0]=4 11882 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 11a_100020588543_100000212012 [0,1,0,0,0,1|2,0,0]=4 11883 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 1626a_100020588543_100000212012 [0,1,0,0,0,1|2,0,0]=4 11884 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 240690a_100020588543_100000212012 [0,1,0,0,0,1|2,0,0]=4 11885 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 527a_100020588543_100000212012 [0,1,0,0,0,1|2,0,0]=4 11886 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 11a_100020588543_100000036491 [0,1,0,0,0,1|2,0,0]=4 11887 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 1626a_100020588543_100000036491 [0,1,0,0,0,1|2,0,0]=4 11888 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 240690a_100020588543_100000036491 [0,1,0,0,0,1|2,0,0]=4 11889 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 527a_100020588543_100000036491 [0,1,0,0,0,1|2,0,0]=4 11890 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1O 240690a_100020588543_100000743006 [0,1,0,0,0,1|1,0,0]=3 11891 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1O 527a_100020588543_100000743006 [0,1,0,0,0,1|1,0,0]=3 11892 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100020588543 [0,1,0,0,0,1|2,0,0]=4 11893 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1C 2430a_100015192222_100020588543 [0,1,0,0,0,1|2,0,0]=4 11894 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020588543 [0,1,0,0,0,1|2,0,0]=4 11895 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1F 2430a_100000210422_100020588543 [0,1,0,0,0,1|2,0,0]=4 11896 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1I 2430a_100000210053_100020588543 [0,1,0,0,0,1|2,0,0]=4 11897 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1O 2430a_100000185747_100020588543 [0,1,0,0,0,1|1,0,0]=3 11898 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1O 22a_100000718999_100000743006 [0,1,0,0,0,1|2,0,0]=4 11899 B16R1.7458 CCC(C)OCC(=O)Nc1ccccc1O 7a_100000210228_100000014494 [0,1,0,0,0,1|2,0,0]=4 11900 B16R1.7458 CCC(C)SCC(=O)Nc1ccccc1O 62a_100000758301_100000014494 [0,1,0,0,0,1|2,0,0]=4 11901 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1Br 1626a_100000210017_203496584001 [0,1,0,0,0,1|2,0,0]=4 11902 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1C 1626a_100015192222_203496584001 [0,1,0,0,0,1|2,0,0]=4 11903 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1C 22a_100015192222_203496584001 [0,1,0,0,0,1|2,0,0]=4 11904 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_203496584001 [0,1,0,0,0,1|2,0,0]=4 11905 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1Cl 22a_100000185783_203496584001 [0,1,0,0,0,1|2,0,0]=4 11906 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1F 1626a_100000210422_203496584001 [0,1,0,0,0,1|2,0,0]=4 11907 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1F 22a_100000210422_203496584001 [0,1,0,0,0,1|2,0,0]=4 11908 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1I 1626a_100000210053_203496584001 [0,1,0,0,0,1|2,0,0]=4 11909 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1O 22a_100000185747_203496584001 [0,1,0,0,0,1|1,0,0]=3 11910 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Br 11a_100011218483_100000751119 [0,1,0,0,0,1|2,0,0]=4 11911 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Br 240690a_100011218483_100000751119 [0,1,0,0,0,1|2,0,0]=4 11912 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Br 527a_100011218483_100000751119 [0,1,0,0,0,1|2,0,0]=4 11913 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1C 11a_100011218483_100000212180 [0,1,0,0,0,1|2,0,0]=4 11914 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1C 240690a_100011218483_100000212180 [0,1,0,0,0,1|2,0,0]=4 11915 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1C 527a_100011218483_100000212180 [0,1,0,0,0,1|2,0,0]=4 11916 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Cl 11a_100011218483_100000183793 [0,1,0,0,0,1|2,0,0]=4 11917 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Cl 240690a_100011218483_100000183793 [0,1,0,0,0,1|2,0,0]=4 11918 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Cl 527a_100011218483_100000183793 [0,1,0,0,0,1|2,0,0]=4 11919 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1F 11a_100011218483_100000212012 [0,1,0,0,0,1|2,0,0]=4 11920 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1F 240690a_100011218483_100000212012 [0,1,0,0,0,1|2,0,0]=4 11921 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1F 527a_100011218483_100000212012 [0,1,0,0,0,1|2,0,0]=4 11922 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1I 11a_100011218483_100000036491 [0,1,0,0,0,1|2,0,0]=4 11923 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1I 240690a_100011218483_100000036491 [0,1,0,0,0,1|2,0,0]=4 11924 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1I 527a_100011218483_100000036491 [0,1,0,0,0,1|2,0,0]=4 11925 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1O 240690a_100011218483_100000743006 [0,1,0,0,0,1|1,0,0]=3 11926 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1O 527a_100011218483_100000743006 [0,1,0,0,0,1|1,0,0]=3 11927 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100011218483 [0,1,0,0,0,1|2,0,0]=4 11928 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1C 2430a_100015192222_100011218483 [0,1,0,0,0,1|2,0,0]=4 11929 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100011218483 [0,1,0,0,0,1|2,0,0]=4 11930 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1F 2430a_100000210422_100011218483 [0,1,0,0,0,1|2,0,0]=4 11931 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1I 2430a_100000210053_100011218483 [0,1,0,0,0,1|2,0,0]=4 11932 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1O 2430a_100000185747_100011218483 [0,1,0,0,0,1|1,0,0]=3 11933 B16R1.7458 CCN(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000755305 [0,1,0,0,0,1|2,0,0]=4 11934 B16R1.7458 CCS(=O)CCC(=O)Nc1ccccc1O 527a_100000185747_100011387550 [0,1,0,0,0,1|2,0,0]=4 11935 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1O 240690a_100020591295_100000743006 [0,1,0,0,0,1|2,0,0]=4 11936 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1O 527a_100020591295_100000743006 [0,1,0,0,0,1|2,0,0]=4 11937 B16R1.7458 CO[C@H](C)CNC(=O)Nc1ccccc1O 2430a_100000185747_100020591295 [0,1,0,0,0,1|2,0,0]=4 11938 B16R1.7458 O=C(Cc1ccccc1O)NC[C@@H](F)CO 240690a_100015665980_100000743006 [0,1,0,0,0,1|2,0,0]=4 11939 B16R1.7458 O=C(Cc1ccccc1O)NC[C@@H](F)CO 527a_100015665980_100000743006 [0,1,0,0,0,1|2,0,0]=4 11940 B16R1.7458 O=C(Cc1ccccc1O)NC[C@H](O)CO 240690a_100020644852_100000743006 [0,1,0,0,0,1|2,0,0]=4 11941 B16R1.7458 O=C(Cc1ccccc1O)NC[C@H](O)CO 527a_100020644852_100000743006 [0,1,0,0,0,1|2,0,0]=4 11942 B16R1.7458 O=C(NC[C@@H](F)CO)Nc1ccccc1O 2430a_100000185747_100015665980 [0,1,0,0,0,1|2,0,0]=4 11943 B16R1.7458 O=C(NC[C@H](O)CO)Nc1ccccc1O 2430a_100000185747_100020644852 [0,1,0,0,0,1|2,0,0]=4 11944 B16R1.7523 CCC/C=C(\C)/C(=O)Nc1ccccc1O 22a_100000185747_200020648666 [0,1,0,0,0,1|1,0,1]=4 11945 B16R1.7523 CCCCC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_100000210211 [0,1,0,0,0,1|2,0,0]=4 11946 B16R1.7523 CCCCC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_100000210211 [0,1,0,0,0,1|2,0,0]=4 11947 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Br 1458a_100000725509_100000184730 [0,1,0,0,0,1|2,0,0]=4 11948 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Br 1458a_100000751119_200011215066 [0,1,0,0,0,1|2,0,0]=4 11949 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1C 1458a_100000212180_200011215066 [0,1,0,0,0,1|2,0,0]=4 11950 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1C 1458a_100000725509_100000211839 [0,1,0,0,0,1|2,0,0]=4 11951 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Cl 1458a_100000183793_200011215066 [0,1,0,0,0,1|2,0,0]=4 11952 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Cl 1458a_100000725509_100000187162 [0,1,0,0,0,1|2,0,0]=4 11953 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1F 1458a_100000212012_200011215066 [0,1,0,0,0,1|2,0,0]=4 11954 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1F 1458a_100000725509_100000187165 [0,1,0,0,0,1|2,0,0]=4 11955 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1I 1458a_100000036491_200011215066 [0,1,0,0,0,1|2,0,0]=4 11956 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1I 1458a_100000725509_100011216222 [0,1,0,0,0,1|2,0,0]=4 11957 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1O 1458a_100000743006_200011215066 [0,1,0,0,0,1|1,0,0]=3 11958 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1O 1458a_100000725509_200020655725 [0,1,0,0,0,1|2,0,0]=4 11959 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Br 11a_100000210017_100000725509 [0,1,0,0,0,1|2,0,0]=4 11960 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100000725509 [0,1,0,0,0,1|2,0,0]=4 11961 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 11a_100015192222_100000725509 [0,1,0,0,0,1|2,0,0]=4 11962 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 1626a_100015192222_100000725509 [0,1,0,0,0,1|2,0,0]=4 11963 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 22a_100015192222_100000725509 [0,1,0,0,0,1|2,0,0]=4 11964 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 527a_100015192222_100000725509 [0,1,0,0,0,1|2,0,0]=4 11965 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100000725509 [0,1,0,0,0,1|2,0,0]=4 11966 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000725509 [0,1,0,0,0,1|2,0,0]=4 11967 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100000725509 [0,1,0,0,0,1|2,0,0]=4 11968 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 527a_100000185783_100000725509 [0,1,0,0,0,1|2,0,0]=4 11969 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 11a_100000210422_100000725509 [0,1,0,0,0,1|2,0,0]=4 11970 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 1626a_100000210422_100000725509 [0,1,0,0,0,1|2,0,0]=4 11971 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 22a_100000210422_100000725509 [0,1,0,0,0,1|2,0,0]=4 11972 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 527a_100000210422_100000725509 [0,1,0,0,0,1|2,0,0]=4 11973 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1I 11a_100000210053_100000725509 [0,1,0,0,0,1|2,0,0]=4 11974 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1I 1626a_100000210053_100000725509 [0,1,0,0,0,1|2,0,0]=4 11975 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1O 22a_100000185747_100000725509 [0,1,0,0,0,1|1,0,0]=3 11976 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1O 527a_100000185747_100000725509 [0,1,0,0,0,1|1,0,0]=3 11977 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1Br 1458a_100000720857_100000184730 [0,1,0,0,0,1|2,0,0]=4 11978 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1C 1458a_100000720857_100000211839 [0,1,0,0,0,1|2,0,0]=4 11979 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1Cl 1458a_100000720857_100000187162 [0,1,0,0,0,1|2,0,0]=4 11980 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1F 1458a_100000720857_100000187165 [0,1,0,0,0,1|2,0,0]=4 11981 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1I 1458a_100000720857_100011216222 [0,1,0,0,0,1|2,0,0]=4 11982 B16R1.7523 CCCCC(O)C(=O)Cc1ncccc1O 1458a_100000720857_200020655725 [0,1,0,0,0,1|2,0,0]=4 11983 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1C 22a_100015192222_100000720857 [0,1,0,0,0,1|2,0,0]=4 11984 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1C 527a_100015192222_100000720857 [0,1,0,0,0,1|2,0,0]=4 11985 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Cl 22a_100000185783_100000720857 [0,1,0,0,0,1|2,0,0]=4 11986 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Cl 527a_100000185783_100000720857 [0,1,0,0,0,1|2,0,0]=4 11987 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1F 22a_100000210422_100000720857 [0,1,0,0,0,1|2,0,0]=4 11988 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1F 527a_100000210422_100000720857 [0,1,0,0,0,1|2,0,0]=4 11989 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1O 22a_100000185747_100000720857 [0,1,0,0,0,1|1,0,0]=3 11990 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1O 527a_100000185747_100000720857 [0,1,0,0,0,1|1,0,0]=3 11991 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Br 11a_100000207549_100000751119 [0,1,0,0,0,1|2,0,0]=4 11992 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Br 240690a_100000207549_100000751119 [0,1,0,0,0,1|2,0,0]=4 11993 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Br 527a_100000207549_100000751119 [0,1,0,0,0,1|2,0,0]=4 11994 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 11a_100000207549_100000212180 [0,1,0,0,0,1|2,0,0]=4 11995 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 1626a_100000207549_100000212180 [0,1,0,0,0,1|2,0,0]=4 11996 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 240690a_100000207549_100000212180 [0,1,0,0,0,1|2,0,0]=4 11997 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 527a_100000207549_100000212180 [0,1,0,0,0,1|2,0,0]=4 11998 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 11a_100000207549_100000183793 [0,1,0,0,0,1|2,0,0]=4 11999 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 1626a_100000207549_100000183793 [0,1,0,0,0,1|2,0,0]=4 12000 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 240690a_100000207549_100000183793 [0,1,0,0,0,1|2,0,0]=4 12001 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 527a_100000207549_100000183793 [0,1,0,0,0,1|2,0,0]=4 12002 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 11a_100000207549_100000212012 [0,1,0,0,0,1|2,0,0]=4 12003 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 1626a_100000207549_100000212012 [0,1,0,0,0,1|2,0,0]=4 12004 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 240690a_100000207549_100000212012 [0,1,0,0,0,1|2,0,0]=4 12005 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 527a_100000207549_100000212012 [0,1,0,0,0,1|2,0,0]=4 12006 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 11a_100000207549_100000036491 [0,1,0,0,0,1|2,0,0]=4 12007 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 1626a_100000207549_100000036491 [0,1,0,0,0,1|2,0,0]=4 12008 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 240690a_100000207549_100000036491 [0,1,0,0,0,1|2,0,0]=4 12009 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 527a_100000207549_100000036491 [0,1,0,0,0,1|2,0,0]=4 12010 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1O 240690a_100000207549_100000743006 [0,1,0,0,0,1|1,0,0]=3 12011 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1O 527a_100000207549_100000743006 [0,1,0,0,0,1|1,0,0]=3 12012 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1Br 2430a_100000210017_100000207549 [0,1,0,0,0,1|2,0,0]=4 12013 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1C 2430a_100015192222_100000207549 [0,1,0,0,0,1|2,0,0]=4 12014 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1Cl 2430a_100000185783_100000207549 [0,1,0,0,0,1|2,0,0]=4 12015 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1F 2430a_100000210422_100000207549 [0,1,0,0,0,1|2,0,0]=4 12016 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1I 2430a_100000210053_100000207549 [0,1,0,0,0,1|2,0,0]=4 12017 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1O 2430a_100000185747_100000207549 [0,1,0,0,0,1|1,0,0]=3 12018 B16R1.7523 CCCNC(=O)C(=O)Nc1ccccc1O 22a_100000185747_200011297150 [0,1,0,0,0,1|2,0,0]=4 12019 B16R1.7523 CCCNC(=O)C(=O)Nc1ccccc1O 527a_100000185747_200011297150 [0,1,0,0,0,1|2,0,0]=4 12020 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1O 240690a_100000213112_100000743006 [0,1,0,0,0,1|2,0,0]=4 12021 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1O 527a_100000213112_100000743006 [0,1,0,0,0,1|2,0,0]=4 12022 B16R1.7523 CN(CCCO)C(=O)Nc1ccccc1O 2430a_100000185747_100000213112 [0,1,0,0,0,1|2,0,0]=4 12023 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1O 240690a_100000743101_100000743006 [0,1,0,0,0,1|2,0,0]=4 12024 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1O 527a_100000743101_100000743006 [0,1,0,0,0,1|2,0,0]=4 12025 B16R1.7523 COCCN(C)C(=O)Nc1ccccc1O 2430a_100000185747_100000743101 [0,1,0,0,0,1|2,0,0]=4 12026 B16R1.7523 CSCCC(O)C(=O)Nc1ccccc1O 22a_100000185747_100000685904 [0,1,0,0,0,1|2,0,0]=4 12027 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1O 240690a_100000686725_100000743006 [0,1,0,0,0,1|2,0,0]=4 12028 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1O 527a_100000686725_100000743006 [0,1,0,0,0,1|2,0,0]=4 12029 B16R1.7523 CSCCN(C)C(=O)Nc1ccccc1O 2430a_100000185747_100000686725 [0,1,0,0,0,1|2,0,0]=4 12030 B16R1.22096 CCCC#CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_200011218047 [0,1,0,0,0,1|1,0,1]=4 12031 B16R1.22096 CCCC#CC(=O)Nc1c(cccc1F)O 22a_100020591140_200011218047 [0,1,0,0,0,1|1,0,1]=4 12032 B16R1.22096 CCCC#CC(=O)Nc1c(cccc1I)O 22a_200000049512_200011218047 [0,1,0,0,0,1|1,0,1]=4 12033 B16R1.22096 CCCC#CC(=O)Nc1c(cccc1O)C 22a_100000743429_200011218047 [0,1,0,0,0,1|1,0,1]=4 12034 B16R1.22096 CCCC#CC(=O)Nc1c(cccc1O)O 22a_100011995820_200011218047 [0,1,0,0,0,1|1,0,1]=4 12035 B16R1.22096 CCCC=CC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000212230 [0,1,0,0,0,1|1,0,1]=4 12036 B16R1.22096 CCCC=CC(=O)Nc1c(cccc1F)O 22a_100020591140_100000212230 [0,1,0,0,0,1|1,0,1]=4 12037 B16R1.22096 CCCC=CC(=O)Nc1c(cccc1I)O 22a_200000049512_100000212230 [0,1,0,0,0,1|1,0,1]=4 12038 B16R1.22096 CCCC=CC(=O)Nc1c(cccc1O)C 22a_100000743429_100000212230 [0,1,0,0,0,1|1,0,1]=4 12039 B16R1.22096 CCCC=CC(=O)Nc1c(cccc1O)O 22a_100011995820_100000212230 [0,1,0,0,0,1|1,0,1]=4 12040 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000210326 [0,1,0,0,0,1|2,0,0]=4 12041 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)C 1458a_100000212188_100010146847 [0,1,0,0,0,1|2,0,0]=4 12042 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000210326 [0,1,0,0,0,1|2,0,0]=4 12043 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000212188_100010138402 [0,1,0,0,0,1|2,0,0]=4 12044 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210326 [0,1,0,0,0,1|2,0,0]=4 12045 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)F 1458a_100000212188_100000696636 [0,1,0,0,0,1|2,0,0]=4 12046 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000210326 [0,1,0,0,0,1|2,0,0]=4 12047 B16R1.22096 CCCCCC(=O)Cc1c(cccc1C)C 1458a_100000212188_100000758300 [0,1,0,0,0,1|2,0,0]=4 12048 B16R1.22096 CCCCCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000210326 [0,1,0,0,0,1|2,0,0]=4 12049 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210326 [0,1,0,0,0,1|2,0,0]=4 12050 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000212188_100000187851 [0,1,0,0,0,1|2,0,0]=4 12051 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210326 [0,1,0,0,0,1|2,0,0]=4 12052 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000212188_100000187852 [0,1,0,0,0,1|2,0,0]=4 12053 B16R1.22096 CCCCCC(=O)Cc1c(cccc1F)C 1458a_100000212188_100009814554 [0,1,0,0,0,1|2,0,0]=4 12054 B16R1.22096 CCCCCC(=O)Cc1c(cccc1F)F 1458a_100000212188_100000698325 [0,1,0,0,0,1|2,0,0]=4 12055 B16R1.22096 CCCCCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000210326 [0,1,0,0,0,1|2,0,0]=4 12056 B16R1.22096 CCCCCC(=O)Cc1c(cccc1I)Br 1458a_100000212188_100010146611 [0,1,0,0,0,1|2,0,0]=4 12057 B16R1.22096 CCCCCC(=O)Cc1c(cccc1I)C 1458a_100000212188_100010150146 [0,1,0,0,0,1|2,0,0]=4 12058 B16R1.22096 CCCCCC(=O)Cc1c(cccc1I)F 1458a_100000212188_100010149602 [0,1,0,0,0,1|2,0,0]=4 12059 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)Br 1626a_100000690995_100000212188 [0,1,0,0,0,1|2,0,0]=4 12060 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)C 11a_100011834072_100000212188 [0,1,0,0,0,1|2,0,0]=4 12061 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)C 1626a_100011834072_100000212188 [0,1,0,0,0,1|2,0,0]=4 12062 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)Cl 11a_100102946385_100000212188 [0,1,0,0,0,1|2,0,0]=4 12063 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)Cl 1626a_100102946385_100000212188 [0,1,0,0,0,1|2,0,0]=4 12064 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)F 11a_100000684712_100000212188 [0,1,0,0,0,1|2,0,0]=4 12065 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)F 1626a_100000684712_100000212188 [0,1,0,0,0,1|2,0,0]=4 12066 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000212188 [0,1,0,0,0,1|1,0,0]=3 12067 B16R1.22096 CCCCCC(=O)Nc1c(cccc1C)C 11a_100000185769_100000212188 [0,1,0,0,0,1|2,0,0]=4 12068 B16R1.22096 CCCCCC(=O)Nc1c(cccc1C)C 1626a_100000185769_100000212188 [0,1,0,0,0,1|2,0,0]=4 12069 B16R1.22096 CCCCCC(=O)Nc1c(cccc1C)C 22a_100000185769_100000212188 [0,1,0,0,0,1|2,0,0]=4 12070 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)C 11a_100000756524_100000212188 [0,1,0,0,0,1|2,0,0]=4 12071 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)C 1626a_100000756524_100000212188 [0,1,0,0,0,1|2,0,0]=4 12072 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100000212188 [0,1,0,0,0,1|2,0,0]=4 12073 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100000212188 [0,1,0,0,0,1|2,0,0]=4 12074 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)F 11a_100000760031_100000212188 [0,1,0,0,0,1|2,0,0]=4 12075 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)F 1626a_100000760031_100000212188 [0,1,0,0,0,1|2,0,0]=4 12076 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000212188 [0,1,0,0,0,1|1,0,0]=3 12077 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000212188 [0,1,0,0,0,1|1,0,0]=3 12078 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)C 11a_100000766463_100000212188 [0,1,0,0,0,1|2,0,0]=4 12079 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)C 1626a_100000766463_100000212188 [0,1,0,0,0,1|2,0,0]=4 12080 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)C 22a_100000766463_100000212188 [0,1,0,0,0,1|2,0,0]=4 12081 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)F 11a_100000210704_100000212188 [0,1,0,0,0,1|2,0,0]=4 12082 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)F 1626a_100000210704_100000212188 [0,1,0,0,0,1|2,0,0]=4 12083 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000212188 [0,1,0,0,0,1|1,0,0]=3 12084 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000212188 [0,1,0,0,0,1|1,0,0]=3 12085 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Br 11a_100010146558_100000212188 [0,1,0,0,0,1|2,0,0]=4 12086 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Br 1626a_100010146558_100000212188 [0,1,0,0,0,1|2,0,0]=4 12087 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Cl 11a_100010190421_100000212188 [0,1,0,0,0,1|2,0,0]=4 12088 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Cl 1626a_100010190421_100000212188 [0,1,0,0,0,1|2,0,0]=4 12089 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)F 11a_100000042321_100000212188 [0,1,0,0,0,1|2,0,0]=4 12090 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)F 1626a_100000042321_100000212188 [0,1,0,0,0,1|2,0,0]=4 12091 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000212188 [0,1,0,0,0,1|1,0,0]=3 12092 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000212188 [0,1,0,0,0,1|1,0,0]=3 12093 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000212188 [0,1,0,0,0,1|1,0,0]=3 12094 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000212188 [0,1,0,0,0,1|1,0,0]=3 12095 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000212188 [0,1,0,0,0,1|1,0,0]=3 12096 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000212188 [0,1,0,0,0,1|1,0,0]=3 12097 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Br 11a_100000102301_100010209379 [0,1,0,0,0,1|2,0,0]=4 12098 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Br 240690a_100000102301_100010209379 [0,1,0,0,0,1|2,0,0]=4 12099 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Br 527a_100000102301_100010209379 [0,1,0,0,0,1|2,0,0]=4 12100 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 11a_100000102301_100010147022 [0,1,0,0,0,1|2,0,0]=4 12101 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 1626a_100000102301_100010147022 [0,1,0,0,0,1|2,0,0]=4 12102 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 240690a_100000102301_100010147022 [0,1,0,0,0,1|2,0,0]=4 12103 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 527a_100000102301_100010147022 [0,1,0,0,0,1|2,0,0]=4 12104 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 11a_100000102301_100013084675 [0,1,0,0,0,1|2,0,0]=4 12105 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 1626a_100000102301_100013084675 [0,1,0,0,0,1|2,0,0]=4 12106 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 240690a_100000102301_100013084675 [0,1,0,0,0,1|2,0,0]=4 12107 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 527a_100000102301_100013084675 [0,1,0,0,0,1|2,0,0]=4 12108 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 11a_100000102301_100010172741 [0,1,0,0,0,1|2,0,0]=4 12109 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 1626a_100000102301_100010172741 [0,1,0,0,0,1|2,0,0]=4 12110 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 240690a_100000102301_100010172741 [0,1,0,0,0,1|2,0,0]=4 12111 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 527a_100000102301_100010172741 [0,1,0,0,0,1|2,0,0]=4 12112 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 11a_100000102301_100000689862 [0,1,0,0,0,1|2,0,0]=4 12113 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 1626a_100000102301_100000689862 [0,1,0,0,0,1|2,0,0]=4 12114 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 240690a_100000102301_100000689862 [0,1,0,0,0,1|2,0,0]=4 12115 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 527a_100000102301_100000689862 [0,1,0,0,0,1|2,0,0]=4 12116 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 11a_100000102301_100000211232 [0,1,0,0,0,1|2,0,0]=4 12117 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100000102301_100000211232 [0,1,0,0,0,1|2,0,0]=4 12118 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100000102301_100000211232 [0,1,0,0,0,1|2,0,0]=4 12119 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 527a_100000102301_100000211232 [0,1,0,0,0,1|2,0,0]=4 12120 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 11a_100000102301_100000185183 [0,1,0,0,0,1|2,0,0]=4 12121 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 1626a_100000102301_100000185183 [0,1,0,0,0,1|2,0,0]=4 12122 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 240690a_100000102301_100000185183 [0,1,0,0,0,1|2,0,0]=4 12123 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 527a_100000102301_100000185183 [0,1,0,0,0,1|2,0,0]=4 12124 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 11a_100000102301_100000684726 [0,1,0,0,0,1|2,0,0]=4 12125 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 1626a_100000102301_100000684726 [0,1,0,0,0,1|2,0,0]=4 12126 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 240690a_100000102301_100000684726 [0,1,0,0,0,1|2,0,0]=4 12127 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 527a_100000102301_100000684726 [0,1,0,0,0,1|2,0,0]=4 12128 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Br)C 2430a_100011834072_100000102301 [0,1,0,0,0,1|2,0,0]=4 12129 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Br)Cl 2430a_100102946385_100000102301 [0,1,0,0,0,1|2,0,0]=4 12130 B16R1.22096 CCCCNC(=O)Nc1c(cccc1C)C 2430a_100000185769_100000102301 [0,1,0,0,0,1|2,0,0]=4 12131 B16R1.22096 CCCCNC(=O)Nc1c(cccc1C)C 512a_100000102301_100000185769 [0,1,0,0,0,1|2,0,0]=4 12132 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Cl)C 2430a_100000756524_100000102301 [0,1,0,0,0,1|2,0,0]=4 12133 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Cl)F 2430a_100000760031_100000102301 [0,1,0,0,0,1|2,0,0]=4 12134 B16R1.22096 CCCCNC(=O)Nc1c(cccc1F)C 2430a_100000766463_100000102301 [0,1,0,0,0,1|2,0,0]=4 12135 B16R1.22096 CCCCNC(=O)Nc1c(cccc1F)F 2430a_100000210704_100000102301 [0,1,0,0,0,1|2,0,0]=4 12136 B16R1.22096 CCCCNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100000102301 [0,1,0,0,0,1|1,0,0]=3 12137 B16R1.22096 CCCCNC(=O)Nc1c(cccc1I)Br 512a_100010146558_100000102301 [0,1,0,0,0,1|2,0,0]=4 12138 B16R1.22096 CCCCNC(=O)Nc1c(cccc1I)F 2430a_100000042321_100000102301 [0,1,0,0,0,1|2,0,0]=4 12139 B16R1.22096 CCCCNC(=O)Nc1c(cccc1O)C 2430a_100000743429_100000102301 [0,1,0,0,0,1|1,0,0]=3 12140 B16R1.22096 CCCOCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000745993 [0,1,0,0,0,1|2,0,0]=4 12141 B16R1.22096 CCCOCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000745993 [0,1,0,0,0,1|2,0,0]=4 12142 B16R1.22096 CCCOCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000745993 [0,1,0,0,0,1|2,0,0]=4 12143 B16R1.22096 CCCOCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000745993 [0,1,0,0,0,1|2,0,0]=4 12144 B16R1.22096 CCCOCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000745993 [0,1,0,0,0,1|2,0,0]=4 12145 B16R1.22096 CCCOCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000745993 [0,1,0,0,0,1|2,0,0]=4 12146 B16R1.22096 CCCOCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000745993 [0,1,0,0,0,1|2,0,0]=4 12147 B16R1.22096 CCCOCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000745993 [0,1,0,0,0,1|2,0,0]=4 12148 B16R1.22096 CCCOCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000745993 [0,1,0,0,0,1|2,0,0]=4 12149 B16R1.22096 CCCOCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000745993 [0,1,0,0,0,1|2,0,0]=4 12150 B16R1.22096 CCCOCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000745993 [0,1,0,0,0,1|2,0,0]=4 12151 B16R1.22096 CCCSCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000217233 [0,1,0,0,0,1|2,0,0]=4 12152 B16R1.22096 CCCSCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000217233 [0,1,0,0,0,1|2,0,0]=4 12153 B16R1.22096 CCCSCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000217233 [0,1,0,0,0,1|2,0,0]=4 12154 B16R1.22096 CCCSCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000217233 [0,1,0,0,0,1|2,0,0]=4 12155 B16R1.22096 CCCSCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000217233 [0,1,0,0,0,1|2,0,0]=4 12156 B16R1.22096 CCCSCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000217233 [0,1,0,0,0,1|2,0,0]=4 12157 B16R1.22096 CCCSCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000217233 [0,1,0,0,0,1|2,0,0]=4 12158 B16R1.22096 CCCSCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000217233 [0,1,0,0,0,1|2,0,0]=4 12159 B16R1.22096 CCCSCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000217233 [0,1,0,0,0,1|2,0,0]=4 12160 B16R1.22096 CCCSCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000217233 [0,1,0,0,0,1|2,0,0]=4 12161 B16R1.22096 CCCSCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000217233 [0,1,0,0,0,1|2,0,0]=4 12162 B16R1.22096 CCOCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000749530 [0,1,0,0,0,1|2,0,0]=4 12163 B16R1.22096 CCOCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000749530 [0,1,0,0,0,1|2,0,0]=4 12164 B16R1.22096 CCOCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000749530 [0,1,0,0,0,1|2,0,0]=4 12165 B16R1.22096 CCOCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000749530 [0,1,0,0,0,1|2,0,0]=4 12166 B16R1.22096 CCOCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000749530 [0,1,0,0,0,1|2,0,0]=4 12167 B16R1.22096 CCOCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000749530 [0,1,0,0,0,1|2,0,0]=4 12168 B16R1.22096 CCOCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000749530 [0,1,0,0,0,1|2,0,0]=4 12169 B16R1.22096 CCOCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000749530 [0,1,0,0,0,1|2,0,0]=4 12170 B16R1.22096 CCOCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000749530 [0,1,0,0,0,1|2,0,0]=4 12171 B16R1.22096 CCOCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000749530 [0,1,0,0,0,1|2,0,0]=4 12172 B16R1.22096 CCOCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000749530 [0,1,0,0,0,1|2,0,0]=4 12173 B16R1.22096 CCSCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000230768 [0,1,0,0,0,1|2,0,0]=4 12174 B16R1.22096 CCSCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000230768 [0,1,0,0,0,1|2,0,0]=4 12175 B16R1.22096 CCSCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000230768 [0,1,0,0,0,1|2,0,0]=4 12176 B16R1.22096 CCSCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000230768 [0,1,0,0,0,1|2,0,0]=4 12177 B16R1.22096 CCSCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000230768 [0,1,0,0,0,1|2,0,0]=4 12178 B16R1.22096 CCSCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000230768 [0,1,0,0,0,1|2,0,0]=4 12179 B16R1.22096 CCSCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000230768 [0,1,0,0,0,1|2,0,0]=4 12180 B16R1.22096 CCSCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000230768 [0,1,0,0,0,1|2,0,0]=4 12181 B16R1.22096 CCSCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000230768 [0,1,0,0,0,1|2,0,0]=4 12182 B16R1.22096 CCSCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000230768 [0,1,0,0,0,1|2,0,0]=4 12183 B16R1.22096 CCSCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000230768 [0,1,0,0,0,1|2,0,0]=4 12184 B16R1.22096 CNCCOC(=O)Nc1c(cccc1C)C 2230a_106832991635_200009990517 [0,1,0,0,0,1|2,0,0]=4 12185 B16R1.22096 CNCCOC(=O)Nc1c(cccc1C)C 34a_100102657272_200009990517 [0,1,0,0,0,1|2,0,0]=4 12186 B16R1.22096 CNCCOC(=O)Nc1c(cccc1C)C 7a_106832991635_200009990517 [0,1,0,0,0,1|2,0,0]=4 12187 B16R1.22096 COCCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000741012 [0,1,0,0,0,1|2,0,0]=4 12188 B16R1.22096 COCCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000741012 [0,1,0,0,0,1|2,0,0]=4 12189 B16R1.22096 COCCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000741012 [0,1,0,0,0,1|2,0,0]=4 12190 B16R1.22096 COCCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000741012 [0,1,0,0,0,1|2,0,0]=4 12191 B16R1.22096 COCCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000741012 [0,1,0,0,0,1|2,0,0]=4 12192 B16R1.22096 COCCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000741012 [0,1,0,0,0,1|2,0,0]=4 12193 B16R1.22096 COCCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000741012 [0,1,0,0,0,1|2,0,0]=4 12194 B16R1.22096 COCCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000741012 [0,1,0,0,0,1|2,0,0]=4 12195 B16R1.22096 COCCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000741012 [0,1,0,0,0,1|2,0,0]=4 12196 B16R1.22096 COCCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000741012 [0,1,0,0,0,1|2,0,0]=4 12197 B16R1.22096 COCCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000741012 [0,1,0,0,0,1|2,0,0]=4 12198 B16R1.22096 COCCNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100000209980 [0,1,0,0,0,1|2,0,0]=4 12199 B16R1.22096 COCCNC(=O)Nc1c(cccc1O)C 2430a_100000743429_100000209980 [0,1,0,0,0,1|2,0,0]=4 12200 B16R1.22096 COCCOC(=O)Nc1c(cccc1C)C 34a_100138415774_200009990517 [0,1,0,0,0,1|2,0,0]=4 12201 B16R1.22096 CSCCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000173376 [0,1,0,0,0,1|2,0,0]=4 12202 B16R1.22096 CSCCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000173376 [0,1,0,0,0,1|2,0,0]=4 12203 B16R1.22096 CSCCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000173376 [0,1,0,0,0,1|2,0,0]=4 12204 B16R1.22096 CSCCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000173376 [0,1,0,0,0,1|2,0,0]=4 12205 B16R1.22096 CSCCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000173376 [0,1,0,0,0,1|2,0,0]=4 12206 B16R1.22096 CSCCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000173376 [0,1,0,0,0,1|2,0,0]=4 12207 B16R1.22096 CSCCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000173376 [0,1,0,0,0,1|2,0,0]=4 12208 B16R1.22096 CSCCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000173376 [0,1,0,0,0,1|2,0,0]=4 12209 B16R1.22096 CSCCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000173376 [0,1,0,0,0,1|2,0,0]=4 12210 B16R1.22096 CSCCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000173376 [0,1,0,0,0,1|2,0,0]=4 12211 B16R1.22096 CSCCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000173376 [0,1,0,0,0,1|2,0,0]=4 12212 B16R1.22096 CSCCNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100020590264 [0,1,0,0,0,1|2,0,0]=4 12213 B16R1.22096 CSCCNC(=O)Nc1c(cccc1O)C 2430a_100000743429_100020590264 [0,1,0,0,0,1|2,0,0]=4 12214 B16R1.22096 CSCCOC(=O)Nc1c(cccc1C)C 62a_200000210301_200009990517 [0,1,0,0,0,1|2,0,0]=4 12215 B16R1.22096 Cc1cccc(c1NC(=O)NCCCF)O 2430a_100000743429_100015189416 [0,1,0,0,0,1|2,0,0]=4 12216 B16R1.22096 Cc1cccc(c1NC(=O)NCCCO)O 2430a_100000743429_100000182051 [0,1,0,0,0,1|2,0,0]=4 12217 B16R1.22096 Cc1cccc(c1NC(=O)OCCS[13CH3])C 62a_200025704644_200009990517 [0,1,0,0,0,1|2,0,0]=4 12218 B16R1.22096 O=C(NCCCF)Nc1c(cccc1F)O 2430a_100020591140_100015189416 [0,1,0,0,0,1|2,0,0]=4 12219 B16R1.22096 O=C(NCCCO)Nc1c(cccc1F)O 2430a_100020591140_100000182051 [0,1,0,0,0,1|2,0,0]=4 12220 B16R1.22955 CCCC#CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_200011218047 [0,1,0,0,0,1|1,0,1]=4 12221 B16R1.22955 CCCC#CC(=O)Nc1ccc(cc1O)C 22a_100000211527_200011218047 [0,1,0,0,0,1|1,0,1]=4 12222 B16R1.22955 CCCC#CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_200011218047 [0,1,0,0,0,1|1,0,1]=4 12223 B16R1.22955 CCCC#CC(=O)Nc1ccc(cc1O)F 22a_100000753323_200011218047 [0,1,0,0,0,1|1,0,1]=4 12224 B16R1.22955 CCCC#CC(=O)Nc1ccc(cc1O)I 22a_100000057187_200011218047 [0,1,0,0,0,1|1,0,1]=4 12225 B16R1.22955 CCCC#CC(=O)Nc1ccc(cc1O)O 22a_100000106777_200011218047 [0,1,0,0,0,1|1,0,1]=4 12226 B16R1.22955 CCCC=CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000212230 [0,1,0,0,0,1|1,0,1]=4 12227 B16R1.22955 CCCC=CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000212230 [0,1,0,0,0,1|1,0,1]=4 12228 B16R1.22955 CCCC=CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000212230 [0,1,0,0,0,1|1,0,1]=4 12229 B16R1.22955 CCCC=CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000212230 [0,1,0,0,0,1|1,0,1]=4 12230 B16R1.22955 CCCC=CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000212230 [0,1,0,0,0,1|1,0,1]=4 12231 B16R1.22955 CCCC=CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000212230 [0,1,0,0,0,1|1,0,1]=4 12232 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000212188_200012351560 [0,1,0,0,0,1|2,0,0]=4 12233 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210326 [0,1,0,0,0,1|2,0,0]=4 12234 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000212188_100000755608 [0,1,0,0,0,1|2,0,0]=4 12235 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210326 [0,1,0,0,0,1|2,0,0]=4 12236 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000212188_100000243222 [0,1,0,0,0,1|2,0,0]=4 12237 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000210326 [0,1,0,0,0,1|2,0,0]=4 12238 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)I 1458a_100000212188_100010146610 [0,1,0,0,0,1|2,0,0]=4 12239 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210326 [0,1,0,0,0,1|2,0,0]=4 12240 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000212188_100000708836 [0,1,0,0,0,1|2,0,0]=4 12241 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000210326 [0,1,0,0,0,1|2,0,0]=4 12242 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)C 1458a_100000212188_100011219618 [0,1,0,0,0,1|2,0,0]=4 12243 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000210326 [0,1,0,0,0,1|2,0,0]=4 12244 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000212188_100012361307 [0,1,0,0,0,1|2,0,0]=4 12245 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)F 1458a_100000212188_100000700533 [0,1,0,0,0,1|2,0,0]=4 12246 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000210326 [0,1,0,0,0,1|2,0,0]=4 12247 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000212188_100011740631 [0,1,0,0,0,1|2,0,0]=4 12248 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210326 [0,1,0,0,0,1|2,0,0]=4 12249 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000212188_100012349684 [0,1,0,0,0,1|2,0,0]=4 12250 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210326 [0,1,0,0,0,1|2,0,0]=4 12251 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000212188_100000188473 [0,1,0,0,0,1|2,0,0]=4 12252 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000212188_100011216360 [0,1,0,0,0,1|2,0,0]=4 12253 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210326 [0,1,0,0,0,1|2,0,0]=4 12254 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Br 1458a_100000212188_100000211606 [0,1,0,0,0,1|2,0,0]=4 12255 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000210326 [0,1,0,0,0,1|2,0,0]=4 12256 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000210326 [0,1,0,0,0,1|2,0,0]=4 12257 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)C 1458a_100000212188_100012002367 [0,1,0,0,0,1|2,0,0]=4 12258 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000212188_100000709361 [0,1,0,0,0,1|2,0,0]=4 12259 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210326 [0,1,0,0,0,1|2,0,0]=4 12260 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)F 1458a_100000212188_100000748237 [0,1,0,0,0,1|2,0,0]=4 12261 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000210326 [0,1,0,0,0,1|2,0,0]=4 12262 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)I 1458a_100000212188_100010244991 [0,1,0,0,0,1|2,0,0]=4 12263 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000210326 [0,1,0,0,0,1|2,0,0]=4 12264 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210326 [0,1,0,0,0,1|2,0,0]=4 12265 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1I)Br 1458a_100000212188_100010146615 [0,1,0,0,0,1|2,0,0]=4 12266 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000212188_100010254388 [0,1,0,0,0,1|2,0,0]=4 12267 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1I)F 1458a_100000212188_100012354799 [0,1,0,0,0,1|2,0,0]=4 12268 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210326 [0,1,0,0,0,1|1,0,0]=3 12269 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100000212188 [0,1,0,0,0,1|2,0,0]=4 12270 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100000212188 [0,1,0,0,0,1|2,0,0]=4 12271 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000212188 [0,1,0,0,0,1|2,0,0]=4 12272 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000212188 [0,1,0,0,0,1|2,0,0]=4 12273 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000212188 [0,1,0,0,0,1|2,0,0]=4 12274 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000212188 [0,1,0,0,0,1|2,0,0]=4 12275 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100000212188 [0,1,0,0,0,1|2,0,0]=4 12276 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100000212188 [0,1,0,0,0,1|2,0,0]=4 12277 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100000212188 [0,1,0,0,0,1|2,0,0]=4 12278 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100000212188 [0,1,0,0,0,1|2,0,0]=4 12279 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000212188 [0,1,0,0,0,1|2,0,0]=4 12280 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100000212188 [0,1,0,0,0,1|2,0,0]=4 12281 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100000212188 [0,1,0,0,0,1|2,0,0]=4 12282 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100000212188 [0,1,0,0,0,1|2,0,0]=4 12283 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000212188 [0,1,0,0,0,1|2,0,0]=4 12284 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000212188 [0,1,0,0,0,1|2,0,0]=4 12285 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000212188 [0,1,0,0,0,1|2,0,0]=4 12286 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000212188 [0,1,0,0,0,1|2,0,0]=4 12287 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000212188 [0,1,0,0,0,1|2,0,0]=4 12288 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000212188 [0,1,0,0,0,1|2,0,0]=4 12289 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000212188 [0,1,0,0,0,1|2,0,0]=4 12290 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000212188 [0,1,0,0,0,1|2,0,0]=4 12291 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 11a_100000211637_100000212188 [0,1,0,0,0,1|2,0,0]=4 12292 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100000212188 [0,1,0,0,0,1|2,0,0]=4 12293 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000212188 [0,1,0,0,0,1|2,0,0]=4 12294 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 527a_100000211637_100000212188 [0,1,0,0,0,1|2,0,0]=4 12295 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)I 11a_100000184554_100000212188 [0,1,0,0,0,1|2,0,0]=4 12296 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100000212188 [0,1,0,0,0,1|2,0,0]=4 12297 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000212188 [0,1,0,0,0,1|2,0,0]=4 12298 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000212188 [0,1,0,0,0,1|2,0,0]=4 12299 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)O 527a_100000756630_100000212188 [0,1,0,0,0,1|2,0,0]=4 12300 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000212188 [0,1,0,0,0,1|2,0,0]=4 12301 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000212188 [0,1,0,0,0,1|2,0,0]=4 12302 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000212188 [0,1,0,0,0,1|2,0,0]=4 12303 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000212188 [0,1,0,0,0,1|2,0,0]=4 12304 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000212188 [0,1,0,0,0,1|2,0,0]=4 12305 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000212188 [0,1,0,0,0,1|2,0,0]=4 12306 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000212188 [0,1,0,0,0,1|2,0,0]=4 12307 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000212188 [0,1,0,0,0,1|2,0,0]=4 12308 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000212188 [0,1,0,0,0,1|2,0,0]=4 12309 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000212188 [0,1,0,0,0,1|2,0,0]=4 12310 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000212188 [0,1,0,0,0,1|2,0,0]=4 12311 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000212188 [0,1,0,0,0,1|2,0,0]=4 12312 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000212188 [0,1,0,0,0,1|2,0,0]=4 12313 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000212188 [0,1,0,0,0,1|2,0,0]=4 12314 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000212188 [0,1,0,0,0,1|2,0,0]=4 12315 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000212188 [0,1,0,0,0,1|2,0,0]=4 12316 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100000212188 [0,1,0,0,0,1|2,0,0]=4 12317 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100000212188 [0,1,0,0,0,1|2,0,0]=4 12318 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000212188 [0,1,0,0,0,1|2,0,0]=4 12319 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000212188 [0,1,0,0,0,1|2,0,0]=4 12320 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000212188 [0,1,0,0,0,1|2,0,0]=4 12321 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000212188 [0,1,0,0,0,1|2,0,0]=4 12322 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000212188 [0,1,0,0,0,1|2,0,0]=4 12323 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000212188 [0,1,0,0,0,1|2,0,0]=4 12324 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000212188 [0,1,0,0,0,1|2,0,0]=4 12325 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000212188 [0,1,0,0,0,1|2,0,0]=4 12326 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)F 11a_100000210720_100000212188 [0,1,0,0,0,1|2,0,0]=4 12327 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100000212188 [0,1,0,0,0,1|2,0,0]=4 12328 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000212188 [0,1,0,0,0,1|2,0,0]=4 12329 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)I 11a_100011215594_100000212188 [0,1,0,0,0,1|2,0,0]=4 12330 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100000212188 [0,1,0,0,0,1|2,0,0]=4 12331 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000212188 [0,1,0,0,0,1|2,0,0]=4 12332 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000212188 [0,1,0,0,0,1|2,0,0]=4 12333 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)O 527a_100000759473_100000212188 [0,1,0,0,0,1|2,0,0]=4 12334 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100000212188 [0,1,0,0,0,1|2,0,0]=4 12335 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100000212188 [0,1,0,0,0,1|2,0,0]=4 12336 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000212188 [0,1,0,0,0,1|2,0,0]=4 12337 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000212188 [0,1,0,0,0,1|2,0,0]=4 12338 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000212188 [0,1,0,0,0,1|2,0,0]=4 12339 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000212188 [0,1,0,0,0,1|2,0,0]=4 12340 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)F 11a_100000760547_100000212188 [0,1,0,0,0,1|2,0,0]=4 12341 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100000212188 [0,1,0,0,0,1|2,0,0]=4 12342 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000212188 [0,1,0,0,0,1|2,0,0]=4 12343 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)I 11a_100010002754_100000212188 [0,1,0,0,0,1|2,0,0]=4 12344 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100000212188 [0,1,0,0,0,1|2,0,0]=4 12345 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000212188 [0,1,0,0,0,1|2,0,0]=4 12346 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)O 527a_100010084370_100000212188 [0,1,0,0,0,1|2,0,0]=4 12347 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000212188 [0,1,0,0,0,1|1,0,0]=3 12348 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000212188 [0,1,0,0,0,1|1,0,0]=3 12349 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000212188 [0,1,0,0,0,1|1,0,0]=3 12350 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000212188 [0,1,0,0,0,1|1,0,0]=3 12351 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000212188 [0,1,0,0,0,1|1,0,0]=3 12352 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000212188 [0,1,0,0,0,1|1,0,0]=3 12353 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000212188 [0,1,0,0,0,1|1,0,0]=3 12354 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000212188 [0,1,0,0,0,1|1,0,0]=3 12355 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000212188 [0,1,0,0,0,1|1,0,0]=3 12356 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000212188 [0,1,0,0,0,1|1,0,0]=3 12357 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000212188 [0,1,0,0,0,1|1,0,0]=3 12358 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000212188 [0,1,0,0,0,1|1,0,0]=3 12359 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br 11a_100000102301_100010172832 [0,1,0,0,0,1|2,0,0]=4 12360 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br 240690a_100000102301_100010172832 [0,1,0,0,0,1|2,0,0]=4 12361 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br 527a_100000102301_100010172832 [0,1,0,0,0,1|2,0,0]=4 12362 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 11a_100000102301_100000755479 [0,1,0,0,0,1|2,0,0]=4 12363 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100000102301_100000755479 [0,1,0,0,0,1|2,0,0]=4 12364 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100000102301_100000755479 [0,1,0,0,0,1|2,0,0]=4 12365 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 527a_100000102301_100000755479 [0,1,0,0,0,1|2,0,0]=4 12366 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 11a_100000102301_100000708238 [0,1,0,0,0,1|2,0,0]=4 12367 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 1626a_100000102301_100000708238 [0,1,0,0,0,1|2,0,0]=4 12368 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 240690a_100000102301_100000708238 [0,1,0,0,0,1|2,0,0]=4 12369 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 527a_100000102301_100000708238 [0,1,0,0,0,1|2,0,0]=4 12370 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)O 240690a_100000102301_100010176083 [0,1,0,0,0,1|2,0,0]=4 12371 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)O 527a_100000102301_100010176083 [0,1,0,0,0,1|2,0,0]=4 12372 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 11a_100000102301_100000697930 [0,1,0,0,0,1|2,0,0]=4 12373 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 1626a_100000102301_100000697930 [0,1,0,0,0,1|2,0,0]=4 12374 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 240690a_100000102301_100000697930 [0,1,0,0,0,1|2,0,0]=4 12375 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 527a_100000102301_100000697930 [0,1,0,0,0,1|2,0,0]=4 12376 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 11a_100000102301_100011236500 [0,1,0,0,0,1|2,0,0]=4 12377 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 1626a_100000102301_100011236500 [0,1,0,0,0,1|2,0,0]=4 12378 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 240690a_100000102301_100011236500 [0,1,0,0,0,1|2,0,0]=4 12379 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 527a_100000102301_100011236500 [0,1,0,0,0,1|2,0,0]=4 12380 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 11a_100000102301_100011667441 [0,1,0,0,0,1|2,0,0]=4 12381 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 1626a_100000102301_100011667441 [0,1,0,0,0,1|2,0,0]=4 12382 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 240690a_100000102301_100011667441 [0,1,0,0,0,1|2,0,0]=4 12383 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 527a_100000102301_100011667441 [0,1,0,0,0,1|2,0,0]=4 12384 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 11a_100000102301_100012361378 [0,1,0,0,0,1|2,0,0]=4 12385 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 1626a_100000102301_100012361378 [0,1,0,0,0,1|2,0,0]=4 12386 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100000102301_100012361378 [0,1,0,0,0,1|2,0,0]=4 12387 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 527a_100000102301_100012361378 [0,1,0,0,0,1|2,0,0]=4 12388 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100000102301_100000210926 [0,1,0,0,0,1|2,0,0]=4 12389 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100000102301_100000210926 [0,1,0,0,0,1|2,0,0]=4 12390 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100000102301_100000210926 [0,1,0,0,0,1|2,0,0]=4 12391 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100000102301_100000210926 [0,1,0,0,0,1|2,0,0]=4 12392 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 11a_100000102301_100000690284 [0,1,0,0,0,1|2,0,0]=4 12393 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 1626a_100000102301_100000690284 [0,1,0,0,0,1|2,0,0]=4 12394 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 240690a_100000102301_100000690284 [0,1,0,0,0,1|2,0,0]=4 12395 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 527a_100000102301_100000690284 [0,1,0,0,0,1|2,0,0]=4 12396 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 11a_100000102301_100011295475 [0,1,0,0,0,1|2,0,0]=4 12397 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 1626a_100000102301_100011295475 [0,1,0,0,0,1|2,0,0]=4 12398 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 240690a_100000102301_100011295475 [0,1,0,0,0,1|2,0,0]=4 12399 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 527a_100000102301_100011295475 [0,1,0,0,0,1|2,0,0]=4 12400 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 11a_100000102301_100000042674 [0,1,0,0,0,1|2,0,0]=4 12401 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 1626a_100000102301_100000042674 [0,1,0,0,0,1|2,0,0]=4 12402 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 240690a_100000102301_100000042674 [0,1,0,0,0,1|2,0,0]=4 12403 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 527a_100000102301_100000042674 [0,1,0,0,0,1|2,0,0]=4 12404 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 11a_100000102301_100011830378 [0,1,0,0,0,1|2,0,0]=4 12405 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 1626a_100000102301_100011830378 [0,1,0,0,0,1|2,0,0]=4 12406 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 240690a_100000102301_100011830378 [0,1,0,0,0,1|2,0,0]=4 12407 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 527a_100000102301_100011830378 [0,1,0,0,0,1|2,0,0]=4 12408 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 11a_100000102301_100000684719 [0,1,0,0,0,1|2,0,0]=4 12409 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 1626a_100000102301_100000684719 [0,1,0,0,0,1|2,0,0]=4 12410 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 240690a_100000102301_100000684719 [0,1,0,0,0,1|2,0,0]=4 12411 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 527a_100000102301_100000684719 [0,1,0,0,0,1|2,0,0]=4 12412 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 11a_100000102301_100010149628 [0,1,0,0,0,1|2,0,0]=4 12413 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 1626a_100000102301_100010149628 [0,1,0,0,0,1|2,0,0]=4 12414 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 240690a_100000102301_100010149628 [0,1,0,0,0,1|2,0,0]=4 12415 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 527a_100000102301_100010149628 [0,1,0,0,0,1|2,0,0]=4 12416 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)O 240690a_100000102301_100000090534 [0,1,0,0,0,1|2,0,0]=4 12417 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)O 527a_100000102301_100000090534 [0,1,0,0,0,1|2,0,0]=4 12418 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1O)Br 240690a_100000102301_100000707504 [0,1,0,0,0,1|1,0,0]=3 12419 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100000102301 [0,1,0,0,0,1|2,0,0]=4 12420 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100000102301 [0,1,0,0,0,1|2,0,0]=4 12421 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100000102301 [0,1,0,0,0,1|2,0,0]=4 12422 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100000102301 [0,1,0,0,0,1|2,0,0]=4 12423 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100000102301 [0,1,0,0,0,1|2,0,0]=4 12424 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100000102301 [0,1,0,0,0,1|2,0,0]=4 12425 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100000102301 [0,1,0,0,0,1|2,0,0]=4 12426 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100000102301 [0,1,0,0,0,1|2,0,0]=4 12427 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100000102301 [0,1,0,0,0,1|2,0,0]=4 12428 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100000102301 [0,1,0,0,0,1|2,0,0]=4 12429 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100000102301 [0,1,0,0,0,1|2,0,0]=4 12430 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100000102301 [0,1,0,0,0,1|2,0,0]=4 12431 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000102301 [0,1,0,0,0,1|2,0,0]=4 12432 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100000102301 [0,1,0,0,0,1|2,0,0]=4 12433 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000102301 [0,1,0,0,0,1|2,0,0]=4 12434 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100000102301 [0,1,0,0,0,1|2,0,0]=4 12435 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100000102301 [0,1,0,0,0,1|2,0,0]=4 12436 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100000102301 [0,1,0,0,0,1|2,0,0]=4 12437 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100000102301 [0,1,0,0,0,1|2,0,0]=4 12438 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100000102301 [0,1,0,0,0,1|2,0,0]=4 12439 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100000102301 [0,1,0,0,0,1|2,0,0]=4 12440 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100000102301 [0,1,0,0,0,1|2,0,0]=4 12441 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100000102301 [0,1,0,0,0,1|2,0,0]=4 12442 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100000102301 [0,1,0,0,0,1|2,0,0]=4 12443 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100000102301 [0,1,0,0,0,1|2,0,0]=4 12444 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100000102301 [0,1,0,0,0,1|2,0,0]=4 12445 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100000102301 [0,1,0,0,0,1|2,0,0]=4 12446 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100000102301 [0,1,0,0,0,1|2,0,0]=4 12447 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100000102301 [0,1,0,0,0,1|2,0,0]=4 12448 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100000102301 [0,1,0,0,0,1|2,0,0]=4 12449 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100000102301 [0,1,0,0,0,1|1,0,0]=3 12450 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100000102301 [0,1,0,0,0,1|1,0,0]=3 12451 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100000102301 [0,1,0,0,0,1|1,0,0]=3 12452 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100000102301 [0,1,0,0,0,1|1,0,0]=3 12453 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100000102301 [0,1,0,0,0,1|1,0,0]=3 12454 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1O)Br 22a_100000740057_100000707504 [0,1,0,0,0,1|2,0,0]=4 12455 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000745993 [0,1,0,0,0,1|2,0,0]=4 12456 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000745993 [0,1,0,0,0,1|2,0,0]=4 12457 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000745993 [0,1,0,0,0,1|2,0,0]=4 12458 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000745993 [0,1,0,0,0,1|2,0,0]=4 12459 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000745993 [0,1,0,0,0,1|2,0,0]=4 12460 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000745993 [0,1,0,0,0,1|2,0,0]=4 12461 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000745993 [0,1,0,0,0,1|2,0,0]=4 12462 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000745993 [0,1,0,0,0,1|2,0,0]=4 12463 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000745993 [0,1,0,0,0,1|2,0,0]=4 12464 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000745993 [0,1,0,0,0,1|2,0,0]=4 12465 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000745993 [0,1,0,0,0,1|2,0,0]=4 12466 B16R1.22955 CCCOCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000745993 [0,1,0,0,0,1|2,0,0]=4 12467 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000217233 [0,1,0,0,0,1|2,0,0]=4 12468 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000217233 [0,1,0,0,0,1|2,0,0]=4 12469 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000217233 [0,1,0,0,0,1|2,0,0]=4 12470 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000217233 [0,1,0,0,0,1|2,0,0]=4 12471 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000217233 [0,1,0,0,0,1|2,0,0]=4 12472 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000217233 [0,1,0,0,0,1|2,0,0]=4 12473 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000217233 [0,1,0,0,0,1|2,0,0]=4 12474 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000217233 [0,1,0,0,0,1|2,0,0]=4 12475 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000217233 [0,1,0,0,0,1|2,0,0]=4 12476 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000217233 [0,1,0,0,0,1|2,0,0]=4 12477 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000217233 [0,1,0,0,0,1|2,0,0]=4 12478 B16R1.22955 CCCSCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000217233 [0,1,0,0,0,1|2,0,0]=4 12479 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100011215890 [0,1,0,0,0,1|2,0,0]=4 12480 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000749530 [0,1,0,0,0,1|2,0,0]=4 12481 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000749530 [0,1,0,0,0,1|2,0,0]=4 12482 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000749530 [0,1,0,0,0,1|2,0,0]=4 12483 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000749530 [0,1,0,0,0,1|2,0,0]=4 12484 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000749530 [0,1,0,0,0,1|2,0,0]=4 12485 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000749530 [0,1,0,0,0,1|2,0,0]=4 12486 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000749530 [0,1,0,0,0,1|2,0,0]=4 12487 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000749530 [0,1,0,0,0,1|2,0,0]=4 12488 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000749530 [0,1,0,0,0,1|2,0,0]=4 12489 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000749530 [0,1,0,0,0,1|2,0,0]=4 12490 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000749530 [0,1,0,0,0,1|2,0,0]=4 12491 B16R1.22955 CCOCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000749530 [0,1,0,0,0,1|2,0,0]=4 12492 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000757381 [0,1,0,0,0,1|2,0,0]=4 12493 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000230768 [0,1,0,0,0,1|2,0,0]=4 12494 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000230768 [0,1,0,0,0,1|2,0,0]=4 12495 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000230768 [0,1,0,0,0,1|2,0,0]=4 12496 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000230768 [0,1,0,0,0,1|2,0,0]=4 12497 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000230768 [0,1,0,0,0,1|2,0,0]=4 12498 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000230768 [0,1,0,0,0,1|2,0,0]=4 12499 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000230768 [0,1,0,0,0,1|2,0,0]=4 12500 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000230768 [0,1,0,0,0,1|2,0,0]=4 12501 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000230768 [0,1,0,0,0,1|2,0,0]=4 12502 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000230768 [0,1,0,0,0,1|2,0,0]=4 12503 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000230768 [0,1,0,0,0,1|2,0,0]=4 12504 B16R1.22955 CCSCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000230768 [0,1,0,0,0,1|2,0,0]=4 12505 B16R1.22955 COCCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000740836 [0,1,0,0,0,1|2,0,0]=4 12506 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000741012 [0,1,0,0,0,1|2,0,0]=4 12507 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000741012 [0,1,0,0,0,1|2,0,0]=4 12508 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000741012 [0,1,0,0,0,1|2,0,0]=4 12509 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000741012 [0,1,0,0,0,1|2,0,0]=4 12510 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000741012 [0,1,0,0,0,1|2,0,0]=4 12511 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000741012 [0,1,0,0,0,1|2,0,0]=4 12512 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000741012 [0,1,0,0,0,1|2,0,0]=4 12513 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000741012 [0,1,0,0,0,1|2,0,0]=4 12514 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000741012 [0,1,0,0,0,1|2,0,0]=4 12515 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000741012 [0,1,0,0,0,1|2,0,0]=4 12516 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000741012 [0,1,0,0,0,1|2,0,0]=4 12517 B16R1.22955 COCCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000741012 [0,1,0,0,0,1|2,0,0]=4 12518 B16R1.22955 COCCNC(=O)Cc1ccc(cc1O)Br 240690a_100000209980_100000707504 [0,1,0,0,0,1|2,0,0]=4 12519 B16R1.22955 COCCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100000209980 [0,1,0,0,0,1|2,0,0]=4 12520 B16R1.22955 COCCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100000209980 [0,1,0,0,0,1|2,0,0]=4 12521 B16R1.22955 COCCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100000209980 [0,1,0,0,0,1|2,0,0]=4 12522 B16R1.22955 COCCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100000209980 [0,1,0,0,0,1|2,0,0]=4 12523 B16R1.22955 COCCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100000209980 [0,1,0,0,0,1|2,0,0]=4 12524 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000173376 [0,1,0,0,0,1|2,0,0]=4 12525 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000173376 [0,1,0,0,0,1|2,0,0]=4 12526 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000173376 [0,1,0,0,0,1|2,0,0]=4 12527 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000173376 [0,1,0,0,0,1|2,0,0]=4 12528 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000173376 [0,1,0,0,0,1|2,0,0]=4 12529 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000173376 [0,1,0,0,0,1|2,0,0]=4 12530 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000173376 [0,1,0,0,0,1|2,0,0]=4 12531 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000173376 [0,1,0,0,0,1|2,0,0]=4 12532 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000173376 [0,1,0,0,0,1|2,0,0]=4 12533 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000173376 [0,1,0,0,0,1|2,0,0]=4 12534 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000173376 [0,1,0,0,0,1|2,0,0]=4 12535 B16R1.22955 CSCCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000173376 [0,1,0,0,0,1|2,0,0]=4 12536 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1O)Br 240690a_100020590264_100000707504 [0,1,0,0,0,1|2,0,0]=4 12537 B16R1.22955 CSCCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100020590264 [0,1,0,0,0,1|2,0,0]=4 12538 B16R1.22955 CSCCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100020590264 [0,1,0,0,0,1|2,0,0]=4 12539 B16R1.22955 CSCCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100020590264 [0,1,0,0,0,1|2,0,0]=4 12540 B16R1.22955 CSCCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100020590264 [0,1,0,0,0,1|2,0,0]=4 12541 B16R1.22955 CSCCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100020590264 [0,1,0,0,0,1|2,0,0]=4 12542 B16R1.22955 Cc1ccc(c(c1)O)NC(=O)NCCCF 2430a_100000211527_100015189416 [0,1,0,0,0,1|2,0,0]=4 12543 B16R1.22955 Cc1ccc(c(c1)O)NC(=O)NCCCO 2430a_100000211527_100000182051 [0,1,0,0,0,1|2,0,0]=4 12544 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1O)Br 1458a_100000707504_100000729493 [0,1,0,0,0,1|2,0,0]=4 12545 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1O)Br 1458a_100000707504_100000210776 [0,1,0,0,0,1|2,0,0]=4 12546 B16R1.22955 O=C(Cc1ccc(cc1O)Br)NCCCF 240690a_100015189416_100000707504 [0,1,0,0,0,1|2,0,0]=4 12547 B16R1.22955 O=C(Cc1ccc(cc1O)Br)NCCCO 240690a_100000182051_100000707504 [0,1,0,0,0,1|2,0,0]=4 12548 B16R1.22955 O=C(NCCCF)Nc1ccc(cc1O)Cl 2430a_100000185728_100015189416 [0,1,0,0,0,1|2,0,0]=4 12549 B16R1.22955 O=C(NCCCF)Nc1ccc(cc1O)F 2430a_100000753323_100015189416 [0,1,0,0,0,1|2,0,0]=4 12550 B16R1.22955 O=C(NCCCF)Nc1ccc(cc1O)I 2430a_100000057187_100015189416 [0,1,0,0,0,1|2,0,0]=4 12551 B16R1.22955 O=C(NCCCF)Nc1ccc(cc1O)O 2430a_100000106777_100015189416 [0,1,0,0,0,1|2,0,0]=4 12552 B16R1.22955 O=C(NCCCO)Nc1ccc(cc1O)Cl 2430a_100000185728_100000182051 [0,1,0,0,0,1|2,0,0]=4 12553 B16R1.22955 O=C(NCCCO)Nc1ccc(cc1O)F 2430a_100000753323_100000182051 [0,1,0,0,0,1|2,0,0]=4 12554 B16R1.22955 O=C(NCCCO)Nc1ccc(cc1O)I 2430a_100000057187_100000182051 [0,1,0,0,0,1|2,0,0]=4 12555 B16R1.22955 O=C(NCCCO)Nc1ccc(cc1O)O 2430a_100000106777_100000182051 [0,1,0,0,0,1|2,0,0]=4 12556 B16R1.19 CCCC(=O)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100000747444 [0,2,0,0,0,0|1,0,1]=4 12557 B16R1.19 CCCC(=O)CC(=O)c1cccc(c1O)C 1458a_100000183896_100000747444 [0,2,0,0,0,0|1,0,1]=4 12558 B16R1.19 CCCC(=O)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000747444 [0,2,0,0,0,0|1,0,1]=4 12559 B16R1.19 CCCC(=O)CC(=O)c1cccc(c1O)F 1458a_100011217230_100000747444 [0,2,0,0,0,0|1,0,1]=4 12560 B16R1.19 CCCC(=O)CC(=O)c1cccc(c1O)O 1458a_100000690420_100000747444 [0,2,0,0,0,0|1,0,1]=4 12561 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011216630 [0,2,0,0,0,0|2,0,0]=4 12562 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Br)C 1458a_100000692419_100011216630 [0,2,0,0,0,0|2,0,0]=4 12563 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011216630 [0,2,0,0,0,0|2,0,0]=4 12564 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Br)F 1458a_100011217547_100011216630 [0,2,0,0,0,0|2,0,0]=4 12565 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Br)I 1458a_100010232522_100011216630 [0,2,0,0,0,0|2,0,0]=4 12566 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Br)O 1458a_100010230362_100011216630 [0,2,0,0,0,0|2,0,0]=4 12567 B16R1.19 CCCC(C)CC(=O)c1cccc(c1C)Br 1458a_100000760464_100011216630 [0,2,0,0,0,0|2,0,0]=4 12568 B16R1.19 CCCC(C)CC(=O)c1cccc(c1C)C 1458a_100000183679_100011216630 [0,2,0,0,0,0|2,0,0]=4 12569 B16R1.19 CCCC(C)CC(=O)c1cccc(c1C)Cl 1458a_100000690184_100011216630 [0,2,0,0,0,0|2,0,0]=4 12570 B16R1.19 CCCC(C)CC(=O)c1cccc(c1C)F 1458a_100011218272_100011216630 [0,2,0,0,0,0|2,0,0]=4 12571 B16R1.19 CCCC(C)CC(=O)c1cccc(c1C)I 1458a_100000751865_100011216630 [0,2,0,0,0,0|2,0,0]=4 12572 B16R1.19 CCCC(C)CC(=O)c1cccc(c1C)O 1458a_100000766327_100011216630 [0,2,0,0,0,0|2,0,0]=4 12573 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011216630 [0,2,0,0,0,0|2,0,0]=4 12574 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Cl)C 1458a_100000693142_100011216630 [0,2,0,0,0,0|2,0,0]=4 12575 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011216630 [0,2,0,0,0,0|2,0,0]=4 12576 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011216630 [0,2,0,0,0,0|2,0,0]=4 12577 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011216630 [0,2,0,0,0,0|2,0,0]=4 12578 B16R1.19 CCCC(C)CC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011216630 [0,2,0,0,0,0|2,0,0]=4 12579 B16R1.19 CCCC(C)CC(=O)c1cccc(c1F)Br 1458a_100000756403_100011216630 [0,2,0,0,0,0|2,0,0]=4 12580 B16R1.19 CCCC(C)CC(=O)c1cccc(c1F)C 1458a_100000766181_100011216630 [0,2,0,0,0,0|2,0,0]=4 12581 B16R1.19 CCCC(C)CC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011216630 [0,2,0,0,0,0|2,0,0]=4 12582 B16R1.19 CCCC(C)CC(=O)c1cccc(c1F)F 1458a_100000748134_100011216630 [0,2,0,0,0,0|2,0,0]=4 12583 B16R1.19 CCCC(C)CC(=O)c1cccc(c1F)I 1458a_100010185205_100011216630 [0,2,0,0,0,0|2,0,0]=4 12584 B16R1.19 CCCC(C)CC(=O)c1cccc(c1F)O 1458a_100000037433_100011216630 [0,2,0,0,0,0|2,0,0]=4 12585 B16R1.19 CCCC(C)CC(=O)c1cccc(c1I)Br 1458a_100000688019_100011216630 [0,2,0,0,0,0|2,0,0]=4 12586 B16R1.19 CCCC(C)CC(=O)c1cccc(c1I)C 1458a_100000739377_100011216630 [0,2,0,0,0,0|2,0,0]=4 12587 B16R1.19 CCCC(C)CC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011216630 [0,2,0,0,0,0|2,0,0]=4 12588 B16R1.19 CCCC(C)CC(=O)c1cccc(c1I)F 1458a_100000690930_100011216630 [0,2,0,0,0,0|2,0,0]=4 12589 B16R1.19 CCCC(C)CC(=O)c1cccc(c1I)O 1458a_100010084636_100011216630 [0,2,0,0,0,0|2,0,0]=4 12590 B16R1.19 CCCC(C)CC(=O)c1cccc(c1O)Br 1458a_100000752940_100011216630 [0,2,0,0,0,0|1,0,0]=3 12591 B16R1.19 CCCC(C)CC(=O)c1cccc(c1O)C 1458a_100000183896_100011216630 [0,2,0,0,0,0|1,0,0]=3 12592 B16R1.19 CCCC(C)CC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011216630 [0,2,0,0,0,0|1,0,0]=3 12593 B16R1.19 CCCC(C)CC(=O)c1cccc(c1O)F 1458a_100011217230_100011216630 [0,2,0,0,0,0|1,0,0]=3 12594 B16R1.19 CCCC(C)CC(=O)c1cccc(c1O)O 1458a_100000690420_100011216630 [0,2,0,0,0,0|1,0,0]=3 12595 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Br 11a_100000741246_100012360534 [0,2,0,0,0,0|2,0,0]=4 12596 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Br 1626a_100000741246_100012360534 [0,2,0,0,0,0|2,0,0]=4 12597 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Br 240690a_100000741246_100012360534 [0,2,0,0,0,0|2,0,0]=4 12598 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Br 527a_100000741246_100012360534 [0,2,0,0,0,0|2,0,0]=4 12599 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)C 11a_100000741246_100000692419 [0,2,0,0,0,0|2,0,0]=4 12600 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)C 1626a_100000741246_100000692419 [0,2,0,0,0,0|2,0,0]=4 12601 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)C 240690a_100000741246_100000692419 [0,2,0,0,0,0|2,0,0]=4 12602 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)C 527a_100000741246_100000692419 [0,2,0,0,0,0|2,0,0]=4 12603 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Cl 11a_100000741246_100012339722 [0,2,0,0,0,0|2,0,0]=4 12604 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Cl 1626a_100000741246_100012339722 [0,2,0,0,0,0|2,0,0]=4 12605 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Cl 240690a_100000741246_100012339722 [0,2,0,0,0,0|2,0,0]=4 12606 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)Cl 527a_100000741246_100012339722 [0,2,0,0,0,0|2,0,0]=4 12607 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)F 11a_100000741246_100011217547 [0,2,0,0,0,0|2,0,0]=4 12608 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)F 1626a_100000741246_100011217547 [0,2,0,0,0,0|2,0,0]=4 12609 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)F 240690a_100000741246_100011217547 [0,2,0,0,0,0|2,0,0]=4 12610 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)F 527a_100000741246_100011217547 [0,2,0,0,0,0|2,0,0]=4 12611 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)I 11a_100000741246_100010232522 [0,2,0,0,0,0|2,0,0]=4 12612 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)I 1626a_100000741246_100010232522 [0,2,0,0,0,0|2,0,0]=4 12613 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)I 240690a_100000741246_100010232522 [0,2,0,0,0,0|2,0,0]=4 12614 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)I 527a_100000741246_100010232522 [0,2,0,0,0,0|2,0,0]=4 12615 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)O 240690a_100000741246_100010230362 [0,2,0,0,0,0|2,0,0]=4 12616 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Br)O 527a_100000741246_100010230362 [0,2,0,0,0,0|2,0,0]=4 12617 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Br 11a_100000741246_100000760464 [0,2,0,0,0,0|2,0,0]=4 12618 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Br 1626a_100000741246_100000760464 [0,2,0,0,0,0|2,0,0]=4 12619 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Br 240690a_100000741246_100000760464 [0,2,0,0,0,0|2,0,0]=4 12620 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Br 527a_100000741246_100000760464 [0,2,0,0,0,0|2,0,0]=4 12621 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)C 11a_100000741246_100000183679 [0,2,0,0,0,0|2,0,0]=4 12622 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)C 1626a_100000741246_100000183679 [0,2,0,0,0,0|2,0,0]=4 12623 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)C 240690a_100000741246_100000183679 [0,2,0,0,0,0|2,0,0]=4 12624 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)C 527a_100000741246_100000183679 [0,2,0,0,0,0|2,0,0]=4 12625 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Cl 11a_100000741246_100000690184 [0,2,0,0,0,0|2,0,0]=4 12626 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Cl 1626a_100000741246_100000690184 [0,2,0,0,0,0|2,0,0]=4 12627 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Cl 240690a_100000741246_100000690184 [0,2,0,0,0,0|2,0,0]=4 12628 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)Cl 527a_100000741246_100000690184 [0,2,0,0,0,0|2,0,0]=4 12629 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)F 11a_100000741246_100011218272 [0,2,0,0,0,0|2,0,0]=4 12630 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)F 1626a_100000741246_100011218272 [0,2,0,0,0,0|2,0,0]=4 12631 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)F 240690a_100000741246_100011218272 [0,2,0,0,0,0|2,0,0]=4 12632 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)F 527a_100000741246_100011218272 [0,2,0,0,0,0|2,0,0]=4 12633 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)I 11a_100000741246_100000751865 [0,2,0,0,0,0|2,0,0]=4 12634 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)I 1626a_100000741246_100000751865 [0,2,0,0,0,0|2,0,0]=4 12635 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)I 240690a_100000741246_100000751865 [0,2,0,0,0,0|2,0,0]=4 12636 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)I 527a_100000741246_100000751865 [0,2,0,0,0,0|2,0,0]=4 12637 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)O 240690a_100000741246_100000766327 [0,2,0,0,0,0|2,0,0]=4 12638 B16R1.19 CCCC(C)NC(=O)c1cccc(c1C)O 527a_100000741246_100000766327 [0,2,0,0,0,0|2,0,0]=4 12639 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Br 11a_100000741246_100000760540 [0,2,0,0,0,0|2,0,0]=4 12640 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Br 1626a_100000741246_100000760540 [0,2,0,0,0,0|2,0,0]=4 12641 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Br 240690a_100000741246_100000760540 [0,2,0,0,0,0|2,0,0]=4 12642 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Br 527a_100000741246_100000760540 [0,2,0,0,0,0|2,0,0]=4 12643 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)C 11a_100000741246_100000693142 [0,2,0,0,0,0|2,0,0]=4 12644 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)C 1626a_100000741246_100000693142 [0,2,0,0,0,0|2,0,0]=4 12645 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)C 240690a_100000741246_100000693142 [0,2,0,0,0,0|2,0,0]=4 12646 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)C 527a_100000741246_100000693142 [0,2,0,0,0,0|2,0,0]=4 12647 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Cl 11a_100000741246_100000183631 [0,2,0,0,0,0|2,0,0]=4 12648 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Cl 1626a_100000741246_100000183631 [0,2,0,0,0,0|2,0,0]=4 12649 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Cl 240690a_100000741246_100000183631 [0,2,0,0,0,0|2,0,0]=4 12650 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)Cl 527a_100000741246_100000183631 [0,2,0,0,0,0|2,0,0]=4 12651 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)F 11a_100000741246_100000759904 [0,2,0,0,0,0|2,0,0]=4 12652 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)F 1626a_100000741246_100000759904 [0,2,0,0,0,0|2,0,0]=4 12653 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)F 240690a_100000741246_100000759904 [0,2,0,0,0,0|2,0,0]=4 12654 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)F 527a_100000741246_100000759904 [0,2,0,0,0,0|2,0,0]=4 12655 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)I 11a_100000741246_100010176783 [0,2,0,0,0,0|2,0,0]=4 12656 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)I 1626a_100000741246_100010176783 [0,2,0,0,0,0|2,0,0]=4 12657 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)I 240690a_100000741246_100010176783 [0,2,0,0,0,0|2,0,0]=4 12658 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)I 527a_100000741246_100010176783 [0,2,0,0,0,0|2,0,0]=4 12659 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)O 240690a_100000741246_100000092362 [0,2,0,0,0,0|2,0,0]=4 12660 B16R1.19 CCCC(C)NC(=O)c1cccc(c1Cl)O 527a_100000741246_100000092362 [0,2,0,0,0,0|2,0,0]=4 12661 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Br 11a_100000741246_100000756403 [0,2,0,0,0,0|2,0,0]=4 12662 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Br 1626a_100000741246_100000756403 [0,2,0,0,0,0|2,0,0]=4 12663 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Br 240690a_100000741246_100000756403 [0,2,0,0,0,0|2,0,0]=4 12664 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Br 527a_100000741246_100000756403 [0,2,0,0,0,0|2,0,0]=4 12665 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)C 11a_100000741246_100000766181 [0,2,0,0,0,0|2,0,0]=4 12666 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)C 1626a_100000741246_100000766181 [0,2,0,0,0,0|2,0,0]=4 12667 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)C 240690a_100000741246_100000766181 [0,2,0,0,0,0|2,0,0]=4 12668 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)C 527a_100000741246_100000766181 [0,2,0,0,0,0|2,0,0]=4 12669 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Cl 11a_100000741246_100000688816 [0,2,0,0,0,0|2,0,0]=4 12670 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Cl 1626a_100000741246_100000688816 [0,2,0,0,0,0|2,0,0]=4 12671 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Cl 240690a_100000741246_100000688816 [0,2,0,0,0,0|2,0,0]=4 12672 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)Cl 527a_100000741246_100000688816 [0,2,0,0,0,0|2,0,0]=4 12673 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)F 11a_100000741246_100000748134 [0,2,0,0,0,0|2,0,0]=4 12674 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)F 1626a_100000741246_100000748134 [0,2,0,0,0,0|2,0,0]=4 12675 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)F 240690a_100000741246_100000748134 [0,2,0,0,0,0|2,0,0]=4 12676 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)F 527a_100000741246_100000748134 [0,2,0,0,0,0|2,0,0]=4 12677 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)I 11a_100000741246_100010185205 [0,2,0,0,0,0|2,0,0]=4 12678 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)I 1626a_100000741246_100010185205 [0,2,0,0,0,0|2,0,0]=4 12679 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)I 240690a_100000741246_100010185205 [0,2,0,0,0,0|2,0,0]=4 12680 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)I 527a_100000741246_100010185205 [0,2,0,0,0,0|2,0,0]=4 12681 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)O 240690a_100000741246_100000037433 [0,2,0,0,0,0|2,0,0]=4 12682 B16R1.19 CCCC(C)NC(=O)c1cccc(c1F)O 527a_100000741246_100000037433 [0,2,0,0,0,0|2,0,0]=4 12683 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Br 11a_100000741246_100000688019 [0,2,0,0,0,0|2,0,0]=4 12684 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Br 1626a_100000741246_100000688019 [0,2,0,0,0,0|2,0,0]=4 12685 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Br 240690a_100000741246_100000688019 [0,2,0,0,0,0|2,0,0]=4 12686 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Br 527a_100000741246_100000688019 [0,2,0,0,0,0|2,0,0]=4 12687 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)C 11a_100000741246_100000739377 [0,2,0,0,0,0|2,0,0]=4 12688 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)C 1626a_100000741246_100000739377 [0,2,0,0,0,0|2,0,0]=4 12689 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)C 240690a_100000741246_100000739377 [0,2,0,0,0,0|2,0,0]=4 12690 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)C 527a_100000741246_100000739377 [0,2,0,0,0,0|2,0,0]=4 12691 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Cl 11a_100000741246_100010176784 [0,2,0,0,0,0|2,0,0]=4 12692 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Cl 1626a_100000741246_100010176784 [0,2,0,0,0,0|2,0,0]=4 12693 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Cl 240690a_100000741246_100010176784 [0,2,0,0,0,0|2,0,0]=4 12694 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)Cl 527a_100000741246_100010176784 [0,2,0,0,0,0|2,0,0]=4 12695 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)F 11a_100000741246_100000690930 [0,2,0,0,0,0|2,0,0]=4 12696 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)F 1626a_100000741246_100000690930 [0,2,0,0,0,0|2,0,0]=4 12697 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)F 240690a_100000741246_100000690930 [0,2,0,0,0,0|2,0,0]=4 12698 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)F 527a_100000741246_100000690930 [0,2,0,0,0,0|2,0,0]=4 12699 B16R1.19 CCCC(C)NC(=O)c1cccc(c1I)O 527a_100000741246_100010084636 [0,2,0,0,0,0|2,0,0]=4 12700 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)Br 240690a_100000741246_100000752940 [0,2,0,0,0,0|1,0,0]=3 12701 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)Br 527a_100000741246_100000752940 [0,2,0,0,0,0|1,0,0]=3 12702 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)C 240690a_100000741246_100000183896 [0,2,0,0,0,0|1,0,0]=3 12703 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)C 527a_100000741246_100000183896 [0,2,0,0,0,0|1,0,0]=3 12704 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)Cl 240690a_100000741246_100000742801 [0,2,0,0,0,0|1,0,0]=3 12705 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)Cl 527a_100000741246_100000742801 [0,2,0,0,0,0|1,0,0]=3 12706 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)F 240690a_100000741246_100011217230 [0,2,0,0,0,0|1,0,0]=3 12707 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)F 527a_100000741246_100011217230 [0,2,0,0,0,0|1,0,0]=3 12708 B16R1.19 CCCC(C)NC(=O)c1cccc(c1O)O 527a_100000741246_100000690420 [0,2,0,0,0,0|1,0,0]=3 12709 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)Br 240690a_100000764878_100000752940 [0,2,0,0,0,0|2,0,0]=4 12710 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)Br 527a_100000764878_100000752940 [0,2,0,0,0,0|2,0,0]=4 12711 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)C 240690a_100000764878_100000183896 [0,2,0,0,0,0|2,0,0]=4 12712 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)C 527a_100000764878_100000183896 [0,2,0,0,0,0|2,0,0]=4 12713 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)Cl 240690a_100000764878_100000742801 [0,2,0,0,0,0|2,0,0]=4 12714 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)Cl 527a_100000764878_100000742801 [0,2,0,0,0,0|2,0,0]=4 12715 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)F 240690a_100000764878_100011217230 [0,2,0,0,0,0|2,0,0]=4 12716 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)F 527a_100000764878_100011217230 [0,2,0,0,0,0|2,0,0]=4 12717 B16R1.19 COC[C@@H](C)NC(=O)c1cccc(c1O)O 527a_100000764878_100000690420 [0,2,0,0,0,0|2,0,0]=4 12718 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)Br 240690a_100000706166_100000752940 [0,2,0,0,0,0|2,0,0]=4 12719 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)Br 527a_100000706166_100000752940 [0,2,0,0,0,0|2,0,0]=4 12720 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)Cl 240690a_100000706166_100000742801 [0,2,0,0,0,0|2,0,0]=4 12721 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)Cl 527a_100000706166_100000742801 [0,2,0,0,0,0|2,0,0]=4 12722 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)F 240690a_100000706166_100011217230 [0,2,0,0,0,0|2,0,0]=4 12723 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)F 527a_100000706166_100011217230 [0,2,0,0,0,0|2,0,0]=4 12724 B16R1.19 C[C@H](CCO)NC(=O)c1cccc(c1O)O 527a_100000706166_100000690420 [0,2,0,0,0,0|2,0,0]=4 12725 B16R1.19 Cc1cccc(c1O)C(=O)N[C@H](C)CCO 240690a_100000706166_100000183896 [0,2,0,0,0,0|2,0,0]=4 12726 B16R1.19 Cc1cccc(c1O)C(=O)N[C@H](C)CCO 527a_100000706166_100000183896 [0,2,0,0,0,0|2,0,0]=4 12727 B16R1.20 C#CCCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100010269958 [0,2,0,0,0,0|1,0,1]=4 12728 B16R1.20 C#CCCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100010269958 [0,2,0,0,0,0|1,0,1]=4 12729 B16R1.20 C#CCCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100010269958 [0,2,0,0,0,0|1,0,1]=4 12730 B16R1.20 C#CCCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100010269958 [0,2,0,0,0,0|1,0,1]=4 12731 B16R1.20 C#CCCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100010269958 [0,2,0,0,0,0|1,0,1]=4 12732 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)Br 240690a_100000718082_100000752940 [0,2,0,0,0,0|1,0,1]=4 12733 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)Br 527a_100000718082_100000752940 [0,2,0,0,0,0|1,0,1]=4 12734 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)C 240690a_100000718082_100000183896 [0,2,0,0,0,0|1,0,1]=4 12735 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)C 527a_100000718082_100000183896 [0,2,0,0,0,0|1,0,1]=4 12736 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)Cl 240690a_100000718082_100000742801 [0,2,0,0,0,0|1,0,1]=4 12737 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)Cl 527a_100000718082_100000742801 [0,2,0,0,0,0|1,0,1]=4 12738 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)F 240690a_100000718082_100011217230 [0,2,0,0,0,0|1,0,1]=4 12739 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)F 527a_100000718082_100011217230 [0,2,0,0,0,0|1,0,1]=4 12740 B16R1.20 C#CCCCNC(=O)c1cccc(c1O)O 527a_100000718082_100000690420 [0,2,0,0,0,0|1,0,1]=4 12741 B16R1.20 C=CCCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215482 [0,2,0,0,0,0|1,0,1]=4 12742 B16R1.20 C=CCCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100011215482 [0,2,0,0,0,0|1,0,1]=4 12743 B16R1.20 C=CCCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215482 [0,2,0,0,0,0|1,0,1]=4 12744 B16R1.20 C=CCCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215482 [0,2,0,0,0,0|1,0,1]=4 12745 B16R1.20 C=CCCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215482 [0,2,0,0,0,0|1,0,1]=4 12746 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)Br 240690a_100000700776_100000752940 [0,2,0,0,0,0|1,0,1]=4 12747 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)Br 527a_100000700776_100000752940 [0,2,0,0,0,0|1,0,1]=4 12748 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)C 240690a_100000700776_100000183896 [0,2,0,0,0,0|1,0,1]=4 12749 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)C 527a_100000700776_100000183896 [0,2,0,0,0,0|1,0,1]=4 12750 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)Cl 240690a_100000700776_100000742801 [0,2,0,0,0,0|1,0,1]=4 12751 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)Cl 527a_100000700776_100000742801 [0,2,0,0,0,0|1,0,1]=4 12752 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)F 240690a_100000700776_100011217230 [0,2,0,0,0,0|1,0,1]=4 12753 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)F 527a_100000700776_100011217230 [0,2,0,0,0,0|1,0,1]=4 12754 B16R1.20 C=CCCCNC(=O)c1cccc(c1O)O 527a_100000700776_100000690420 [0,2,0,0,0,0|1,0,1]=4 12755 B16R1.20 CC/C=C\CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100015370543 [0,2,0,0,0,0|1,0,1]=4 12756 B16R1.20 CC/C=C\CCC(=O)c1cccc(c1O)C 1458a_100000183896_100015370543 [0,2,0,0,0,0|1,0,1]=4 12757 B16R1.20 CC/C=C\CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100015370543 [0,2,0,0,0,0|1,0,1]=4 12758 B16R1.20 CC/C=C\CCC(=O)c1cccc(c1O)F 1458a_100011217230_100015370543 [0,2,0,0,0,0|1,0,1]=4 12759 B16R1.20 CC/C=C\CCC(=O)c1cccc(c1O)O 1458a_100000690420_100015370543 [0,2,0,0,0,0|1,0,1]=4 12760 B16R1.20 CCCCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210757 [0,2,0,0,0,0|2,0,0]=4 12761 B16R1.20 CCCCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210757 [0,2,0,0,0,0|2,0,0]=4 12762 B16R1.20 CCCCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210757 [0,2,0,0,0,0|2,0,0]=4 12763 B16R1.20 CCCCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210757 [0,2,0,0,0,0|2,0,0]=4 12764 B16R1.20 CCCCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210757 [0,2,0,0,0,0|2,0,0]=4 12765 B16R1.20 CCCCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210757 [0,2,0,0,0,0|2,0,0]=4 12766 B16R1.20 CCCCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210757 [0,2,0,0,0,0|2,0,0]=4 12767 B16R1.20 CCCCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210757 [0,2,0,0,0,0|2,0,0]=4 12768 B16R1.20 CCCCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210757 [0,2,0,0,0,0|2,0,0]=4 12769 B16R1.20 CCCCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210757 [0,2,0,0,0,0|2,0,0]=4 12770 B16R1.20 CCCCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210757 [0,2,0,0,0,0|2,0,0]=4 12771 B16R1.20 CCCCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210757 [0,2,0,0,0,0|2,0,0]=4 12772 B16R1.20 CCCCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210757 [0,2,0,0,0,0|2,0,0]=4 12773 B16R1.20 CCCCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210757 [0,2,0,0,0,0|2,0,0]=4 12774 B16R1.20 CCCCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210757 [0,2,0,0,0,0|2,0,0]=4 12775 B16R1.20 CCCCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210757 [0,2,0,0,0,0|2,0,0]=4 12776 B16R1.20 CCCCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210757 [0,2,0,0,0,0|2,0,0]=4 12777 B16R1.20 CCCCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210757 [0,2,0,0,0,0|2,0,0]=4 12778 B16R1.20 CCCCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210757 [0,2,0,0,0,0|2,0,0]=4 12779 B16R1.20 CCCCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210757 [0,2,0,0,0,0|2,0,0]=4 12780 B16R1.20 CCCCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210757 [0,2,0,0,0,0|2,0,0]=4 12781 B16R1.20 CCCCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210757 [0,2,0,0,0,0|2,0,0]=4 12782 B16R1.20 CCCCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210757 [0,2,0,0,0,0|2,0,0]=4 12783 B16R1.20 CCCCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210757 [0,2,0,0,0,0|2,0,0]=4 12784 B16R1.20 CCCCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210757 [0,2,0,0,0,0|2,0,0]=4 12785 B16R1.20 CCCCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210757 [0,2,0,0,0,0|2,0,0]=4 12786 B16R1.20 CCCCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210757 [0,2,0,0,0,0|2,0,0]=4 12787 B16R1.20 CCCCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210757 [0,2,0,0,0,0|2,0,0]=4 12788 B16R1.20 CCCCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210757 [0,2,0,0,0,0|2,0,0]=4 12789 B16R1.20 CCCCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210757 [0,2,0,0,0,0|1,0,0]=3 12790 B16R1.20 CCCCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210757 [0,2,0,0,0,0|1,0,0]=3 12791 B16R1.20 CCCCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210757 [0,2,0,0,0,0|1,0,0]=3 12792 B16R1.20 CCCCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210757 [0,2,0,0,0,0|1,0,0]=3 12793 B16R1.20 CCCCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210757 [0,2,0,0,0,0|1,0,0]=3 12794 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Br 11a_100000209983_100012360534 [0,2,0,0,0,0|2,0,0]=4 12795 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Br 1626a_100000209983_100012360534 [0,2,0,0,0,0|2,0,0]=4 12796 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Br 240690a_100000209983_100012360534 [0,2,0,0,0,0|2,0,0]=4 12797 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Br 527a_100000209983_100012360534 [0,2,0,0,0,0|2,0,0]=4 12798 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)C 11a_100000209983_100000692419 [0,2,0,0,0,0|2,0,0]=4 12799 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)C 1626a_100000209983_100000692419 [0,2,0,0,0,0|2,0,0]=4 12800 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)C 240690a_100000209983_100000692419 [0,2,0,0,0,0|2,0,0]=4 12801 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)C 527a_100000209983_100000692419 [0,2,0,0,0,0|2,0,0]=4 12802 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Cl 11a_100000209983_100012339722 [0,2,0,0,0,0|2,0,0]=4 12803 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Cl 1626a_100000209983_100012339722 [0,2,0,0,0,0|2,0,0]=4 12804 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Cl 240690a_100000209983_100012339722 [0,2,0,0,0,0|2,0,0]=4 12805 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)Cl 527a_100000209983_100012339722 [0,2,0,0,0,0|2,0,0]=4 12806 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)F 11a_100000209983_100011217547 [0,2,0,0,0,0|2,0,0]=4 12807 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)F 1626a_100000209983_100011217547 [0,2,0,0,0,0|2,0,0]=4 12808 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)F 240690a_100000209983_100011217547 [0,2,0,0,0,0|2,0,0]=4 12809 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)F 527a_100000209983_100011217547 [0,2,0,0,0,0|2,0,0]=4 12810 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)I 11a_100000209983_100010232522 [0,2,0,0,0,0|2,0,0]=4 12811 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)I 1626a_100000209983_100010232522 [0,2,0,0,0,0|2,0,0]=4 12812 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)I 240690a_100000209983_100010232522 [0,2,0,0,0,0|2,0,0]=4 12813 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)I 527a_100000209983_100010232522 [0,2,0,0,0,0|2,0,0]=4 12814 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)O 240690a_100000209983_100010230362 [0,2,0,0,0,0|2,0,0]=4 12815 B16R1.20 CCCCCNC(=O)c1cccc(c1Br)O 527a_100000209983_100010230362 [0,2,0,0,0,0|2,0,0]=4 12816 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Br 11a_100000209983_100000760464 [0,2,0,0,0,0|2,0,0]=4 12817 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Br 1626a_100000209983_100000760464 [0,2,0,0,0,0|2,0,0]=4 12818 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Br 240690a_100000209983_100000760464 [0,2,0,0,0,0|2,0,0]=4 12819 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Br 527a_100000209983_100000760464 [0,2,0,0,0,0|2,0,0]=4 12820 B16R1.20 CCCCCNC(=O)c1cccc(c1C)C 11a_100000209983_100000183679 [0,2,0,0,0,0|2,0,0]=4 12821 B16R1.20 CCCCCNC(=O)c1cccc(c1C)C 1626a_100000209983_100000183679 [0,2,0,0,0,0|2,0,0]=4 12822 B16R1.20 CCCCCNC(=O)c1cccc(c1C)C 240690a_100000209983_100000183679 [0,2,0,0,0,0|2,0,0]=4 12823 B16R1.20 CCCCCNC(=O)c1cccc(c1C)C 527a_100000209983_100000183679 [0,2,0,0,0,0|2,0,0]=4 12824 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Cl 11a_100000209983_100000690184 [0,2,0,0,0,0|2,0,0]=4 12825 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Cl 1626a_100000209983_100000690184 [0,2,0,0,0,0|2,0,0]=4 12826 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Cl 240690a_100000209983_100000690184 [0,2,0,0,0,0|2,0,0]=4 12827 B16R1.20 CCCCCNC(=O)c1cccc(c1C)Cl 527a_100000209983_100000690184 [0,2,0,0,0,0|2,0,0]=4 12828 B16R1.20 CCCCCNC(=O)c1cccc(c1C)F 11a_100000209983_100011218272 [0,2,0,0,0,0|2,0,0]=4 12829 B16R1.20 CCCCCNC(=O)c1cccc(c1C)F 1626a_100000209983_100011218272 [0,2,0,0,0,0|2,0,0]=4 12830 B16R1.20 CCCCCNC(=O)c1cccc(c1C)F 240690a_100000209983_100011218272 [0,2,0,0,0,0|2,0,0]=4 12831 B16R1.20 CCCCCNC(=O)c1cccc(c1C)F 527a_100000209983_100011218272 [0,2,0,0,0,0|2,0,0]=4 12832 B16R1.20 CCCCCNC(=O)c1cccc(c1C)I 11a_100000209983_100000751865 [0,2,0,0,0,0|2,0,0]=4 12833 B16R1.20 CCCCCNC(=O)c1cccc(c1C)I 1626a_100000209983_100000751865 [0,2,0,0,0,0|2,0,0]=4 12834 B16R1.20 CCCCCNC(=O)c1cccc(c1C)I 240690a_100000209983_100000751865 [0,2,0,0,0,0|2,0,0]=4 12835 B16R1.20 CCCCCNC(=O)c1cccc(c1C)I 527a_100000209983_100000751865 [0,2,0,0,0,0|2,0,0]=4 12836 B16R1.20 CCCCCNC(=O)c1cccc(c1C)O 240690a_100000209983_100000766327 [0,2,0,0,0,0|2,0,0]=4 12837 B16R1.20 CCCCCNC(=O)c1cccc(c1C)O 527a_100000209983_100000766327 [0,2,0,0,0,0|2,0,0]=4 12838 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Br 11a_100000209983_100000760540 [0,2,0,0,0,0|2,0,0]=4 12839 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Br 1626a_100000209983_100000760540 [0,2,0,0,0,0|2,0,0]=4 12840 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Br 240690a_100000209983_100000760540 [0,2,0,0,0,0|2,0,0]=4 12841 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Br 527a_100000209983_100000760540 [0,2,0,0,0,0|2,0,0]=4 12842 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)C 11a_100000209983_100000693142 [0,2,0,0,0,0|2,0,0]=4 12843 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)C 1626a_100000209983_100000693142 [0,2,0,0,0,0|2,0,0]=4 12844 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)C 240690a_100000209983_100000693142 [0,2,0,0,0,0|2,0,0]=4 12845 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)C 527a_100000209983_100000693142 [0,2,0,0,0,0|2,0,0]=4 12846 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Cl 11a_100000209983_100000183631 [0,2,0,0,0,0|2,0,0]=4 12847 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Cl 1626a_100000209983_100000183631 [0,2,0,0,0,0|2,0,0]=4 12848 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Cl 240690a_100000209983_100000183631 [0,2,0,0,0,0|2,0,0]=4 12849 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)Cl 527a_100000209983_100000183631 [0,2,0,0,0,0|2,0,0]=4 12850 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)F 11a_100000209983_100000759904 [0,2,0,0,0,0|2,0,0]=4 12851 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)F 1626a_100000209983_100000759904 [0,2,0,0,0,0|2,0,0]=4 12852 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)F 240690a_100000209983_100000759904 [0,2,0,0,0,0|2,0,0]=4 12853 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)F 527a_100000209983_100000759904 [0,2,0,0,0,0|2,0,0]=4 12854 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)I 11a_100000209983_100010176783 [0,2,0,0,0,0|2,0,0]=4 12855 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)I 1626a_100000209983_100010176783 [0,2,0,0,0,0|2,0,0]=4 12856 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)I 240690a_100000209983_100010176783 [0,2,0,0,0,0|2,0,0]=4 12857 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)I 527a_100000209983_100010176783 [0,2,0,0,0,0|2,0,0]=4 12858 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)O 240690a_100000209983_100000092362 [0,2,0,0,0,0|2,0,0]=4 12859 B16R1.20 CCCCCNC(=O)c1cccc(c1Cl)O 527a_100000209983_100000092362 [0,2,0,0,0,0|2,0,0]=4 12860 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Br 11a_100000209983_100000756403 [0,2,0,0,0,0|2,0,0]=4 12861 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Br 1626a_100000209983_100000756403 [0,2,0,0,0,0|2,0,0]=4 12862 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Br 240690a_100000209983_100000756403 [0,2,0,0,0,0|2,0,0]=4 12863 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Br 527a_100000209983_100000756403 [0,2,0,0,0,0|2,0,0]=4 12864 B16R1.20 CCCCCNC(=O)c1cccc(c1F)C 11a_100000209983_100000766181 [0,2,0,0,0,0|2,0,0]=4 12865 B16R1.20 CCCCCNC(=O)c1cccc(c1F)C 1626a_100000209983_100000766181 [0,2,0,0,0,0|2,0,0]=4 12866 B16R1.20 CCCCCNC(=O)c1cccc(c1F)C 240690a_100000209983_100000766181 [0,2,0,0,0,0|2,0,0]=4 12867 B16R1.20 CCCCCNC(=O)c1cccc(c1F)C 527a_100000209983_100000766181 [0,2,0,0,0,0|2,0,0]=4 12868 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Cl 11a_100000209983_100000688816 [0,2,0,0,0,0|2,0,0]=4 12869 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Cl 1626a_100000209983_100000688816 [0,2,0,0,0,0|2,0,0]=4 12870 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Cl 240690a_100000209983_100000688816 [0,2,0,0,0,0|2,0,0]=4 12871 B16R1.20 CCCCCNC(=O)c1cccc(c1F)Cl 527a_100000209983_100000688816 [0,2,0,0,0,0|2,0,0]=4 12872 B16R1.20 CCCCCNC(=O)c1cccc(c1F)F 11a_100000209983_100000748134 [0,2,0,0,0,0|2,0,0]=4 12873 B16R1.20 CCCCCNC(=O)c1cccc(c1F)F 1626a_100000209983_100000748134 [0,2,0,0,0,0|2,0,0]=4 12874 B16R1.20 CCCCCNC(=O)c1cccc(c1F)F 240690a_100000209983_100000748134 [0,2,0,0,0,0|2,0,0]=4 12875 B16R1.20 CCCCCNC(=O)c1cccc(c1F)F 527a_100000209983_100000748134 [0,2,0,0,0,0|2,0,0]=4 12876 B16R1.20 CCCCCNC(=O)c1cccc(c1F)I 11a_100000209983_100010185205 [0,2,0,0,0,0|2,0,0]=4 12877 B16R1.20 CCCCCNC(=O)c1cccc(c1F)I 1626a_100000209983_100010185205 [0,2,0,0,0,0|2,0,0]=4 12878 B16R1.20 CCCCCNC(=O)c1cccc(c1F)I 240690a_100000209983_100010185205 [0,2,0,0,0,0|2,0,0]=4 12879 B16R1.20 CCCCCNC(=O)c1cccc(c1F)I 527a_100000209983_100010185205 [0,2,0,0,0,0|2,0,0]=4 12880 B16R1.20 CCCCCNC(=O)c1cccc(c1F)O 240690a_100000209983_100000037433 [0,2,0,0,0,0|2,0,0]=4 12881 B16R1.20 CCCCCNC(=O)c1cccc(c1F)O 527a_100000209983_100000037433 [0,2,0,0,0,0|2,0,0]=4 12882 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Br 11a_100000209983_100000688019 [0,2,0,0,0,0|2,0,0]=4 12883 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Br 1626a_100000209983_100000688019 [0,2,0,0,0,0|2,0,0]=4 12884 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Br 240690a_100000209983_100000688019 [0,2,0,0,0,0|2,0,0]=4 12885 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Br 527a_100000209983_100000688019 [0,2,0,0,0,0|2,0,0]=4 12886 B16R1.20 CCCCCNC(=O)c1cccc(c1I)C 11a_100000209983_100000739377 [0,2,0,0,0,0|2,0,0]=4 12887 B16R1.20 CCCCCNC(=O)c1cccc(c1I)C 1626a_100000209983_100000739377 [0,2,0,0,0,0|2,0,0]=4 12888 B16R1.20 CCCCCNC(=O)c1cccc(c1I)C 240690a_100000209983_100000739377 [0,2,0,0,0,0|2,0,0]=4 12889 B16R1.20 CCCCCNC(=O)c1cccc(c1I)C 527a_100000209983_100000739377 [0,2,0,0,0,0|2,0,0]=4 12890 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Cl 11a_100000209983_100010176784 [0,2,0,0,0,0|2,0,0]=4 12891 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Cl 1626a_100000209983_100010176784 [0,2,0,0,0,0|2,0,0]=4 12892 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Cl 240690a_100000209983_100010176784 [0,2,0,0,0,0|2,0,0]=4 12893 B16R1.20 CCCCCNC(=O)c1cccc(c1I)Cl 527a_100000209983_100010176784 [0,2,0,0,0,0|2,0,0]=4 12894 B16R1.20 CCCCCNC(=O)c1cccc(c1I)F 11a_100000209983_100000690930 [0,2,0,0,0,0|2,0,0]=4 12895 B16R1.20 CCCCCNC(=O)c1cccc(c1I)F 1626a_100000209983_100000690930 [0,2,0,0,0,0|2,0,0]=4 12896 B16R1.20 CCCCCNC(=O)c1cccc(c1I)F 240690a_100000209983_100000690930 [0,2,0,0,0,0|2,0,0]=4 12897 B16R1.20 CCCCCNC(=O)c1cccc(c1I)F 527a_100000209983_100000690930 [0,2,0,0,0,0|2,0,0]=4 12898 B16R1.20 CCCCCNC(=O)c1cccc(c1I)O 527a_100000209983_100010084636 [0,2,0,0,0,0|2,0,0]=4 12899 B16R1.20 CCCCCNC(=O)c1cccc(c1O)Br 240690a_100000209983_100000752940 [0,2,0,0,0,0|1,0,0]=3 12900 B16R1.20 CCCCCNC(=O)c1cccc(c1O)Br 527a_100000209983_100000752940 [0,2,0,0,0,0|1,0,0]=3 12901 B16R1.20 CCCCCNC(=O)c1cccc(c1O)C 240690a_100000209983_100000183896 [0,2,0,0,0,0|1,0,0]=3 12902 B16R1.20 CCCCCNC(=O)c1cccc(c1O)C 527a_100000209983_100000183896 [0,2,0,0,0,0|1,0,0]=3 12903 B16R1.20 CCCCCNC(=O)c1cccc(c1O)Cl 240690a_100000209983_100000742801 [0,2,0,0,0,0|1,0,0]=3 12904 B16R1.20 CCCCCNC(=O)c1cccc(c1O)Cl 527a_100000209983_100000742801 [0,2,0,0,0,0|1,0,0]=3 12905 B16R1.20 CCCCCNC(=O)c1cccc(c1O)F 240690a_100000209983_100011217230 [0,2,0,0,0,0|1,0,0]=3 12906 B16R1.20 CCCCCNC(=O)c1cccc(c1O)F 527a_100000209983_100011217230 [0,2,0,0,0,0|1,0,0]=3 12907 B16R1.20 CCCCCNC(=O)c1cccc(c1O)O 527a_100000209983_100000690420 [0,2,0,0,0,0|1,0,0]=3 12908 B16R1.20 CCCCNCC(=O)c1cccc(c1C)I 7a_106832991798_100160470822 [0,2,0,0,0,0|2,0,0]=4 12909 B16R1.20 CCCCNCC(=O)c1cccc(c1F)Br 2230a_100000102301_100012356374 [0,2,0,0,0,0|2,0,0]=4 12910 B16R1.20 CCCCNCC(=O)c1cccc(c1F)Br 7a_106832991798_100012356374 [0,2,0,0,0,0|2,0,0]=4 12911 B16R1.20 CCCCNCC(=O)c1cccc(c1F)Cl 2230a_100000102301_200012351890 [0,2,0,0,0,0|2,0,0]=4 12912 B16R1.20 CCCCNCC(=O)c1cccc(c1F)Cl 7a_106832991798_200012351890 [0,2,0,0,0,0|2,0,0]=4 12913 B16R1.20 CCCCNN=C(C)c1cccc(c1O)Br 4a_100025702795_100009815558 [0,2,0,0,0,0|2,0,0]=4 12914 B16R1.20 CCCCNN=C(C)c1cccc(c1O)C 4a_100025702795_100009847209 [0,2,0,0,0,0|2,0,0]=4 12915 B16R1.20 CCCCNN=C(C)c1cccc(c1O)Cl 4a_100025702795_100000043392 [0,2,0,0,0,0|2,0,0]=4 12916 B16R1.20 CCCCNN=C(C)c1cccc(c1O)F 4a_100025702795_100011246037 [0,2,0,0,0,0|2,0,0]=4 12917 B16R1.20 CCCCNN=C(C)c1cccc(c1O)O 4a_100025702795_200000080400 [0,2,0,0,0,0|2,0,0]=4 12918 B16R1.20 CCCCNNC(=O)c1cccc(c1Br)Br 22a_100025702795_100012360534 [0,2,0,0,0,0|2,0,0]=4 12919 B16R1.20 CCCCNNC(=O)c1cccc(c1Br)C 22a_100025702795_100000692419 [0,2,0,0,0,0|2,0,0]=4 12920 B16R1.20 CCCCNNC(=O)c1cccc(c1Br)Cl 22a_100025702795_100012339722 [0,2,0,0,0,0|2,0,0]=4 12921 B16R1.20 CCCCNNC(=O)c1cccc(c1Br)F 22a_100025702795_100011217547 [0,2,0,0,0,0|2,0,0]=4 12922 B16R1.20 CCCCNNC(=O)c1cccc(c1Br)I 22a_100025702795_100010232522 [0,2,0,0,0,0|2,0,0]=4 12923 B16R1.20 CCCCNNC(=O)c1cccc(c1Br)O 22a_100025702795_100010230362 [0,2,0,0,0,0|2,0,0]=4 12924 B16R1.20 CCCCNNC(=O)c1cccc(c1C)Br 22a_100025702795_100000760464 [0,2,0,0,0,0|2,0,0]=4 12925 B16R1.20 CCCCNNC(=O)c1cccc(c1C)C 22a_100025702795_100000183679 [0,2,0,0,0,0|2,0,0]=4 12926 B16R1.20 CCCCNNC(=O)c1cccc(c1C)Cl 22a_100025702795_100000690184 [0,2,0,0,0,0|2,0,0]=4 12927 B16R1.20 CCCCNNC(=O)c1cccc(c1C)F 22a_100025702795_100011218272 [0,2,0,0,0,0|2,0,0]=4 12928 B16R1.20 CCCCNNC(=O)c1cccc(c1C)I 22a_100025702795_100000751865 [0,2,0,0,0,0|2,0,0]=4 12929 B16R1.20 CCCCNNC(=O)c1cccc(c1C)O 22a_100025702795_100000766327 [0,2,0,0,0,0|2,0,0]=4 12930 B16R1.20 CCCCNNC(=O)c1cccc(c1Cl)Br 22a_100025702795_100000760540 [0,2,0,0,0,0|2,0,0]=4 12931 B16R1.20 CCCCNNC(=O)c1cccc(c1Cl)C 22a_100025702795_100000693142 [0,2,0,0,0,0|2,0,0]=4 12932 B16R1.20 CCCCNNC(=O)c1cccc(c1Cl)Cl 22a_100025702795_100000183631 [0,2,0,0,0,0|2,0,0]=4 12933 B16R1.20 CCCCNNC(=O)c1cccc(c1Cl)F 22a_100025702795_100000759904 [0,2,0,0,0,0|2,0,0]=4 12934 B16R1.20 CCCCNNC(=O)c1cccc(c1Cl)I 22a_100025702795_100010176783 [0,2,0,0,0,0|2,0,0]=4 12935 B16R1.20 CCCCNNC(=O)c1cccc(c1Cl)O 22a_100025702795_100000092362 [0,2,0,0,0,0|2,0,0]=4 12936 B16R1.20 CCCCNNC(=O)c1cccc(c1F)Br 22a_100025702795_100000756403 [0,2,0,0,0,0|2,0,0]=4 12937 B16R1.20 CCCCNNC(=O)c1cccc(c1F)C 22a_100025702795_100000766181 [0,2,0,0,0,0|2,0,0]=4 12938 B16R1.20 CCCCNNC(=O)c1cccc(c1F)Cl 22a_100025702795_100000688816 [0,2,0,0,0,0|2,0,0]=4 12939 B16R1.20 CCCCNNC(=O)c1cccc(c1F)F 22a_100025702795_100000748134 [0,2,0,0,0,0|2,0,0]=4 12940 B16R1.20 CCCCNNC(=O)c1cccc(c1F)I 22a_100025702795_100010185205 [0,2,0,0,0,0|2,0,0]=4 12941 B16R1.20 CCCCNNC(=O)c1cccc(c1F)O 22a_100025702795_100000037433 [0,2,0,0,0,0|2,0,0]=4 12942 B16R1.20 CCCCNNC(=O)c1cccc(c1I)Br 22a_100025702795_100000688019 [0,2,0,0,0,0|2,0,0]=4 12943 B16R1.20 CCCCNNC(=O)c1cccc(c1I)C 22a_100025702795_100000739377 [0,2,0,0,0,0|2,0,0]=4 12944 B16R1.20 CCCCNNC(=O)c1cccc(c1I)Cl 22a_100025702795_100010176784 [0,2,0,0,0,0|2,0,0]=4 12945 B16R1.20 CCCCNNC(=O)c1cccc(c1I)F 22a_100025702795_100000690930 [0,2,0,0,0,0|2,0,0]=4 12946 B16R1.20 CCCCNNC(=O)c1cccc(c1I)O 22a_100025702795_100010084636 [0,2,0,0,0,0|2,0,0]=4 12947 B16R1.20 CCCCNNC(=O)c1cccc(c1O)Br 22a_100025702795_100000752940 [0,2,0,0,0,0|1,0,0]=3 12948 B16R1.20 CCCCNNC(=O)c1cccc(c1O)C 22a_100025702795_100000183896 [0,2,0,0,0,0|1,0,0]=3 12949 B16R1.20 CCCCNNC(=O)c1cccc(c1O)Cl 22a_100025702795_100000742801 [0,2,0,0,0,0|1,0,0]=3 12950 B16R1.20 CCCCNNC(=O)c1cccc(c1O)F 22a_100025702795_100011217230 [0,2,0,0,0,0|1,0,0]=3 12951 B16R1.20 CCCCNNC(=O)c1cccc(c1O)O 22a_100025702795_100000690420 [0,2,0,0,0,0|1,0,0]=3 12952 B16R1.20 CCCCOCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011995733 [0,2,0,0,0,0|1,0,0]=3 12953 B16R1.20 CCCCOCC(=O)c1cccc(c1Br)C 1458a_100000692419_100011995733 [0,2,0,0,0,0|1,0,0]=3 12954 B16R1.20 CCCCOCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011995733 [0,2,0,0,0,0|1,0,0]=3 12955 B16R1.20 CCCCOCC(=O)c1cccc(c1Br)F 1458a_100011217547_100011995733 [0,2,0,0,0,0|1,0,0]=3 12956 B16R1.20 CCCCOCC(=O)c1cccc(c1Br)I 1458a_100010232522_100011995733 [0,2,0,0,0,0|1,0,0]=3 12957 B16R1.20 CCCCOCC(=O)c1cccc(c1Br)O 1458a_100010230362_100011995733 [0,2,0,0,0,0|1,0,0]=3 12958 B16R1.20 CCCCOCC(=O)c1cccc(c1C)Br 1458a_100000760464_100011995733 [0,2,0,0,0,0|1,0,0]=3 12959 B16R1.20 CCCCOCC(=O)c1cccc(c1C)C 1458a_100000183679_100011995733 [0,2,0,0,0,0|1,0,0]=3 12960 B16R1.20 CCCCOCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100011995733 [0,2,0,0,0,0|1,0,0]=3 12961 B16R1.20 CCCCOCC(=O)c1cccc(c1C)F 1458a_100011218272_100011995733 [0,2,0,0,0,0|1,0,0]=3 12962 B16R1.20 CCCCOCC(=O)c1cccc(c1C)I 1458a_100000751865_100011995733 [0,2,0,0,0,0|1,0,0]=3 12963 B16R1.20 CCCCOCC(=O)c1cccc(c1C)I 34a_100000210227_100160470822 [0,2,0,0,0,0|1,0,0]=3 12964 B16R1.20 CCCCOCC(=O)c1cccc(c1C)I 7a_100000210227_100160470822 [0,2,0,0,0,0|1,0,0]=3 12965 B16R1.20 CCCCOCC(=O)c1cccc(c1C)O 1458a_100000766327_100011995733 [0,2,0,0,0,0|1,0,0]=3 12966 B16R1.20 CCCCOCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011995733 [0,2,0,0,0,0|1,0,0]=3 12967 B16R1.20 CCCCOCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100011995733 [0,2,0,0,0,0|1,0,0]=3 12968 B16R1.20 CCCCOCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011995733 [0,2,0,0,0,0|1,0,0]=3 12969 B16R1.20 CCCCOCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011995733 [0,2,0,0,0,0|1,0,0]=3 12970 B16R1.20 CCCCOCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011995733 [0,2,0,0,0,0|1,0,0]=3 12971 B16R1.20 CCCCOCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011995733 [0,2,0,0,0,0|1,0,0]=3 12972 B16R1.20 CCCCOCC(=O)c1cccc(c1F)Br 1458a_100000756403_100011995733 [0,2,0,0,0,0|1,0,0]=3 12973 B16R1.20 CCCCOCC(=O)c1cccc(c1F)Br 34a_100000210227_100012356374 [0,2,0,0,0,0|1,0,0]=3 12974 B16R1.20 CCCCOCC(=O)c1cccc(c1F)Br 7a_100000210227_100012356374 [0,2,0,0,0,0|1,0,0]=3 12975 B16R1.20 CCCCOCC(=O)c1cccc(c1F)C 1458a_100000766181_100011995733 [0,2,0,0,0,0|1,0,0]=3 12976 B16R1.20 CCCCOCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011995733 [0,2,0,0,0,0|1,0,0]=3 12977 B16R1.20 CCCCOCC(=O)c1cccc(c1F)Cl 34a_100000210227_200012351890 [0,2,0,0,0,0|1,0,0]=3 12978 B16R1.20 CCCCOCC(=O)c1cccc(c1F)Cl 7a_100000210227_200012351890 [0,2,0,0,0,0|1,0,0]=3 12979 B16R1.20 CCCCOCC(=O)c1cccc(c1F)F 1458a_100000748134_100011995733 [0,2,0,0,0,0|1,0,0]=3 12980 B16R1.20 CCCCOCC(=O)c1cccc(c1F)I 1458a_100010185205_100011995733 [0,2,0,0,0,0|1,0,0]=3 12981 B16R1.20 CCCCOCC(=O)c1cccc(c1F)O 1458a_100000037433_100011995733 [0,2,0,0,0,0|1,0,0]=3 12982 B16R1.20 CCCCOCC(=O)c1cccc(c1I)Br 1458a_100000688019_100011995733 [0,2,0,0,0,0|1,0,0]=3 12983 B16R1.20 CCCCOCC(=O)c1cccc(c1I)C 1458a_100000739377_100011995733 [0,2,0,0,0,0|1,0,0]=3 12984 B16R1.20 CCCCOCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011995733 [0,2,0,0,0,0|1,0,0]=3 12985 B16R1.20 CCCCOCC(=O)c1cccc(c1I)F 1458a_100000690930_100011995733 [0,2,0,0,0,0|1,0,0]=3 12986 B16R1.20 CCCCOCC(=O)c1cccc(c1I)O 1458a_100010084636_100011995733 [0,2,0,0,0,0|1,0,0]=3 12987 B16R1.20 CCCCOCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011995733 [0,2,0,0,0,0|0,0,0]=2 12988 B16R1.20 CCCCOCC(=O)c1cccc(c1O)C 1458a_100000183896_100011995733 [0,2,0,0,0,0|0,0,0]=2 12989 B16R1.20 CCCCOCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011995733 [0,2,0,0,0,0|0,0,0]=2 12990 B16R1.20 CCCCOCC(=O)c1cccc(c1O)F 1458a_100011217230_100011995733 [0,2,0,0,0,0|0,0,0]=2 12991 B16R1.20 CCCCOCC(=O)c1cccc(c1O)O 1458a_100000690420_100011995733 [0,2,0,0,0,0|0,0,0]=2 12992 B16R1.20 CCCCSCC(=O)c1cccc(c1C)I 62a_100000210211_100160470822 [0,2,0,0,0,0|1,1,0]=4 12993 B16R1.20 CCCCSCC(=O)c1cccc(c1C)I 62a_100160470822_100000210210 [0,2,0,0,0,0|1,1,0]=4 12994 B16R1.20 CCCCSCC(=O)c1cccc(c1F)Br 62a_100000210211_100012356374 [0,2,0,0,0,0|1,1,0]=4 12995 B16R1.20 CCCCSCC(=O)c1cccc(c1F)Br 62a_100012356374_100000210210 [0,2,0,0,0,0|1,1,0]=4 12996 B16R1.20 CCCCSCC(=O)c1cccc(c1F)Cl 62a_100000210211_200012351890 [0,2,0,0,0,0|1,1,0]=4 12997 B16R1.20 CCCCSCC(=O)c1cccc(c1F)Cl 62a_200012351890_100000210210 [0,2,0,0,0,0|1,1,0]=4 12998 B16R1.20 CCCOCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011215938 [0,2,0,0,0,0|2,0,0]=4 12999 B16R1.20 CCCOCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100011215938 [0,2,0,0,0,0|2,0,0]=4 13000 B16R1.20 CCCOCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011215938 [0,2,0,0,0,0|2,0,0]=4 13001 B16R1.20 CCCOCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100011215938 [0,2,0,0,0,0|2,0,0]=4 13002 B16R1.20 CCCOCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100011215938 [0,2,0,0,0,0|2,0,0]=4 13003 B16R1.20 CCCOCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100011215938 [0,2,0,0,0,0|2,0,0]=4 13004 B16R1.20 CCCOCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100011215938 [0,2,0,0,0,0|2,0,0]=4 13005 B16R1.20 CCCOCCC(=O)c1cccc(c1C)C 1458a_100000183679_100011215938 [0,2,0,0,0,0|2,0,0]=4 13006 B16R1.20 CCCOCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100011215938 [0,2,0,0,0,0|2,0,0]=4 13007 B16R1.20 CCCOCCC(=O)c1cccc(c1C)F 1458a_100011218272_100011215938 [0,2,0,0,0,0|2,0,0]=4 13008 B16R1.20 CCCOCCC(=O)c1cccc(c1C)I 1458a_100000751865_100011215938 [0,2,0,0,0,0|2,0,0]=4 13009 B16R1.20 CCCOCCC(=O)c1cccc(c1C)O 1458a_100000766327_100011215938 [0,2,0,0,0,0|2,0,0]=4 13010 B16R1.20 CCCOCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011215938 [0,2,0,0,0,0|2,0,0]=4 13011 B16R1.20 CCCOCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100011215938 [0,2,0,0,0,0|2,0,0]=4 13012 B16R1.20 CCCOCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011215938 [0,2,0,0,0,0|2,0,0]=4 13013 B16R1.20 CCCOCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011215938 [0,2,0,0,0,0|2,0,0]=4 13014 B16R1.20 CCCOCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011215938 [0,2,0,0,0,0|2,0,0]=4 13015 B16R1.20 CCCOCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011215938 [0,2,0,0,0,0|2,0,0]=4 13016 B16R1.20 CCCOCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100011215938 [0,2,0,0,0,0|2,0,0]=4 13017 B16R1.20 CCCOCCC(=O)c1cccc(c1F)C 1458a_100000766181_100011215938 [0,2,0,0,0,0|2,0,0]=4 13018 B16R1.20 CCCOCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011215938 [0,2,0,0,0,0|2,0,0]=4 13019 B16R1.20 CCCOCCC(=O)c1cccc(c1F)F 1458a_100000748134_100011215938 [0,2,0,0,0,0|2,0,0]=4 13020 B16R1.20 CCCOCCC(=O)c1cccc(c1F)I 1458a_100010185205_100011215938 [0,2,0,0,0,0|2,0,0]=4 13021 B16R1.20 CCCOCCC(=O)c1cccc(c1F)O 1458a_100000037433_100011215938 [0,2,0,0,0,0|2,0,0]=4 13022 B16R1.20 CCCOCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100011215938 [0,2,0,0,0,0|2,0,0]=4 13023 B16R1.20 CCCOCCC(=O)c1cccc(c1I)C 1458a_100000739377_100011215938 [0,2,0,0,0,0|2,0,0]=4 13024 B16R1.20 CCCOCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011215938 [0,2,0,0,0,0|2,0,0]=4 13025 B16R1.20 CCCOCCC(=O)c1cccc(c1I)F 1458a_100000690930_100011215938 [0,2,0,0,0,0|2,0,0]=4 13026 B16R1.20 CCCOCCC(=O)c1cccc(c1I)O 1458a_100010084636_100011215938 [0,2,0,0,0,0|2,0,0]=4 13027 B16R1.20 CCCOCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215938 [0,2,0,0,0,0|1,0,0]=3 13028 B16R1.20 CCCOCCC(=O)c1cccc(c1O)C 1458a_100000183896_100011215938 [0,2,0,0,0,0|1,0,0]=3 13029 B16R1.20 CCCOCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215938 [0,2,0,0,0,0|1,0,0]=3 13030 B16R1.20 CCCOCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215938 [0,2,0,0,0,0|1,0,0]=3 13031 B16R1.20 CCCOCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215938 [0,2,0,0,0,0|1,0,0]=3 13032 B16R1.20 CCOCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100012232248 [0,2,0,0,0,0|2,0,0]=4 13033 B16R1.20 CCOCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100012232248 [0,2,0,0,0,0|2,0,0]=4 13034 B16R1.20 CCOCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100012232248 [0,2,0,0,0,0|2,0,0]=4 13035 B16R1.20 CCOCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100012232248 [0,2,0,0,0,0|2,0,0]=4 13036 B16R1.20 CCOCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100012232248 [0,2,0,0,0,0|2,0,0]=4 13037 B16R1.20 CCOCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100012232248 [0,2,0,0,0,0|2,0,0]=4 13038 B16R1.20 CCOCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100012232248 [0,2,0,0,0,0|2,0,0]=4 13039 B16R1.20 CCOCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100012232248 [0,2,0,0,0,0|2,0,0]=4 13040 B16R1.20 CCOCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100012232248 [0,2,0,0,0,0|2,0,0]=4 13041 B16R1.20 CCOCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100012232248 [0,2,0,0,0,0|2,0,0]=4 13042 B16R1.20 CCOCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100012232248 [0,2,0,0,0,0|2,0,0]=4 13043 B16R1.20 CCOCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100012232248 [0,2,0,0,0,0|2,0,0]=4 13044 B16R1.20 CCOCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100012232248 [0,2,0,0,0,0|2,0,0]=4 13045 B16R1.20 CCOCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100012232248 [0,2,0,0,0,0|2,0,0]=4 13046 B16R1.20 CCOCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100012232248 [0,2,0,0,0,0|2,0,0]=4 13047 B16R1.20 CCOCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100012232248 [0,2,0,0,0,0|2,0,0]=4 13048 B16R1.20 CCOCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100012232248 [0,2,0,0,0,0|2,0,0]=4 13049 B16R1.20 CCOCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100012232248 [0,2,0,0,0,0|2,0,0]=4 13050 B16R1.20 CCOCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100012232248 [0,2,0,0,0,0|2,0,0]=4 13051 B16R1.20 CCOCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100012232248 [0,2,0,0,0,0|2,0,0]=4 13052 B16R1.20 CCOCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100012232248 [0,2,0,0,0,0|2,0,0]=4 13053 B16R1.20 CCOCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100012232248 [0,2,0,0,0,0|2,0,0]=4 13054 B16R1.20 CCOCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100012232248 [0,2,0,0,0,0|2,0,0]=4 13055 B16R1.20 CCOCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100012232248 [0,2,0,0,0,0|2,0,0]=4 13056 B16R1.20 CCOCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100012232248 [0,2,0,0,0,0|2,0,0]=4 13057 B16R1.20 CCOCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100012232248 [0,2,0,0,0,0|2,0,0]=4 13058 B16R1.20 CCOCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100012232248 [0,2,0,0,0,0|2,0,0]=4 13059 B16R1.20 CCOCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100012232248 [0,2,0,0,0,0|2,0,0]=4 13060 B16R1.20 CCOCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100012232248 [0,2,0,0,0,0|2,0,0]=4 13061 B16R1.20 CCOCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100012232248 [0,2,0,0,0,0|1,0,0]=3 13062 B16R1.20 CCOCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100012232248 [0,2,0,0,0,0|1,0,0]=3 13063 B16R1.20 CCOCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100012232248 [0,2,0,0,0,0|1,0,0]=3 13064 B16R1.20 CCOCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100012232248 [0,2,0,0,0,0|1,0,0]=3 13065 B16R1.20 CCOCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100012232248 [0,2,0,0,0,0|1,0,0]=3 13066 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Br 11a_100011200944_100012360534 [0,2,0,0,0,0|2,0,0]=4 13067 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Br 1626a_102516460346_100012360534 [0,2,0,0,0,0|2,0,0]=4 13068 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Br 240690a_100011200944_100012360534 [0,2,0,0,0,0|2,0,0]=4 13069 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Br 527a_100011200944_100012360534 [0,2,0,0,0,0|2,0,0]=4 13070 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)C 11a_100011200944_100000692419 [0,2,0,0,0,0|2,0,0]=4 13071 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)C 1626a_102516460346_100000692419 [0,2,0,0,0,0|2,0,0]=4 13072 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)C 240690a_100011200944_100000692419 [0,2,0,0,0,0|2,0,0]=4 13073 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)C 527a_100011200944_100000692419 [0,2,0,0,0,0|2,0,0]=4 13074 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Cl 11a_100011200944_100012339722 [0,2,0,0,0,0|2,0,0]=4 13075 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Cl 1626a_102516460346_100012339722 [0,2,0,0,0,0|2,0,0]=4 13076 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Cl 240690a_100011200944_100012339722 [0,2,0,0,0,0|2,0,0]=4 13077 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)Cl 527a_100011200944_100012339722 [0,2,0,0,0,0|2,0,0]=4 13078 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)F 11a_100011200944_100011217547 [0,2,0,0,0,0|2,0,0]=4 13079 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)F 1626a_102516460346_100011217547 [0,2,0,0,0,0|2,0,0]=4 13080 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)F 240690a_100011200944_100011217547 [0,2,0,0,0,0|2,0,0]=4 13081 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)F 527a_100011200944_100011217547 [0,2,0,0,0,0|2,0,0]=4 13082 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)I 11a_100011200944_100010232522 [0,2,0,0,0,0|2,0,0]=4 13083 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)I 1626a_102516460346_100010232522 [0,2,0,0,0,0|2,0,0]=4 13084 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)I 240690a_100011200944_100010232522 [0,2,0,0,0,0|2,0,0]=4 13085 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)I 527a_100011200944_100010232522 [0,2,0,0,0,0|2,0,0]=4 13086 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)O 240690a_100011200944_100010230362 [0,2,0,0,0,0|2,0,0]=4 13087 B16R1.20 CCOCCNC(=O)c1cccc(c1Br)O 527a_100011200944_100010230362 [0,2,0,0,0,0|2,0,0]=4 13088 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Br 11a_100011200944_100000760464 [0,2,0,0,0,0|2,0,0]=4 13089 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Br 1626a_102516460346_100000760464 [0,2,0,0,0,0|2,0,0]=4 13090 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Br 240690a_100011200944_100000760464 [0,2,0,0,0,0|2,0,0]=4 13091 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Br 527a_100011200944_100000760464 [0,2,0,0,0,0|2,0,0]=4 13092 B16R1.20 CCOCCNC(=O)c1cccc(c1C)C 11a_100011200944_100000183679 [0,2,0,0,0,0|2,0,0]=4 13093 B16R1.20 CCOCCNC(=O)c1cccc(c1C)C 1626a_102516460346_100000183679 [0,2,0,0,0,0|2,0,0]=4 13094 B16R1.20 CCOCCNC(=O)c1cccc(c1C)C 240690a_100011200944_100000183679 [0,2,0,0,0,0|2,0,0]=4 13095 B16R1.20 CCOCCNC(=O)c1cccc(c1C)C 527a_100011200944_100000183679 [0,2,0,0,0,0|2,0,0]=4 13096 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Cl 11a_100011200944_100000690184 [0,2,0,0,0,0|2,0,0]=4 13097 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Cl 1626a_102516460346_100000690184 [0,2,0,0,0,0|2,0,0]=4 13098 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Cl 240690a_100011200944_100000690184 [0,2,0,0,0,0|2,0,0]=4 13099 B16R1.20 CCOCCNC(=O)c1cccc(c1C)Cl 527a_100011200944_100000690184 [0,2,0,0,0,0|2,0,0]=4 13100 B16R1.20 CCOCCNC(=O)c1cccc(c1C)F 11a_100011200944_100011218272 [0,2,0,0,0,0|2,0,0]=4 13101 B16R1.20 CCOCCNC(=O)c1cccc(c1C)F 1626a_102516460346_100011218272 [0,2,0,0,0,0|2,0,0]=4 13102 B16R1.20 CCOCCNC(=O)c1cccc(c1C)F 240690a_100011200944_100011218272 [0,2,0,0,0,0|2,0,0]=4 13103 B16R1.20 CCOCCNC(=O)c1cccc(c1C)F 527a_100011200944_100011218272 [0,2,0,0,0,0|2,0,0]=4 13104 B16R1.20 CCOCCNC(=O)c1cccc(c1C)I 11a_100011200944_100000751865 [0,2,0,0,0,0|2,0,0]=4 13105 B16R1.20 CCOCCNC(=O)c1cccc(c1C)I 1626a_102516460346_100000751865 [0,2,0,0,0,0|2,0,0]=4 13106 B16R1.20 CCOCCNC(=O)c1cccc(c1C)I 240690a_100011200944_100000751865 [0,2,0,0,0,0|2,0,0]=4 13107 B16R1.20 CCOCCNC(=O)c1cccc(c1C)I 527a_100011200944_100000751865 [0,2,0,0,0,0|2,0,0]=4 13108 B16R1.20 CCOCCNC(=O)c1cccc(c1C)O 240690a_100011200944_100000766327 [0,2,0,0,0,0|2,0,0]=4 13109 B16R1.20 CCOCCNC(=O)c1cccc(c1C)O 527a_100011200944_100000766327 [0,2,0,0,0,0|2,0,0]=4 13110 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Br 11a_100011200944_100000760540 [0,2,0,0,0,0|2,0,0]=4 13111 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Br 1626a_102516460346_100000760540 [0,2,0,0,0,0|2,0,0]=4 13112 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Br 240690a_100011200944_100000760540 [0,2,0,0,0,0|2,0,0]=4 13113 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Br 527a_100011200944_100000760540 [0,2,0,0,0,0|2,0,0]=4 13114 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)C 11a_100011200944_100000693142 [0,2,0,0,0,0|2,0,0]=4 13115 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)C 1626a_102516460346_100000693142 [0,2,0,0,0,0|2,0,0]=4 13116 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)C 240690a_100011200944_100000693142 [0,2,0,0,0,0|2,0,0]=4 13117 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)C 527a_100011200944_100000693142 [0,2,0,0,0,0|2,0,0]=4 13118 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Cl 11a_100011200944_100000183631 [0,2,0,0,0,0|2,0,0]=4 13119 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Cl 1626a_102516460346_100000183631 [0,2,0,0,0,0|2,0,0]=4 13120 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Cl 240690a_100011200944_100000183631 [0,2,0,0,0,0|2,0,0]=4 13121 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)Cl 527a_100011200944_100000183631 [0,2,0,0,0,0|2,0,0]=4 13122 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)F 11a_100011200944_100000759904 [0,2,0,0,0,0|2,0,0]=4 13123 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)F 1626a_102516460346_100000759904 [0,2,0,0,0,0|2,0,0]=4 13124 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)F 240690a_100011200944_100000759904 [0,2,0,0,0,0|2,0,0]=4 13125 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)F 527a_100011200944_100000759904 [0,2,0,0,0,0|2,0,0]=4 13126 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)I 11a_100011200944_100010176783 [0,2,0,0,0,0|2,0,0]=4 13127 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)I 1626a_102516460346_100010176783 [0,2,0,0,0,0|2,0,0]=4 13128 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)I 240690a_100011200944_100010176783 [0,2,0,0,0,0|2,0,0]=4 13129 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)I 527a_100011200944_100010176783 [0,2,0,0,0,0|2,0,0]=4 13130 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)O 240690a_100011200944_100000092362 [0,2,0,0,0,0|2,0,0]=4 13131 B16R1.20 CCOCCNC(=O)c1cccc(c1Cl)O 527a_100011200944_100000092362 [0,2,0,0,0,0|2,0,0]=4 13132 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Br 11a_100011200944_100000756403 [0,2,0,0,0,0|2,0,0]=4 13133 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Br 1626a_102516460346_100000756403 [0,2,0,0,0,0|2,0,0]=4 13134 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Br 240690a_100011200944_100000756403 [0,2,0,0,0,0|2,0,0]=4 13135 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Br 527a_100011200944_100000756403 [0,2,0,0,0,0|2,0,0]=4 13136 B16R1.20 CCOCCNC(=O)c1cccc(c1F)C 11a_100011200944_100000766181 [0,2,0,0,0,0|2,0,0]=4 13137 B16R1.20 CCOCCNC(=O)c1cccc(c1F)C 1626a_102516460346_100000766181 [0,2,0,0,0,0|2,0,0]=4 13138 B16R1.20 CCOCCNC(=O)c1cccc(c1F)C 240690a_100011200944_100000766181 [0,2,0,0,0,0|2,0,0]=4 13139 B16R1.20 CCOCCNC(=O)c1cccc(c1F)C 527a_100011200944_100000766181 [0,2,0,0,0,0|2,0,0]=4 13140 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Cl 11a_100011200944_100000688816 [0,2,0,0,0,0|2,0,0]=4 13141 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Cl 1626a_102516460346_100000688816 [0,2,0,0,0,0|2,0,0]=4 13142 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Cl 240690a_100011200944_100000688816 [0,2,0,0,0,0|2,0,0]=4 13143 B16R1.20 CCOCCNC(=O)c1cccc(c1F)Cl 527a_100011200944_100000688816 [0,2,0,0,0,0|2,0,0]=4 13144 B16R1.20 CCOCCNC(=O)c1cccc(c1F)F 11a_100011200944_100000748134 [0,2,0,0,0,0|2,0,0]=4 13145 B16R1.20 CCOCCNC(=O)c1cccc(c1F)F 1626a_102516460346_100000748134 [0,2,0,0,0,0|2,0,0]=4 13146 B16R1.20 CCOCCNC(=O)c1cccc(c1F)F 240690a_100011200944_100000748134 [0,2,0,0,0,0|2,0,0]=4 13147 B16R1.20 CCOCCNC(=O)c1cccc(c1F)F 527a_100011200944_100000748134 [0,2,0,0,0,0|2,0,0]=4 13148 B16R1.20 CCOCCNC(=O)c1cccc(c1F)I 11a_100011200944_100010185205 [0,2,0,0,0,0|2,0,0]=4 13149 B16R1.20 CCOCCNC(=O)c1cccc(c1F)I 1626a_102516460346_100010185205 [0,2,0,0,0,0|2,0,0]=4 13150 B16R1.20 CCOCCNC(=O)c1cccc(c1F)I 240690a_100011200944_100010185205 [0,2,0,0,0,0|2,0,0]=4 13151 B16R1.20 CCOCCNC(=O)c1cccc(c1F)I 527a_100011200944_100010185205 [0,2,0,0,0,0|2,0,0]=4 13152 B16R1.20 CCOCCNC(=O)c1cccc(c1F)O 240690a_100011200944_100000037433 [0,2,0,0,0,0|2,0,0]=4 13153 B16R1.20 CCOCCNC(=O)c1cccc(c1F)O 527a_100011200944_100000037433 [0,2,0,0,0,0|2,0,0]=4 13154 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Br 11a_100011200944_100000688019 [0,2,0,0,0,0|2,0,0]=4 13155 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Br 1626a_102516460346_100000688019 [0,2,0,0,0,0|2,0,0]=4 13156 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Br 240690a_100011200944_100000688019 [0,2,0,0,0,0|2,0,0]=4 13157 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Br 527a_100011200944_100000688019 [0,2,0,0,0,0|2,0,0]=4 13158 B16R1.20 CCOCCNC(=O)c1cccc(c1I)C 11a_100011200944_100000739377 [0,2,0,0,0,0|2,0,0]=4 13159 B16R1.20 CCOCCNC(=O)c1cccc(c1I)C 1626a_102516460346_100000739377 [0,2,0,0,0,0|2,0,0]=4 13160 B16R1.20 CCOCCNC(=O)c1cccc(c1I)C 240690a_100011200944_100000739377 [0,2,0,0,0,0|2,0,0]=4 13161 B16R1.20 CCOCCNC(=O)c1cccc(c1I)C 527a_100011200944_100000739377 [0,2,0,0,0,0|2,0,0]=4 13162 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Cl 11a_100011200944_100010176784 [0,2,0,0,0,0|2,0,0]=4 13163 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Cl 1626a_102516460346_100010176784 [0,2,0,0,0,0|2,0,0]=4 13164 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Cl 240690a_100011200944_100010176784 [0,2,0,0,0,0|2,0,0]=4 13165 B16R1.20 CCOCCNC(=O)c1cccc(c1I)Cl 527a_100011200944_100010176784 [0,2,0,0,0,0|2,0,0]=4 13166 B16R1.20 CCOCCNC(=O)c1cccc(c1I)F 11a_100011200944_100000690930 [0,2,0,0,0,0|2,0,0]=4 13167 B16R1.20 CCOCCNC(=O)c1cccc(c1I)F 1626a_102516460346_100000690930 [0,2,0,0,0,0|2,0,0]=4 13168 B16R1.20 CCOCCNC(=O)c1cccc(c1I)F 240690a_100011200944_100000690930 [0,2,0,0,0,0|2,0,0]=4 13169 B16R1.20 CCOCCNC(=O)c1cccc(c1I)F 527a_100011200944_100000690930 [0,2,0,0,0,0|2,0,0]=4 13170 B16R1.20 CCOCCNC(=O)c1cccc(c1I)O 527a_100011200944_100010084636 [0,2,0,0,0,0|2,0,0]=4 13171 B16R1.20 CCOCCNC(=O)c1cccc(c1O)Br 240690a_100011200944_100000752940 [0,2,0,0,0,0|1,0,0]=3 13172 B16R1.20 CCOCCNC(=O)c1cccc(c1O)Br 527a_100011200944_100000752940 [0,2,0,0,0,0|1,0,0]=3 13173 B16R1.20 CCOCCNC(=O)c1cccc(c1O)C 240690a_100011200944_100000183896 [0,2,0,0,0,0|1,0,0]=3 13174 B16R1.20 CCOCCNC(=O)c1cccc(c1O)C 527a_100011200944_100000183896 [0,2,0,0,0,0|1,0,0]=3 13175 B16R1.20 CCOCCNC(=O)c1cccc(c1O)Cl 240690a_100011200944_100000742801 [0,2,0,0,0,0|1,0,0]=3 13176 B16R1.20 CCOCCNC(=O)c1cccc(c1O)Cl 527a_100011200944_100000742801 [0,2,0,0,0,0|1,0,0]=3 13177 B16R1.20 CCOCCNC(=O)c1cccc(c1O)F 240690a_100011200944_100011217230 [0,2,0,0,0,0|1,0,0]=3 13178 B16R1.20 CCOCCNC(=O)c1cccc(c1O)F 527a_100011200944_100011217230 [0,2,0,0,0,0|1,0,0]=3 13179 B16R1.20 CCOCCNC(=O)c1cccc(c1O)O 527a_100011200944_100000690420 [0,2,0,0,0,0|1,0,0]=3 13180 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Br 11a_100000106463_100012360534 [0,2,0,0,0,0|2,0,0]=4 13181 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Br 1626a_100000106463_100012360534 [0,2,0,0,0,0|2,0,0]=4 13182 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Br 240690a_100000106463_100012360534 [0,2,0,0,0,0|2,0,0]=4 13183 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Br 527a_100000106463_100012360534 [0,2,0,0,0,0|2,0,0]=4 13184 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)C 11a_100000106463_100000692419 [0,2,0,0,0,0|2,0,0]=4 13185 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)C 1626a_100000106463_100000692419 [0,2,0,0,0,0|2,0,0]=4 13186 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)C 240690a_100000106463_100000692419 [0,2,0,0,0,0|2,0,0]=4 13187 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)C 527a_100000106463_100000692419 [0,2,0,0,0,0|2,0,0]=4 13188 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Cl 11a_100000106463_100012339722 [0,2,0,0,0,0|2,0,0]=4 13189 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Cl 1626a_100000106463_100012339722 [0,2,0,0,0,0|2,0,0]=4 13190 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Cl 240690a_100000106463_100012339722 [0,2,0,0,0,0|2,0,0]=4 13191 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)Cl 527a_100000106463_100012339722 [0,2,0,0,0,0|2,0,0]=4 13192 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)F 11a_100000106463_100011217547 [0,2,0,0,0,0|2,0,0]=4 13193 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)F 1626a_100000106463_100011217547 [0,2,0,0,0,0|2,0,0]=4 13194 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)F 240690a_100000106463_100011217547 [0,2,0,0,0,0|2,0,0]=4 13195 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)F 527a_100000106463_100011217547 [0,2,0,0,0,0|2,0,0]=4 13196 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)I 11a_100000106463_100010232522 [0,2,0,0,0,0|2,0,0]=4 13197 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)I 1626a_100000106463_100010232522 [0,2,0,0,0,0|2,0,0]=4 13198 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)I 240690a_100000106463_100010232522 [0,2,0,0,0,0|2,0,0]=4 13199 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)I 527a_100000106463_100010232522 [0,2,0,0,0,0|2,0,0]=4 13200 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)O 240690a_100000106463_100010230362 [0,2,0,0,0,0|2,0,0]=4 13201 B16R1.20 CCSCCNC(=O)c1cccc(c1Br)O 527a_100000106463_100010230362 [0,2,0,0,0,0|2,0,0]=4 13202 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Br 11a_100000106463_100000760464 [0,2,0,0,0,0|2,0,0]=4 13203 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Br 1626a_100000106463_100000760464 [0,2,0,0,0,0|2,0,0]=4 13204 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Br 240690a_100000106463_100000760464 [0,2,0,0,0,0|2,0,0]=4 13205 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Br 527a_100000106463_100000760464 [0,2,0,0,0,0|2,0,0]=4 13206 B16R1.20 CCSCCNC(=O)c1cccc(c1C)C 11a_100000106463_100000183679 [0,2,0,0,0,0|2,0,0]=4 13207 B16R1.20 CCSCCNC(=O)c1cccc(c1C)C 1626a_100000106463_100000183679 [0,2,0,0,0,0|2,0,0]=4 13208 B16R1.20 CCSCCNC(=O)c1cccc(c1C)C 240690a_100000106463_100000183679 [0,2,0,0,0,0|2,0,0]=4 13209 B16R1.20 CCSCCNC(=O)c1cccc(c1C)C 527a_100000106463_100000183679 [0,2,0,0,0,0|2,0,0]=4 13210 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Cl 11a_100000106463_100000690184 [0,2,0,0,0,0|2,0,0]=4 13211 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Cl 1626a_100000106463_100000690184 [0,2,0,0,0,0|2,0,0]=4 13212 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Cl 240690a_100000106463_100000690184 [0,2,0,0,0,0|2,0,0]=4 13213 B16R1.20 CCSCCNC(=O)c1cccc(c1C)Cl 527a_100000106463_100000690184 [0,2,0,0,0,0|2,0,0]=4 13214 B16R1.20 CCSCCNC(=O)c1cccc(c1C)F 11a_100000106463_100011218272 [0,2,0,0,0,0|2,0,0]=4 13215 B16R1.20 CCSCCNC(=O)c1cccc(c1C)F 1626a_100000106463_100011218272 [0,2,0,0,0,0|2,0,0]=4 13216 B16R1.20 CCSCCNC(=O)c1cccc(c1C)F 240690a_100000106463_100011218272 [0,2,0,0,0,0|2,0,0]=4 13217 B16R1.20 CCSCCNC(=O)c1cccc(c1C)F 527a_100000106463_100011218272 [0,2,0,0,0,0|2,0,0]=4 13218 B16R1.20 CCSCCNC(=O)c1cccc(c1C)I 11a_100000106463_100000751865 [0,2,0,0,0,0|2,0,0]=4 13219 B16R1.20 CCSCCNC(=O)c1cccc(c1C)I 1626a_100000106463_100000751865 [0,2,0,0,0,0|2,0,0]=4 13220 B16R1.20 CCSCCNC(=O)c1cccc(c1C)I 240690a_100000106463_100000751865 [0,2,0,0,0,0|2,0,0]=4 13221 B16R1.20 CCSCCNC(=O)c1cccc(c1C)I 527a_100000106463_100000751865 [0,2,0,0,0,0|2,0,0]=4 13222 B16R1.20 CCSCCNC(=O)c1cccc(c1C)O 240690a_100000106463_100000766327 [0,2,0,0,0,0|2,0,0]=4 13223 B16R1.20 CCSCCNC(=O)c1cccc(c1C)O 527a_100000106463_100000766327 [0,2,0,0,0,0|2,0,0]=4 13224 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Br 11a_100000106463_100000760540 [0,2,0,0,0,0|2,0,0]=4 13225 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Br 1626a_100000106463_100000760540 [0,2,0,0,0,0|2,0,0]=4 13226 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Br 240690a_100000106463_100000760540 [0,2,0,0,0,0|2,0,0]=4 13227 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Br 527a_100000106463_100000760540 [0,2,0,0,0,0|2,0,0]=4 13228 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)C 11a_100000106463_100000693142 [0,2,0,0,0,0|2,0,0]=4 13229 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)C 1626a_100000106463_100000693142 [0,2,0,0,0,0|2,0,0]=4 13230 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)C 240690a_100000106463_100000693142 [0,2,0,0,0,0|2,0,0]=4 13231 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)C 527a_100000106463_100000693142 [0,2,0,0,0,0|2,0,0]=4 13232 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Cl 11a_100000106463_100000183631 [0,2,0,0,0,0|2,0,0]=4 13233 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Cl 1626a_100000106463_100000183631 [0,2,0,0,0,0|2,0,0]=4 13234 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Cl 240690a_100000106463_100000183631 [0,2,0,0,0,0|2,0,0]=4 13235 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)Cl 527a_100000106463_100000183631 [0,2,0,0,0,0|2,0,0]=4 13236 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)F 11a_100000106463_100000759904 [0,2,0,0,0,0|2,0,0]=4 13237 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)F 1626a_100000106463_100000759904 [0,2,0,0,0,0|2,0,0]=4 13238 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)F 240690a_100000106463_100000759904 [0,2,0,0,0,0|2,0,0]=4 13239 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)F 527a_100000106463_100000759904 [0,2,0,0,0,0|2,0,0]=4 13240 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)I 11a_100000106463_100010176783 [0,2,0,0,0,0|2,0,0]=4 13241 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)I 1626a_100000106463_100010176783 [0,2,0,0,0,0|2,0,0]=4 13242 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)I 240690a_100000106463_100010176783 [0,2,0,0,0,0|2,0,0]=4 13243 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)I 527a_100000106463_100010176783 [0,2,0,0,0,0|2,0,0]=4 13244 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)O 240690a_100000106463_100000092362 [0,2,0,0,0,0|2,0,0]=4 13245 B16R1.20 CCSCCNC(=O)c1cccc(c1Cl)O 527a_100000106463_100000092362 [0,2,0,0,0,0|2,0,0]=4 13246 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Br 11a_100000106463_100000756403 [0,2,0,0,0,0|2,0,0]=4 13247 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Br 1626a_100000106463_100000756403 [0,2,0,0,0,0|2,0,0]=4 13248 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Br 240690a_100000106463_100000756403 [0,2,0,0,0,0|2,0,0]=4 13249 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Br 527a_100000106463_100000756403 [0,2,0,0,0,0|2,0,0]=4 13250 B16R1.20 CCSCCNC(=O)c1cccc(c1F)C 11a_100000106463_100000766181 [0,2,0,0,0,0|2,0,0]=4 13251 B16R1.20 CCSCCNC(=O)c1cccc(c1F)C 1626a_100000106463_100000766181 [0,2,0,0,0,0|2,0,0]=4 13252 B16R1.20 CCSCCNC(=O)c1cccc(c1F)C 240690a_100000106463_100000766181 [0,2,0,0,0,0|2,0,0]=4 13253 B16R1.20 CCSCCNC(=O)c1cccc(c1F)C 527a_100000106463_100000766181 [0,2,0,0,0,0|2,0,0]=4 13254 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Cl 11a_100000106463_100000688816 [0,2,0,0,0,0|2,0,0]=4 13255 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Cl 1626a_100000106463_100000688816 [0,2,0,0,0,0|2,0,0]=4 13256 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Cl 240690a_100000106463_100000688816 [0,2,0,0,0,0|2,0,0]=4 13257 B16R1.20 CCSCCNC(=O)c1cccc(c1F)Cl 527a_100000106463_100000688816 [0,2,0,0,0,0|2,0,0]=4 13258 B16R1.20 CCSCCNC(=O)c1cccc(c1F)F 11a_100000106463_100000748134 [0,2,0,0,0,0|2,0,0]=4 13259 B16R1.20 CCSCCNC(=O)c1cccc(c1F)F 1626a_100000106463_100000748134 [0,2,0,0,0,0|2,0,0]=4 13260 B16R1.20 CCSCCNC(=O)c1cccc(c1F)F 240690a_100000106463_100000748134 [0,2,0,0,0,0|2,0,0]=4 13261 B16R1.20 CCSCCNC(=O)c1cccc(c1F)F 527a_100000106463_100000748134 [0,2,0,0,0,0|2,0,0]=4 13262 B16R1.20 CCSCCNC(=O)c1cccc(c1F)I 11a_100000106463_100010185205 [0,2,0,0,0,0|2,0,0]=4 13263 B16R1.20 CCSCCNC(=O)c1cccc(c1F)I 1626a_100000106463_100010185205 [0,2,0,0,0,0|2,0,0]=4 13264 B16R1.20 CCSCCNC(=O)c1cccc(c1F)I 240690a_100000106463_100010185205 [0,2,0,0,0,0|2,0,0]=4 13265 B16R1.20 CCSCCNC(=O)c1cccc(c1F)I 527a_100000106463_100010185205 [0,2,0,0,0,0|2,0,0]=4 13266 B16R1.20 CCSCCNC(=O)c1cccc(c1F)O 240690a_100000106463_100000037433 [0,2,0,0,0,0|2,0,0]=4 13267 B16R1.20 CCSCCNC(=O)c1cccc(c1F)O 527a_100000106463_100000037433 [0,2,0,0,0,0|2,0,0]=4 13268 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Br 11a_100000106463_100000688019 [0,2,0,0,0,0|2,0,0]=4 13269 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Br 1626a_100000106463_100000688019 [0,2,0,0,0,0|2,0,0]=4 13270 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Br 240690a_100000106463_100000688019 [0,2,0,0,0,0|2,0,0]=4 13271 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Br 527a_100000106463_100000688019 [0,2,0,0,0,0|2,0,0]=4 13272 B16R1.20 CCSCCNC(=O)c1cccc(c1I)C 11a_100000106463_100000739377 [0,2,0,0,0,0|2,0,0]=4 13273 B16R1.20 CCSCCNC(=O)c1cccc(c1I)C 1626a_100000106463_100000739377 [0,2,0,0,0,0|2,0,0]=4 13274 B16R1.20 CCSCCNC(=O)c1cccc(c1I)C 240690a_100000106463_100000739377 [0,2,0,0,0,0|2,0,0]=4 13275 B16R1.20 CCSCCNC(=O)c1cccc(c1I)C 527a_100000106463_100000739377 [0,2,0,0,0,0|2,0,0]=4 13276 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Cl 11a_100000106463_100010176784 [0,2,0,0,0,0|2,0,0]=4 13277 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Cl 1626a_100000106463_100010176784 [0,2,0,0,0,0|2,0,0]=4 13278 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Cl 240690a_100000106463_100010176784 [0,2,0,0,0,0|2,0,0]=4 13279 B16R1.20 CCSCCNC(=O)c1cccc(c1I)Cl 527a_100000106463_100010176784 [0,2,0,0,0,0|2,0,0]=4 13280 B16R1.20 CCSCCNC(=O)c1cccc(c1I)F 11a_100000106463_100000690930 [0,2,0,0,0,0|2,0,0]=4 13281 B16R1.20 CCSCCNC(=O)c1cccc(c1I)F 1626a_100000106463_100000690930 [0,2,0,0,0,0|2,0,0]=4 13282 B16R1.20 CCSCCNC(=O)c1cccc(c1I)F 240690a_100000106463_100000690930 [0,2,0,0,0,0|2,0,0]=4 13283 B16R1.20 CCSCCNC(=O)c1cccc(c1I)F 527a_100000106463_100000690930 [0,2,0,0,0,0|2,0,0]=4 13284 B16R1.20 CCSCCNC(=O)c1cccc(c1I)O 527a_100000106463_100010084636 [0,2,0,0,0,0|2,0,0]=4 13285 B16R1.20 CCSCCNC(=O)c1cccc(c1O)Br 240690a_100000106463_100000752940 [0,2,0,0,0,0|1,0,0]=3 13286 B16R1.20 CCSCCNC(=O)c1cccc(c1O)Br 527a_100000106463_100000752940 [0,2,0,0,0,0|1,0,0]=3 13287 B16R1.20 CCSCCNC(=O)c1cccc(c1O)C 240690a_100000106463_100000183896 [0,2,0,0,0,0|1,0,0]=3 13288 B16R1.20 CCSCCNC(=O)c1cccc(c1O)C 527a_100000106463_100000183896 [0,2,0,0,0,0|1,0,0]=3 13289 B16R1.20 CCSCCNC(=O)c1cccc(c1O)Cl 240690a_100000106463_100000742801 [0,2,0,0,0,0|1,0,0]=3 13290 B16R1.20 CCSCCNC(=O)c1cccc(c1O)Cl 527a_100000106463_100000742801 [0,2,0,0,0,0|1,0,0]=3 13291 B16R1.20 CCSCCNC(=O)c1cccc(c1O)F 240690a_100000106463_100011217230 [0,2,0,0,0,0|1,0,0]=3 13292 B16R1.20 CCSCCNC(=O)c1cccc(c1O)F 527a_100000106463_100011217230 [0,2,0,0,0,0|1,0,0]=3 13293 B16R1.20 CCSCCNC(=O)c1cccc(c1O)O 527a_100000106463_100000690420 [0,2,0,0,0,0|1,0,0]=3 13294 B16R1.20 COCCCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000755781 [0,2,0,0,0,0|2,0,0]=4 13295 B16R1.20 COCCCCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000755781 [0,2,0,0,0,0|2,0,0]=4 13296 B16R1.20 COCCCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000755781 [0,2,0,0,0,0|2,0,0]=4 13297 B16R1.20 COCCCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000755781 [0,2,0,0,0,0|2,0,0]=4 13298 B16R1.20 COCCCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000755781 [0,2,0,0,0,0|2,0,0]=4 13299 B16R1.20 COCCCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000755781 [0,2,0,0,0,0|2,0,0]=4 13300 B16R1.20 COCCCCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000755781 [0,2,0,0,0,0|2,0,0]=4 13301 B16R1.20 COCCCCC(=O)c1cccc(c1C)C 1458a_100000183679_100000755781 [0,2,0,0,0,0|2,0,0]=4 13302 B16R1.20 COCCCCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000755781 [0,2,0,0,0,0|2,0,0]=4 13303 B16R1.20 COCCCCC(=O)c1cccc(c1C)F 1458a_100011218272_100000755781 [0,2,0,0,0,0|2,0,0]=4 13304 B16R1.20 COCCCCC(=O)c1cccc(c1C)I 1458a_100000751865_100000755781 [0,2,0,0,0,0|2,0,0]=4 13305 B16R1.20 COCCCCC(=O)c1cccc(c1C)O 1458a_100000766327_100000755781 [0,2,0,0,0,0|2,0,0]=4 13306 B16R1.20 COCCCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000755781 [0,2,0,0,0,0|2,0,0]=4 13307 B16R1.20 COCCCCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000755781 [0,2,0,0,0,0|2,0,0]=4 13308 B16R1.20 COCCCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000755781 [0,2,0,0,0,0|2,0,0]=4 13309 B16R1.20 COCCCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000755781 [0,2,0,0,0,0|2,0,0]=4 13310 B16R1.20 COCCCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000755781 [0,2,0,0,0,0|2,0,0]=4 13311 B16R1.20 COCCCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000755781 [0,2,0,0,0,0|2,0,0]=4 13312 B16R1.20 COCCCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000755781 [0,2,0,0,0,0|2,0,0]=4 13313 B16R1.20 COCCCCC(=O)c1cccc(c1F)C 1458a_100000766181_100000755781 [0,2,0,0,0,0|2,0,0]=4 13314 B16R1.20 COCCCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000755781 [0,2,0,0,0,0|2,0,0]=4 13315 B16R1.20 COCCCCC(=O)c1cccc(c1F)F 1458a_100000748134_100000755781 [0,2,0,0,0,0|2,0,0]=4 13316 B16R1.20 COCCCCC(=O)c1cccc(c1F)I 1458a_100010185205_100000755781 [0,2,0,0,0,0|2,0,0]=4 13317 B16R1.20 COCCCCC(=O)c1cccc(c1F)O 1458a_100000037433_100000755781 [0,2,0,0,0,0|2,0,0]=4 13318 B16R1.20 COCCCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000755781 [0,2,0,0,0,0|2,0,0]=4 13319 B16R1.20 COCCCCC(=O)c1cccc(c1I)C 1458a_100000739377_100000755781 [0,2,0,0,0,0|2,0,0]=4 13320 B16R1.20 COCCCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000755781 [0,2,0,0,0,0|2,0,0]=4 13321 B16R1.20 COCCCCC(=O)c1cccc(c1I)F 1458a_100000690930_100000755781 [0,2,0,0,0,0|2,0,0]=4 13322 B16R1.20 COCCCCC(=O)c1cccc(c1I)O 1458a_100010084636_100000755781 [0,2,0,0,0,0|2,0,0]=4 13323 B16R1.20 COCCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000755781 [0,2,0,0,0,0|1,0,0]=3 13324 B16R1.20 COCCCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000755781 [0,2,0,0,0,0|1,0,0]=3 13325 B16R1.20 COCCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000755781 [0,2,0,0,0,0|1,0,0]=3 13326 B16R1.20 COCCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000755781 [0,2,0,0,0,0|1,0,0]=3 13327 B16R1.20 COCCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000755781 [0,2,0,0,0,0|1,0,0]=3 13328 B16R1.20 COCCCNC(=O)c1cccc(c1Br)Br 1626a_100150723488_100012360534 [0,2,0,0,0,0|2,0,0]=4 13329 B16R1.20 COCCCNC(=O)c1cccc(c1Br)Br 240690a_100150723488_100012360534 [0,2,0,0,0,0|2,0,0]=4 13330 B16R1.20 COCCCNC(=O)c1cccc(c1Br)Br 527a_100150723488_100012360534 [0,2,0,0,0,0|2,0,0]=4 13331 B16R1.20 COCCCNC(=O)c1cccc(c1Br)C 1626a_100150723488_100000692419 [0,2,0,0,0,0|2,0,0]=4 13332 B16R1.20 COCCCNC(=O)c1cccc(c1Br)C 240690a_100150723488_100000692419 [0,2,0,0,0,0|2,0,0]=4 13333 B16R1.20 COCCCNC(=O)c1cccc(c1Br)C 527a_100150723488_100000692419 [0,2,0,0,0,0|2,0,0]=4 13334 B16R1.20 COCCCNC(=O)c1cccc(c1Br)Cl 1626a_100150723488_100012339722 [0,2,0,0,0,0|2,0,0]=4 13335 B16R1.20 COCCCNC(=O)c1cccc(c1Br)Cl 240690a_100150723488_100012339722 [0,2,0,0,0,0|2,0,0]=4 13336 B16R1.20 COCCCNC(=O)c1cccc(c1Br)Cl 527a_100150723488_100012339722 [0,2,0,0,0,0|2,0,0]=4 13337 B16R1.20 COCCCNC(=O)c1cccc(c1Br)F 1626a_100150723488_100011217547 [0,2,0,0,0,0|2,0,0]=4 13338 B16R1.20 COCCCNC(=O)c1cccc(c1Br)F 240690a_100150723488_100011217547 [0,2,0,0,0,0|2,0,0]=4 13339 B16R1.20 COCCCNC(=O)c1cccc(c1Br)F 527a_100150723488_100011217547 [0,2,0,0,0,0|2,0,0]=4 13340 B16R1.20 COCCCNC(=O)c1cccc(c1Br)I 1626a_100150723488_100010232522 [0,2,0,0,0,0|2,0,0]=4 13341 B16R1.20 COCCCNC(=O)c1cccc(c1Br)I 240690a_100150723488_100010232522 [0,2,0,0,0,0|2,0,0]=4 13342 B16R1.20 COCCCNC(=O)c1cccc(c1Br)I 527a_100150723488_100010232522 [0,2,0,0,0,0|2,0,0]=4 13343 B16R1.20 COCCCNC(=O)c1cccc(c1Br)O 240690a_100150723488_100010230362 [0,2,0,0,0,0|2,0,0]=4 13344 B16R1.20 COCCCNC(=O)c1cccc(c1Br)O 527a_100150723488_100010230362 [0,2,0,0,0,0|2,0,0]=4 13345 B16R1.20 COCCCNC(=O)c1cccc(c1C)Br 1626a_100150723488_100000760464 [0,2,0,0,0,0|2,0,0]=4 13346 B16R1.20 COCCCNC(=O)c1cccc(c1C)Br 240690a_100150723488_100000760464 [0,2,0,0,0,0|2,0,0]=4 13347 B16R1.20 COCCCNC(=O)c1cccc(c1C)Br 527a_100150723488_100000760464 [0,2,0,0,0,0|2,0,0]=4 13348 B16R1.20 COCCCNC(=O)c1cccc(c1C)C 1626a_100150723488_100000183679 [0,2,0,0,0,0|2,0,0]=4 13349 B16R1.20 COCCCNC(=O)c1cccc(c1C)C 240690a_100150723488_100000183679 [0,2,0,0,0,0|2,0,0]=4 13350 B16R1.20 COCCCNC(=O)c1cccc(c1C)C 527a_100150723488_100000183679 [0,2,0,0,0,0|2,0,0]=4 13351 B16R1.20 COCCCNC(=O)c1cccc(c1C)Cl 1626a_100150723488_100000690184 [0,2,0,0,0,0|2,0,0]=4 13352 B16R1.20 COCCCNC(=O)c1cccc(c1C)Cl 240690a_100150723488_100000690184 [0,2,0,0,0,0|2,0,0]=4 13353 B16R1.20 COCCCNC(=O)c1cccc(c1C)Cl 527a_100150723488_100000690184 [0,2,0,0,0,0|2,0,0]=4 13354 B16R1.20 COCCCNC(=O)c1cccc(c1C)F 1626a_100150723488_100011218272 [0,2,0,0,0,0|2,0,0]=4 13355 B16R1.20 COCCCNC(=O)c1cccc(c1C)F 240690a_100150723488_100011218272 [0,2,0,0,0,0|2,0,0]=4 13356 B16R1.20 COCCCNC(=O)c1cccc(c1C)F 527a_100150723488_100011218272 [0,2,0,0,0,0|2,0,0]=4 13357 B16R1.20 COCCCNC(=O)c1cccc(c1C)I 1626a_100150723488_100000751865 [0,2,0,0,0,0|2,0,0]=4 13358 B16R1.20 COCCCNC(=O)c1cccc(c1C)I 240690a_100150723488_100000751865 [0,2,0,0,0,0|2,0,0]=4 13359 B16R1.20 COCCCNC(=O)c1cccc(c1C)I 527a_100150723488_100000751865 [0,2,0,0,0,0|2,0,0]=4 13360 B16R1.20 COCCCNC(=O)c1cccc(c1C)O 240690a_100150723488_100000766327 [0,2,0,0,0,0|2,0,0]=4 13361 B16R1.20 COCCCNC(=O)c1cccc(c1C)O 527a_100150723488_100000766327 [0,2,0,0,0,0|2,0,0]=4 13362 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)Br 1626a_100150723488_100000760540 [0,2,0,0,0,0|2,0,0]=4 13363 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)Br 240690a_100150723488_100000760540 [0,2,0,0,0,0|2,0,0]=4 13364 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)Br 527a_100150723488_100000760540 [0,2,0,0,0,0|2,0,0]=4 13365 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)C 1626a_100150723488_100000693142 [0,2,0,0,0,0|2,0,0]=4 13366 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)C 240690a_100150723488_100000693142 [0,2,0,0,0,0|2,0,0]=4 13367 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)C 527a_100150723488_100000693142 [0,2,0,0,0,0|2,0,0]=4 13368 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)Cl 1626a_100150723488_100000183631 [0,2,0,0,0,0|2,0,0]=4 13369 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)Cl 240690a_100150723488_100000183631 [0,2,0,0,0,0|2,0,0]=4 13370 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)Cl 527a_100150723488_100000183631 [0,2,0,0,0,0|2,0,0]=4 13371 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)F 1626a_100150723488_100000759904 [0,2,0,0,0,0|2,0,0]=4 13372 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)F 240690a_100150723488_100000759904 [0,2,0,0,0,0|2,0,0]=4 13373 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)F 527a_100150723488_100000759904 [0,2,0,0,0,0|2,0,0]=4 13374 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)I 1626a_100150723488_100010176783 [0,2,0,0,0,0|2,0,0]=4 13375 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)I 240690a_100150723488_100010176783 [0,2,0,0,0,0|2,0,0]=4 13376 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)I 527a_100150723488_100010176783 [0,2,0,0,0,0|2,0,0]=4 13377 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)O 240690a_100150723488_100000092362 [0,2,0,0,0,0|2,0,0]=4 13378 B16R1.20 COCCCNC(=O)c1cccc(c1Cl)O 527a_100150723488_100000092362 [0,2,0,0,0,0|2,0,0]=4 13379 B16R1.20 COCCCNC(=O)c1cccc(c1F)Br 1626a_100150723488_100000756403 [0,2,0,0,0,0|2,0,0]=4 13380 B16R1.20 COCCCNC(=O)c1cccc(c1F)Br 240690a_100150723488_100000756403 [0,2,0,0,0,0|2,0,0]=4 13381 B16R1.20 COCCCNC(=O)c1cccc(c1F)Br 527a_100150723488_100000756403 [0,2,0,0,0,0|2,0,0]=4 13382 B16R1.20 COCCCNC(=O)c1cccc(c1F)C 1626a_100150723488_100000766181 [0,2,0,0,0,0|2,0,0]=4 13383 B16R1.20 COCCCNC(=O)c1cccc(c1F)C 240690a_100150723488_100000766181 [0,2,0,0,0,0|2,0,0]=4 13384 B16R1.20 COCCCNC(=O)c1cccc(c1F)C 527a_100150723488_100000766181 [0,2,0,0,0,0|2,0,0]=4 13385 B16R1.20 COCCCNC(=O)c1cccc(c1F)Cl 1626a_100150723488_100000688816 [0,2,0,0,0,0|2,0,0]=4 13386 B16R1.20 COCCCNC(=O)c1cccc(c1F)Cl 240690a_100150723488_100000688816 [0,2,0,0,0,0|2,0,0]=4 13387 B16R1.20 COCCCNC(=O)c1cccc(c1F)Cl 527a_100150723488_100000688816 [0,2,0,0,0,0|2,0,0]=4 13388 B16R1.20 COCCCNC(=O)c1cccc(c1F)F 1626a_100150723488_100000748134 [0,2,0,0,0,0|2,0,0]=4 13389 B16R1.20 COCCCNC(=O)c1cccc(c1F)F 240690a_100150723488_100000748134 [0,2,0,0,0,0|2,0,0]=4 13390 B16R1.20 COCCCNC(=O)c1cccc(c1F)F 527a_100150723488_100000748134 [0,2,0,0,0,0|2,0,0]=4 13391 B16R1.20 COCCCNC(=O)c1cccc(c1F)I 1626a_100150723488_100010185205 [0,2,0,0,0,0|2,0,0]=4 13392 B16R1.20 COCCCNC(=O)c1cccc(c1F)I 240690a_100150723488_100010185205 [0,2,0,0,0,0|2,0,0]=4 13393 B16R1.20 COCCCNC(=O)c1cccc(c1F)I 527a_100150723488_100010185205 [0,2,0,0,0,0|2,0,0]=4 13394 B16R1.20 COCCCNC(=O)c1cccc(c1F)O 240690a_100150723488_100000037433 [0,2,0,0,0,0|2,0,0]=4 13395 B16R1.20 COCCCNC(=O)c1cccc(c1F)O 527a_100150723488_100000037433 [0,2,0,0,0,0|2,0,0]=4 13396 B16R1.20 COCCCNC(=O)c1cccc(c1I)Br 1626a_100150723488_100000688019 [0,2,0,0,0,0|2,0,0]=4 13397 B16R1.20 COCCCNC(=O)c1cccc(c1I)Br 240690a_100150723488_100000688019 [0,2,0,0,0,0|2,0,0]=4 13398 B16R1.20 COCCCNC(=O)c1cccc(c1I)Br 527a_100150723488_100000688019 [0,2,0,0,0,0|2,0,0]=4 13399 B16R1.20 COCCCNC(=O)c1cccc(c1I)C 1626a_100150723488_100000739377 [0,2,0,0,0,0|2,0,0]=4 13400 B16R1.20 COCCCNC(=O)c1cccc(c1I)C 240690a_100150723488_100000739377 [0,2,0,0,0,0|2,0,0]=4 13401 B16R1.20 COCCCNC(=O)c1cccc(c1I)C 527a_100150723488_100000739377 [0,2,0,0,0,0|2,0,0]=4 13402 B16R1.20 COCCCNC(=O)c1cccc(c1I)Cl 1626a_100150723488_100010176784 [0,2,0,0,0,0|2,0,0]=4 13403 B16R1.20 COCCCNC(=O)c1cccc(c1I)Cl 240690a_100150723488_100010176784 [0,2,0,0,0,0|2,0,0]=4 13404 B16R1.20 COCCCNC(=O)c1cccc(c1I)Cl 527a_100150723488_100010176784 [0,2,0,0,0,0|2,0,0]=4 13405 B16R1.20 COCCCNC(=O)c1cccc(c1I)F 1626a_100150723488_100000690930 [0,2,0,0,0,0|2,0,0]=4 13406 B16R1.20 COCCCNC(=O)c1cccc(c1I)F 240690a_100150723488_100000690930 [0,2,0,0,0,0|2,0,0]=4 13407 B16R1.20 COCCCNC(=O)c1cccc(c1I)F 527a_100150723488_100000690930 [0,2,0,0,0,0|2,0,0]=4 13408 B16R1.20 COCCCNC(=O)c1cccc(c1I)O 527a_100150723488_100010084636 [0,2,0,0,0,0|2,0,0]=4 13409 B16R1.20 COCCCNC(=O)c1cccc(c1O)Br 240690a_100150723488_100000752940 [0,2,0,0,0,0|1,0,0]=3 13410 B16R1.20 COCCCNC(=O)c1cccc(c1O)Br 527a_100150723488_100000752940 [0,2,0,0,0,0|1,0,0]=3 13411 B16R1.20 COCCCNC(=O)c1cccc(c1O)C 240690a_100150723488_100000183896 [0,2,0,0,0,0|1,0,0]=3 13412 B16R1.20 COCCCNC(=O)c1cccc(c1O)C 527a_100150723488_100000183896 [0,2,0,0,0,0|1,0,0]=3 13413 B16R1.20 COCCCNC(=O)c1cccc(c1O)Cl 240690a_100150723488_100000742801 [0,2,0,0,0,0|1,0,0]=3 13414 B16R1.20 COCCCNC(=O)c1cccc(c1O)Cl 527a_100150723488_100000742801 [0,2,0,0,0,0|1,0,0]=3 13415 B16R1.20 COCCCNC(=O)c1cccc(c1O)F 240690a_100150723488_100011217230 [0,2,0,0,0,0|1,0,0]=3 13416 B16R1.20 COCCCNC(=O)c1cccc(c1O)F 527a_100150723488_100011217230 [0,2,0,0,0,0|1,0,0]=3 13417 B16R1.20 COCCCNC(=O)c1cccc(c1O)O 527a_100150723488_100000690420 [0,2,0,0,0,0|1,0,0]=3 13418 B16R1.20 COCCNNC(=O)c1cccc(c1O)Br 22a_100000741390_100000752940 [0,2,0,0,0,0|2,0,0]=4 13419 B16R1.20 COCCNNC(=O)c1cccc(c1O)C 22a_100000741390_100000183896 [0,2,0,0,0,0|2,0,0]=4 13420 B16R1.20 COCCNNC(=O)c1cccc(c1O)Cl 22a_100000741390_100000742801 [0,2,0,0,0,0|2,0,0]=4 13421 B16R1.20 COCCNNC(=O)c1cccc(c1O)F 22a_100000741390_100011217230 [0,2,0,0,0,0|2,0,0]=4 13422 B16R1.20 COCCNNC(=O)c1cccc(c1O)O 22a_100000741390_100000690420 [0,2,0,0,0,0|2,0,0]=4 13423 B16R1.20 COCCOCC(=O)c1cccc(c1C)I 34a_100000210237_100160470822 [0,2,0,0,0,0|2,0,0]=4 13424 B16R1.20 COCCOCC(=O)c1cccc(c1F)Br 34a_100000210237_100012356374 [0,2,0,0,0,0|2,0,0]=4 13425 B16R1.20 COCCOCC(=O)c1cccc(c1F)Cl 34a_100000210237_200012351890 [0,2,0,0,0,0|2,0,0]=4 13426 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Br 11a_100000749238_100012360534 [0,2,0,0,0,0|2,0,0]=4 13427 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Br 1626a_100000749238_100012360534 [0,2,0,0,0,0|2,0,0]=4 13428 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Br 240690a_100000749238_100012360534 [0,2,0,0,0,0|2,0,0]=4 13429 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Br 527a_100000749238_100012360534 [0,2,0,0,0,0|2,0,0]=4 13430 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)C 11a_100000749238_100000692419 [0,2,0,0,0,0|2,0,0]=4 13431 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)C 1626a_100000749238_100000692419 [0,2,0,0,0,0|2,0,0]=4 13432 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)C 240690a_100000749238_100000692419 [0,2,0,0,0,0|2,0,0]=4 13433 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)C 527a_100000749238_100000692419 [0,2,0,0,0,0|2,0,0]=4 13434 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Cl 11a_100000749238_100012339722 [0,2,0,0,0,0|2,0,0]=4 13435 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Cl 1626a_100000749238_100012339722 [0,2,0,0,0,0|2,0,0]=4 13436 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Cl 240690a_100000749238_100012339722 [0,2,0,0,0,0|2,0,0]=4 13437 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)Cl 527a_100000749238_100012339722 [0,2,0,0,0,0|2,0,0]=4 13438 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)F 11a_100000749238_100011217547 [0,2,0,0,0,0|2,0,0]=4 13439 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)F 1626a_100000749238_100011217547 [0,2,0,0,0,0|2,0,0]=4 13440 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)F 240690a_100000749238_100011217547 [0,2,0,0,0,0|2,0,0]=4 13441 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)F 527a_100000749238_100011217547 [0,2,0,0,0,0|2,0,0]=4 13442 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)I 11a_100000749238_100010232522 [0,2,0,0,0,0|2,0,0]=4 13443 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)I 1626a_100000749238_100010232522 [0,2,0,0,0,0|2,0,0]=4 13444 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)I 240690a_100000749238_100010232522 [0,2,0,0,0,0|2,0,0]=4 13445 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)I 527a_100000749238_100010232522 [0,2,0,0,0,0|2,0,0]=4 13446 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)O 240690a_100000749238_100010230362 [0,2,0,0,0,0|2,0,0]=4 13447 B16R1.20 CSCCCNC(=O)c1cccc(c1Br)O 527a_100000749238_100010230362 [0,2,0,0,0,0|2,0,0]=4 13448 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Br 11a_100000749238_100000760464 [0,2,0,0,0,0|2,0,0]=4 13449 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Br 1626a_100000749238_100000760464 [0,2,0,0,0,0|2,0,0]=4 13450 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Br 240690a_100000749238_100000760464 [0,2,0,0,0,0|2,0,0]=4 13451 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Br 527a_100000749238_100000760464 [0,2,0,0,0,0|2,0,0]=4 13452 B16R1.20 CSCCCNC(=O)c1cccc(c1C)C 11a_100000749238_100000183679 [0,2,0,0,0,0|2,0,0]=4 13453 B16R1.20 CSCCCNC(=O)c1cccc(c1C)C 1626a_100000749238_100000183679 [0,2,0,0,0,0|2,0,0]=4 13454 B16R1.20 CSCCCNC(=O)c1cccc(c1C)C 240690a_100000749238_100000183679 [0,2,0,0,0,0|2,0,0]=4 13455 B16R1.20 CSCCCNC(=O)c1cccc(c1C)C 527a_100000749238_100000183679 [0,2,0,0,0,0|2,0,0]=4 13456 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Cl 11a_100000749238_100000690184 [0,2,0,0,0,0|2,0,0]=4 13457 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Cl 1626a_100000749238_100000690184 [0,2,0,0,0,0|2,0,0]=4 13458 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Cl 240690a_100000749238_100000690184 [0,2,0,0,0,0|2,0,0]=4 13459 B16R1.20 CSCCCNC(=O)c1cccc(c1C)Cl 527a_100000749238_100000690184 [0,2,0,0,0,0|2,0,0]=4 13460 B16R1.20 CSCCCNC(=O)c1cccc(c1C)F 11a_100000749238_100011218272 [0,2,0,0,0,0|2,0,0]=4 13461 B16R1.20 CSCCCNC(=O)c1cccc(c1C)F 1626a_100000749238_100011218272 [0,2,0,0,0,0|2,0,0]=4 13462 B16R1.20 CSCCCNC(=O)c1cccc(c1C)F 240690a_100000749238_100011218272 [0,2,0,0,0,0|2,0,0]=4 13463 B16R1.20 CSCCCNC(=O)c1cccc(c1C)F 527a_100000749238_100011218272 [0,2,0,0,0,0|2,0,0]=4 13464 B16R1.20 CSCCCNC(=O)c1cccc(c1C)I 11a_100000749238_100000751865 [0,2,0,0,0,0|2,0,0]=4 13465 B16R1.20 CSCCCNC(=O)c1cccc(c1C)I 1626a_100000749238_100000751865 [0,2,0,0,0,0|2,0,0]=4 13466 B16R1.20 CSCCCNC(=O)c1cccc(c1C)I 240690a_100000749238_100000751865 [0,2,0,0,0,0|2,0,0]=4 13467 B16R1.20 CSCCCNC(=O)c1cccc(c1C)I 527a_100000749238_100000751865 [0,2,0,0,0,0|2,0,0]=4 13468 B16R1.20 CSCCCNC(=O)c1cccc(c1C)O 240690a_100000749238_100000766327 [0,2,0,0,0,0|2,0,0]=4 13469 B16R1.20 CSCCCNC(=O)c1cccc(c1C)O 527a_100000749238_100000766327 [0,2,0,0,0,0|2,0,0]=4 13470 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Br 11a_100000749238_100000760540 [0,2,0,0,0,0|2,0,0]=4 13471 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Br 1626a_100000749238_100000760540 [0,2,0,0,0,0|2,0,0]=4 13472 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Br 240690a_100000749238_100000760540 [0,2,0,0,0,0|2,0,0]=4 13473 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Br 527a_100000749238_100000760540 [0,2,0,0,0,0|2,0,0]=4 13474 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)C 11a_100000749238_100000693142 [0,2,0,0,0,0|2,0,0]=4 13475 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)C 1626a_100000749238_100000693142 [0,2,0,0,0,0|2,0,0]=4 13476 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)C 240690a_100000749238_100000693142 [0,2,0,0,0,0|2,0,0]=4 13477 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)C 527a_100000749238_100000693142 [0,2,0,0,0,0|2,0,0]=4 13478 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Cl 11a_100000749238_100000183631 [0,2,0,0,0,0|2,0,0]=4 13479 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Cl 1626a_100000749238_100000183631 [0,2,0,0,0,0|2,0,0]=4 13480 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Cl 240690a_100000749238_100000183631 [0,2,0,0,0,0|2,0,0]=4 13481 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)Cl 527a_100000749238_100000183631 [0,2,0,0,0,0|2,0,0]=4 13482 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)F 11a_100000749238_100000759904 [0,2,0,0,0,0|2,0,0]=4 13483 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)F 1626a_100000749238_100000759904 [0,2,0,0,0,0|2,0,0]=4 13484 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)F 240690a_100000749238_100000759904 [0,2,0,0,0,0|2,0,0]=4 13485 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)F 527a_100000749238_100000759904 [0,2,0,0,0,0|2,0,0]=4 13486 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)I 11a_100000749238_100010176783 [0,2,0,0,0,0|2,0,0]=4 13487 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)I 1626a_100000749238_100010176783 [0,2,0,0,0,0|2,0,0]=4 13488 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)I 240690a_100000749238_100010176783 [0,2,0,0,0,0|2,0,0]=4 13489 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)I 527a_100000749238_100010176783 [0,2,0,0,0,0|2,0,0]=4 13490 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)O 240690a_100000749238_100000092362 [0,2,0,0,0,0|2,0,0]=4 13491 B16R1.20 CSCCCNC(=O)c1cccc(c1Cl)O 527a_100000749238_100000092362 [0,2,0,0,0,0|2,0,0]=4 13492 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Br 11a_100000749238_100000756403 [0,2,0,0,0,0|2,0,0]=4 13493 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Br 1626a_100000749238_100000756403 [0,2,0,0,0,0|2,0,0]=4 13494 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Br 240690a_100000749238_100000756403 [0,2,0,0,0,0|2,0,0]=4 13495 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Br 527a_100000749238_100000756403 [0,2,0,0,0,0|2,0,0]=4 13496 B16R1.20 CSCCCNC(=O)c1cccc(c1F)C 11a_100000749238_100000766181 [0,2,0,0,0,0|2,0,0]=4 13497 B16R1.20 CSCCCNC(=O)c1cccc(c1F)C 1626a_100000749238_100000766181 [0,2,0,0,0,0|2,0,0]=4 13498 B16R1.20 CSCCCNC(=O)c1cccc(c1F)C 240690a_100000749238_100000766181 [0,2,0,0,0,0|2,0,0]=4 13499 B16R1.20 CSCCCNC(=O)c1cccc(c1F)C 527a_100000749238_100000766181 [0,2,0,0,0,0|2,0,0]=4 13500 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Cl 11a_100000749238_100000688816 [0,2,0,0,0,0|2,0,0]=4 13501 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Cl 1626a_100000749238_100000688816 [0,2,0,0,0,0|2,0,0]=4 13502 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Cl 240690a_100000749238_100000688816 [0,2,0,0,0,0|2,0,0]=4 13503 B16R1.20 CSCCCNC(=O)c1cccc(c1F)Cl 527a_100000749238_100000688816 [0,2,0,0,0,0|2,0,0]=4 13504 B16R1.20 CSCCCNC(=O)c1cccc(c1F)F 11a_100000749238_100000748134 [0,2,0,0,0,0|2,0,0]=4 13505 B16R1.20 CSCCCNC(=O)c1cccc(c1F)F 1626a_100000749238_100000748134 [0,2,0,0,0,0|2,0,0]=4 13506 B16R1.20 CSCCCNC(=O)c1cccc(c1F)F 240690a_100000749238_100000748134 [0,2,0,0,0,0|2,0,0]=4 13507 B16R1.20 CSCCCNC(=O)c1cccc(c1F)F 527a_100000749238_100000748134 [0,2,0,0,0,0|2,0,0]=4 13508 B16R1.20 CSCCCNC(=O)c1cccc(c1F)I 11a_100000749238_100010185205 [0,2,0,0,0,0|2,0,0]=4 13509 B16R1.20 CSCCCNC(=O)c1cccc(c1F)I 1626a_100000749238_100010185205 [0,2,0,0,0,0|2,0,0]=4 13510 B16R1.20 CSCCCNC(=O)c1cccc(c1F)I 240690a_100000749238_100010185205 [0,2,0,0,0,0|2,0,0]=4 13511 B16R1.20 CSCCCNC(=O)c1cccc(c1F)I 527a_100000749238_100010185205 [0,2,0,0,0,0|2,0,0]=4 13512 B16R1.20 CSCCCNC(=O)c1cccc(c1F)O 240690a_100000749238_100000037433 [0,2,0,0,0,0|2,0,0]=4 13513 B16R1.20 CSCCCNC(=O)c1cccc(c1F)O 527a_100000749238_100000037433 [0,2,0,0,0,0|2,0,0]=4 13514 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Br 11a_100000749238_100000688019 [0,2,0,0,0,0|2,0,0]=4 13515 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Br 1626a_100000749238_100000688019 [0,2,0,0,0,0|2,0,0]=4 13516 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Br 240690a_100000749238_100000688019 [0,2,0,0,0,0|2,0,0]=4 13517 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Br 527a_100000749238_100000688019 [0,2,0,0,0,0|2,0,0]=4 13518 B16R1.20 CSCCCNC(=O)c1cccc(c1I)C 11a_100000749238_100000739377 [0,2,0,0,0,0|2,0,0]=4 13519 B16R1.20 CSCCCNC(=O)c1cccc(c1I)C 1626a_100000749238_100000739377 [0,2,0,0,0,0|2,0,0]=4 13520 B16R1.20 CSCCCNC(=O)c1cccc(c1I)C 240690a_100000749238_100000739377 [0,2,0,0,0,0|2,0,0]=4 13521 B16R1.20 CSCCCNC(=O)c1cccc(c1I)C 527a_100000749238_100000739377 [0,2,0,0,0,0|2,0,0]=4 13522 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Cl 11a_100000749238_100010176784 [0,2,0,0,0,0|2,0,0]=4 13523 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Cl 1626a_100000749238_100010176784 [0,2,0,0,0,0|2,0,0]=4 13524 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Cl 240690a_100000749238_100010176784 [0,2,0,0,0,0|2,0,0]=4 13525 B16R1.20 CSCCCNC(=O)c1cccc(c1I)Cl 527a_100000749238_100010176784 [0,2,0,0,0,0|2,0,0]=4 13526 B16R1.20 CSCCCNC(=O)c1cccc(c1I)F 11a_100000749238_100000690930 [0,2,0,0,0,0|2,0,0]=4 13527 B16R1.20 CSCCCNC(=O)c1cccc(c1I)F 1626a_100000749238_100000690930 [0,2,0,0,0,0|2,0,0]=4 13528 B16R1.20 CSCCCNC(=O)c1cccc(c1I)F 240690a_100000749238_100000690930 [0,2,0,0,0,0|2,0,0]=4 13529 B16R1.20 CSCCCNC(=O)c1cccc(c1I)F 527a_100000749238_100000690930 [0,2,0,0,0,0|2,0,0]=4 13530 B16R1.20 CSCCCNC(=O)c1cccc(c1I)O 527a_100000749238_100010084636 [0,2,0,0,0,0|2,0,0]=4 13531 B16R1.20 CSCCCNC(=O)c1cccc(c1O)Br 240690a_100000749238_100000752940 [0,2,0,0,0,0|1,0,0]=3 13532 B16R1.20 CSCCCNC(=O)c1cccc(c1O)Br 527a_100000749238_100000752940 [0,2,0,0,0,0|1,0,0]=3 13533 B16R1.20 CSCCCNC(=O)c1cccc(c1O)C 240690a_100000749238_100000183896 [0,2,0,0,0,0|1,0,0]=3 13534 B16R1.20 CSCCCNC(=O)c1cccc(c1O)C 527a_100000749238_100000183896 [0,2,0,0,0,0|1,0,0]=3 13535 B16R1.20 CSCCCNC(=O)c1cccc(c1O)Cl 240690a_100000749238_100000742801 [0,2,0,0,0,0|1,0,0]=3 13536 B16R1.20 CSCCCNC(=O)c1cccc(c1O)Cl 527a_100000749238_100000742801 [0,2,0,0,0,0|1,0,0]=3 13537 B16R1.20 CSCCCNC(=O)c1cccc(c1O)F 240690a_100000749238_100011217230 [0,2,0,0,0,0|1,0,0]=3 13538 B16R1.20 CSCCCNC(=O)c1cccc(c1O)F 527a_100000749238_100011217230 [0,2,0,0,0,0|1,0,0]=3 13539 B16R1.20 CSCCCNC(=O)c1cccc(c1O)O 527a_100000749238_100000690420 [0,2,0,0,0,0|1,0,0]=3 13540 B16R1.20 CSCCOCC(=O)c1cccc(c1C)I 34a_100000230434_100160470822 [0,2,0,0,0,0|2,0,0]=4 13541 B16R1.20 CSCCOCC(=O)c1cccc(c1C)I 7a_100000230434_100160470822 [0,2,0,0,0,0|2,0,0]=4 13542 B16R1.20 CSCCOCC(=O)c1cccc(c1F)Br 34a_100000230434_100012356374 [0,2,0,0,0,0|2,0,0]=4 13543 B16R1.20 CSCCOCC(=O)c1cccc(c1F)Br 7a_100000230434_100012356374 [0,2,0,0,0,0|2,0,0]=4 13544 B16R1.20 CSCCOCC(=O)c1cccc(c1F)Cl 34a_100000230434_200012351890 [0,2,0,0,0,0|2,0,0]=4 13545 B16R1.20 CSCCOCC(=O)c1cccc(c1F)Cl 7a_100000230434_200012351890 [0,2,0,0,0,0|2,0,0]=4 13546 B16R1.20 Cc1c(cccc1C(=O)CCCCCF)Br 1458a_100000760464_100000729378 [0,2,0,0,0,0|2,0,0]=4 13547 B16R1.20 Cc1c(cccc1C(=O)CCCCCF)Cl 1458a_100000690184_100000729378 [0,2,0,0,0,0|2,0,0]=4 13548 B16R1.20 Cc1c(cccc1C(=O)CCCCCF)F 1458a_100011218272_100000729378 [0,2,0,0,0,0|2,0,0]=4 13549 B16R1.20 Cc1c(cccc1C(=O)CCCCCF)I 1458a_100000751865_100000729378 [0,2,0,0,0,0|2,0,0]=4 13550 B16R1.20 Cc1c(cccc1C(=O)CCCCCF)O 1458a_100000766327_100000729378 [0,2,0,0,0,0|2,0,0]=4 13551 B16R1.20 Cc1c(cccc1C(=O)CCCCCO)Br 1458a_100000760464_100000746330 [0,2,0,0,0,0|2,0,0]=4 13552 B16R1.20 Cc1c(cccc1C(=O)CCCCCO)Cl 1458a_100000690184_100000746330 [0,2,0,0,0,0|2,0,0]=4 13553 B16R1.20 Cc1c(cccc1C(=O)CCCCCO)F 1458a_100011218272_100000746330 [0,2,0,0,0,0|2,0,0]=4 13554 B16R1.20 Cc1c(cccc1C(=O)CCCCCO)I 1458a_100000751865_100000746330 [0,2,0,0,0,0|2,0,0]=4 13555 B16R1.20 Cc1c(cccc1C(=O)CCCCCO)O 1458a_100000766327_100000746330 [0,2,0,0,0,0|2,0,0]=4 13556 B16R1.20 Cc1c(cccc1C(=O)COCCCBr)I 34a_100011217188_100160470822 [0,2,0,0,0,0|2,0,0]=4 13557 B16R1.20 Cc1c(cccc1C(=O)COCCCCl)I 34a_100000230001_100160470822 [0,2,0,0,0,0|2,0,0]=4 13558 B16R1.20 Cc1c(cccc1C(=O)COCCCF)I 34a_100000759539_100160470822 [0,2,0,0,0,0|2,0,0]=4 13559 B16R1.20 Cc1c(cccc1C(=O)COCCCN)I 34a_100000182051_100160470822 [0,2,0,0,0,0|2,0,0]=4 13560 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)Br 240690a_100000750430_100000760464 [0,2,0,0,0,0|2,0,0]=4 13561 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)Br 527a_100000750430_100000760464 [0,2,0,0,0,0|2,0,0]=4 13562 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)Cl 240690a_100000750430_100000690184 [0,2,0,0,0,0|2,0,0]=4 13563 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)Cl 527a_100000750430_100000690184 [0,2,0,0,0,0|2,0,0]=4 13564 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)F 240690a_100000750430_100011218272 [0,2,0,0,0,0|2,0,0]=4 13565 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)F 527a_100000750430_100011218272 [0,2,0,0,0,0|2,0,0]=4 13566 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)I 240690a_100000750430_100000751865 [0,2,0,0,0,0|2,0,0]=4 13567 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)I 527a_100000750430_100000751865 [0,2,0,0,0,0|2,0,0]=4 13568 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)O 240690a_100000750430_100000766327 [0,2,0,0,0,0|2,0,0]=4 13569 B16R1.20 Cc1c(cccc1C(=O)NCCCCO)O 527a_100000750430_100000766327 [0,2,0,0,0,0|2,0,0]=4 13570 B16R1.20 Cc1cccc(c1Br)C(=O)CCCCCF 1458a_100000692419_100000729378 [0,2,0,0,0,0|2,0,0]=4 13571 B16R1.20 Cc1cccc(c1Br)C(=O)CCCCCO 1458a_100000692419_100000746330 [0,2,0,0,0,0|2,0,0]=4 13572 B16R1.20 Cc1cccc(c1Br)C(=O)NCCCCO 240690a_100000750430_100000692419 [0,2,0,0,0,0|2,0,0]=4 13573 B16R1.20 Cc1cccc(c1Br)C(=O)NCCCCO 527a_100000750430_100000692419 [0,2,0,0,0,0|2,0,0]=4 13574 B16R1.20 Cc1cccc(c1C)C(=O)CCCCCF 1458a_100000183679_100000729378 [0,2,0,0,0,0|2,0,0]=4 13575 B16R1.20 Cc1cccc(c1C)C(=O)CCCCCO 1458a_100000183679_100000746330 [0,2,0,0,0,0|2,0,0]=4 13576 B16R1.20 Cc1cccc(c1C)C(=O)NCCCCO 240690a_100000750430_100000183679 [0,2,0,0,0,0|2,0,0]=4 13577 B16R1.20 Cc1cccc(c1C)C(=O)NCCCCO 527a_100000750430_100000183679 [0,2,0,0,0,0|2,0,0]=4 13578 B16R1.20 Cc1cccc(c1Cl)C(=O)CCCCCF 1458a_100000693142_100000729378 [0,2,0,0,0,0|2,0,0]=4 13579 B16R1.20 Cc1cccc(c1Cl)C(=O)CCCCCO 1458a_100000693142_100000746330 [0,2,0,0,0,0|2,0,0]=4 13580 B16R1.20 Cc1cccc(c1Cl)C(=O)NCCCCO 240690a_100000750430_100000693142 [0,2,0,0,0,0|2,0,0]=4 13581 B16R1.20 Cc1cccc(c1Cl)C(=O)NCCCCO 527a_100000750430_100000693142 [0,2,0,0,0,0|2,0,0]=4 13582 B16R1.20 Cc1cccc(c1F)C(=O)CCCCCF 1458a_100000766181_100000729378 [0,2,0,0,0,0|2,0,0]=4 13583 B16R1.20 Cc1cccc(c1F)C(=O)CCCCCO 1458a_100000766181_100000746330 [0,2,0,0,0,0|2,0,0]=4 13584 B16R1.20 Cc1cccc(c1F)C(=O)NCCCCO 240690a_100000750430_100000766181 [0,2,0,0,0,0|2,0,0]=4 13585 B16R1.20 Cc1cccc(c1F)C(=O)NCCCCO 527a_100000750430_100000766181 [0,2,0,0,0,0|2,0,0]=4 13586 B16R1.20 Cc1cccc(c1I)C(=O)CCCCCF 1458a_100000739377_100000729378 [0,2,0,0,0,0|2,0,0]=4 13587 B16R1.20 Cc1cccc(c1I)C(=O)CCCCCO 1458a_100000739377_100000746330 [0,2,0,0,0,0|2,0,0]=4 13588 B16R1.20 Cc1cccc(c1I)C(=O)NCCCCO 240690a_100000750430_100000739377 [0,2,0,0,0,0|2,0,0]=4 13589 B16R1.20 Cc1cccc(c1I)C(=O)NCCCCO 527a_100000750430_100000739377 [0,2,0,0,0,0|2,0,0]=4 13590 B16R1.20 Cc1cccc(c1O)C(=O)CCCCC#N 1458a_100000183896_100000211819 [0,2,0,0,0,0|1,0,1]=4 13591 B16R1.20 Cc1cccc(c1O)C(=O)CCCCCF 1458a_100000183896_100000729378 [0,2,0,0,0,0|1,0,0]=3 13592 B16R1.20 Cc1cccc(c1O)C(=O)CCCCCO 1458a_100000183896_100000746330 [0,2,0,0,0,0|1,0,0]=3 13593 B16R1.20 Cc1cccc(c1O)C(=O)CCOCCO 1458a_100000183896_100011215305 [0,2,0,0,0,0|2,0,0]=4 13594 B16R1.20 Cc1cccc(c1O)C(=O)NCCCCO 240690a_100000750430_100000183896 [0,2,0,0,0,0|1,0,0]=3 13595 B16R1.20 Cc1cccc(c1O)C(=O)NCCCCO 527a_100000750430_100000183896 [0,2,0,0,0,0|1,0,0]=3 13596 B16R1.20 N#CCCCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000211819 [0,2,0,0,0,0|1,0,1]=4 13597 B16R1.20 N#CCCCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000211819 [0,2,0,0,0,0|1,0,1]=4 13598 B16R1.20 N#CCCCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000211819 [0,2,0,0,0,0|1,0,1]=4 13599 B16R1.20 N#CCCCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000211819 [0,2,0,0,0,0|1,0,1]=4 13600 B16R1.20 NCCCOCC(=O)c1cccc(c1F)Br 34a_100000182051_100012356374 [0,2,0,0,0,0|2,0,0]=4 13601 B16R1.20 NCCCOCC(=O)c1cccc(c1F)Cl 34a_100000182051_200012351890 [0,2,0,0,0,0|2,0,0]=4 13602 B16R1.20 O=C(CCCCCF)c1cccc(c1Br)Br 1458a_100012360534_100000729378 [0,2,0,0,0,0|2,0,0]=4 13603 B16R1.20 O=C(CCCCCF)c1cccc(c1Br)Cl 1458a_100012339722_100000729378 [0,2,0,0,0,0|2,0,0]=4 13604 B16R1.20 O=C(CCCCCF)c1cccc(c1Br)F 1458a_100011217547_100000729378 [0,2,0,0,0,0|2,0,0]=4 13605 B16R1.20 O=C(CCCCCF)c1cccc(c1Br)I 1458a_100010232522_100000729378 [0,2,0,0,0,0|2,0,0]=4 13606 B16R1.20 O=C(CCCCCF)c1cccc(c1Br)O 1458a_100010230362_100000729378 [0,2,0,0,0,0|2,0,0]=4 13607 B16R1.20 O=C(CCCCCF)c1cccc(c1Cl)Br 1458a_100000760540_100000729378 [0,2,0,0,0,0|2,0,0]=4 13608 B16R1.20 O=C(CCCCCF)c1cccc(c1Cl)Cl 1458a_100000183631_100000729378 [0,2,0,0,0,0|2,0,0]=4 13609 B16R1.20 O=C(CCCCCF)c1cccc(c1Cl)F 1458a_100000759904_100000729378 [0,2,0,0,0,0|2,0,0]=4 13610 B16R1.20 O=C(CCCCCF)c1cccc(c1Cl)I 1458a_100010176783_100000729378 [0,2,0,0,0,0|2,0,0]=4 13611 B16R1.20 O=C(CCCCCF)c1cccc(c1Cl)O 1458a_100000092362_100000729378 [0,2,0,0,0,0|2,0,0]=4 13612 B16R1.20 O=C(CCCCCF)c1cccc(c1F)Br 1458a_100000756403_100000729378 [0,2,0,0,0,0|2,0,0]=4 13613 B16R1.20 O=C(CCCCCF)c1cccc(c1F)Cl 1458a_100000688816_100000729378 [0,2,0,0,0,0|2,0,0]=4 13614 B16R1.20 O=C(CCCCCF)c1cccc(c1F)F 1458a_100000748134_100000729378 [0,2,0,0,0,0|2,0,0]=4 13615 B16R1.20 O=C(CCCCCF)c1cccc(c1F)I 1458a_100010185205_100000729378 [0,2,0,0,0,0|2,0,0]=4 13616 B16R1.20 O=C(CCCCCF)c1cccc(c1F)O 1458a_100000037433_100000729378 [0,2,0,0,0,0|2,0,0]=4 13617 B16R1.20 O=C(CCCCCF)c1cccc(c1I)Br 1458a_100000688019_100000729378 [0,2,0,0,0,0|2,0,0]=4 13618 B16R1.20 O=C(CCCCCF)c1cccc(c1I)Cl 1458a_100010176784_100000729378 [0,2,0,0,0,0|2,0,0]=4 13619 B16R1.20 O=C(CCCCCF)c1cccc(c1I)F 1458a_100000690930_100000729378 [0,2,0,0,0,0|2,0,0]=4 13620 B16R1.20 O=C(CCCCCF)c1cccc(c1I)O 1458a_100010084636_100000729378 [0,2,0,0,0,0|2,0,0]=4 13621 B16R1.20 O=C(CCCCCF)c1cccc(c1O)Br 1458a_100000752940_100000729378 [0,2,0,0,0,0|1,0,0]=3 13622 B16R1.20 O=C(CCCCCF)c1cccc(c1O)Cl 1458a_100000742801_100000729378 [0,2,0,0,0,0|1,0,0]=3 13623 B16R1.20 O=C(CCCCCF)c1cccc(c1O)F 1458a_100011217230_100000729378 [0,2,0,0,0,0|1,0,0]=3 13624 B16R1.20 O=C(CCCCCF)c1cccc(c1O)O 1458a_100000690420_100000729378 [0,2,0,0,0,0|1,0,0]=3 13625 B16R1.20 O=C(CCCCCO)c1cccc(c1Br)Br 1458a_100012360534_100000746330 [0,2,0,0,0,0|2,0,0]=4 13626 B16R1.20 O=C(CCCCCO)c1cccc(c1Br)Cl 1458a_100012339722_100000746330 [0,2,0,0,0,0|2,0,0]=4 13627 B16R1.20 O=C(CCCCCO)c1cccc(c1Br)F 1458a_100011217547_100000746330 [0,2,0,0,0,0|2,0,0]=4 13628 B16R1.20 O=C(CCCCCO)c1cccc(c1Br)I 1458a_100010232522_100000746330 [0,2,0,0,0,0|2,0,0]=4 13629 B16R1.20 O=C(CCCCCO)c1cccc(c1Br)O 1458a_100010230362_100000746330 [0,2,0,0,0,0|2,0,0]=4 13630 B16R1.20 O=C(CCCCCO)c1cccc(c1Cl)Br 1458a_100000760540_100000746330 [0,2,0,0,0,0|2,0,0]=4 13631 B16R1.20 O=C(CCCCCO)c1cccc(c1Cl)Cl 1458a_100000183631_100000746330 [0,2,0,0,0,0|2,0,0]=4 13632 B16R1.20 O=C(CCCCCO)c1cccc(c1Cl)F 1458a_100000759904_100000746330 [0,2,0,0,0,0|2,0,0]=4 13633 B16R1.20 O=C(CCCCCO)c1cccc(c1Cl)I 1458a_100010176783_100000746330 [0,2,0,0,0,0|2,0,0]=4 13634 B16R1.20 O=C(CCCCCO)c1cccc(c1Cl)O 1458a_100000092362_100000746330 [0,2,0,0,0,0|2,0,0]=4 13635 B16R1.20 O=C(CCCCCO)c1cccc(c1F)Br 1458a_100000756403_100000746330 [0,2,0,0,0,0|2,0,0]=4 13636 B16R1.20 O=C(CCCCCO)c1cccc(c1F)Cl 1458a_100000688816_100000746330 [0,2,0,0,0,0|2,0,0]=4 13637 B16R1.20 O=C(CCCCCO)c1cccc(c1F)F 1458a_100000748134_100000746330 [0,2,0,0,0,0|2,0,0]=4 13638 B16R1.20 O=C(CCCCCO)c1cccc(c1F)I 1458a_100010185205_100000746330 [0,2,0,0,0,0|2,0,0]=4 13639 B16R1.20 O=C(CCCCCO)c1cccc(c1F)O 1458a_100000037433_100000746330 [0,2,0,0,0,0|2,0,0]=4 13640 B16R1.20 O=C(CCCCCO)c1cccc(c1I)Br 1458a_100000688019_100000746330 [0,2,0,0,0,0|2,0,0]=4 13641 B16R1.20 O=C(CCCCCO)c1cccc(c1I)Cl 1458a_100010176784_100000746330 [0,2,0,0,0,0|2,0,0]=4 13642 B16R1.20 O=C(CCCCCO)c1cccc(c1I)F 1458a_100000690930_100000746330 [0,2,0,0,0,0|2,0,0]=4 13643 B16R1.20 O=C(CCCCCO)c1cccc(c1I)O 1458a_100010084636_100000746330 [0,2,0,0,0,0|2,0,0]=4 13644 B16R1.20 O=C(CCCCCO)c1cccc(c1O)Br 1458a_100000752940_100000746330 [0,2,0,0,0,0|1,0,0]=3 13645 B16R1.20 O=C(CCCCCO)c1cccc(c1O)Cl 1458a_100000742801_100000746330 [0,2,0,0,0,0|1,0,0]=3 13646 B16R1.20 O=C(CCCCCO)c1cccc(c1O)F 1458a_100011217230_100000746330 [0,2,0,0,0,0|1,0,0]=3 13647 B16R1.20 O=C(CCCCCO)c1cccc(c1O)O 1458a_100000690420_100000746330 [0,2,0,0,0,0|1,0,0]=3 13648 B16R1.20 O=C(CCOCCO)c1cccc(c1O)Br 1458a_100000752940_100011215305 [0,2,0,0,0,0|2,0,0]=4 13649 B16R1.20 O=C(CCOCCO)c1cccc(c1O)Cl 1458a_100000742801_100011215305 [0,2,0,0,0,0|2,0,0]=4 13650 B16R1.20 O=C(CCOCCO)c1cccc(c1O)F 1458a_100011217230_100011215305 [0,2,0,0,0,0|2,0,0]=4 13651 B16R1.20 O=C(CCOCCO)c1cccc(c1O)O 1458a_100000690420_100011215305 [0,2,0,0,0,0|2,0,0]=4 13652 B16R1.20 O=C(COCCCBr)c1cccc(c1F)Br 34a_100011217188_100012356374 [0,2,0,0,0,0|2,0,0]=4 13653 B16R1.20 O=C(COCCCBr)c1cccc(c1F)Cl 34a_100011217188_200012351890 [0,2,0,0,0,0|2,0,0]=4 13654 B16R1.20 O=C(COCCCCl)c1cccc(c1F)Br 34a_100000230001_100012356374 [0,2,0,0,0,0|2,0,0]=4 13655 B16R1.20 O=C(COCCCCl)c1cccc(c1F)Cl 34a_100000230001_200012351890 [0,2,0,0,0,0|2,0,0]=4 13656 B16R1.20 O=C(COCCCF)c1cccc(c1F)Br 34a_100000759539_100012356374 [0,2,0,0,0,0|2,0,0]=4 13657 B16R1.20 O=C(COCCCF)c1cccc(c1F)Cl 34a_100000759539_200012351890 [0,2,0,0,0,0|2,0,0]=4 13658 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)Br 240690a_100000750430_100012360534 [0,2,0,0,0,0|2,0,0]=4 13659 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)Br 527a_100000750430_100012360534 [0,2,0,0,0,0|2,0,0]=4 13660 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)Cl 240690a_100000750430_100012339722 [0,2,0,0,0,0|2,0,0]=4 13661 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)Cl 527a_100000750430_100012339722 [0,2,0,0,0,0|2,0,0]=4 13662 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)F 240690a_100000750430_100011217547 [0,2,0,0,0,0|2,0,0]=4 13663 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)F 527a_100000750430_100011217547 [0,2,0,0,0,0|2,0,0]=4 13664 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)I 240690a_100000750430_100010232522 [0,2,0,0,0,0|2,0,0]=4 13665 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)I 527a_100000750430_100010232522 [0,2,0,0,0,0|2,0,0]=4 13666 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)O 240690a_100000750430_100010230362 [0,2,0,0,0,0|2,0,0]=4 13667 B16R1.20 O=C(NCCCCO)c1cccc(c1Br)O 527a_100000750430_100010230362 [0,2,0,0,0,0|2,0,0]=4 13668 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)Br 240690a_100000750430_100000760540 [0,2,0,0,0,0|2,0,0]=4 13669 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)Br 527a_100000750430_100000760540 [0,2,0,0,0,0|2,0,0]=4 13670 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)Cl 240690a_100000750430_100000183631 [0,2,0,0,0,0|2,0,0]=4 13671 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)Cl 527a_100000750430_100000183631 [0,2,0,0,0,0|2,0,0]=4 13672 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)F 240690a_100000750430_100000759904 [0,2,0,0,0,0|2,0,0]=4 13673 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)F 527a_100000750430_100000759904 [0,2,0,0,0,0|2,0,0]=4 13674 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)I 240690a_100000750430_100010176783 [0,2,0,0,0,0|2,0,0]=4 13675 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)I 527a_100000750430_100010176783 [0,2,0,0,0,0|2,0,0]=4 13676 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)O 240690a_100000750430_100000092362 [0,2,0,0,0,0|2,0,0]=4 13677 B16R1.20 O=C(NCCCCO)c1cccc(c1Cl)O 527a_100000750430_100000092362 [0,2,0,0,0,0|2,0,0]=4 13678 B16R1.20 O=C(NCCCCO)c1cccc(c1F)Br 240690a_100000750430_100000756403 [0,2,0,0,0,0|2,0,0]=4 13679 B16R1.20 O=C(NCCCCO)c1cccc(c1F)Br 527a_100000750430_100000756403 [0,2,0,0,0,0|2,0,0]=4 13680 B16R1.20 O=C(NCCCCO)c1cccc(c1F)Cl 240690a_100000750430_100000688816 [0,2,0,0,0,0|2,0,0]=4 13681 B16R1.20 O=C(NCCCCO)c1cccc(c1F)Cl 527a_100000750430_100000688816 [0,2,0,0,0,0|2,0,0]=4 13682 B16R1.20 O=C(NCCCCO)c1cccc(c1F)F 240690a_100000750430_100000748134 [0,2,0,0,0,0|2,0,0]=4 13683 B16R1.20 O=C(NCCCCO)c1cccc(c1F)F 527a_100000750430_100000748134 [0,2,0,0,0,0|2,0,0]=4 13684 B16R1.20 O=C(NCCCCO)c1cccc(c1F)I 240690a_100000750430_100010185205 [0,2,0,0,0,0|2,0,0]=4 13685 B16R1.20 O=C(NCCCCO)c1cccc(c1F)I 527a_100000750430_100010185205 [0,2,0,0,0,0|2,0,0]=4 13686 B16R1.20 O=C(NCCCCO)c1cccc(c1F)O 240690a_100000750430_100000037433 [0,2,0,0,0,0|2,0,0]=4 13687 B16R1.20 O=C(NCCCCO)c1cccc(c1F)O 527a_100000750430_100000037433 [0,2,0,0,0,0|2,0,0]=4 13688 B16R1.20 O=C(NCCCCO)c1cccc(c1I)Br 240690a_100000750430_100000688019 [0,2,0,0,0,0|2,0,0]=4 13689 B16R1.20 O=C(NCCCCO)c1cccc(c1I)Br 527a_100000750430_100000688019 [0,2,0,0,0,0|2,0,0]=4 13690 B16R1.20 O=C(NCCCCO)c1cccc(c1I)Cl 240690a_100000750430_100010176784 [0,2,0,0,0,0|2,0,0]=4 13691 B16R1.20 O=C(NCCCCO)c1cccc(c1I)Cl 527a_100000750430_100010176784 [0,2,0,0,0,0|2,0,0]=4 13692 B16R1.20 O=C(NCCCCO)c1cccc(c1I)F 240690a_100000750430_100000690930 [0,2,0,0,0,0|2,0,0]=4 13693 B16R1.20 O=C(NCCCCO)c1cccc(c1I)F 527a_100000750430_100000690930 [0,2,0,0,0,0|2,0,0]=4 13694 B16R1.20 O=C(NCCCCO)c1cccc(c1I)O 527a_100000750430_100010084636 [0,2,0,0,0,0|2,0,0]=4 13695 B16R1.20 O=C(NCCCCO)c1cccc(c1O)Br 240690a_100000750430_100000752940 [0,2,0,0,0,0|1,0,0]=3 13696 B16R1.20 O=C(NCCCCO)c1cccc(c1O)Br 527a_100000750430_100000752940 [0,2,0,0,0,0|1,0,0]=3 13697 B16R1.20 O=C(NCCCCO)c1cccc(c1O)Cl 240690a_100000750430_100000742801 [0,2,0,0,0,0|1,0,0]=3 13698 B16R1.20 O=C(NCCCCO)c1cccc(c1O)Cl 527a_100000750430_100000742801 [0,2,0,0,0,0|1,0,0]=3 13699 B16R1.20 O=C(NCCCCO)c1cccc(c1O)F 240690a_100000750430_100011217230 [0,2,0,0,0,0|1,0,0]=3 13700 B16R1.20 O=C(NCCCCO)c1cccc(c1O)F 527a_100000750430_100011217230 [0,2,0,0,0,0|1,0,0]=3 13701 B16R1.20 O=C(NCCCCO)c1cccc(c1O)O 527a_100000750430_100000690420 [0,2,0,0,0,0|1,0,0]=3 13702 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)Br 240690a_100000744482_100000752940 [0,2,0,0,0,0|2,0,0]=4 13703 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)Br 527a_100000744482_100000752940 [0,2,0,0,0,0|2,0,0]=4 13704 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)Cl 240690a_100000744482_100000742801 [0,2,0,0,0,0|2,0,0]=4 13705 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)Cl 527a_100000744482_100000742801 [0,2,0,0,0,0|2,0,0]=4 13706 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)F 240690a_100000744482_100011217230 [0,2,0,0,0,0|2,0,0]=4 13707 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)F 527a_100000744482_100011217230 [0,2,0,0,0,0|2,0,0]=4 13708 B16R1.89 CC(CO)CNC(=O)c1cccc(c1O)O 527a_100000744482_100000690420 [0,2,0,0,0,0|2,0,0]=4 13709 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Br 11a_100020588543_100012360534 [0,2,0,0,0,0|2,0,0]=4 13710 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Br 1626a_100020588543_100012360534 [0,2,0,0,0,0|2,0,0]=4 13711 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Br 240690a_100020588543_100012360534 [0,2,0,0,0,0|2,0,0]=4 13712 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Br 527a_100020588543_100012360534 [0,2,0,0,0,0|2,0,0]=4 13713 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)C 11a_100020588543_100000692419 [0,2,0,0,0,0|2,0,0]=4 13714 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)C 1626a_100020588543_100000692419 [0,2,0,0,0,0|2,0,0]=4 13715 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)C 240690a_100020588543_100000692419 [0,2,0,0,0,0|2,0,0]=4 13716 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)C 527a_100020588543_100000692419 [0,2,0,0,0,0|2,0,0]=4 13717 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Cl 11a_100020588543_100012339722 [0,2,0,0,0,0|2,0,0]=4 13718 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Cl 1626a_100020588543_100012339722 [0,2,0,0,0,0|2,0,0]=4 13719 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Cl 240690a_100020588543_100012339722 [0,2,0,0,0,0|2,0,0]=4 13720 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)Cl 527a_100020588543_100012339722 [0,2,0,0,0,0|2,0,0]=4 13721 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)F 11a_100020588543_100011217547 [0,2,0,0,0,0|2,0,0]=4 13722 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)F 1626a_100020588543_100011217547 [0,2,0,0,0,0|2,0,0]=4 13723 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)F 240690a_100020588543_100011217547 [0,2,0,0,0,0|2,0,0]=4 13724 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)F 527a_100020588543_100011217547 [0,2,0,0,0,0|2,0,0]=4 13725 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)I 11a_100020588543_100010232522 [0,2,0,0,0,0|2,0,0]=4 13726 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)I 1626a_100020588543_100010232522 [0,2,0,0,0,0|2,0,0]=4 13727 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)I 240690a_100020588543_100010232522 [0,2,0,0,0,0|2,0,0]=4 13728 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)I 527a_100020588543_100010232522 [0,2,0,0,0,0|2,0,0]=4 13729 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)O 240690a_100020588543_100010230362 [0,2,0,0,0,0|2,0,0]=4 13730 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Br)O 527a_100020588543_100010230362 [0,2,0,0,0,0|2,0,0]=4 13731 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Br 11a_100020588543_100000760464 [0,2,0,0,0,0|2,0,0]=4 13732 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Br 1626a_100020588543_100000760464 [0,2,0,0,0,0|2,0,0]=4 13733 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Br 240690a_100020588543_100000760464 [0,2,0,0,0,0|2,0,0]=4 13734 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Br 527a_100020588543_100000760464 [0,2,0,0,0,0|2,0,0]=4 13735 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)C 11a_100020588543_100000183679 [0,2,0,0,0,0|2,0,0]=4 13736 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)C 1626a_100020588543_100000183679 [0,2,0,0,0,0|2,0,0]=4 13737 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)C 240690a_100020588543_100000183679 [0,2,0,0,0,0|2,0,0]=4 13738 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)C 527a_100020588543_100000183679 [0,2,0,0,0,0|2,0,0]=4 13739 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Cl 11a_100020588543_100000690184 [0,2,0,0,0,0|2,0,0]=4 13740 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Cl 1626a_100020588543_100000690184 [0,2,0,0,0,0|2,0,0]=4 13741 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Cl 240690a_100020588543_100000690184 [0,2,0,0,0,0|2,0,0]=4 13742 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)Cl 527a_100020588543_100000690184 [0,2,0,0,0,0|2,0,0]=4 13743 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)F 11a_100020588543_100011218272 [0,2,0,0,0,0|2,0,0]=4 13744 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)F 1626a_100020588543_100011218272 [0,2,0,0,0,0|2,0,0]=4 13745 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)F 240690a_100020588543_100011218272 [0,2,0,0,0,0|2,0,0]=4 13746 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)F 527a_100020588543_100011218272 [0,2,0,0,0,0|2,0,0]=4 13747 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)I 11a_100020588543_100000751865 [0,2,0,0,0,0|2,0,0]=4 13748 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)I 1626a_100020588543_100000751865 [0,2,0,0,0,0|2,0,0]=4 13749 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)I 240690a_100020588543_100000751865 [0,2,0,0,0,0|2,0,0]=4 13750 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)I 527a_100020588543_100000751865 [0,2,0,0,0,0|2,0,0]=4 13751 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)O 240690a_100020588543_100000766327 [0,2,0,0,0,0|2,0,0]=4 13752 B16R1.89 CCC(C)CNC(=O)c1cccc(c1C)O 527a_100020588543_100000766327 [0,2,0,0,0,0|2,0,0]=4 13753 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Br 11a_100020588543_100000760540 [0,2,0,0,0,0|2,0,0]=4 13754 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Br 1626a_100020588543_100000760540 [0,2,0,0,0,0|2,0,0]=4 13755 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Br 240690a_100020588543_100000760540 [0,2,0,0,0,0|2,0,0]=4 13756 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Br 527a_100020588543_100000760540 [0,2,0,0,0,0|2,0,0]=4 13757 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)C 11a_100020588543_100000693142 [0,2,0,0,0,0|2,0,0]=4 13758 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)C 1626a_100020588543_100000693142 [0,2,0,0,0,0|2,0,0]=4 13759 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)C 240690a_100020588543_100000693142 [0,2,0,0,0,0|2,0,0]=4 13760 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)C 527a_100020588543_100000693142 [0,2,0,0,0,0|2,0,0]=4 13761 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Cl 11a_100020588543_100000183631 [0,2,0,0,0,0|2,0,0]=4 13762 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Cl 1626a_100020588543_100000183631 [0,2,0,0,0,0|2,0,0]=4 13763 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Cl 240690a_100020588543_100000183631 [0,2,0,0,0,0|2,0,0]=4 13764 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)Cl 527a_100020588543_100000183631 [0,2,0,0,0,0|2,0,0]=4 13765 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)F 11a_100020588543_100000759904 [0,2,0,0,0,0|2,0,0]=4 13766 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)F 1626a_100020588543_100000759904 [0,2,0,0,0,0|2,0,0]=4 13767 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)F 240690a_100020588543_100000759904 [0,2,0,0,0,0|2,0,0]=4 13768 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)F 527a_100020588543_100000759904 [0,2,0,0,0,0|2,0,0]=4 13769 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)I 11a_100020588543_100010176783 [0,2,0,0,0,0|2,0,0]=4 13770 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)I 1626a_100020588543_100010176783 [0,2,0,0,0,0|2,0,0]=4 13771 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)I 240690a_100020588543_100010176783 [0,2,0,0,0,0|2,0,0]=4 13772 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)I 527a_100020588543_100010176783 [0,2,0,0,0,0|2,0,0]=4 13773 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)O 240690a_100020588543_100000092362 [0,2,0,0,0,0|2,0,0]=4 13774 B16R1.89 CCC(C)CNC(=O)c1cccc(c1Cl)O 527a_100020588543_100000092362 [0,2,0,0,0,0|2,0,0]=4 13775 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Br 11a_100020588543_100000756403 [0,2,0,0,0,0|2,0,0]=4 13776 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Br 1626a_100020588543_100000756403 [0,2,0,0,0,0|2,0,0]=4 13777 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Br 240690a_100020588543_100000756403 [0,2,0,0,0,0|2,0,0]=4 13778 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Br 527a_100020588543_100000756403 [0,2,0,0,0,0|2,0,0]=4 13779 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)C 11a_100020588543_100000766181 [0,2,0,0,0,0|2,0,0]=4 13780 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)C 1626a_100020588543_100000766181 [0,2,0,0,0,0|2,0,0]=4 13781 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)C 240690a_100020588543_100000766181 [0,2,0,0,0,0|2,0,0]=4 13782 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)C 527a_100020588543_100000766181 [0,2,0,0,0,0|2,0,0]=4 13783 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Cl 11a_100020588543_100000688816 [0,2,0,0,0,0|2,0,0]=4 13784 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Cl 1626a_100020588543_100000688816 [0,2,0,0,0,0|2,0,0]=4 13785 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Cl 240690a_100020588543_100000688816 [0,2,0,0,0,0|2,0,0]=4 13786 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)Cl 527a_100020588543_100000688816 [0,2,0,0,0,0|2,0,0]=4 13787 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)F 11a_100020588543_100000748134 [0,2,0,0,0,0|2,0,0]=4 13788 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)F 1626a_100020588543_100000748134 [0,2,0,0,0,0|2,0,0]=4 13789 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)F 240690a_100020588543_100000748134 [0,2,0,0,0,0|2,0,0]=4 13790 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)F 527a_100020588543_100000748134 [0,2,0,0,0,0|2,0,0]=4 13791 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)I 11a_100020588543_100010185205 [0,2,0,0,0,0|2,0,0]=4 13792 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)I 1626a_100020588543_100010185205 [0,2,0,0,0,0|2,0,0]=4 13793 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)I 240690a_100020588543_100010185205 [0,2,0,0,0,0|2,0,0]=4 13794 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)I 527a_100020588543_100010185205 [0,2,0,0,0,0|2,0,0]=4 13795 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)O 240690a_100020588543_100000037433 [0,2,0,0,0,0|2,0,0]=4 13796 B16R1.89 CCC(C)CNC(=O)c1cccc(c1F)O 527a_100020588543_100000037433 [0,2,0,0,0,0|2,0,0]=4 13797 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Br 11a_100020588543_100000688019 [0,2,0,0,0,0|2,0,0]=4 13798 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Br 1626a_100020588543_100000688019 [0,2,0,0,0,0|2,0,0]=4 13799 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Br 240690a_100020588543_100000688019 [0,2,0,0,0,0|2,0,0]=4 13800 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Br 527a_100020588543_100000688019 [0,2,0,0,0,0|2,0,0]=4 13801 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)C 11a_100020588543_100000739377 [0,2,0,0,0,0|2,0,0]=4 13802 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)C 1626a_100020588543_100000739377 [0,2,0,0,0,0|2,0,0]=4 13803 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)C 240690a_100020588543_100000739377 [0,2,0,0,0,0|2,0,0]=4 13804 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)C 527a_100020588543_100000739377 [0,2,0,0,0,0|2,0,0]=4 13805 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Cl 11a_100020588543_100010176784 [0,2,0,0,0,0|2,0,0]=4 13806 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Cl 1626a_100020588543_100010176784 [0,2,0,0,0,0|2,0,0]=4 13807 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Cl 240690a_100020588543_100010176784 [0,2,0,0,0,0|2,0,0]=4 13808 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)Cl 527a_100020588543_100010176784 [0,2,0,0,0,0|2,0,0]=4 13809 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)F 11a_100020588543_100000690930 [0,2,0,0,0,0|2,0,0]=4 13810 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)F 1626a_100020588543_100000690930 [0,2,0,0,0,0|2,0,0]=4 13811 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)F 240690a_100020588543_100000690930 [0,2,0,0,0,0|2,0,0]=4 13812 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)F 527a_100020588543_100000690930 [0,2,0,0,0,0|2,0,0]=4 13813 B16R1.89 CCC(C)CNC(=O)c1cccc(c1I)O 527a_100020588543_100010084636 [0,2,0,0,0,0|2,0,0]=4 13814 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)Br 240690a_100020588543_100000752940 [0,2,0,0,0,0|1,0,0]=3 13815 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)Br 527a_100020588543_100000752940 [0,2,0,0,0,0|1,0,0]=3 13816 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)C 240690a_100020588543_100000183896 [0,2,0,0,0,0|1,0,0]=3 13817 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)C 527a_100020588543_100000183896 [0,2,0,0,0,0|1,0,0]=3 13818 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)Cl 240690a_100020588543_100000742801 [0,2,0,0,0,0|1,0,0]=3 13819 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)Cl 527a_100020588543_100000742801 [0,2,0,0,0,0|1,0,0]=3 13820 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)F 240690a_100020588543_100011217230 [0,2,0,0,0,0|1,0,0]=3 13821 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)F 527a_100020588543_100011217230 [0,2,0,0,0,0|1,0,0]=3 13822 B16R1.89 CCC(C)CNC(=O)c1cccc(c1O)O 527a_100020588543_100000690420 [0,2,0,0,0,0|1,0,0]=3 13823 B16R1.89 CCC(C)NNC(=O)c1cccc(c1O)Br 22a_100000718999_100000752940 [0,2,0,0,0,0|2,0,0]=4 13824 B16R1.89 CCC(C)NNC(=O)c1cccc(c1O)C 22a_100000718999_100000183896 [0,2,0,0,0,0|2,0,0]=4 13825 B16R1.89 CCC(C)NNC(=O)c1cccc(c1O)Cl 22a_100000718999_100000742801 [0,2,0,0,0,0|2,0,0]=4 13826 B16R1.89 CCC(C)NNC(=O)c1cccc(c1O)F 22a_100000718999_100011217230 [0,2,0,0,0,0|2,0,0]=4 13827 B16R1.89 CCC(C)NNC(=O)c1cccc(c1O)O 22a_100000718999_100000690420 [0,2,0,0,0,0|2,0,0]=4 13828 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)Br 11a_100011218483_100012360534 [0,2,0,0,0,0|2,0,0]=4 13829 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)Br 240690a_100011218483_100012360534 [0,2,0,0,0,0|2,0,0]=4 13830 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)Br 527a_100011218483_100012360534 [0,2,0,0,0,0|2,0,0]=4 13831 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)C 11a_100011218483_100000692419 [0,2,0,0,0,0|2,0,0]=4 13832 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)C 240690a_100011218483_100000692419 [0,2,0,0,0,0|2,0,0]=4 13833 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)C 527a_100011218483_100000692419 [0,2,0,0,0,0|2,0,0]=4 13834 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)Cl 11a_100011218483_100012339722 [0,2,0,0,0,0|2,0,0]=4 13835 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)Cl 240690a_100011218483_100012339722 [0,2,0,0,0,0|2,0,0]=4 13836 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)Cl 527a_100011218483_100012339722 [0,2,0,0,0,0|2,0,0]=4 13837 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)F 11a_100011218483_100011217547 [0,2,0,0,0,0|2,0,0]=4 13838 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)F 240690a_100011218483_100011217547 [0,2,0,0,0,0|2,0,0]=4 13839 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)F 527a_100011218483_100011217547 [0,2,0,0,0,0|2,0,0]=4 13840 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)I 11a_100011218483_100010232522 [0,2,0,0,0,0|2,0,0]=4 13841 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)I 240690a_100011218483_100010232522 [0,2,0,0,0,0|2,0,0]=4 13842 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)I 527a_100011218483_100010232522 [0,2,0,0,0,0|2,0,0]=4 13843 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)O 240690a_100011218483_100010230362 [0,2,0,0,0,0|2,0,0]=4 13844 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Br)O 527a_100011218483_100010230362 [0,2,0,0,0,0|2,0,0]=4 13845 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)Br 11a_100011218483_100000760464 [0,2,0,0,0,0|2,0,0]=4 13846 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)Br 240690a_100011218483_100000760464 [0,2,0,0,0,0|2,0,0]=4 13847 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)Br 527a_100011218483_100000760464 [0,2,0,0,0,0|2,0,0]=4 13848 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)C 11a_100011218483_100000183679 [0,2,0,0,0,0|2,0,0]=4 13849 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)C 240690a_100011218483_100000183679 [0,2,0,0,0,0|2,0,0]=4 13850 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)C 527a_100011218483_100000183679 [0,2,0,0,0,0|2,0,0]=4 13851 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)Cl 11a_100011218483_100000690184 [0,2,0,0,0,0|2,0,0]=4 13852 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)Cl 240690a_100011218483_100000690184 [0,2,0,0,0,0|2,0,0]=4 13853 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)Cl 527a_100011218483_100000690184 [0,2,0,0,0,0|2,0,0]=4 13854 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)F 11a_100011218483_100011218272 [0,2,0,0,0,0|2,0,0]=4 13855 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)F 240690a_100011218483_100011218272 [0,2,0,0,0,0|2,0,0]=4 13856 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)F 527a_100011218483_100011218272 [0,2,0,0,0,0|2,0,0]=4 13857 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)I 11a_100011218483_100000751865 [0,2,0,0,0,0|2,0,0]=4 13858 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)I 240690a_100011218483_100000751865 [0,2,0,0,0,0|2,0,0]=4 13859 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)I 527a_100011218483_100000751865 [0,2,0,0,0,0|2,0,0]=4 13860 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)O 240690a_100011218483_100000766327 [0,2,0,0,0,0|2,0,0]=4 13861 B16R1.89 CCC(O)CNC(=O)c1cccc(c1C)O 527a_100011218483_100000766327 [0,2,0,0,0,0|2,0,0]=4 13862 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)Br 11a_100011218483_100000760540 [0,2,0,0,0,0|2,0,0]=4 13863 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)Br 240690a_100011218483_100000760540 [0,2,0,0,0,0|2,0,0]=4 13864 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)Br 527a_100011218483_100000760540 [0,2,0,0,0,0|2,0,0]=4 13865 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)C 11a_100011218483_100000693142 [0,2,0,0,0,0|2,0,0]=4 13866 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)C 240690a_100011218483_100000693142 [0,2,0,0,0,0|2,0,0]=4 13867 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)C 527a_100011218483_100000693142 [0,2,0,0,0,0|2,0,0]=4 13868 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)Cl 11a_100011218483_100000183631 [0,2,0,0,0,0|2,0,0]=4 13869 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)Cl 240690a_100011218483_100000183631 [0,2,0,0,0,0|2,0,0]=4 13870 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)Cl 527a_100011218483_100000183631 [0,2,0,0,0,0|2,0,0]=4 13871 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)F 11a_100011218483_100000759904 [0,2,0,0,0,0|2,0,0]=4 13872 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)F 240690a_100011218483_100000759904 [0,2,0,0,0,0|2,0,0]=4 13873 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)F 527a_100011218483_100000759904 [0,2,0,0,0,0|2,0,0]=4 13874 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)I 11a_100011218483_100010176783 [0,2,0,0,0,0|2,0,0]=4 13875 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)I 240690a_100011218483_100010176783 [0,2,0,0,0,0|2,0,0]=4 13876 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)I 527a_100011218483_100010176783 [0,2,0,0,0,0|2,0,0]=4 13877 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)O 240690a_100011218483_100000092362 [0,2,0,0,0,0|2,0,0]=4 13878 B16R1.89 CCC(O)CNC(=O)c1cccc(c1Cl)O 527a_100011218483_100000092362 [0,2,0,0,0,0|2,0,0]=4 13879 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)Br 11a_100011218483_100000756403 [0,2,0,0,0,0|2,0,0]=4 13880 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)Br 240690a_100011218483_100000756403 [0,2,0,0,0,0|2,0,0]=4 13881 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)Br 527a_100011218483_100000756403 [0,2,0,0,0,0|2,0,0]=4 13882 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)C 11a_100011218483_100000766181 [0,2,0,0,0,0|2,0,0]=4 13883 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)C 240690a_100011218483_100000766181 [0,2,0,0,0,0|2,0,0]=4 13884 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)C 527a_100011218483_100000766181 [0,2,0,0,0,0|2,0,0]=4 13885 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)Cl 11a_100011218483_100000688816 [0,2,0,0,0,0|2,0,0]=4 13886 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)Cl 240690a_100011218483_100000688816 [0,2,0,0,0,0|2,0,0]=4 13887 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)Cl 527a_100011218483_100000688816 [0,2,0,0,0,0|2,0,0]=4 13888 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)F 11a_100011218483_100000748134 [0,2,0,0,0,0|2,0,0]=4 13889 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)F 240690a_100011218483_100000748134 [0,2,0,0,0,0|2,0,0]=4 13890 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)F 527a_100011218483_100000748134 [0,2,0,0,0,0|2,0,0]=4 13891 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)I 11a_100011218483_100010185205 [0,2,0,0,0,0|2,0,0]=4 13892 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)I 240690a_100011218483_100010185205 [0,2,0,0,0,0|2,0,0]=4 13893 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)I 527a_100011218483_100010185205 [0,2,0,0,0,0|2,0,0]=4 13894 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)O 240690a_100011218483_100000037433 [0,2,0,0,0,0|2,0,0]=4 13895 B16R1.89 CCC(O)CNC(=O)c1cccc(c1F)O 527a_100011218483_100000037433 [0,2,0,0,0,0|2,0,0]=4 13896 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)Br 11a_100011218483_100000688019 [0,2,0,0,0,0|2,0,0]=4 13897 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)Br 240690a_100011218483_100000688019 [0,2,0,0,0,0|2,0,0]=4 13898 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)Br 527a_100011218483_100000688019 [0,2,0,0,0,0|2,0,0]=4 13899 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)C 11a_100011218483_100000739377 [0,2,0,0,0,0|2,0,0]=4 13900 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)C 240690a_100011218483_100000739377 [0,2,0,0,0,0|2,0,0]=4 13901 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)C 527a_100011218483_100000739377 [0,2,0,0,0,0|2,0,0]=4 13902 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)Cl 11a_100011218483_100010176784 [0,2,0,0,0,0|2,0,0]=4 13903 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)Cl 240690a_100011218483_100010176784 [0,2,0,0,0,0|2,0,0]=4 13904 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)Cl 527a_100011218483_100010176784 [0,2,0,0,0,0|2,0,0]=4 13905 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)F 11a_100011218483_100000690930 [0,2,0,0,0,0|2,0,0]=4 13906 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)F 240690a_100011218483_100000690930 [0,2,0,0,0,0|2,0,0]=4 13907 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)F 527a_100011218483_100000690930 [0,2,0,0,0,0|2,0,0]=4 13908 B16R1.89 CCC(O)CNC(=O)c1cccc(c1I)O 527a_100011218483_100010084636 [0,2,0,0,0,0|2,0,0]=4 13909 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)Br 240690a_100011218483_100000752940 [0,2,0,0,0,0|1,0,0]=3 13910 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)Br 527a_100011218483_100000752940 [0,2,0,0,0,0|1,0,0]=3 13911 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)C 240690a_100011218483_100000183896 [0,2,0,0,0,0|1,0,0]=3 13912 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)C 527a_100011218483_100000183896 [0,2,0,0,0,0|1,0,0]=3 13913 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)Cl 240690a_100011218483_100000742801 [0,2,0,0,0,0|1,0,0]=3 13914 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)Cl 527a_100011218483_100000742801 [0,2,0,0,0,0|1,0,0]=3 13915 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)F 240690a_100011218483_100011217230 [0,2,0,0,0,0|1,0,0]=3 13916 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)F 527a_100011218483_100011217230 [0,2,0,0,0,0|1,0,0]=3 13917 B16R1.89 CCC(O)CNC(=O)c1cccc(c1O)O 527a_100011218483_100000690420 [0,2,0,0,0,0|1,0,0]=3 13918 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)Br 240690a_100020591295_100000752940 [0,2,0,0,0,0|2,0,0]=4 13919 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)Br 527a_100020591295_100000752940 [0,2,0,0,0,0|2,0,0]=4 13920 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)C 240690a_100020591295_100000183896 [0,2,0,0,0,0|2,0,0]=4 13921 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)C 527a_100020591295_100000183896 [0,2,0,0,0,0|2,0,0]=4 13922 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)Cl 240690a_100020591295_100000742801 [0,2,0,0,0,0|2,0,0]=4 13923 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)Cl 527a_100020591295_100000742801 [0,2,0,0,0,0|2,0,0]=4 13924 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)F 240690a_100020591295_100011217230 [0,2,0,0,0,0|2,0,0]=4 13925 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)F 527a_100020591295_100011217230 [0,2,0,0,0,0|2,0,0]=4 13926 B16R1.89 CO[C@H](C)CNC(=O)c1cccc(c1O)O 527a_100020591295_100000690420 [0,2,0,0,0,0|2,0,0]=4 13927 B16R1.89 Cc1cccc(c1O)C(=O)NCC(C)CO 240690a_100000744482_100000183896 [0,2,0,0,0,0|2,0,0]=4 13928 B16R1.89 Cc1cccc(c1O)C(=O)NCC(C)CO 527a_100000744482_100000183896 [0,2,0,0,0,0|2,0,0]=4 13929 B16R1.89 Cc1cccc(c1O)C(=O)NC[C@@H](F)CO 240690a_100015665980_100000183896 [0,2,0,0,0,0|2,0,0]=4 13930 B16R1.89 Cc1cccc(c1O)C(=O)NC[C@@H](F)CO 527a_100015665980_100000183896 [0,2,0,0,0,0|2,0,0]=4 13931 B16R1.89 Cc1cccc(c1O)C(=O)NC[C@H](O)CO 240690a_100020644852_100000183896 [0,2,0,0,0,0|2,0,0]=4 13932 B16R1.89 Cc1cccc(c1O)C(=O)NC[C@H](O)CO 527a_100020644852_100000183896 [0,2,0,0,0,0|2,0,0]=4 13933 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)Br 240690a_100015665980_100000752940 [0,2,0,0,0,0|2,0,0]=4 13934 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)Br 527a_100015665980_100000752940 [0,2,0,0,0,0|2,0,0]=4 13935 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)Cl 240690a_100015665980_100000742801 [0,2,0,0,0,0|2,0,0]=4 13936 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)Cl 527a_100015665980_100000742801 [0,2,0,0,0,0|2,0,0]=4 13937 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)F 240690a_100015665980_100011217230 [0,2,0,0,0,0|2,0,0]=4 13938 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)F 527a_100015665980_100011217230 [0,2,0,0,0,0|2,0,0]=4 13939 B16R1.89 O=C(NC[C@@H](F)CO)c1cccc(c1O)O 527a_100015665980_100000690420 [0,2,0,0,0,0|2,0,0]=4 13940 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)Br 240690a_100020644852_100000752940 [0,2,0,0,0,0|2,0,0]=4 13941 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)Br 527a_100020644852_100000752940 [0,2,0,0,0,0|2,0,0]=4 13942 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)Cl 240690a_100020644852_100000742801 [0,2,0,0,0,0|2,0,0]=4 13943 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)Cl 527a_100020644852_100000742801 [0,2,0,0,0,0|2,0,0]=4 13944 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)F 240690a_100020644852_100011217230 [0,2,0,0,0,0|2,0,0]=4 13945 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)F 527a_100020644852_100011217230 [0,2,0,0,0,0|2,0,0]=4 13946 B16R1.89 O=C(NC[C@H](O)CO)c1cccc(c1O)O 527a_100020644852_100000690420 [0,2,0,0,0,0|2,0,0]=4 13947 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Br)Br 1458a_100012360534_200011215066 [0,2,0,0,0,0|2,0,0]=4 13948 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Br)C 1458a_100000692419_200011215066 [0,2,0,0,0,0|2,0,0]=4 13949 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200011215066 [0,2,0,0,0,0|2,0,0]=4 13950 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Br)F 1458a_100011217547_200011215066 [0,2,0,0,0,0|2,0,0]=4 13951 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Br)I 1458a_100010232522_200011215066 [0,2,0,0,0,0|2,0,0]=4 13952 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Br)O 1458a_100010230362_200011215066 [0,2,0,0,0,0|2,0,0]=4 13953 B16R1.90 CCCCC(C)C(=O)c1cccc(c1C)Br 1458a_100000760464_200011215066 [0,2,0,0,0,0|2,0,0]=4 13954 B16R1.90 CCCCC(C)C(=O)c1cccc(c1C)C 1458a_100000183679_200011215066 [0,2,0,0,0,0|2,0,0]=4 13955 B16R1.90 CCCCC(C)C(=O)c1cccc(c1C)Cl 1458a_100000690184_200011215066 [0,2,0,0,0,0|2,0,0]=4 13956 B16R1.90 CCCCC(C)C(=O)c1cccc(c1C)F 1458a_100011218272_200011215066 [0,2,0,0,0,0|2,0,0]=4 13957 B16R1.90 CCCCC(C)C(=O)c1cccc(c1C)I 1458a_100000751865_200011215066 [0,2,0,0,0,0|2,0,0]=4 13958 B16R1.90 CCCCC(C)C(=O)c1cccc(c1C)O 1458a_100000766327_200011215066 [0,2,0,0,0,0|2,0,0]=4 13959 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200011215066 [0,2,0,0,0,0|2,0,0]=4 13960 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Cl)C 1458a_100000693142_200011215066 [0,2,0,0,0,0|2,0,0]=4 13961 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200011215066 [0,2,0,0,0,0|2,0,0]=4 13962 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Cl)F 1458a_100000759904_200011215066 [0,2,0,0,0,0|2,0,0]=4 13963 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Cl)I 1458a_100010176783_200011215066 [0,2,0,0,0,0|2,0,0]=4 13964 B16R1.90 CCCCC(C)C(=O)c1cccc(c1Cl)O 1458a_100000092362_200011215066 [0,2,0,0,0,0|2,0,0]=4 13965 B16R1.90 CCCCC(C)C(=O)c1cccc(c1F)Br 1458a_100000756403_200011215066 [0,2,0,0,0,0|2,0,0]=4 13966 B16R1.90 CCCCC(C)C(=O)c1cccc(c1F)C 1458a_100000766181_200011215066 [0,2,0,0,0,0|2,0,0]=4 13967 B16R1.90 CCCCC(C)C(=O)c1cccc(c1F)Cl 1458a_100000688816_200011215066 [0,2,0,0,0,0|2,0,0]=4 13968 B16R1.90 CCCCC(C)C(=O)c1cccc(c1F)F 1458a_100000748134_200011215066 [0,2,0,0,0,0|2,0,0]=4 13969 B16R1.90 CCCCC(C)C(=O)c1cccc(c1F)I 1458a_100010185205_200011215066 [0,2,0,0,0,0|2,0,0]=4 13970 B16R1.90 CCCCC(C)C(=O)c1cccc(c1F)O 1458a_100000037433_200011215066 [0,2,0,0,0,0|2,0,0]=4 13971 B16R1.90 CCCCC(C)C(=O)c1cccc(c1I)Br 1458a_100000688019_200011215066 [0,2,0,0,0,0|2,0,0]=4 13972 B16R1.90 CCCCC(C)C(=O)c1cccc(c1I)C 1458a_100000739377_200011215066 [0,2,0,0,0,0|2,0,0]=4 13973 B16R1.90 CCCCC(C)C(=O)c1cccc(c1I)Cl 1458a_100010176784_200011215066 [0,2,0,0,0,0|2,0,0]=4 13974 B16R1.90 CCCCC(C)C(=O)c1cccc(c1I)F 1458a_100000690930_200011215066 [0,2,0,0,0,0|2,0,0]=4 13975 B16R1.90 CCCCC(C)C(=O)c1cccc(c1I)O 1458a_100010084636_200011215066 [0,2,0,0,0,0|2,0,0]=4 13976 B16R1.90 CCCCC(C)C(=O)c1cccc(c1O)Br 1458a_100000752940_200011215066 [0,2,0,0,0,0|1,0,0]=3 13977 B16R1.90 CCCCC(C)C(=O)c1cccc(c1O)C 1458a_100000183896_200011215066 [0,2,0,0,0,0|1,0,0]=3 13978 B16R1.90 CCCCC(C)C(=O)c1cccc(c1O)Cl 1458a_100000742801_200011215066 [0,2,0,0,0,0|1,0,0]=3 13979 B16R1.90 CCCCC(C)C(=O)c1cccc(c1O)F 1458a_100011217230_200011215066 [0,2,0,0,0,0|1,0,0]=3 13980 B16R1.90 CCCCC(C)C(=O)c1cccc(c1O)O 1458a_100000690420_200011215066 [0,2,0,0,0,0|1,0,0]=3 13981 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Br 11a_100000207549_100012360534 [0,2,0,0,0,0|2,0,0]=4 13982 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Br 1626a_100000207549_100012360534 [0,2,0,0,0,0|2,0,0]=4 13983 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Br 240690a_100000207549_100012360534 [0,2,0,0,0,0|2,0,0]=4 13984 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Br 527a_100000207549_100012360534 [0,2,0,0,0,0|2,0,0]=4 13985 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)C 11a_100000207549_100000692419 [0,2,0,0,0,0|2,0,0]=4 13986 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)C 1626a_100000207549_100000692419 [0,2,0,0,0,0|2,0,0]=4 13987 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)C 240690a_100000207549_100000692419 [0,2,0,0,0,0|2,0,0]=4 13988 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)C 527a_100000207549_100000692419 [0,2,0,0,0,0|2,0,0]=4 13989 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Cl 11a_100000207549_100012339722 [0,2,0,0,0,0|2,0,0]=4 13990 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Cl 1626a_100000207549_100012339722 [0,2,0,0,0,0|2,0,0]=4 13991 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Cl 240690a_100000207549_100012339722 [0,2,0,0,0,0|2,0,0]=4 13992 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)Cl 527a_100000207549_100012339722 [0,2,0,0,0,0|2,0,0]=4 13993 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)F 11a_100000207549_100011217547 [0,2,0,0,0,0|2,0,0]=4 13994 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)F 1626a_100000207549_100011217547 [0,2,0,0,0,0|2,0,0]=4 13995 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)F 240690a_100000207549_100011217547 [0,2,0,0,0,0|2,0,0]=4 13996 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)F 527a_100000207549_100011217547 [0,2,0,0,0,0|2,0,0]=4 13997 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)I 11a_100000207549_100010232522 [0,2,0,0,0,0|2,0,0]=4 13998 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)I 1626a_100000207549_100010232522 [0,2,0,0,0,0|2,0,0]=4 13999 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)I 240690a_100000207549_100010232522 [0,2,0,0,0,0|2,0,0]=4 14000 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)I 527a_100000207549_100010232522 [0,2,0,0,0,0|2,0,0]=4 14001 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)O 240690a_100000207549_100010230362 [0,2,0,0,0,0|2,0,0]=4 14002 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Br)O 527a_100000207549_100010230362 [0,2,0,0,0,0|2,0,0]=4 14003 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Br 11a_100000207549_100000760464 [0,2,0,0,0,0|2,0,0]=4 14004 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Br 1626a_100000207549_100000760464 [0,2,0,0,0,0|2,0,0]=4 14005 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Br 240690a_100000207549_100000760464 [0,2,0,0,0,0|2,0,0]=4 14006 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Br 527a_100000207549_100000760464 [0,2,0,0,0,0|2,0,0]=4 14007 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)C 11a_100000207549_100000183679 [0,2,0,0,0,0|2,0,0]=4 14008 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)C 1626a_100000207549_100000183679 [0,2,0,0,0,0|2,0,0]=4 14009 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)C 240690a_100000207549_100000183679 [0,2,0,0,0,0|2,0,0]=4 14010 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)C 527a_100000207549_100000183679 [0,2,0,0,0,0|2,0,0]=4 14011 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Cl 11a_100000207549_100000690184 [0,2,0,0,0,0|2,0,0]=4 14012 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Cl 1626a_100000207549_100000690184 [0,2,0,0,0,0|2,0,0]=4 14013 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Cl 240690a_100000207549_100000690184 [0,2,0,0,0,0|2,0,0]=4 14014 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)Cl 527a_100000207549_100000690184 [0,2,0,0,0,0|2,0,0]=4 14015 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)F 11a_100000207549_100011218272 [0,2,0,0,0,0|2,0,0]=4 14016 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)F 1626a_100000207549_100011218272 [0,2,0,0,0,0|2,0,0]=4 14017 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)F 240690a_100000207549_100011218272 [0,2,0,0,0,0|2,0,0]=4 14018 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)F 527a_100000207549_100011218272 [0,2,0,0,0,0|2,0,0]=4 14019 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)I 11a_100000207549_100000751865 [0,2,0,0,0,0|2,0,0]=4 14020 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)I 1626a_100000207549_100000751865 [0,2,0,0,0,0|2,0,0]=4 14021 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)I 240690a_100000207549_100000751865 [0,2,0,0,0,0|2,0,0]=4 14022 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)I 527a_100000207549_100000751865 [0,2,0,0,0,0|2,0,0]=4 14023 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)O 240690a_100000207549_100000766327 [0,2,0,0,0,0|2,0,0]=4 14024 B16R1.90 CCCCN(C)C(=O)c1cccc(c1C)O 527a_100000207549_100000766327 [0,2,0,0,0,0|2,0,0]=4 14025 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Br 11a_100000207549_100000760540 [0,2,0,0,0,0|2,0,0]=4 14026 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Br 1626a_100000207549_100000760540 [0,2,0,0,0,0|2,0,0]=4 14027 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Br 240690a_100000207549_100000760540 [0,2,0,0,0,0|2,0,0]=4 14028 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Br 527a_100000207549_100000760540 [0,2,0,0,0,0|2,0,0]=4 14029 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)C 11a_100000207549_100000693142 [0,2,0,0,0,0|2,0,0]=4 14030 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)C 1626a_100000207549_100000693142 [0,2,0,0,0,0|2,0,0]=4 14031 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)C 240690a_100000207549_100000693142 [0,2,0,0,0,0|2,0,0]=4 14032 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)C 527a_100000207549_100000693142 [0,2,0,0,0,0|2,0,0]=4 14033 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Cl 11a_100000207549_100000183631 [0,2,0,0,0,0|2,0,0]=4 14034 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Cl 1626a_100000207549_100000183631 [0,2,0,0,0,0|2,0,0]=4 14035 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Cl 240690a_100000207549_100000183631 [0,2,0,0,0,0|2,0,0]=4 14036 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)Cl 527a_100000207549_100000183631 [0,2,0,0,0,0|2,0,0]=4 14037 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)F 11a_100000207549_100000759904 [0,2,0,0,0,0|2,0,0]=4 14038 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)F 1626a_100000207549_100000759904 [0,2,0,0,0,0|2,0,0]=4 14039 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)F 240690a_100000207549_100000759904 [0,2,0,0,0,0|2,0,0]=4 14040 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)F 527a_100000207549_100000759904 [0,2,0,0,0,0|2,0,0]=4 14041 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)I 11a_100000207549_100010176783 [0,2,0,0,0,0|2,0,0]=4 14042 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)I 1626a_100000207549_100010176783 [0,2,0,0,0,0|2,0,0]=4 14043 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)I 240690a_100000207549_100010176783 [0,2,0,0,0,0|2,0,0]=4 14044 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)I 527a_100000207549_100010176783 [0,2,0,0,0,0|2,0,0]=4 14045 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)O 240690a_100000207549_100000092362 [0,2,0,0,0,0|2,0,0]=4 14046 B16R1.90 CCCCN(C)C(=O)c1cccc(c1Cl)O 527a_100000207549_100000092362 [0,2,0,0,0,0|2,0,0]=4 14047 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Br 11a_100000207549_100000756403 [0,2,0,0,0,0|2,0,0]=4 14048 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Br 1626a_100000207549_100000756403 [0,2,0,0,0,0|2,0,0]=4 14049 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Br 240690a_100000207549_100000756403 [0,2,0,0,0,0|2,0,0]=4 14050 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Br 527a_100000207549_100000756403 [0,2,0,0,0,0|2,0,0]=4 14051 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)C 11a_100000207549_100000766181 [0,2,0,0,0,0|2,0,0]=4 14052 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)C 1626a_100000207549_100000766181 [0,2,0,0,0,0|2,0,0]=4 14053 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)C 240690a_100000207549_100000766181 [0,2,0,0,0,0|2,0,0]=4 14054 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)C 527a_100000207549_100000766181 [0,2,0,0,0,0|2,0,0]=4 14055 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Cl 11a_100000207549_100000688816 [0,2,0,0,0,0|2,0,0]=4 14056 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Cl 1626a_100000207549_100000688816 [0,2,0,0,0,0|2,0,0]=4 14057 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Cl 240690a_100000207549_100000688816 [0,2,0,0,0,0|2,0,0]=4 14058 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)Cl 527a_100000207549_100000688816 [0,2,0,0,0,0|2,0,0]=4 14059 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)F 11a_100000207549_100000748134 [0,2,0,0,0,0|2,0,0]=4 14060 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)F 1626a_100000207549_100000748134 [0,2,0,0,0,0|2,0,0]=4 14061 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)F 240690a_100000207549_100000748134 [0,2,0,0,0,0|2,0,0]=4 14062 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)F 527a_100000207549_100000748134 [0,2,0,0,0,0|2,0,0]=4 14063 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)I 11a_100000207549_100010185205 [0,2,0,0,0,0|2,0,0]=4 14064 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)I 1626a_100000207549_100010185205 [0,2,0,0,0,0|2,0,0]=4 14065 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)I 240690a_100000207549_100010185205 [0,2,0,0,0,0|2,0,0]=4 14066 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)I 527a_100000207549_100010185205 [0,2,0,0,0,0|2,0,0]=4 14067 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)O 240690a_100000207549_100000037433 [0,2,0,0,0,0|2,0,0]=4 14068 B16R1.90 CCCCN(C)C(=O)c1cccc(c1F)O 527a_100000207549_100000037433 [0,2,0,0,0,0|2,0,0]=4 14069 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Br 11a_100000207549_100000688019 [0,2,0,0,0,0|2,0,0]=4 14070 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Br 1626a_100000207549_100000688019 [0,2,0,0,0,0|2,0,0]=4 14071 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Br 240690a_100000207549_100000688019 [0,2,0,0,0,0|2,0,0]=4 14072 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Br 527a_100000207549_100000688019 [0,2,0,0,0,0|2,0,0]=4 14073 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)C 11a_100000207549_100000739377 [0,2,0,0,0,0|2,0,0]=4 14074 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)C 1626a_100000207549_100000739377 [0,2,0,0,0,0|2,0,0]=4 14075 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)C 240690a_100000207549_100000739377 [0,2,0,0,0,0|2,0,0]=4 14076 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)C 527a_100000207549_100000739377 [0,2,0,0,0,0|2,0,0]=4 14077 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Cl 11a_100000207549_100010176784 [0,2,0,0,0,0|2,0,0]=4 14078 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Cl 1626a_100000207549_100010176784 [0,2,0,0,0,0|2,0,0]=4 14079 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Cl 240690a_100000207549_100010176784 [0,2,0,0,0,0|2,0,0]=4 14080 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)Cl 527a_100000207549_100010176784 [0,2,0,0,0,0|2,0,0]=4 14081 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)F 11a_100000207549_100000690930 [0,2,0,0,0,0|2,0,0]=4 14082 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)F 1626a_100000207549_100000690930 [0,2,0,0,0,0|2,0,0]=4 14083 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)F 240690a_100000207549_100000690930 [0,2,0,0,0,0|2,0,0]=4 14084 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)F 527a_100000207549_100000690930 [0,2,0,0,0,0|2,0,0]=4 14085 B16R1.90 CCCCN(C)C(=O)c1cccc(c1I)O 527a_100000207549_100010084636 [0,2,0,0,0,0|2,0,0]=4 14086 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)Br 240690a_100000207549_100000752940 [0,2,0,0,0,0|1,0,0]=3 14087 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)Br 527a_100000207549_100000752940 [0,2,0,0,0,0|1,0,0]=3 14088 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)C 240690a_100000207549_100000183896 [0,2,0,0,0,0|1,0,0]=3 14089 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)C 527a_100000207549_100000183896 [0,2,0,0,0,0|1,0,0]=3 14090 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)Cl 240690a_100000207549_100000742801 [0,2,0,0,0,0|1,0,0]=3 14091 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)Cl 527a_100000207549_100000742801 [0,2,0,0,0,0|1,0,0]=3 14092 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)F 240690a_100000207549_100011217230 [0,2,0,0,0,0|1,0,0]=3 14093 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)F 527a_100000207549_100011217230 [0,2,0,0,0,0|1,0,0]=3 14094 B16R1.90 CCCCN(C)C(=O)c1cccc(c1O)O 527a_100000207549_100000690420 [0,2,0,0,0,0|1,0,0]=3 14095 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)Br 240690a_100000213112_100000752940 [0,2,0,0,0,0|2,0,0]=4 14096 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)Br 527a_100000213112_100000752940 [0,2,0,0,0,0|2,0,0]=4 14097 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)Cl 240690a_100000213112_100000742801 [0,2,0,0,0,0|2,0,0]=4 14098 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)Cl 527a_100000213112_100000742801 [0,2,0,0,0,0|2,0,0]=4 14099 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)F 240690a_100000213112_100011217230 [0,2,0,0,0,0|2,0,0]=4 14100 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)F 527a_100000213112_100011217230 [0,2,0,0,0,0|2,0,0]=4 14101 B16R1.90 CN(CCCO)C(=O)c1cccc(c1O)O 527a_100000213112_100000690420 [0,2,0,0,0,0|2,0,0]=4 14102 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)Br 240690a_100000743101_100000752940 [0,2,0,0,0,0|2,0,0]=4 14103 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)Br 527a_100000743101_100000752940 [0,2,0,0,0,0|2,0,0]=4 14104 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)C 240690a_100000743101_100000183896 [0,2,0,0,0,0|2,0,0]=4 14105 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)C 527a_100000743101_100000183896 [0,2,0,0,0,0|2,0,0]=4 14106 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)Cl 240690a_100000743101_100000742801 [0,2,0,0,0,0|2,0,0]=4 14107 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)Cl 527a_100000743101_100000742801 [0,2,0,0,0,0|2,0,0]=4 14108 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)F 240690a_100000743101_100011217230 [0,2,0,0,0,0|2,0,0]=4 14109 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)F 527a_100000743101_100011217230 [0,2,0,0,0,0|2,0,0]=4 14110 B16R1.90 COCCN(C)C(=O)c1cccc(c1O)O 527a_100000743101_100000690420 [0,2,0,0,0,0|2,0,0]=4 14111 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)Br 240690a_100000686725_100000752940 [0,2,0,0,0,0|2,0,0]=4 14112 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)Br 527a_100000686725_100000752940 [0,2,0,0,0,0|2,0,0]=4 14113 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)C 240690a_100000686725_100000183896 [0,2,0,0,0,0|2,0,0]=4 14114 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)C 527a_100000686725_100000183896 [0,2,0,0,0,0|2,0,0]=4 14115 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)Cl 240690a_100000686725_100000742801 [0,2,0,0,0,0|2,0,0]=4 14116 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)Cl 527a_100000686725_100000742801 [0,2,0,0,0,0|2,0,0]=4 14117 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)F 240690a_100000686725_100011217230 [0,2,0,0,0,0|2,0,0]=4 14118 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)F 527a_100000686725_100011217230 [0,2,0,0,0,0|2,0,0]=4 14119 B16R1.90 CSCCN(C)C(=O)c1cccc(c1O)O 527a_100000686725_100000690420 [0,2,0,0,0,0|2,0,0]=4 14120 B16R1.90 Cc1cccc(c1O)C(=O)N(C)CCCO 240690a_100000213112_100000183896 [0,2,0,0,0,0|2,0,0]=4 14121 B16R1.90 Cc1cccc(c1O)C(=O)N(C)CCCO 527a_100000213112_100000183896 [0,2,0,0,0,0|2,0,0]=4 14122 B16R1.1724 CCCCCC(=O)c1cccc(c1Br)OC 1458a_100010245468_100000210326 [0,2,0,0,0,0|2,0,0]=4 14123 B16R1.1724 CCCCCC(=O)c1cccc(c1C)OC 1458a_100011217801_100000210326 [0,2,0,0,0,0|2,0,0]=4 14124 B16R1.1724 CCCCCC(=O)c1cccc(c1Cl)C#N 1458a_100009860865_100000210326 [0,2,0,0,0,0|2,0,0]=4 14125 B16R1.1724 CCCCCC(=O)c1cccc(c1Cl)OC 1458a_100000068443_100000210326 [0,2,0,0,0,0|2,0,0]=4 14126 B16R1.1724 CCCCCC(=O)c1cccc(c1F)C#N 1458a_100011999812_100000210326 [0,2,0,0,0,0|2,0,0]=4 14127 B16R1.1724 CCCCCC(=O)c1cccc(c1F)OC 1458a_100000766180_100000210326 [0,2,0,0,0,0|2,0,0]=4 14128 B16R1.1724 CCCCCC(=O)c1cccc(c1I)OC 1458a_100010075502_100000210326 [0,2,0,0,0,0|2,0,0]=4 14129 B16R1.1724 CCCCCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100000210326 [0,2,0,0,0,0|1,0,0]=3 14130 B16R1.1724 CCCCCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000210326 [0,2,0,0,0,0|1,0,0]=3 14131 B16R1.1724 CCCCNC(=O)c1cccc(c1Br)OC 11a_100000102301_100010245468 [0,2,0,0,0,0|2,0,0]=4 14132 B16R1.1724 CCCCNC(=O)c1cccc(c1Br)OC 1626a_100000102301_100010245468 [0,2,0,0,0,0|2,0,0]=4 14133 B16R1.1724 CCCCNC(=O)c1cccc(c1Br)OC 240690a_100000102301_100010245468 [0,2,0,0,0,0|2,0,0]=4 14134 B16R1.1724 CCCCNC(=O)c1cccc(c1Br)OC 527a_100000102301_100010245468 [0,2,0,0,0,0|2,0,0]=4 14135 B16R1.1724 CCCCNC(=O)c1cccc(c1C)OC 11a_100000102301_100011217801 [0,2,0,0,0,0|2,0,0]=4 14136 B16R1.1724 CCCCNC(=O)c1cccc(c1C)OC 1626a_100000102301_100011217801 [0,2,0,0,0,0|2,0,0]=4 14137 B16R1.1724 CCCCNC(=O)c1cccc(c1C)OC 240690a_100000102301_100011217801 [0,2,0,0,0,0|2,0,0]=4 14138 B16R1.1724 CCCCNC(=O)c1cccc(c1C)OC 527a_100000102301_100011217801 [0,2,0,0,0,0|2,0,0]=4 14139 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)C#N 11a_100000102301_100009860865 [0,2,0,0,0,0|2,0,0]=4 14140 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)C#N 1626a_100000102301_100009860865 [0,2,0,0,0,0|2,0,0]=4 14141 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)C#N 527a_100000102301_100009860865 [0,2,0,0,0,0|2,0,0]=4 14142 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)OC 11a_100000102301_100000068443 [0,2,0,0,0,0|2,0,0]=4 14143 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)OC 1626a_100000102301_100000068443 [0,2,0,0,0,0|2,0,0]=4 14144 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)OC 240690a_100000102301_100000068443 [0,2,0,0,0,0|2,0,0]=4 14145 B16R1.1724 CCCCNC(=O)c1cccc(c1Cl)OC 527a_100000102301_100000068443 [0,2,0,0,0,0|2,0,0]=4 14146 B16R1.1724 CCCCNC(=O)c1cccc(c1F)C#N 11a_100000102301_100011999812 [0,2,0,0,0,0|2,0,0]=4 14147 B16R1.1724 CCCCNC(=O)c1cccc(c1F)C#N 1626a_100000102301_100011999812 [0,2,0,0,0,0|2,0,0]=4 14148 B16R1.1724 CCCCNC(=O)c1cccc(c1F)C#N 240690a_100000102301_100011999812 [0,2,0,0,0,0|2,0,0]=4 14149 B16R1.1724 CCCCNC(=O)c1cccc(c1F)C#N 527a_100000102301_100011999812 [0,2,0,0,0,0|2,0,0]=4 14150 B16R1.1724 CCCCNC(=O)c1cccc(c1F)OC 11a_100000102301_100000766180 [0,2,0,0,0,0|2,0,0]=4 14151 B16R1.1724 CCCCNC(=O)c1cccc(c1F)OC 1626a_100000102301_100000766180 [0,2,0,0,0,0|2,0,0]=4 14152 B16R1.1724 CCCCNC(=O)c1cccc(c1F)OC 240690a_100000102301_100000766180 [0,2,0,0,0,0|2,0,0]=4 14153 B16R1.1724 CCCCNC(=O)c1cccc(c1F)OC 527a_100000102301_100000766180 [0,2,0,0,0,0|2,0,0]=4 14154 B16R1.1724 CCCCNC(=O)c1cccc(c1I)OC 11a_100000102301_100010075502 [0,2,0,0,0,0|2,0,0]=4 14155 B16R1.1724 CCCCNC(=O)c1cccc(c1I)OC 1626a_100000102301_100010075502 [0,2,0,0,0,0|2,0,0]=4 14156 B16R1.1724 CCCCNC(=O)c1cccc(c1I)OC 240690a_100000102301_100010075502 [0,2,0,0,0,0|2,0,0]=4 14157 B16R1.1724 CCCCNC(=O)c1cccc(c1I)OC 527a_100000102301_100010075502 [0,2,0,0,0,0|2,0,0]=4 14158 B16R1.1724 CCCCNC(=O)c1cccc(c1O)C#N 527a_100000102301_100009886288 [0,2,0,0,0,0|1,0,0]=3 14159 B16R1.1724 CCCCNC(=O)c1cccc(c1O)OC 240690a_100000102301_100000212136 [0,2,0,0,0,0|1,0,0]=3 14160 B16R1.1724 CCCCNC(=O)c1cccc(c1O)OC 527a_100000102301_100000212136 [0,2,0,0,0,0|1,0,0]=3 14161 B16R1.1724 CCCNNC(=O)c1cccc(c1O)OC 22a_100000740057_100000212136 [0,2,0,0,0,0|2,0,0]=4 14162 B16R1.1724 CCOCCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100011215890 [0,2,0,0,0,0|2,0,0]=4 14163 B16R1.1724 CCOCCC(=O)c1cccc(c1O)OC 1458a_100000212136_100011215890 [0,2,0,0,0,0|2,0,0]=4 14164 B16R1.1724 CCSCCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100000757381 [0,2,0,0,0,0|2,0,0]=4 14165 B16R1.1724 CCSCCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000757381 [0,2,0,0,0,0|2,0,0]=4 14166 B16R1.1724 COCCCC(=O)c1cccc(c1O)C#N 1458a_100009886288_100000740836 [0,2,0,0,0,0|2,0,0]=4 14167 B16R1.1724 COCCCC(=O)c1cccc(c1O)OC 1458a_100000212136_100000740836 [0,2,0,0,0,0|2,0,0]=4 14168 B16R1.1724 COCCNC(=O)c1cccc(c1O)C#N 527a_100000209980_100009886288 [0,2,0,0,0,0|2,0,0]=4 14169 B16R1.1724 COCCNC(=O)c1cccc(c1O)OC 240690a_100000209980_100000212136 [0,2,0,0,0,0|2,0,0]=4 14170 B16R1.1724 COCCNC(=O)c1cccc(c1O)OC 527a_100000209980_100000212136 [0,2,0,0,0,0|2,0,0]=4 14171 B16R1.1724 COc1cccc(c1O)C(=O)CCCCF 1458a_100000212136_100000729493 [0,2,0,0,0,0|2,0,0]=4 14172 B16R1.1724 COc1cccc(c1O)C(=O)CCCCO 1458a_100000212136_100000210776 [0,2,0,0,0,0|2,0,0]=4 14173 B16R1.1724 COc1cccc(c1O)C(=O)NCCCF 240690a_100015189416_100000212136 [0,2,0,0,0,0|2,0,0]=4 14174 B16R1.1724 COc1cccc(c1O)C(=O)NCCCF 527a_100015189416_100000212136 [0,2,0,0,0,0|2,0,0]=4 14175 B16R1.1724 COc1cccc(c1O)C(=O)NCCCO 240690a_100000182051_100000212136 [0,2,0,0,0,0|2,0,0]=4 14176 B16R1.1724 COc1cccc(c1O)C(=O)NCCCO 527a_100000182051_100000212136 [0,2,0,0,0,0|2,0,0]=4 14177 B16R1.1724 COc1cccc(c1O)C(=O)NCCSC 240690a_100020590264_100000212136 [0,2,0,0,0,0|2,0,0]=4 14178 B16R1.1724 COc1cccc(c1O)C(=O)NCCSC 527a_100020590264_100000212136 [0,2,0,0,0,0|2,0,0]=4 14179 B16R1.1724 CSCCNC(=O)c1cccc(c1O)C#N 527a_100020590264_100009886288 [0,2,0,0,0,0|2,0,0]=4 14180 B16R1.1724 N#Cc1cccc(c1O)C(=O)CCCCF 1458a_100009886288_100000729493 [0,2,0,0,0,0|2,0,0]=4 14181 B16R1.1724 N#Cc1cccc(c1O)C(=O)CCCCO 1458a_100009886288_100000210776 [0,2,0,0,0,0|2,0,0]=4 14182 B16R1.1724 N#Cc1cccc(c1O)C(=O)NCCCF 527a_100015189416_100009886288 [0,2,0,0,0,0|2,0,0]=4 14183 B16R1.1724 N#Cc1cccc(c1O)C(=O)NCCCO 527a_100000182051_100009886288 [0,2,0,0,0,0|2,0,0]=4 14184 B16R1.3564 CCCCCC(=O)c1cccc(c1C#N)F 1458a_100000702252_100000210326 [0,2,0,0,0,0|2,0,0]=4 14185 B16R1.3564 CCCCCC(=O)c1cccc(c1CC)Br 1458a_100010125490_100000210326 [0,2,0,0,0,0|2,0,0]=4 14186 B16R1.3564 CCCCCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000210326 [0,2,0,0,0,0|1,0,0]=3 14187 B16R1.3564 CCCCCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000210326 [0,2,0,0,0,0|1,0,0]=3 14188 B16R1.3564 CCCCCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000210326 [0,2,0,0,0,0|1,0,0]=3 14189 B16R1.3564 CCCCCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000210326 [0,2,0,0,0,0|1,0,0]=3 14190 B16R1.3564 CCCCCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000210326 [0,2,0,0,0,0|1,0,0]=3 14191 B16R1.3564 CCCCNC(=O)c1cccc(c1C#N)F 240690a_100000102301_100000702252 [0,2,0,0,0,0|2,0,0]=4 14192 B16R1.3564 CCCCNC(=O)c1cccc(c1C#N)F 527a_100000102301_100000702252 [0,2,0,0,0,0|2,0,0]=4 14193 B16R1.3564 CCCCNC(=O)c1cccc(c1CC)Br 11a_100000102301_100010125490 [0,2,0,0,0,0|2,0,0]=4 14194 B16R1.3564 CCCCNC(=O)c1cccc(c1CC)Br 1626a_100000102301_100010125490 [0,2,0,0,0,0|2,0,0]=4 14195 B16R1.3564 CCCCNC(=O)c1cccc(c1CC)Br 240690a_100000102301_100010125490 [0,2,0,0,0,0|2,0,0]=4 14196 B16R1.3564 CCCCNC(=O)c1cccc(c1CC)Br 527a_100000102301_100010125490 [0,2,0,0,0,0|2,0,0]=4 14197 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Br 11a_100000102301_100000689802 [0,2,0,0,0,0|1,0,0]=3 14198 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Br 1626a_100000102301_100000689802 [0,2,0,0,0,0|1,0,0]=3 14199 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Br 240690a_100000102301_100000689802 [0,2,0,0,0,0|1,0,0]=3 14200 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Br 527a_100000102301_100000689802 [0,2,0,0,0,0|1,0,0]=3 14201 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)C 11a_100000102301_100000187929 [0,2,0,0,0,0|1,0,0]=3 14202 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)C 1626a_100000102301_100000187929 [0,2,0,0,0,0|1,0,0]=3 14203 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)C 240690a_100000102301_100000187929 [0,2,0,0,0,0|1,0,0]=3 14204 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)C 527a_100000102301_100000187929 [0,2,0,0,0,0|1,0,0]=3 14205 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Cl 11a_100000102301_100011934004 [0,2,0,0,0,0|1,0,0]=3 14206 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Cl 1626a_100000102301_100011934004 [0,2,0,0,0,0|1,0,0]=3 14207 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Cl 240690a_100000102301_100011934004 [0,2,0,0,0,0|1,0,0]=3 14208 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)Cl 527a_100000102301_100011934004 [0,2,0,0,0,0|1,0,0]=3 14209 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)F 11a_100000102301_100011218433 [0,2,0,0,0,0|1,0,0]=3 14210 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)F 1626a_100000102301_100011218433 [0,2,0,0,0,0|1,0,0]=3 14211 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)F 240690a_100000102301_100011218433 [0,2,0,0,0,0|1,0,0]=3 14212 B16R1.3564 CCCCNC(=O)c1cccc(c1OC)F 527a_100000102301_100011218433 [0,2,0,0,0,0|1,0,0]=3 14213 B16R1.3564 CCCNNC(=O)c1cccc(c1OC)Br 22a_100000740057_100000689802 [0,2,0,0,0,0|2,0,0]=4 14214 B16R1.3564 CCCNNC(=O)c1cccc(c1OC)C 22a_100000740057_100000187929 [0,2,0,0,0,0|2,0,0]=4 14215 B16R1.3564 CCCNNC(=O)c1cccc(c1OC)Cl 22a_100000740057_100011934004 [0,2,0,0,0,0|2,0,0]=4 14216 B16R1.3564 CCCNNC(=O)c1cccc(c1OC)F 22a_100000740057_100011218433 [0,2,0,0,0,0|2,0,0]=4 14217 B16R1.3564 CCCNNC(=O)c1cccc(c1OC)O 22a_100000740057_100000080799 [0,2,0,0,0,0|2,0,0]=4 14218 B16R1.3564 CCOCCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100011215890 [0,2,0,0,0,0|2,0,0]=4 14219 B16R1.3564 CCOCCC(=O)c1cccc(c1OC)C 1458a_100000187929_100011215890 [0,2,0,0,0,0|2,0,0]=4 14220 B16R1.3564 CCOCCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100011215890 [0,2,0,0,0,0|2,0,0]=4 14221 B16R1.3564 CCOCCC(=O)c1cccc(c1OC)F 1458a_100011218433_100011215890 [0,2,0,0,0,0|2,0,0]=4 14222 B16R1.3564 CCOCCC(=O)c1cccc(c1OC)O 1458a_100000080799_100011215890 [0,2,0,0,0,0|2,0,0]=4 14223 B16R1.3564 CCSCCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000757381 [0,2,0,0,0,0|2,0,0]=4 14224 B16R1.3564 CCSCCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000757381 [0,2,0,0,0,0|2,0,0]=4 14225 B16R1.3564 CCSCCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000757381 [0,2,0,0,0,0|2,0,0]=4 14226 B16R1.3564 CCSCCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000757381 [0,2,0,0,0,0|2,0,0]=4 14227 B16R1.3564 CCSCCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000757381 [0,2,0,0,0,0|2,0,0]=4 14228 B16R1.3564 COCCCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000740836 [0,2,0,0,0,0|2,0,0]=4 14229 B16R1.3564 COCCCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000740836 [0,2,0,0,0,0|2,0,0]=4 14230 B16R1.3564 COCCCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000740836 [0,2,0,0,0,0|2,0,0]=4 14231 B16R1.3564 COCCCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000740836 [0,2,0,0,0,0|2,0,0]=4 14232 B16R1.3564 COCCCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000740836 [0,2,0,0,0,0|2,0,0]=4 14233 B16R1.3564 COCCNC(=O)c1cccc(c1OC)Br 1626a_100000209980_100000689802 [0,2,0,0,0,0|2,0,0]=4 14234 B16R1.3564 COCCNC(=O)c1cccc(c1OC)Br 240690a_100000209980_100000689802 [0,2,0,0,0,0|2,0,0]=4 14235 B16R1.3564 COCCNC(=O)c1cccc(c1OC)Br 527a_100000209980_100000689802 [0,2,0,0,0,0|2,0,0]=4 14236 B16R1.3564 COCCNC(=O)c1cccc(c1OC)C 1626a_100000209980_100000187929 [0,2,0,0,0,0|2,0,0]=4 14237 B16R1.3564 COCCNC(=O)c1cccc(c1OC)C 240690a_100000209980_100000187929 [0,2,0,0,0,0|2,0,0]=4 14238 B16R1.3564 COCCNC(=O)c1cccc(c1OC)C 527a_100000209980_100000187929 [0,2,0,0,0,0|2,0,0]=4 14239 B16R1.3564 COCCNC(=O)c1cccc(c1OC)Cl 1626a_100000209980_100011934004 [0,2,0,0,0,0|2,0,0]=4 14240 B16R1.3564 COCCNC(=O)c1cccc(c1OC)Cl 240690a_100000209980_100011934004 [0,2,0,0,0,0|2,0,0]=4 14241 B16R1.3564 COCCNC(=O)c1cccc(c1OC)Cl 527a_100000209980_100011934004 [0,2,0,0,0,0|2,0,0]=4 14242 B16R1.3564 COCCNC(=O)c1cccc(c1OC)F 1626a_100000209980_100011218433 [0,2,0,0,0,0|2,0,0]=4 14243 B16R1.3564 COCCNC(=O)c1cccc(c1OC)F 240690a_100000209980_100011218433 [0,2,0,0,0,0|2,0,0]=4 14244 B16R1.3564 COCCNC(=O)c1cccc(c1OC)F 527a_100000209980_100011218433 [0,2,0,0,0,0|2,0,0]=4 14245 B16R1.3564 COc1c(cccc1C(=O)CCCCF)Br 1458a_100000689802_100000729493 [0,2,0,0,0,0|2,0,0]=4 14246 B16R1.3564 COc1c(cccc1C(=O)CCCCF)C 1458a_100000187929_100000729493 [0,2,0,0,0,0|2,0,0]=4 14247 B16R1.3564 COc1c(cccc1C(=O)CCCCF)Cl 1458a_100011934004_100000729493 [0,2,0,0,0,0|2,0,0]=4 14248 B16R1.3564 COc1c(cccc1C(=O)CCCCF)F 1458a_100011218433_100000729493 [0,2,0,0,0,0|2,0,0]=4 14249 B16R1.3564 COc1c(cccc1C(=O)CCCCF)O 1458a_100000080799_100000729493 [0,2,0,0,0,0|2,0,0]=4 14250 B16R1.3564 COc1c(cccc1C(=O)CCCCO)Br 1458a_100000689802_100000210776 [0,2,0,0,0,0|2,0,0]=4 14251 B16R1.3564 COc1c(cccc1C(=O)CCCCO)C 1458a_100000187929_100000210776 [0,2,0,0,0,0|2,0,0]=4 14252 B16R1.3564 COc1c(cccc1C(=O)CCCCO)Cl 1458a_100011934004_100000210776 [0,2,0,0,0,0|2,0,0]=4 14253 B16R1.3564 COc1c(cccc1C(=O)CCCCO)F 1458a_100011218433_100000210776 [0,2,0,0,0,0|2,0,0]=4 14254 B16R1.3564 COc1c(cccc1C(=O)CCCCO)O 1458a_100000080799_100000210776 [0,2,0,0,0,0|2,0,0]=4 14255 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Br 11a_100015189416_100000689802 [0,2,0,0,0,0|2,0,0]=4 14256 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Br 1626a_100015189416_100000689802 [0,2,0,0,0,0|2,0,0]=4 14257 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Br 240690a_100015189416_100000689802 [0,2,0,0,0,0|2,0,0]=4 14258 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Br 527a_100015189416_100000689802 [0,2,0,0,0,0|2,0,0]=4 14259 B16R1.3564 COc1c(cccc1C(=O)NCCCF)C 11a_100015189416_100000187929 [0,2,0,0,0,0|2,0,0]=4 14260 B16R1.3564 COc1c(cccc1C(=O)NCCCF)C 1626a_100015189416_100000187929 [0,2,0,0,0,0|2,0,0]=4 14261 B16R1.3564 COc1c(cccc1C(=O)NCCCF)C 240690a_100015189416_100000187929 [0,2,0,0,0,0|2,0,0]=4 14262 B16R1.3564 COc1c(cccc1C(=O)NCCCF)C 527a_100015189416_100000187929 [0,2,0,0,0,0|2,0,0]=4 14263 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Cl 11a_100015189416_100011934004 [0,2,0,0,0,0|2,0,0]=4 14264 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Cl 1626a_100015189416_100011934004 [0,2,0,0,0,0|2,0,0]=4 14265 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Cl 240690a_100015189416_100011934004 [0,2,0,0,0,0|2,0,0]=4 14266 B16R1.3564 COc1c(cccc1C(=O)NCCCF)Cl 527a_100015189416_100011934004 [0,2,0,0,0,0|2,0,0]=4 14267 B16R1.3564 COc1c(cccc1C(=O)NCCCF)F 11a_100015189416_100011218433 [0,2,0,0,0,0|2,0,0]=4 14268 B16R1.3564 COc1c(cccc1C(=O)NCCCF)F 1626a_100015189416_100011218433 [0,2,0,0,0,0|2,0,0]=4 14269 B16R1.3564 COc1c(cccc1C(=O)NCCCF)F 240690a_100015189416_100011218433 [0,2,0,0,0,0|2,0,0]=4 14270 B16R1.3564 COc1c(cccc1C(=O)NCCCF)F 527a_100015189416_100011218433 [0,2,0,0,0,0|2,0,0]=4 14271 B16R1.3564 COc1c(cccc1C(=O)NCCCO)Br 240690a_100000182051_100000689802 [0,2,0,0,0,0|2,0,0]=4 14272 B16R1.3564 COc1c(cccc1C(=O)NCCCO)Br 527a_100000182051_100000689802 [0,2,0,0,0,0|2,0,0]=4 14273 B16R1.3564 COc1c(cccc1C(=O)NCCCO)C 240690a_100000182051_100000187929 [0,2,0,0,0,0|2,0,0]=4 14274 B16R1.3564 COc1c(cccc1C(=O)NCCCO)C 527a_100000182051_100000187929 [0,2,0,0,0,0|2,0,0]=4 14275 B16R1.3564 COc1c(cccc1C(=O)NCCCO)Cl 240690a_100000182051_100011934004 [0,2,0,0,0,0|2,0,0]=4 14276 B16R1.3564 COc1c(cccc1C(=O)NCCCO)Cl 527a_100000182051_100011934004 [0,2,0,0,0,0|2,0,0]=4 14277 B16R1.3564 COc1c(cccc1C(=O)NCCCO)F 240690a_100000182051_100011218433 [0,2,0,0,0,0|2,0,0]=4 14278 B16R1.3564 COc1c(cccc1C(=O)NCCCO)F 527a_100000182051_100011218433 [0,2,0,0,0,0|2,0,0]=4 14279 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Br 11a_100020590264_100000689802 [0,2,0,0,0,0|2,0,0]=4 14280 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Br 1626a_100020590264_100000689802 [0,2,0,0,0,0|2,0,0]=4 14281 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Br 240690a_100020590264_100000689802 [0,2,0,0,0,0|2,0,0]=4 14282 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Br 527a_100020590264_100000689802 [0,2,0,0,0,0|2,0,0]=4 14283 B16R1.3564 COc1c(cccc1C(=O)NCCSC)C 11a_100020590264_100000187929 [0,2,0,0,0,0|2,0,0]=4 14284 B16R1.3564 COc1c(cccc1C(=O)NCCSC)C 1626a_100020590264_100000187929 [0,2,0,0,0,0|2,0,0]=4 14285 B16R1.3564 COc1c(cccc1C(=O)NCCSC)C 240690a_100020590264_100000187929 [0,2,0,0,0,0|2,0,0]=4 14286 B16R1.3564 COc1c(cccc1C(=O)NCCSC)C 527a_100020590264_100000187929 [0,2,0,0,0,0|2,0,0]=4 14287 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Cl 11a_100020590264_100011934004 [0,2,0,0,0,0|2,0,0]=4 14288 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Cl 1626a_100020590264_100011934004 [0,2,0,0,0,0|2,0,0]=4 14289 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Cl 240690a_100020590264_100011934004 [0,2,0,0,0,0|2,0,0]=4 14290 B16R1.3564 COc1c(cccc1C(=O)NCCSC)Cl 527a_100020590264_100011934004 [0,2,0,0,0,0|2,0,0]=4 14291 B16R1.3564 COc1c(cccc1C(=O)NCCSC)F 11a_100020590264_100011218433 [0,2,0,0,0,0|2,0,0]=4 14292 B16R1.3564 COc1c(cccc1C(=O)NCCSC)F 1626a_100020590264_100011218433 [0,2,0,0,0,0|2,0,0]=4 14293 B16R1.3564 COc1c(cccc1C(=O)NCCSC)F 240690a_100020590264_100011218433 [0,2,0,0,0,0|2,0,0]=4 14294 B16R1.3564 COc1c(cccc1C(=O)NCCSC)F 527a_100020590264_100011218433 [0,2,0,0,0,0|2,0,0]=4 14295 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_100000210326 [0,2,0,0,0,0|2,0,0]=4 14296 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210326 [0,2,0,0,0,0|2,0,0]=4 14297 B16R1.3574 CCCCCC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_100000210326 [0,2,0,0,0,0|2,0,0]=4 14298 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100000210326 [0,2,0,0,0,0|2,0,0]=4 14299 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210326 [0,2,0,0,0,0|2,0,0]=4 14300 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_100000210326 [0,2,0,0,0,0|2,0,0]=4 14301 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_100000210326 [0,2,0,0,0,0|2,0,0]=4 14302 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_100000210326 [0,2,0,0,0,0|2,0,0]=4 14303 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000210326 [0,2,0,0,0,0|2,0,0]=4 14304 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_100000210326 [0,2,0,0,0,0|2,0,0]=4 14305 B16R1.3574 CCCCCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210326 [0,2,0,0,0,0|2,0,0]=4 14306 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_100000210326 [0,2,0,0,0,0|2,0,0]=4 14307 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_100000210326 [0,2,0,0,0,0|2,0,0]=4 14308 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_100000210326 [0,2,0,0,0,0|2,0,0]=4 14309 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_100000210326 [0,2,0,0,0,0|2,0,0]=4 14310 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_100000210326 [0,2,0,0,0,0|2,0,0]=4 14311 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_100000210326 [0,2,0,0,0,0|2,0,0]=4 14312 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_100000210326 [0,2,0,0,0,0|2,0,0]=4 14313 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_100000210326 [0,2,0,0,0,0|2,0,0]=4 14314 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_100000210326 [0,2,0,0,0,0|2,0,0]=4 14315 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_100000210326 [0,2,0,0,0,0|2,0,0]=4 14316 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_100000210326 [0,2,0,0,0,0|2,0,0]=4 14317 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000210326 [0,2,0,0,0,0|2,0,0]=4 14318 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_100000210326 [0,2,0,0,0,0|2,0,0]=4 14319 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_100000210326 [0,2,0,0,0,0|2,0,0]=4 14320 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_100000210326 [0,2,0,0,0,0|2,0,0]=4 14321 B16R1.3574 CCCCCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210326 [0,2,0,0,0,0|2,0,0]=4 14322 B16R1.3574 CCCCCC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_100000210326 [0,2,0,0,0,0|2,0,0]=4 14323 B16R1.3574 CCCCCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210326 [0,2,0,0,0,0|1,0,0]=3 14324 B16R1.3574 CCCCCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000210326 [0,2,0,0,0,0|1,0,0]=3 14325 B16R1.3574 CCCCCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000210326 [0,2,0,0,0,0|1,0,0]=3 14326 B16R1.3574 CCCCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210326 [0,2,0,0,0,0|1,0,0]=3 14327 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Br)F)F 11a_100000102301_100012356454 [0,2,0,0,0,0|2,0,0]=4 14328 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Br)F)F 1626a_100000102301_100012356454 [0,2,0,0,0,0|2,0,0]=4 14329 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Br)F)F 240690a_100000102301_100012356454 [0,2,0,0,0,0|2,0,0]=4 14330 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Br)F)F 527a_100000102301_100012356454 [0,2,0,0,0,0|2,0,0]=4 14331 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Br)O)Br 240690a_100000102301_100016068111 [0,2,0,0,0,0|2,0,0]=4 14332 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Br)O)Br 527a_100000102301_100016068111 [0,2,0,0,0,0|2,0,0]=4 14333 B16R1.3574 CCCCNC(=O)c1ccc(c(c1C)F)F 11a_100000102301_100000061971 [0,2,0,0,0,0|2,0,0]=4 14334 B16R1.3574 CCCCNC(=O)c1ccc(c(c1C)F)F 1626a_100000102301_100000061971 [0,2,0,0,0,0|2,0,0]=4 14335 B16R1.3574 CCCCNC(=O)c1ccc(c(c1C)F)F 240690a_100000102301_100000061971 [0,2,0,0,0,0|2,0,0]=4 14336 B16R1.3574 CCCCNC(=O)c1ccc(c(c1C)F)F 527a_100000102301_100000061971 [0,2,0,0,0,0|2,0,0]=4 14337 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_100000102301_100010208263 [0,2,0,0,0,0|2,0,0]=4 14338 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100000102301_100010208263 [0,2,0,0,0,0|2,0,0]=4 14339 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100000102301_100010208263 [0,2,0,0,0,0|2,0,0]=4 14340 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100000102301_100010208263 [0,2,0,0,0,0|2,0,0]=4 14341 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)Cl 11a_100000102301_100010074829 [0,2,0,0,0,0|2,0,0]=4 14342 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100000102301_100010074829 [0,2,0,0,0,0|2,0,0]=4 14343 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100000102301_100010074829 [0,2,0,0,0,0|2,0,0]=4 14344 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100000102301_100010074829 [0,2,0,0,0,0|2,0,0]=4 14345 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)F 11a_100000102301_100000061447 [0,2,0,0,0,0|2,0,0]=4 14346 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)F 1626a_100000102301_100000061447 [0,2,0,0,0,0|2,0,0]=4 14347 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)F 240690a_100000102301_100000061447 [0,2,0,0,0,0|2,0,0]=4 14348 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)C)F 527a_100000102301_100000061447 [0,2,0,0,0,0|2,0,0]=4 14349 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)Br 11a_100000102301_200012347731 [0,2,0,0,0,0|2,0,0]=4 14350 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)Br 1626a_100000102301_200012347731 [0,2,0,0,0,0|2,0,0]=4 14351 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)Br 240690a_100000102301_200012347731 [0,2,0,0,0,0|2,0,0]=4 14352 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)Br 527a_100000102301_200012347731 [0,2,0,0,0,0|2,0,0]=4 14353 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)F 11a_100000102301_100010209669 [0,2,0,0,0,0|2,0,0]=4 14354 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)F 1626a_100000102301_100010209669 [0,2,0,0,0,0|2,0,0]=4 14355 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)F 240690a_100000102301_100010209669 [0,2,0,0,0,0|2,0,0]=4 14356 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)Cl)F 527a_100000102301_100010209669 [0,2,0,0,0,0|2,0,0]=4 14357 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)Cl 11a_100000102301_200010192171 [0,2,0,0,0,0|2,0,0]=4 14358 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100000102301_200010192171 [0,2,0,0,0,0|2,0,0]=4 14359 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100000102301_200010192171 [0,2,0,0,0,0|2,0,0]=4 14360 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100000102301_200010192171 [0,2,0,0,0,0|2,0,0]=4 14361 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)F 11a_100000102301_100009888510 [0,2,0,0,0,0|2,0,0]=4 14362 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)F 1626a_100000102301_100009888510 [0,2,0,0,0,0|2,0,0]=4 14363 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)F 240690a_100000102301_100009888510 [0,2,0,0,0,0|2,0,0]=4 14364 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)F)F 527a_100000102301_100009888510 [0,2,0,0,0,0|2,0,0]=4 14365 B16R1.3574 CCCCNC(=O)c1ccc(c(c1Cl)O)O 240690a_100000102301_100009910189 [0,2,0,0,0,0|2,0,0]=4 14366 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)Br 11a_100000102301_200016032200 [0,2,0,0,0,0|2,0,0]=4 14367 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)Br 1626a_100000102301_200016032200 [0,2,0,0,0,0|2,0,0]=4 14368 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)Br 240690a_100000102301_200016032200 [0,2,0,0,0,0|2,0,0]=4 14369 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)Br 527a_100000102301_200016032200 [0,2,0,0,0,0|2,0,0]=4 14370 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)F 11a_100000102301_100010204296 [0,2,0,0,0,0|2,0,0]=4 14371 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)F 1626a_100000102301_100010204296 [0,2,0,0,0,0|2,0,0]=4 14372 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)F 240690a_100000102301_100010204296 [0,2,0,0,0,0|2,0,0]=4 14373 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Br)F 527a_100000102301_100010204296 [0,2,0,0,0,0|2,0,0]=4 14374 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Br 11a_100000102301_100000722919 [0,2,0,0,0,0|2,0,0]=4 14375 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Br 1626a_100000102301_100000722919 [0,2,0,0,0,0|2,0,0]=4 14376 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Br 240690a_100000102301_100000722919 [0,2,0,0,0,0|2,0,0]=4 14377 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Br 527a_100000102301_100000722919 [0,2,0,0,0,0|2,0,0]=4 14378 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)C 11a_100000102301_100010768504 [0,2,0,0,0,0|2,0,0]=4 14379 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)C 1626a_100000102301_100010768504 [0,2,0,0,0,0|2,0,0]=4 14380 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)C 240690a_100000102301_100010768504 [0,2,0,0,0,0|2,0,0]=4 14381 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)C 527a_100000102301_100010768504 [0,2,0,0,0,0|2,0,0]=4 14382 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Cl 11a_100000102301_100012183103 [0,2,0,0,0,0|2,0,0]=4 14383 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Cl 1626a_100000102301_100012183103 [0,2,0,0,0,0|2,0,0]=4 14384 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Cl 240690a_100000102301_100012183103 [0,2,0,0,0,0|2,0,0]=4 14385 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)Cl 527a_100000102301_100012183103 [0,2,0,0,0,0|2,0,0]=4 14386 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)F 11a_100000102301_100000067293 [0,2,0,0,0,0|2,0,0]=4 14387 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)F 1626a_100000102301_100000067293 [0,2,0,0,0,0|2,0,0]=4 14388 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)F 240690a_100000102301_100000067293 [0,2,0,0,0,0|2,0,0]=4 14389 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)C)F 527a_100000102301_100000067293 [0,2,0,0,0,0|2,0,0]=4 14390 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)Br 11a_100000102301_100000719840 [0,2,0,0,0,0|2,0,0]=4 14391 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)Br 1626a_100000102301_100000719840 [0,2,0,0,0,0|2,0,0]=4 14392 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)Br 240690a_100000102301_100000719840 [0,2,0,0,0,0|2,0,0]=4 14393 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)Br 527a_100000102301_100000719840 [0,2,0,0,0,0|2,0,0]=4 14394 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)C 11a_100000102301_100000722910 [0,2,0,0,0,0|2,0,0]=4 14395 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)C 1626a_100000102301_100000722910 [0,2,0,0,0,0|2,0,0]=4 14396 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)C 240690a_100000102301_100000722910 [0,2,0,0,0,0|2,0,0]=4 14397 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)C 527a_100000102301_100000722910 [0,2,0,0,0,0|2,0,0]=4 14398 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)F 11a_100000102301_100000034381 [0,2,0,0,0,0|2,0,0]=4 14399 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)F 1626a_100000102301_100000034381 [0,2,0,0,0,0|2,0,0]=4 14400 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)F 240690a_100000102301_100000034381 [0,2,0,0,0,0|2,0,0]=4 14401 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)Cl)F 527a_100000102301_100000034381 [0,2,0,0,0,0|2,0,0]=4 14402 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Br 11a_100000102301_100009816880 [0,2,0,0,0,0|2,0,0]=4 14403 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Br 1626a_100000102301_100009816880 [0,2,0,0,0,0|2,0,0]=4 14404 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Br 240690a_100000102301_100009816880 [0,2,0,0,0,0|2,0,0]=4 14405 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Br 527a_100000102301_100009816880 [0,2,0,0,0,0|2,0,0]=4 14406 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)C 11a_100000102301_100011219789 [0,2,0,0,0,0|2,0,0]=4 14407 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)C 1626a_100000102301_100011219789 [0,2,0,0,0,0|2,0,0]=4 14408 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)C 240690a_100000102301_100011219789 [0,2,0,0,0,0|2,0,0]=4 14409 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)C 527a_100000102301_100011219789 [0,2,0,0,0,0|2,0,0]=4 14410 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Cl 11a_100000102301_100000085317 [0,2,0,0,0,0|2,0,0]=4 14411 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Cl 1626a_100000102301_100000085317 [0,2,0,0,0,0|2,0,0]=4 14412 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Cl 240690a_100000102301_100000085317 [0,2,0,0,0,0|2,0,0]=4 14413 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)Cl 527a_100000102301_100000085317 [0,2,0,0,0,0|2,0,0]=4 14414 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)F 11a_100000102301_100000766628 [0,2,0,0,0,0|2,0,0]=4 14415 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)F 1626a_100000102301_100000766628 [0,2,0,0,0,0|2,0,0]=4 14416 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)F 240690a_100000102301_100000766628 [0,2,0,0,0,0|2,0,0]=4 14417 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)F 527a_100000102301_100000766628 [0,2,0,0,0,0|2,0,0]=4 14418 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)I 11a_100000102301_100010177778 [0,2,0,0,0,0|2,0,0]=4 14419 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)I 1626a_100000102301_100010177778 [0,2,0,0,0,0|2,0,0]=4 14420 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)I 240690a_100000102301_100010177778 [0,2,0,0,0,0|2,0,0]=4 14421 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)I 527a_100000102301_100010177778 [0,2,0,0,0,0|2,0,0]=4 14422 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)F)O 240690a_100000102301_100000036740 [0,2,0,0,0,0|2,0,0]=4 14423 B16R1.3574 CCCCNC(=O)c1ccc(c(c1F)O)F 240690a_100000102301_100000084588 [0,2,0,0,0,0|2,0,0]=4 14424 B16R1.3574 CCCCNC(=O)c1ccc(c(c1I)C)C 11a_100000102301_100010188221 [0,2,0,0,0,0|2,0,0]=4 14425 B16R1.3574 CCCCNC(=O)c1ccc(c(c1I)C)C 1626a_100000102301_100010188221 [0,2,0,0,0,0|2,0,0]=4 14426 B16R1.3574 CCCCNC(=O)c1ccc(c(c1I)C)C 240690a_100000102301_100010188221 [0,2,0,0,0,0|2,0,0]=4 14427 B16R1.3574 CCCCNC(=O)c1ccc(c(c1I)C)C 527a_100000102301_100010188221 [0,2,0,0,0,0|2,0,0]=4 14428 B16R1.3574 CCCCNC(=O)c1ccc(c(c1O)C)C 240690a_100000102301_100000742916 [0,2,0,0,0,0|1,0,0]=3 14429 B16R1.3574 CCCCNC(=O)c1ccc(c(c1O)C)C 527a_100000102301_100000742916 [0,2,0,0,0,0|1,0,0]=3 14430 B16R1.3574 CCCCNC(=O)c1ccc(c(c1O)F)Br 240690a_100000102301_100010761495 [0,2,0,0,0,0|1,0,0]=3 14431 B16R1.3574 CCCCNC(=O)c1ccc(c(c1O)F)Br 527a_100000102301_100010761495 [0,2,0,0,0,0|1,0,0]=3 14432 B16R1.3574 CCCCNC(=O)c1ccc(c(c1O)F)F 240690a_100000102301_100011799213 [0,2,0,0,0,0|1,0,0]=3 14433 B16R1.3574 CCCNNC(=O)c1ccc(c(c1O)C)C 22a_100000740057_100000742916 [0,2,0,0,0,0|2,0,0]=4 14434 B16R1.3574 CCCNNC(=O)c1ccc(c(c1O)F)Br 22a_100000740057_100010761495 [0,2,0,0,0,0|2,0,0]=4 14435 B16R1.3574 CCCNNC(=O)c1ccc(c(c1O)F)F 22a_100000740057_100011799213 [0,2,0,0,0,0|2,0,0]=4 14436 B16R1.3574 CCOCCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100011215890 [0,2,0,0,0,0|2,0,0]=4 14437 B16R1.3574 CCOCCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100011215890 [0,2,0,0,0,0|2,0,0]=4 14438 B16R1.3574 CCOCCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100011215890 [0,2,0,0,0,0|2,0,0]=4 14439 B16R1.3574 CCOCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100011215890 [0,2,0,0,0,0|2,0,0]=4 14440 B16R1.3574 CCSCCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000757381 [0,2,0,0,0,0|2,0,0]=4 14441 B16R1.3574 CCSCCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000757381 [0,2,0,0,0,0|2,0,0]=4 14442 B16R1.3574 CCSCCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000757381 [0,2,0,0,0,0|2,0,0]=4 14443 B16R1.3574 CCSCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000757381 [0,2,0,0,0,0|2,0,0]=4 14444 B16R1.3574 COCCCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000740836 [0,2,0,0,0,0|2,0,0]=4 14445 B16R1.3574 COCCCC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_100000740836 [0,2,0,0,0,0|2,0,0]=4 14446 B16R1.3574 COCCCC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_100000740836 [0,2,0,0,0,0|2,0,0]=4 14447 B16R1.3574 COCCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000740836 [0,2,0,0,0,0|2,0,0]=4 14448 B16R1.3574 COCCNC(=O)c1ccc(c(c1O)C)C 240690a_100000209980_100000742916 [0,2,0,0,0,0|2,0,0]=4 14449 B16R1.3574 COCCNC(=O)c1ccc(c(c1O)C)C 527a_100000209980_100000742916 [0,2,0,0,0,0|2,0,0]=4 14450 B16R1.3574 COCCNC(=O)c1ccc(c(c1O)F)Br 240690a_100000209980_100010761495 [0,2,0,0,0,0|2,0,0]=4 14451 B16R1.3574 COCCNC(=O)c1ccc(c(c1O)F)Br 527a_100000209980_100010761495 [0,2,0,0,0,0|2,0,0]=4 14452 B16R1.3574 COCCNC(=O)c1ccc(c(c1O)F)F 240690a_100000209980_100011799213 [0,2,0,0,0,0|2,0,0]=4 14453 B16R1.3574 CSCCNC(=O)c1ccc(c(c1O)C)C 240690a_100020590264_100000742916 [0,2,0,0,0,0|2,0,0]=4 14454 B16R1.3574 CSCCNC(=O)c1ccc(c(c1O)C)C 527a_100020590264_100000742916 [0,2,0,0,0,0|2,0,0]=4 14455 B16R1.3574 CSCCNC(=O)c1ccc(c(c1O)F)Br 240690a_100020590264_100010761495 [0,2,0,0,0,0|2,0,0]=4 14456 B16R1.3574 CSCCNC(=O)c1ccc(c(c1O)F)Br 527a_100020590264_100010761495 [0,2,0,0,0,0|2,0,0]=4 14457 B16R1.3574 CSCCNC(=O)c1ccc(c(c1O)F)F 240690a_100020590264_100011799213 [0,2,0,0,0,0|2,0,0]=4 14458 B16R1.3574 Cc1ccc(c(c1C)O)C(=O)CCCCF 1458a_100000742916_100000729493 [0,2,0,0,0,0|2,0,0]=4 14459 B16R1.3574 Cc1ccc(c(c1C)O)C(=O)CCCCO 1458a_100000742916_100000210776 [0,2,0,0,0,0|2,0,0]=4 14460 B16R1.3574 Cc1ccc(c(c1C)O)C(=O)NCCCF 240690a_100015189416_100000742916 [0,2,0,0,0,0|2,0,0]=4 14461 B16R1.3574 Cc1ccc(c(c1C)O)C(=O)NCCCF 527a_100015189416_100000742916 [0,2,0,0,0,0|2,0,0]=4 14462 B16R1.3574 Cc1ccc(c(c1C)O)C(=O)NCCCO 240690a_100000182051_100000742916 [0,2,0,0,0,0|2,0,0]=4 14463 B16R1.3574 Cc1ccc(c(c1C)O)C(=O)NCCCO 527a_100000182051_100000742916 [0,2,0,0,0,0|2,0,0]=4 14464 B16R1.3574 O=C(CCCCF)c1ccc(c(c1O)F)Br 1458a_100010761495_100000729493 [0,2,0,0,0,0|2,0,0]=4 14465 B16R1.3574 O=C(CCCCF)c1ccc(c(c1O)F)F 1458a_100011799213_100000729493 [0,2,0,0,0,0|2,0,0]=4 14466 B16R1.3574 O=C(CCCCF)c1ccc(c(c1O)O)O 1458a_100000037941_100000729493 [0,2,0,0,0,0|2,0,0]=4 14467 B16R1.3574 O=C(CCCCO)c1ccc(c(c1O)F)Br 1458a_100010761495_100000210776 [0,2,0,0,0,0|2,0,0]=4 14468 B16R1.3574 O=C(CCCCO)c1ccc(c(c1O)F)F 1458a_100011799213_100000210776 [0,2,0,0,0,0|2,0,0]=4 14469 B16R1.3574 O=C(CCCCO)c1ccc(c(c1O)O)O 1458a_100000037941_100000210776 [0,2,0,0,0,0|2,0,0]=4 14470 B16R1.3574 O=C(NCCCF)c1ccc(c(c1O)F)Br 240690a_100015189416_100010761495 [0,2,0,0,0,0|2,0,0]=4 14471 B16R1.3574 O=C(NCCCF)c1ccc(c(c1O)F)Br 527a_100015189416_100010761495 [0,2,0,0,0,0|2,0,0]=4 14472 B16R1.3574 O=C(NCCCF)c1ccc(c(c1O)F)F 240690a_100015189416_100011799213 [0,2,0,0,0,0|2,0,0]=4 14473 B16R1.3574 O=C(NCCCO)c1ccc(c(c1O)F)Br 240690a_100000182051_100010761495 [0,2,0,0,0,0|2,0,0]=4 14474 B16R1.3574 O=C(NCCCO)c1ccc(c(c1O)F)Br 527a_100000182051_100010761495 [0,2,0,0,0,0|2,0,0]=4 14475 B16R1.3574 O=C(NCCCO)c1ccc(c(c1O)F)F 240690a_100000182051_100011799213 [0,2,0,0,0,0|2,0,0]=4 14476 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_100000210326 [0,2,0,0,0,0|2,0,0]=4 14477 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_100000210326 [0,2,0,0,0,0|2,0,0]=4 14478 B16R1.3593 CCCCCC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_100000210326 [0,2,0,0,0,0|2,0,0]=4 14479 B16R1.3593 CCCCCC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_100000210326 [0,2,0,0,0,0|2,0,0]=4 14480 B16R1.3593 CCCCCC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_100000210326 [0,2,0,0,0,0|2,0,0]=4 14481 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_100000210326 [0,2,0,0,0,0|2,0,0]=4 14482 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_100000210326 [0,2,0,0,0,0|2,0,0]=4 14483 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_100000210326 [0,2,0,0,0,0|2,0,0]=4 14484 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_100000210326 [0,2,0,0,0,0|2,0,0]=4 14485 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_100000210326 [0,2,0,0,0,0|2,0,0]=4 14486 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_100000210326 [0,2,0,0,0,0|2,0,0]=4 14487 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_100000210326 [0,2,0,0,0,0|2,0,0]=4 14488 B16R1.3593 CCCCCC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_100000210326 [0,2,0,0,0,0|2,0,0]=4 14489 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_100000210326 [0,2,0,0,0,0|2,0,0]=4 14490 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_100000210326 [0,2,0,0,0,0|2,0,0]=4 14491 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_100000210326 [0,2,0,0,0,0|2,0,0]=4 14492 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_100000210326 [0,2,0,0,0,0|2,0,0]=4 14493 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_100000210326 [0,2,0,0,0,0|2,0,0]=4 14494 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_100000210326 [0,2,0,0,0,0|2,0,0]=4 14495 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_100000210326 [0,2,0,0,0,0|2,0,0]=4 14496 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_100000210326 [0,2,0,0,0,0|2,0,0]=4 14497 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_100000210326 [0,2,0,0,0,0|2,0,0]=4 14498 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_100000210326 [0,2,0,0,0,0|2,0,0]=4 14499 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_100000210326 [0,2,0,0,0,0|2,0,0]=4 14500 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_100000210326 [0,2,0,0,0,0|2,0,0]=4 14501 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_100000210326 [0,2,0,0,0,0|2,0,0]=4 14502 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000210326 [0,2,0,0,0,0|1,0,0]=3 14503 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_100000210326 [0,2,0,0,0,0|2,0,0]=4 14504 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_100000210326 [0,2,0,0,0,0|2,0,0]=4 14505 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_100000210326 [0,2,0,0,0,0|2,0,0]=4 14506 B16R1.3593 CCCCCC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_100000210326 [0,2,0,0,0,0|2,0,0]=4 14507 B16R1.3593 CCCCCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000210326 [0,2,0,0,0,0|1,0,0]=3 14508 B16R1.3593 CCCCCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000210326 [0,2,0,0,0,0|1,0,0]=3 14509 B16R1.3593 CCCCCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000210326 [0,2,0,0,0,0|1,0,0]=3 14510 B16R1.3593 CCCCCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000210326 [0,2,0,0,0,0|1,0,0]=3 14511 B16R1.3593 CCCCCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000210326 [0,2,0,0,0,0|1,0,0]=3 14512 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)C)F 11a_100000102301_100000720849 [0,2,0,0,0,0|2,0,0]=4 14513 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)C)F 1626a_100000102301_100000720849 [0,2,0,0,0,0|2,0,0]=4 14514 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)C)F 240690a_100000102301_100000720849 [0,2,0,0,0,0|2,0,0]=4 14515 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)C)F 527a_100000102301_100000720849 [0,2,0,0,0,0|2,0,0]=4 14516 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)F)F 11a_100000102301_100010245744 [0,2,0,0,0,0|2,0,0]=4 14517 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)F)F 1626a_100000102301_100010245744 [0,2,0,0,0,0|2,0,0]=4 14518 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)F)F 240690a_100000102301_100010245744 [0,2,0,0,0,0|2,0,0]=4 14519 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Br)F)F 527a_100000102301_100010245744 [0,2,0,0,0,0|2,0,0]=4 14520 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)C 11a_100000102301_100012355652 [0,2,0,0,0,0|2,0,0]=4 14521 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)C 1626a_100000102301_100012355652 [0,2,0,0,0,0|2,0,0]=4 14522 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)C 240690a_100000102301_100012355652 [0,2,0,0,0,0|2,0,0]=4 14523 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)C 527a_100000102301_100012355652 [0,2,0,0,0,0|2,0,0]=4 14524 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)F 11a_100000102301_100010768519 [0,2,0,0,0,0|2,0,0]=4 14525 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)F 1626a_100000102301_100010768519 [0,2,0,0,0,0|2,0,0]=4 14526 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)F 240690a_100000102301_100010768519 [0,2,0,0,0,0|2,0,0]=4 14527 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)Br)F 527a_100000102301_100010768519 [0,2,0,0,0,0|2,0,0]=4 14528 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)F)Br 11a_100000102301_100010768524 [0,2,0,0,0,0|2,0,0]=4 14529 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)F)Br 1626a_100000102301_100010768524 [0,2,0,0,0,0|2,0,0]=4 14530 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)F)Br 240690a_100000102301_100010768524 [0,2,0,0,0,0|2,0,0]=4 14531 B16R1.3593 CCCCNC(=O)c1c(ccc(c1C)F)Br 527a_100000102301_100010768524 [0,2,0,0,0,0|2,0,0]=4 14532 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)Cl 11a_100000102301_100012350121 [0,2,0,0,0,0|2,0,0]=4 14533 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)Cl 1626a_100000102301_100012350121 [0,2,0,0,0,0|2,0,0]=4 14534 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)Cl 240690a_100000102301_100012350121 [0,2,0,0,0,0|2,0,0]=4 14535 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)Cl 527a_100000102301_100012350121 [0,2,0,0,0,0|2,0,0]=4 14536 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)F 11a_100000102301_100010245877 [0,2,0,0,0,0|2,0,0]=4 14537 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)F 1626a_100000102301_100010245877 [0,2,0,0,0,0|2,0,0]=4 14538 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)F 240690a_100000102301_100010245877 [0,2,0,0,0,0|2,0,0]=4 14539 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Br)F 527a_100000102301_100010245877 [0,2,0,0,0,0|2,0,0]=4 14540 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)Br 11a_100000102301_200010769262 [0,2,0,0,0,0|2,0,0]=4 14541 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)Br 1626a_100000102301_200010769262 [0,2,0,0,0,0|2,0,0]=4 14542 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)Br 240690a_100000102301_200010769262 [0,2,0,0,0,0|2,0,0]=4 14543 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)Br 527a_100000102301_200010769262 [0,2,0,0,0,0|2,0,0]=4 14544 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)F 11a_100000102301_100000036856 [0,2,0,0,0,0|2,0,0]=4 14545 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)F 1626a_100000102301_100000036856 [0,2,0,0,0,0|2,0,0]=4 14546 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)F 240690a_100000102301_100000036856 [0,2,0,0,0,0|2,0,0]=4 14547 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)C)F 527a_100000102301_100000036856 [0,2,0,0,0,0|2,0,0]=4 14548 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)Cl 11a_100000102301_100000182695 [0,2,0,0,0,0|2,0,0]=4 14549 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)Cl 1626a_100000102301_100000182695 [0,2,0,0,0,0|2,0,0]=4 14550 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)Cl 240690a_100000102301_100000182695 [0,2,0,0,0,0|2,0,0]=4 14551 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)Cl 527a_100000102301_100000182695 [0,2,0,0,0,0|2,0,0]=4 14552 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)F 11a_100000102301_100000061834 [0,2,0,0,0,0|2,0,0]=4 14553 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)F 1626a_100000102301_100000061834 [0,2,0,0,0,0|2,0,0]=4 14554 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)F 240690a_100000102301_100000061834 [0,2,0,0,0,0|2,0,0]=4 14555 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)Cl)F 527a_100000102301_100000061834 [0,2,0,0,0,0|2,0,0]=4 14556 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)Cl 11a_100000102301_100000068355 [0,2,0,0,0,0|2,0,0]=4 14557 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)Cl 1626a_100000102301_100000068355 [0,2,0,0,0,0|2,0,0]=4 14558 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)Cl 240690a_100000102301_100000068355 [0,2,0,0,0,0|2,0,0]=4 14559 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)F 11a_100000102301_100000043044 [0,2,0,0,0,0|2,0,0]=4 14560 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)F 1626a_100000102301_100000043044 [0,2,0,0,0,0|2,0,0]=4 14561 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)F 240690a_100000102301_100000043044 [0,2,0,0,0,0|2,0,0]=4 14562 B16R1.3593 CCCCNC(=O)c1c(ccc(c1Cl)F)F 527a_100000102301_100000043044 [0,2,0,0,0,0|2,0,0]=4 14563 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Br 11a_100000102301_100010233042 [0,2,0,0,0,0|2,0,0]=4 14564 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Br 240690a_100000102301_100010233042 [0,2,0,0,0,0|2,0,0]=4 14565 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Br 527a_100000102301_100010233042 [0,2,0,0,0,0|2,0,0]=4 14566 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Cl 11a_100000102301_100010235752 [0,2,0,0,0,0|2,0,0]=4 14567 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Cl 1626a_100000102301_100010235752 [0,2,0,0,0,0|2,0,0]=4 14568 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Cl 240690a_100000102301_100010235752 [0,2,0,0,0,0|2,0,0]=4 14569 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)Cl 527a_100000102301_100010235752 [0,2,0,0,0,0|2,0,0]=4 14570 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)F 11a_100000102301_100000721511 [0,2,0,0,0,0|2,0,0]=4 14571 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)F 1626a_100000102301_100000721511 [0,2,0,0,0,0|2,0,0]=4 14572 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)F 240690a_100000102301_100000721511 [0,2,0,0,0,0|2,0,0]=4 14573 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Br)F 527a_100000102301_100000721511 [0,2,0,0,0,0|2,0,0]=4 14574 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Br 11a_100000102301_100010271678 [0,2,0,0,0,0|2,0,0]=4 14575 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Br 1626a_100000102301_100010271678 [0,2,0,0,0,0|2,0,0]=4 14576 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Br 240690a_100000102301_100010271678 [0,2,0,0,0,0|2,0,0]=4 14577 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Br 527a_100000102301_100010271678 [0,2,0,0,0,0|2,0,0]=4 14578 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Cl 11a_100000102301_100000039063 [0,2,0,0,0,0|2,0,0]=4 14579 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Cl 1626a_100000102301_100000039063 [0,2,0,0,0,0|2,0,0]=4 14580 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Cl 240690a_100000102301_100000039063 [0,2,0,0,0,0|2,0,0]=4 14581 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)Cl 527a_100000102301_100000039063 [0,2,0,0,0,0|2,0,0]=4 14582 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)F 11a_100000102301_100000692215 [0,2,0,0,0,0|2,0,0]=4 14583 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)F 1626a_100000102301_100000692215 [0,2,0,0,0,0|2,0,0]=4 14584 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)F 240690a_100000102301_100000692215 [0,2,0,0,0,0|2,0,0]=4 14585 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)C)F 527a_100000102301_100000692215 [0,2,0,0,0,0|2,0,0]=4 14586 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Br 11a_100000102301_100010769261 [0,2,0,0,0,0|2,0,0]=4 14587 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Br 1626a_100000102301_100010769261 [0,2,0,0,0,0|2,0,0]=4 14588 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Br 240690a_100000102301_100010769261 [0,2,0,0,0,0|2,0,0]=4 14589 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Br 527a_100000102301_100010769261 [0,2,0,0,0,0|2,0,0]=4 14590 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Cl 11a_100000102301_100000061686 [0,2,0,0,0,0|2,0,0]=4 14591 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Cl 1626a_100000102301_100000061686 [0,2,0,0,0,0|2,0,0]=4 14592 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Cl 240690a_100000102301_100000061686 [0,2,0,0,0,0|2,0,0]=4 14593 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)Cl 527a_100000102301_100000061686 [0,2,0,0,0,0|2,0,0]=4 14594 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)F 11a_100000102301_100011219569 [0,2,0,0,0,0|2,0,0]=4 14595 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)F 1626a_100000102301_100011219569 [0,2,0,0,0,0|2,0,0]=4 14596 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)F 240690a_100000102301_100011219569 [0,2,0,0,0,0|2,0,0]=4 14597 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)Cl)F 527a_100000102301_100011219569 [0,2,0,0,0,0|2,0,0]=4 14598 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Br 11a_100000102301_100010177765 [0,2,0,0,0,0|2,0,0]=4 14599 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Br 1626a_100000102301_100010177765 [0,2,0,0,0,0|2,0,0]=4 14600 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Br 240690a_100000102301_100010177765 [0,2,0,0,0,0|2,0,0]=4 14601 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Br 527a_100000102301_100010177765 [0,2,0,0,0,0|2,0,0]=4 14602 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Cl 11a_100000102301_100011998153 [0,2,0,0,0,0|2,0,0]=4 14603 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Cl 1626a_100000102301_100011998153 [0,2,0,0,0,0|2,0,0]=4 14604 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Cl 240690a_100000102301_100011998153 [0,2,0,0,0,0|2,0,0]=4 14605 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)Cl 527a_100000102301_100011998153 [0,2,0,0,0,0|2,0,0]=4 14606 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)F 11a_100000102301_100000031524 [0,2,0,0,0,0|2,0,0]=4 14607 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)F 1626a_100000102301_100000031524 [0,2,0,0,0,0|2,0,0]=4 14608 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)F 240690a_100000102301_100000031524 [0,2,0,0,0,0|2,0,0]=4 14609 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)F 527a_100000102301_100000031524 [0,2,0,0,0,0|2,0,0]=4 14610 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)I 11a_100000102301_100010177766 [0,2,0,0,0,0|2,0,0]=4 14611 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)I 1626a_100000102301_100010177766 [0,2,0,0,0,0|2,0,0]=4 14612 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)I 240690a_100000102301_100010177766 [0,2,0,0,0,0|2,0,0]=4 14613 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)I 527a_100000102301_100010177766 [0,2,0,0,0,0|2,0,0]=4 14614 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)O 240690a_100000102301_100000062415 [0,2,0,0,0,0|1,0,0]=3 14615 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)F)O 527a_100000102301_100000062415 [0,2,0,0,0,0|1,0,0]=3 14616 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Br 11a_100000102301_100010782274 [0,2,0,0,0,0|2,0,0]=4 14617 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Br 1626a_100000102301_100010782274 [0,2,0,0,0,0|2,0,0]=4 14618 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Br 240690a_100000102301_100010782274 [0,2,0,0,0,0|2,0,0]=4 14619 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Br 527a_100000102301_100010782274 [0,2,0,0,0,0|2,0,0]=4 14620 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Cl 11a_100000102301_100021583479 [0,2,0,0,0,0|2,0,0]=4 14621 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Cl 1626a_100000102301_100021583479 [0,2,0,0,0,0|2,0,0]=4 14622 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Cl 240690a_100000102301_100021583479 [0,2,0,0,0,0|2,0,0]=4 14623 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)Cl 527a_100000102301_100021583479 [0,2,0,0,0,0|2,0,0]=4 14624 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)F 11a_100000102301_100012359589 [0,2,0,0,0,0|2,0,0]=4 14625 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)F 1626a_100000102301_100012359589 [0,2,0,0,0,0|2,0,0]=4 14626 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)F 240690a_100000102301_100012359589 [0,2,0,0,0,0|2,0,0]=4 14627 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)I)F 527a_100000102301_100012359589 [0,2,0,0,0,0|2,0,0]=4 14628 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)O)F 240690a_100000102301_100000068660 [0,2,0,0,0,0|2,0,0]=4 14629 B16R1.3593 CCCCNC(=O)c1c(ccc(c1F)O)F 527a_100000102301_100000068660 [0,2,0,0,0,0|2,0,0]=4 14630 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)Br)O 240690a_100000102301_100010008628 [0,2,0,0,0,0|1,0,0]=3 14631 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)Br)O 527a_100000102301_100010008628 [0,2,0,0,0,0|1,0,0]=3 14632 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)C)C 240690a_100000102301_100011255215 [0,2,0,0,0,0|1,0,0]=3 14633 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100000102301_100011255222 [0,2,0,0,0,0|1,0,0]=3 14634 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100000102301_100011255222 [0,2,0,0,0,0|1,0,0]=3 14635 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)Cl)O 240690a_100000102301_100000080727 [0,2,0,0,0,0|1,0,0]=3 14636 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)Cl)O 527a_100000102301_100000080727 [0,2,0,0,0,0|1,0,0]=3 14637 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)F)F 240690a_100000102301_100011830443 [0,2,0,0,0,0|1,0,0]=3 14638 B16R1.3593 CCCCNC(=O)c1c(ccc(c1O)F)F 527a_100000102301_100011830443 [0,2,0,0,0,0|1,0,0]=3 14639 B16R1.3593 CCCNNC(=O)c1c(ccc(c1F)F)O 22a_100000740057_100000062415 [0,2,0,0,0,0|2,0,0]=4 14640 B16R1.3593 CCCNNC(=O)c1c(ccc(c1O)C)C 22a_100000740057_100011255215 [0,2,0,0,0,0|2,0,0]=4 14641 B16R1.3593 CCCNNC(=O)c1c(ccc(c1O)Cl)Cl 22a_100000740057_100011255222 [0,2,0,0,0,0|2,0,0]=4 14642 B16R1.3593 CCCNNC(=O)c1c(ccc(c1O)F)F 22a_100000740057_100011830443 [0,2,0,0,0,0|2,0,0]=4 14643 B16R1.3593 CCOCCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100011215890 [0,2,0,0,0,0|2,0,0]=4 14644 B16R1.3593 CCOCCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100011215890 [0,2,0,0,0,0|2,0,0]=4 14645 B16R1.3593 CCOCCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100011215890 [0,2,0,0,0,0|2,0,0]=4 14646 B16R1.3593 CCOCCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100011215890 [0,2,0,0,0,0|2,0,0]=4 14647 B16R1.3593 CCOCCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100011215890 [0,2,0,0,0,0|2,0,0]=4 14648 B16R1.3593 CCOCCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100011215890 [0,2,0,0,0,0|2,0,0]=4 14649 B16R1.3593 CCSCCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000757381 [0,2,0,0,0,0|2,0,0]=4 14650 B16R1.3593 CCSCCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000757381 [0,2,0,0,0,0|2,0,0]=4 14651 B16R1.3593 CCSCCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000757381 [0,2,0,0,0,0|2,0,0]=4 14652 B16R1.3593 CCSCCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000757381 [0,2,0,0,0,0|2,0,0]=4 14653 B16R1.3593 CCSCCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000757381 [0,2,0,0,0,0|2,0,0]=4 14654 B16R1.3593 CCSCCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000757381 [0,2,0,0,0,0|2,0,0]=4 14655 B16R1.3593 COCCCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000740836 [0,2,0,0,0,0|2,0,0]=4 14656 B16R1.3593 COCCCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000740836 [0,2,0,0,0,0|2,0,0]=4 14657 B16R1.3593 COCCCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000740836 [0,2,0,0,0,0|2,0,0]=4 14658 B16R1.3593 COCCCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000740836 [0,2,0,0,0,0|2,0,0]=4 14659 B16R1.3593 COCCCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000740836 [0,2,0,0,0,0|2,0,0]=4 14660 B16R1.3593 COCCCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000740836 [0,2,0,0,0,0|2,0,0]=4 14661 B16R1.3593 COCCNC(=O)c1c(ccc(c1F)F)O 240690a_100000209980_100000062415 [0,2,0,0,0,0|2,0,0]=4 14662 B16R1.3593 COCCNC(=O)c1c(ccc(c1F)F)O 527a_100000209980_100000062415 [0,2,0,0,0,0|2,0,0]=4 14663 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)Br)O 240690a_100000209980_100010008628 [0,2,0,0,0,0|2,0,0]=4 14664 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)Br)O 527a_100000209980_100010008628 [0,2,0,0,0,0|2,0,0]=4 14665 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)C)C 240690a_100000209980_100011255215 [0,2,0,0,0,0|2,0,0]=4 14666 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100000209980_100011255222 [0,2,0,0,0,0|2,0,0]=4 14667 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100000209980_100011255222 [0,2,0,0,0,0|2,0,0]=4 14668 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)Cl)O 240690a_100000209980_100000080727 [0,2,0,0,0,0|2,0,0]=4 14669 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)Cl)O 527a_100000209980_100000080727 [0,2,0,0,0,0|2,0,0]=4 14670 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)F)F 240690a_100000209980_100011830443 [0,2,0,0,0,0|2,0,0]=4 14671 B16R1.3593 COCCNC(=O)c1c(ccc(c1O)F)F 527a_100000209980_100011830443 [0,2,0,0,0,0|2,0,0]=4 14672 B16R1.3593 CSCCNC(=O)c1c(ccc(c1F)F)O 240690a_100020590264_100000062415 [0,2,0,0,0,0|2,0,0]=4 14673 B16R1.3593 CSCCNC(=O)c1c(ccc(c1F)F)O 527a_100020590264_100000062415 [0,2,0,0,0,0|2,0,0]=4 14674 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)Br)O 240690a_100020590264_100010008628 [0,2,0,0,0,0|2,0,0]=4 14675 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)Br)O 527a_100020590264_100010008628 [0,2,0,0,0,0|2,0,0]=4 14676 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)C)C 240690a_100020590264_100011255215 [0,2,0,0,0,0|2,0,0]=4 14677 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100020590264_100011255222 [0,2,0,0,0,0|2,0,0]=4 14678 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100020590264_100011255222 [0,2,0,0,0,0|2,0,0]=4 14679 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)Cl)O 240690a_100020590264_100000080727 [0,2,0,0,0,0|2,0,0]=4 14680 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)Cl)O 527a_100020590264_100000080727 [0,2,0,0,0,0|2,0,0]=4 14681 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)F)F 240690a_100020590264_100011830443 [0,2,0,0,0,0|2,0,0]=4 14682 B16R1.3593 CSCCNC(=O)c1c(ccc(c1O)F)F 527a_100020590264_100011830443 [0,2,0,0,0,0|2,0,0]=4 14683 B16R1.3593 Cc1ccc(c(c1O)C(=O)CCCCF)C 1458a_100011255215_100000729493 [0,2,0,0,0,0|2,0,0]=4 14684 B16R1.3593 Cc1ccc(c(c1O)C(=O)CCCCO)C 1458a_100011255215_100000210776 [0,2,0,0,0,0|2,0,0]=4 14685 B16R1.3593 Cc1ccc(c(c1O)C(=O)NCCCF)C 240690a_100015189416_100011255215 [0,2,0,0,0,0|2,0,0]=4 14686 B16R1.3593 Cc1ccc(c(c1O)C(=O)NCCCO)C 240690a_100000182051_100011255215 [0,2,0,0,0,0|2,0,0]=4 14687 B16R1.3593 O=C(CCCCF)c1c(ccc(c1F)F)O 1458a_100000062415_100000729493 [0,2,0,0,0,0|2,0,0]=4 14688 B16R1.3593 O=C(CCCCF)c1c(ccc(c1O)Br)O 1458a_100010008628_100000729493 [0,2,0,0,0,0|2,0,0]=4 14689 B16R1.3593 O=C(CCCCF)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000729493 [0,2,0,0,0,0|2,0,0]=4 14690 B16R1.3593 O=C(CCCCF)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000729493 [0,2,0,0,0,0|2,0,0]=4 14691 B16R1.3593 O=C(CCCCF)c1c(ccc(c1O)F)F 1458a_100011830443_100000729493 [0,2,0,0,0,0|2,0,0]=4 14692 B16R1.3593 O=C(CCCCO)c1c(ccc(c1F)F)O 1458a_100000062415_100000210776 [0,2,0,0,0,0|2,0,0]=4 14693 B16R1.3593 O=C(CCCCO)c1c(ccc(c1O)Br)O 1458a_100010008628_100000210776 [0,2,0,0,0,0|2,0,0]=4 14694 B16R1.3593 O=C(CCCCO)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000210776 [0,2,0,0,0,0|2,0,0]=4 14695 B16R1.3593 O=C(CCCCO)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000210776 [0,2,0,0,0,0|2,0,0]=4 14696 B16R1.3593 O=C(CCCCO)c1c(ccc(c1O)F)F 1458a_100011830443_100000210776 [0,2,0,0,0,0|2,0,0]=4 14697 B16R1.3593 O=C(NCCCF)c1c(ccc(c1F)F)O 240690a_100015189416_100000062415 [0,2,0,0,0,0|2,0,0]=4 14698 B16R1.3593 O=C(NCCCF)c1c(ccc(c1F)F)O 527a_100015189416_100000062415 [0,2,0,0,0,0|2,0,0]=4 14699 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)Br)O 240690a_100015189416_100010008628 [0,2,0,0,0,0|2,0,0]=4 14700 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)Br)O 527a_100015189416_100010008628 [0,2,0,0,0,0|2,0,0]=4 14701 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)Cl)Cl 240690a_100015189416_100011255222 [0,2,0,0,0,0|2,0,0]=4 14702 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)Cl)Cl 527a_100015189416_100011255222 [0,2,0,0,0,0|2,0,0]=4 14703 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)Cl)O 240690a_100015189416_100000080727 [0,2,0,0,0,0|2,0,0]=4 14704 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)Cl)O 527a_100015189416_100000080727 [0,2,0,0,0,0|2,0,0]=4 14705 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)F)F 240690a_100015189416_100011830443 [0,2,0,0,0,0|2,0,0]=4 14706 B16R1.3593 O=C(NCCCF)c1c(ccc(c1O)F)F 527a_100015189416_100011830443 [0,2,0,0,0,0|2,0,0]=4 14707 B16R1.3593 O=C(NCCCO)c1c(ccc(c1F)F)O 240690a_100000182051_100000062415 [0,2,0,0,0,0|2,0,0]=4 14708 B16R1.3593 O=C(NCCCO)c1c(ccc(c1F)F)O 527a_100000182051_100000062415 [0,2,0,0,0,0|2,0,0]=4 14709 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)Br)O 240690a_100000182051_100010008628 [0,2,0,0,0,0|2,0,0]=4 14710 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)Br)O 527a_100000182051_100010008628 [0,2,0,0,0,0|2,0,0]=4 14711 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)Cl)Cl 240690a_100000182051_100011255222 [0,2,0,0,0,0|2,0,0]=4 14712 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)Cl)Cl 527a_100000182051_100011255222 [0,2,0,0,0,0|2,0,0]=4 14713 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)Cl)O 240690a_100000182051_100000080727 [0,2,0,0,0,0|2,0,0]=4 14714 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)Cl)O 527a_100000182051_100000080727 [0,2,0,0,0,0|2,0,0]=4 14715 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)F)F 240690a_100000182051_100011830443 [0,2,0,0,0,0|2,0,0]=4 14716 B16R1.3593 O=C(NCCCO)c1c(ccc(c1O)F)F 527a_100000182051_100011830443 [0,2,0,0,0,0|2,0,0]=4 14717 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011215641 [0,2,0,0,0,0|1,0,1]=4 14718 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100011215641 [0,2,0,0,0,0|1,0,1]=4 14719 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011215641 [0,2,0,0,0,0|1,0,1]=4 14720 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011215641 [0,2,0,0,0,0|1,0,1]=4 14721 B16R1.11264 CC(=O)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011215641 [0,2,0,0,0,0|1,0,1]=4 14722 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100011214892 [0,2,0,0,0,0|2,0,0]=4 14723 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100011214892 [0,2,0,0,0,0|2,0,0]=4 14724 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_100011214892 [0,2,0,0,0,0|2,0,0]=4 14725 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_100011214892 [0,2,0,0,0,0|2,0,0]=4 14726 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_100011214892 [0,2,0,0,0,0|2,0,0]=4 14727 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100011214892 [0,2,0,0,0,0|2,0,0]=4 14728 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100011214892 [0,2,0,0,0,0|2,0,0]=4 14729 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100011214892 [0,2,0,0,0,0|2,0,0]=4 14730 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100011214892 [0,2,0,0,0,0|2,0,0]=4 14731 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100011214892 [0,2,0,0,0,0|2,0,0]=4 14732 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_100011214892 [0,2,0,0,0,0|2,0,0]=4 14733 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100011214892 [0,2,0,0,0,0|2,0,0]=4 14734 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1F)F 1458a_100000748134_100011214892 [0,2,0,0,0,0|2,0,0]=4 14735 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1F)I 1458a_100010185205_100011214892 [0,2,0,0,0,0|2,0,0]=4 14736 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1F)O 1458a_100000037433_100011214892 [0,2,0,0,0,0|2,0,0]=4 14737 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_100011214892 [0,2,0,0,0,0|2,0,0]=4 14738 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100011214892 [0,2,0,0,0,0|2,0,0]=4 14739 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1I)F 1458a_100000690930_100011214892 [0,2,0,0,0,0|2,0,0]=4 14740 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1I)O 1458a_100010084636_100011214892 [0,2,0,0,0,0|2,0,0]=4 14741 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100011214892 [0,2,0,0,0,0|1,0,0]=3 14742 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100011214892 [0,2,0,0,0,0|1,0,0]=3 14743 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100011214892 [0,2,0,0,0,0|1,0,0]=3 14744 B16R1.11264 CC(C)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100011214892 [0,2,0,0,0,0|1,0,0]=3 14745 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Br 11a_100000210545_100012360534 [0,2,0,0,0,0|2,0,0]=4 14746 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Br 1626a_100000210545_100012360534 [0,2,0,0,0,0|2,0,0]=4 14747 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Br 240690a_100000210545_100012360534 [0,2,0,0,0,0|2,0,0]=4 14748 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Br 527a_100000210545_100012360534 [0,2,0,0,0,0|2,0,0]=4 14749 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Cl 11a_100000210545_100012339722 [0,2,0,0,0,0|2,0,0]=4 14750 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Cl 1626a_100000210545_100012339722 [0,2,0,0,0,0|2,0,0]=4 14751 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Cl 240690a_100000210545_100012339722 [0,2,0,0,0,0|2,0,0]=4 14752 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)Cl 527a_100000210545_100012339722 [0,2,0,0,0,0|2,0,0]=4 14753 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)F 11a_100000210545_100011217547 [0,2,0,0,0,0|2,0,0]=4 14754 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)F 1626a_100000210545_100011217547 [0,2,0,0,0,0|2,0,0]=4 14755 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)F 240690a_100000210545_100011217547 [0,2,0,0,0,0|2,0,0]=4 14756 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)F 527a_100000210545_100011217547 [0,2,0,0,0,0|2,0,0]=4 14757 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)I 11a_100000210545_100010232522 [0,2,0,0,0,0|2,0,0]=4 14758 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)I 1626a_100000210545_100010232522 [0,2,0,0,0,0|2,0,0]=4 14759 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)I 240690a_100000210545_100010232522 [0,2,0,0,0,0|2,0,0]=4 14760 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)I 527a_100000210545_100010232522 [0,2,0,0,0,0|2,0,0]=4 14761 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)O 240690a_100000210545_100010230362 [0,2,0,0,0,0|2,0,0]=4 14762 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Br)O 527a_100000210545_100010230362 [0,2,0,0,0,0|2,0,0]=4 14763 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Br 11a_100000210545_100000760540 [0,2,0,0,0,0|2,0,0]=4 14764 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Br 1626a_100000210545_100000760540 [0,2,0,0,0,0|2,0,0]=4 14765 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Br 240690a_100000210545_100000760540 [0,2,0,0,0,0|2,0,0]=4 14766 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Br 527a_100000210545_100000760540 [0,2,0,0,0,0|2,0,0]=4 14767 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Cl 11a_100000210545_100000183631 [0,2,0,0,0,0|2,0,0]=4 14768 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Cl 1626a_100000210545_100000183631 [0,2,0,0,0,0|2,0,0]=4 14769 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Cl 240690a_100000210545_100000183631 [0,2,0,0,0,0|2,0,0]=4 14770 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)Cl 527a_100000210545_100000183631 [0,2,0,0,0,0|2,0,0]=4 14771 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)F 11a_100000210545_100000759904 [0,2,0,0,0,0|2,0,0]=4 14772 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)F 1626a_100000210545_100000759904 [0,2,0,0,0,0|2,0,0]=4 14773 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)F 240690a_100000210545_100000759904 [0,2,0,0,0,0|2,0,0]=4 14774 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)F 527a_100000210545_100000759904 [0,2,0,0,0,0|2,0,0]=4 14775 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)I 11a_100000210545_100010176783 [0,2,0,0,0,0|2,0,0]=4 14776 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)I 1626a_100000210545_100010176783 [0,2,0,0,0,0|2,0,0]=4 14777 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)I 240690a_100000210545_100010176783 [0,2,0,0,0,0|2,0,0]=4 14778 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)I 527a_100000210545_100010176783 [0,2,0,0,0,0|2,0,0]=4 14779 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)O 240690a_100000210545_100000092362 [0,2,0,0,0,0|2,0,0]=4 14780 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1Cl)O 527a_100000210545_100000092362 [0,2,0,0,0,0|2,0,0]=4 14781 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Br 11a_100000210545_100000756403 [0,2,0,0,0,0|2,0,0]=4 14782 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Br 1626a_100000210545_100000756403 [0,2,0,0,0,0|2,0,0]=4 14783 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Br 240690a_100000210545_100000756403 [0,2,0,0,0,0|2,0,0]=4 14784 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Br 527a_100000210545_100000756403 [0,2,0,0,0,0|2,0,0]=4 14785 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Cl 11a_100000210545_100000688816 [0,2,0,0,0,0|2,0,0]=4 14786 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Cl 1626a_100000210545_100000688816 [0,2,0,0,0,0|2,0,0]=4 14787 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Cl 240690a_100000210545_100000688816 [0,2,0,0,0,0|2,0,0]=4 14788 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)Cl 527a_100000210545_100000688816 [0,2,0,0,0,0|2,0,0]=4 14789 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)F 11a_100000210545_100000748134 [0,2,0,0,0,0|2,0,0]=4 14790 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)F 1626a_100000210545_100000748134 [0,2,0,0,0,0|2,0,0]=4 14791 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)F 240690a_100000210545_100000748134 [0,2,0,0,0,0|2,0,0]=4 14792 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)F 527a_100000210545_100000748134 [0,2,0,0,0,0|2,0,0]=4 14793 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)I 11a_100000210545_100010185205 [0,2,0,0,0,0|2,0,0]=4 14794 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)I 1626a_100000210545_100010185205 [0,2,0,0,0,0|2,0,0]=4 14795 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)I 240690a_100000210545_100010185205 [0,2,0,0,0,0|2,0,0]=4 14796 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)I 527a_100000210545_100010185205 [0,2,0,0,0,0|2,0,0]=4 14797 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)O 240690a_100000210545_100000037433 [0,2,0,0,0,0|2,0,0]=4 14798 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1F)O 527a_100000210545_100000037433 [0,2,0,0,0,0|2,0,0]=4 14799 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Br 11a_100000210545_100000688019 [0,2,0,0,0,0|2,0,0]=4 14800 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Br 1626a_100000210545_100000688019 [0,2,0,0,0,0|2,0,0]=4 14801 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Br 240690a_100000210545_100000688019 [0,2,0,0,0,0|2,0,0]=4 14802 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Br 527a_100000210545_100000688019 [0,2,0,0,0,0|2,0,0]=4 14803 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Cl 11a_100000210545_100010176784 [0,2,0,0,0,0|2,0,0]=4 14804 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Cl 1626a_100000210545_100010176784 [0,2,0,0,0,0|2,0,0]=4 14805 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Cl 240690a_100000210545_100010176784 [0,2,0,0,0,0|2,0,0]=4 14806 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)Cl 527a_100000210545_100010176784 [0,2,0,0,0,0|2,0,0]=4 14807 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)F 11a_100000210545_100000690930 [0,2,0,0,0,0|2,0,0]=4 14808 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)F 1626a_100000210545_100000690930 [0,2,0,0,0,0|2,0,0]=4 14809 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)F 240690a_100000210545_100000690930 [0,2,0,0,0,0|2,0,0]=4 14810 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)F 527a_100000210545_100000690930 [0,2,0,0,0,0|2,0,0]=4 14811 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1I)O 527a_100000210545_100010084636 [0,2,0,0,0,0|2,0,0]=4 14812 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)Br 240690a_100000210545_100000752940 [0,2,0,0,0,0|1,0,0]=3 14813 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)Br 527a_100000210545_100000752940 [0,2,0,0,0,0|1,0,0]=3 14814 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)Cl 240690a_100000210545_100000742801 [0,2,0,0,0,0|1,0,0]=3 14815 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)Cl 527a_100000210545_100000742801 [0,2,0,0,0,0|1,0,0]=3 14816 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)F 240690a_100000210545_100011217230 [0,2,0,0,0,0|1,0,0]=3 14817 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)F 527a_100000210545_100011217230 [0,2,0,0,0,0|1,0,0]=3 14818 B16R1.11264 CC(C)CCNC(=O)c1cccc(c1O)O 527a_100000210545_100000690420 [0,2,0,0,0,0|1,0,0]=3 14819 B16R1.11264 CC(C)CNNC(=O)c1cccc(c1O)Br 22a_100000696102_100000752940 [0,2,0,0,0,0|2,0,0]=4 14820 B16R1.11264 CC(C)CNNC(=O)c1cccc(c1O)Cl 22a_100000696102_100000742801 [0,2,0,0,0,0|2,0,0]=4 14821 B16R1.11264 CC(C)CNNC(=O)c1cccc(c1O)F 22a_100000696102_100011217230 [0,2,0,0,0,0|2,0,0]=4 14822 B16R1.11264 CC(C)CNNC(=O)c1cccc(c1O)O 22a_100000696102_100000690420 [0,2,0,0,0,0|2,0,0]=4 14823 B16R1.11264 CC(C)OCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000211751 [0,2,0,0,0,0|2,0,0]=4 14824 B16R1.11264 CC(C)OCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000211751 [0,2,0,0,0,0|2,0,0]=4 14825 B16R1.11264 CC(C)OCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000211751 [0,2,0,0,0,0|2,0,0]=4 14826 B16R1.11264 CC(C)OCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000211751 [0,2,0,0,0,0|2,0,0]=4 14827 B16R1.11264 CC(C)SCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000730970 [0,2,0,0,0,0|2,0,0]=4 14828 B16R1.11264 CC(C)SCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000730970 [0,2,0,0,0,0|2,0,0]=4 14829 B16R1.11264 CC(C)SCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000730970 [0,2,0,0,0,0|2,0,0]=4 14830 B16R1.11264 CC(C)SCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000730970 [0,2,0,0,0,0|2,0,0]=4 14831 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000718107 [0,2,0,0,0,0|2,0,0]=4 14832 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000718107 [0,2,0,0,0,0|2,0,0]=4 14833 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Br)F 1458a_100011217547_200000718107 [0,2,0,0,0,0|2,0,0]=4 14834 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Br)I 1458a_100010232522_200000718107 [0,2,0,0,0,0|2,0,0]=4 14835 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Br)O 1458a_100010230362_200000718107 [0,2,0,0,0,0|2,0,0]=4 14836 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000718107 [0,2,0,0,0,0|2,0,0]=4 14837 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000718107 [0,2,0,0,0,0|2,0,0]=4 14838 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000718107 [0,2,0,0,0,0|2,0,0]=4 14839 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000718107 [0,2,0,0,0,0|2,0,0]=4 14840 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000718107 [0,2,0,0,0,0|2,0,0]=4 14841 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1F)Br 1458a_100000756403_200000718107 [0,2,0,0,0,0|2,0,0]=4 14842 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000718107 [0,2,0,0,0,0|2,0,0]=4 14843 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1F)F 1458a_100000748134_200000718107 [0,2,0,0,0,0|2,0,0]=4 14844 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1F)I 1458a_100010185205_200000718107 [0,2,0,0,0,0|2,0,0]=4 14845 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1F)O 1458a_100000037433_200000718107 [0,2,0,0,0,0|2,0,0]=4 14846 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1I)Br 1458a_100000688019_200000718107 [0,2,0,0,0,0|2,0,0]=4 14847 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000718107 [0,2,0,0,0,0|2,0,0]=4 14848 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1I)F 1458a_100000690930_200000718107 [0,2,0,0,0,0|2,0,0]=4 14849 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1I)O 1458a_100010084636_200000718107 [0,2,0,0,0,0|2,0,0]=4 14850 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_200000718107 [0,2,0,0,0,0|1,0,0]=3 14851 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000718107 [0,2,0,0,0,0|1,0,0]=3 14852 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_200000718107 [0,2,0,0,0,0|1,0,0]=3 14853 B16R1.11264 CC(O)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_200000718107 [0,2,0,0,0,0|1,0,0]=3 14854 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)Br 240690a_200000755665_100012360534 [0,2,0,0,0,0|2,0,0]=4 14855 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)Br 527a_200000755665_100012360534 [0,2,0,0,0,0|2,0,0]=4 14856 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)Cl 240690a_200000755665_100012339722 [0,2,0,0,0,0|2,0,0]=4 14857 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)Cl 527a_200000755665_100012339722 [0,2,0,0,0,0|2,0,0]=4 14858 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)F 240690a_200000755665_100011217547 [0,2,0,0,0,0|2,0,0]=4 14859 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)F 527a_200000755665_100011217547 [0,2,0,0,0,0|2,0,0]=4 14860 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)I 240690a_200000755665_100010232522 [0,2,0,0,0,0|2,0,0]=4 14861 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)I 527a_200000755665_100010232522 [0,2,0,0,0,0|2,0,0]=4 14862 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)O 240690a_200000755665_100010230362 [0,2,0,0,0,0|2,0,0]=4 14863 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Br)O 527a_200000755665_100010230362 [0,2,0,0,0,0|2,0,0]=4 14864 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)Br 240690a_200000755665_100000760540 [0,2,0,0,0,0|2,0,0]=4 14865 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)Br 527a_200000755665_100000760540 [0,2,0,0,0,0|2,0,0]=4 14866 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)Cl 240690a_200000755665_100000183631 [0,2,0,0,0,0|2,0,0]=4 14867 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)Cl 527a_200000755665_100000183631 [0,2,0,0,0,0|2,0,0]=4 14868 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)F 240690a_200000755665_100000759904 [0,2,0,0,0,0|2,0,0]=4 14869 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)F 527a_200000755665_100000759904 [0,2,0,0,0,0|2,0,0]=4 14870 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)I 240690a_200000755665_100010176783 [0,2,0,0,0,0|2,0,0]=4 14871 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)I 527a_200000755665_100010176783 [0,2,0,0,0,0|2,0,0]=4 14872 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)O 240690a_200000755665_100000092362 [0,2,0,0,0,0|2,0,0]=4 14873 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1Cl)O 527a_200000755665_100000092362 [0,2,0,0,0,0|2,0,0]=4 14874 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)Br 240690a_200000755665_100000756403 [0,2,0,0,0,0|2,0,0]=4 14875 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)Br 527a_200000755665_100000756403 [0,2,0,0,0,0|2,0,0]=4 14876 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)Cl 240690a_200000755665_100000688816 [0,2,0,0,0,0|2,0,0]=4 14877 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)Cl 527a_200000755665_100000688816 [0,2,0,0,0,0|2,0,0]=4 14878 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)F 240690a_200000755665_100000748134 [0,2,0,0,0,0|2,0,0]=4 14879 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)F 527a_200000755665_100000748134 [0,2,0,0,0,0|2,0,0]=4 14880 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)I 240690a_200000755665_100010185205 [0,2,0,0,0,0|2,0,0]=4 14881 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)I 527a_200000755665_100010185205 [0,2,0,0,0,0|2,0,0]=4 14882 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)O 240690a_200000755665_100000037433 [0,2,0,0,0,0|2,0,0]=4 14883 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1F)O 527a_200000755665_100000037433 [0,2,0,0,0,0|2,0,0]=4 14884 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)Br 240690a_200000755665_100000688019 [0,2,0,0,0,0|2,0,0]=4 14885 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)Br 527a_200000755665_100000688019 [0,2,0,0,0,0|2,0,0]=4 14886 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)Cl 240690a_200000755665_100010176784 [0,2,0,0,0,0|2,0,0]=4 14887 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)Cl 527a_200000755665_100010176784 [0,2,0,0,0,0|2,0,0]=4 14888 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)F 240690a_200000755665_100000690930 [0,2,0,0,0,0|2,0,0]=4 14889 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)F 527a_200000755665_100000690930 [0,2,0,0,0,0|2,0,0]=4 14890 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1I)O 527a_200000755665_100010084636 [0,2,0,0,0,0|2,0,0]=4 14891 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Br 240690a_200000755665_100000752940 [0,2,0,0,0,0|1,0,0]=3 14892 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Br 527a_200000755665_100000752940 [0,2,0,0,0,0|1,0,0]=3 14893 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Cl 240690a_200000755665_100000742801 [0,2,0,0,0,0|1,0,0]=3 14894 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)Cl 527a_200000755665_100000742801 [0,2,0,0,0,0|1,0,0]=3 14895 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)F 240690a_200000755665_100011217230 [0,2,0,0,0,0|1,0,0]=3 14896 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)F 527a_200000755665_100011217230 [0,2,0,0,0,0|1,0,0]=3 14897 B16R1.11264 CC(O)CCNC(=O)c1cccc(c1O)O 527a_200000755665_100000690420 [0,2,0,0,0,0|1,0,0]=3 14898 B16R1.11264 CC(O)CNNC(=O)c1cccc(c1O)Br 22a_200000730056_100000752940 [0,2,0,0,0,0|2,0,0]=4 14899 B16R1.11264 CC(O)CNNC(=O)c1cccc(c1O)Cl 22a_200000730056_100000742801 [0,2,0,0,0,0|2,0,0]=4 14900 B16R1.11264 CC(O)CNNC(=O)c1cccc(c1O)F 22a_200000730056_100011217230 [0,2,0,0,0,0|2,0,0]=4 14901 B16R1.11264 CC(O)CNNC(=O)c1cccc(c1O)O 22a_200000730056_100000690420 [0,2,0,0,0,0|2,0,0]=4 14902 B16R1.11264 CN(C)CCCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000695564 [0,2,0,0,0,0|2,0,0]=4 14903 B16R1.11264 CN(C)CCCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000695564 [0,2,0,0,0,0|2,0,0]=4 14904 B16R1.11264 CN(C)CCCC(=O)c1cccc(c1O)F 1458a_100011217230_100000695564 [0,2,0,0,0,0|2,0,0]=4 14905 B16R1.11264 CN(C)CCCC(=O)c1cccc(c1O)O 1458a_100000690420_100000695564 [0,2,0,0,0,0|2,0,0]=4 14906 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)Br 240690a_100000210585_100000752940 [0,2,0,0,0,0|2,0,0]=4 14907 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)Br 527a_100000210585_100000752940 [0,2,0,0,0,0|2,0,0]=4 14908 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)Cl 240690a_100000210585_100000742801 [0,2,0,0,0,0|2,0,0]=4 14909 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)Cl 527a_100000210585_100000742801 [0,2,0,0,0,0|2,0,0]=4 14910 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)F 240690a_100000210585_100011217230 [0,2,0,0,0,0|2,0,0]=4 14911 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)F 527a_100000210585_100011217230 [0,2,0,0,0,0|2,0,0]=4 14912 B16R1.11264 CN(C)CCNC(=O)c1cccc(c1O)O 527a_100000210585_100000690420 [0,2,0,0,0,0|2,0,0]=4 14913 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)C)Br 1458a_100000760464_100011214892 [0,2,0,0,0,0|2,0,0]=4 14914 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)C)Cl 1458a_100000690184_100011214892 [0,2,0,0,0,0|2,0,0]=4 14915 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)C)F 1458a_100011218272_100011214892 [0,2,0,0,0,0|2,0,0]=4 14916 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)C)I 1458a_100000751865_100011214892 [0,2,0,0,0,0|2,0,0]=4 14917 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)C)O 1458a_100000766327_100011214892 [0,2,0,0,0,0|2,0,0]=4 14918 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)O)Br 1458a_100000760464_200000718107 [0,2,0,0,0,0|2,0,0]=4 14919 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)O)Cl 1458a_100000690184_200000718107 [0,2,0,0,0,0|2,0,0]=4 14920 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)O)F 1458a_100011218272_200000718107 [0,2,0,0,0,0|2,0,0]=4 14921 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)O)I 1458a_100000751865_200000718107 [0,2,0,0,0,0|2,0,0]=4 14922 B16R1.11264 Cc1c(cccc1C(=O)CCCC(C)O)O 1458a_100000766327_200000718107 [0,2,0,0,0,0|2,0,0]=4 14923 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Br 11a_100000210545_100000760464 [0,2,0,0,0,0|2,0,0]=4 14924 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Br 1626a_100000210545_100000760464 [0,2,0,0,0,0|2,0,0]=4 14925 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Br 240690a_100000210545_100000760464 [0,2,0,0,0,0|2,0,0]=4 14926 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Br 527a_100000210545_100000760464 [0,2,0,0,0,0|2,0,0]=4 14927 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Cl 11a_100000210545_100000690184 [0,2,0,0,0,0|2,0,0]=4 14928 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000690184 [0,2,0,0,0,0|2,0,0]=4 14929 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000690184 [0,2,0,0,0,0|2,0,0]=4 14930 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)Cl 527a_100000210545_100000690184 [0,2,0,0,0,0|2,0,0]=4 14931 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)F 11a_100000210545_100011218272 [0,2,0,0,0,0|2,0,0]=4 14932 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)F 1626a_100000210545_100011218272 [0,2,0,0,0,0|2,0,0]=4 14933 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)F 240690a_100000210545_100011218272 [0,2,0,0,0,0|2,0,0]=4 14934 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)F 527a_100000210545_100011218272 [0,2,0,0,0,0|2,0,0]=4 14935 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)I 11a_100000210545_100000751865 [0,2,0,0,0,0|2,0,0]=4 14936 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)I 1626a_100000210545_100000751865 [0,2,0,0,0,0|2,0,0]=4 14937 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)I 240690a_100000210545_100000751865 [0,2,0,0,0,0|2,0,0]=4 14938 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)I 527a_100000210545_100000751865 [0,2,0,0,0,0|2,0,0]=4 14939 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)O 240690a_100000210545_100000766327 [0,2,0,0,0,0|2,0,0]=4 14940 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)C)O 527a_100000210545_100000766327 [0,2,0,0,0,0|2,0,0]=4 14941 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)Br 240690a_200000755665_100000760464 [0,2,0,0,0,0|2,0,0]=4 14942 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)Br 527a_200000755665_100000760464 [0,2,0,0,0,0|2,0,0]=4 14943 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)Cl 240690a_200000755665_100000690184 [0,2,0,0,0,0|2,0,0]=4 14944 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)Cl 527a_200000755665_100000690184 [0,2,0,0,0,0|2,0,0]=4 14945 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)F 240690a_200000755665_100011218272 [0,2,0,0,0,0|2,0,0]=4 14946 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)F 527a_200000755665_100011218272 [0,2,0,0,0,0|2,0,0]=4 14947 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)I 240690a_200000755665_100000751865 [0,2,0,0,0,0|2,0,0]=4 14948 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)I 527a_200000755665_100000751865 [0,2,0,0,0,0|2,0,0]=4 14949 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)O 240690a_200000755665_100000766327 [0,2,0,0,0,0|2,0,0]=4 14950 B16R1.11264 Cc1c(cccc1C(=O)NCCC(C)O)O 527a_200000755665_100000766327 [0,2,0,0,0,0|2,0,0]=4 14951 B16R1.11264 Cc1cccc(c1Br)C(=O)CCCC(C)C 1458a_100000692419_100011214892 [0,2,0,0,0,0|2,0,0]=4 14952 B16R1.11264 Cc1cccc(c1Br)C(=O)CCCC(C)O 1458a_100000692419_200000718107 [0,2,0,0,0,0|2,0,0]=4 14953 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(C)C 11a_100000210545_100000692419 [0,2,0,0,0,0|2,0,0]=4 14954 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(C)C 1626a_100000210545_100000692419 [0,2,0,0,0,0|2,0,0]=4 14955 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(C)C 240690a_100000210545_100000692419 [0,2,0,0,0,0|2,0,0]=4 14956 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(C)C 527a_100000210545_100000692419 [0,2,0,0,0,0|2,0,0]=4 14957 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(C)O 240690a_200000755665_100000692419 [0,2,0,0,0,0|2,0,0]=4 14958 B16R1.11264 Cc1cccc(c1Br)C(=O)NCCC(C)O 527a_200000755665_100000692419 [0,2,0,0,0,0|2,0,0]=4 14959 B16R1.11264 Cc1cccc(c1C)C(=O)CCCC(C)C 1458a_100000183679_100011214892 [0,2,0,0,0,0|2,0,0]=4 14960 B16R1.11264 Cc1cccc(c1C)C(=O)CCCC(C)O 1458a_100000183679_200000718107 [0,2,0,0,0,0|2,0,0]=4 14961 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(C)C 11a_100000210545_100000183679 [0,2,0,0,0,0|2,0,0]=4 14962 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(C)C 1626a_100000210545_100000183679 [0,2,0,0,0,0|2,0,0]=4 14963 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(C)C 240690a_100000210545_100000183679 [0,2,0,0,0,0|2,0,0]=4 14964 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(C)C 527a_100000210545_100000183679 [0,2,0,0,0,0|2,0,0]=4 14965 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(C)O 240690a_200000755665_100000183679 [0,2,0,0,0,0|2,0,0]=4 14966 B16R1.11264 Cc1cccc(c1C)C(=O)NCCC(C)O 527a_200000755665_100000183679 [0,2,0,0,0,0|2,0,0]=4 14967 B16R1.11264 Cc1cccc(c1Cl)C(=O)CCCC(C)C 1458a_100000693142_100011214892 [0,2,0,0,0,0|2,0,0]=4 14968 B16R1.11264 Cc1cccc(c1Cl)C(=O)CCCC(C)O 1458a_100000693142_200000718107 [0,2,0,0,0,0|2,0,0]=4 14969 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(C)C 11a_100000210545_100000693142 [0,2,0,0,0,0|2,0,0]=4 14970 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(C)C 1626a_100000210545_100000693142 [0,2,0,0,0,0|2,0,0]=4 14971 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(C)C 240690a_100000210545_100000693142 [0,2,0,0,0,0|2,0,0]=4 14972 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(C)C 527a_100000210545_100000693142 [0,2,0,0,0,0|2,0,0]=4 14973 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(C)O 240690a_200000755665_100000693142 [0,2,0,0,0,0|2,0,0]=4 14974 B16R1.11264 Cc1cccc(c1Cl)C(=O)NCCC(C)O 527a_200000755665_100000693142 [0,2,0,0,0,0|2,0,0]=4 14975 B16R1.11264 Cc1cccc(c1F)C(=O)CCCC(C)C 1458a_100000766181_100011214892 [0,2,0,0,0,0|2,0,0]=4 14976 B16R1.11264 Cc1cccc(c1F)C(=O)CCCC(C)O 1458a_100000766181_200000718107 [0,2,0,0,0,0|2,0,0]=4 14977 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(C)C 11a_100000210545_100000766181 [0,2,0,0,0,0|2,0,0]=4 14978 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(C)C 1626a_100000210545_100000766181 [0,2,0,0,0,0|2,0,0]=4 14979 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(C)C 240690a_100000210545_100000766181 [0,2,0,0,0,0|2,0,0]=4 14980 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(C)C 527a_100000210545_100000766181 [0,2,0,0,0,0|2,0,0]=4 14981 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(C)O 240690a_200000755665_100000766181 [0,2,0,0,0,0|2,0,0]=4 14982 B16R1.11264 Cc1cccc(c1F)C(=O)NCCC(C)O 527a_200000755665_100000766181 [0,2,0,0,0,0|2,0,0]=4 14983 B16R1.11264 Cc1cccc(c1I)C(=O)CCCC(C)C 1458a_100000739377_100011214892 [0,2,0,0,0,0|2,0,0]=4 14984 B16R1.11264 Cc1cccc(c1I)C(=O)CCCC(C)O 1458a_100000739377_200000718107 [0,2,0,0,0,0|2,0,0]=4 14985 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(C)C 11a_100000210545_100000739377 [0,2,0,0,0,0|2,0,0]=4 14986 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(C)C 1626a_100000210545_100000739377 [0,2,0,0,0,0|2,0,0]=4 14987 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(C)C 240690a_100000210545_100000739377 [0,2,0,0,0,0|2,0,0]=4 14988 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(C)C 527a_100000210545_100000739377 [0,2,0,0,0,0|2,0,0]=4 14989 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(C)O 240690a_200000755665_100000739377 [0,2,0,0,0,0|2,0,0]=4 14990 B16R1.11264 Cc1cccc(c1I)C(=O)NCCC(C)O 527a_200000755665_100000739377 [0,2,0,0,0,0|2,0,0]=4 14991 B16R1.11264 Cc1cccc(c1O)C(=O)CCCC(C)C 1458a_100000183896_100011214892 [0,2,0,0,0,0|1,0,0]=3 14992 B16R1.11264 Cc1cccc(c1O)C(=O)CCCC(C)O 1458a_100000183896_200000718107 [0,2,0,0,0,0|1,0,0]=3 14993 B16R1.11264 Cc1cccc(c1O)C(=O)CCCN(C)C 1458a_100000183896_100000695564 [0,2,0,0,0,0|2,0,0]=4 14994 B16R1.11264 Cc1cccc(c1O)C(=O)CCOC(C)C 1458a_100000183896_100000211751 [0,2,0,0,0,0|2,0,0]=4 14995 B16R1.11264 Cc1cccc(c1O)C(=O)CCSC(C)C 1458a_100000183896_100000730970 [0,2,0,0,0,0|2,0,0]=4 14996 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(C)C 240690a_100000210545_100000183896 [0,2,0,0,0,0|1,0,0]=3 14997 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(C)C 527a_100000210545_100000183896 [0,2,0,0,0,0|1,0,0]=3 14998 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(C)O 240690a_200000755665_100000183896 [0,2,0,0,0,0|1,0,0]=3 14999 B16R1.11264 Cc1cccc(c1O)C(=O)NCCC(C)O 527a_200000755665_100000183896 [0,2,0,0,0,0|1,0,0]=3 15000 B16R1.11264 Cc1cccc(c1O)C(=O)NCCN(C)C 240690a_100000210585_100000183896 [0,2,0,0,0,0|2,0,0]=4 15001 B16R1.11264 Cc1cccc(c1O)C(=O)NCCN(C)C 527a_100000210585_100000183896 [0,2,0,0,0,0|2,0,0]=4 15002 B16R1.11264 Cc1cccc(c1O)C(=O)NNCC(C)C 22a_100000696102_100000183896 [0,2,0,0,0,0|2,0,0]=4 15003 B16R1.11264 Cc1cccc(c1O)C(=O)NNCC(C)O 22a_200000730056_100000183896 [0,2,0,0,0,0|2,0,0]=4 15004 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_100000210326 [0,2,0,0,0,0|2,0,0]=4 15005 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_100000210326 [0,2,0,0,0,0|2,0,0]=4 15006 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_100000210326 [0,2,0,0,0,0|2,0,0]=4 15007 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_100000210326 [0,2,0,0,0,0|2,0,0]=4 15008 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_100000210326 [0,2,0,0,0,0|2,0,0]=4 15009 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_100000210326 [0,2,0,0,0,0|2,0,0]=4 15010 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_100000210326 [0,2,0,0,0,0|2,0,0]=4 15011 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_100000210326 [0,2,0,0,0,0|2,0,0]=4 15012 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_100000210326 [0,2,0,0,0,0|2,0,0]=4 15013 B16R1.21863 CCCCCC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_100000210326 [0,2,0,0,0,0|2,0,0]=4 15014 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_100000210326 [0,2,0,0,0,0|2,0,0]=4 15015 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_100000210326 [0,2,0,0,0,0|2,0,0]=4 15016 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_100000210326 [0,2,0,0,0,0|2,0,0]=4 15017 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_100000210326 [0,2,0,0,0,0|2,0,0]=4 15018 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_100000210326 [0,2,0,0,0,0|2,0,0]=4 15019 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_100000210326 [0,2,0,0,0,0|2,0,0]=4 15020 B16R1.21863 CCCCCC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_100000210326 [0,2,0,0,0,0|2,0,0]=4 15021 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_100000210326 [0,2,0,0,0,0|2,0,0]=4 15022 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_100000210326 [0,2,0,0,0,0|2,0,0]=4 15023 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_100000210326 [0,2,0,0,0,0|2,0,0]=4 15024 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_100000210326 [0,2,0,0,0,0|2,0,0]=4 15025 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_100000210326 [0,2,0,0,0,0|2,0,0]=4 15026 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_100000210326 [0,2,0,0,0,0|2,0,0]=4 15027 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_100000210326 [0,2,0,0,0,0|2,0,0]=4 15028 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_100000210326 [0,2,0,0,0,0|2,0,0]=4 15029 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_100000210326 [0,2,0,0,0,0|2,0,0]=4 15030 B16R1.21863 CCCCCC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_100000210326 [0,2,0,0,0,0|2,0,0]=4 15031 B16R1.21863 CCCCCC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_100000210326 [0,2,0,0,0,0|2,0,0]=4 15032 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000210326 [0,2,0,0,0,0|1,0,0]=3 15033 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000210326 [0,2,0,0,0,0|1,0,0]=3 15034 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000210326 [0,2,0,0,0,0|1,0,0]=3 15035 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000210326 [0,2,0,0,0,0|1,0,0]=3 15036 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000210326 [0,2,0,0,0,0|1,0,0]=3 15037 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000210326 [0,2,0,0,0,0|1,0,0]=3 15038 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000210326 [0,2,0,0,0,0|1,0,0]=3 15039 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210326 [0,2,0,0,0,0|1,0,0]=3 15040 B16R1.21863 CCCCCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210326 [0,2,0,0,0,0|1,0,0]=3 15041 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)Br)C 11a_100000102301_200012920551 [0,2,0,0,0,0|2,0,0]=4 15042 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)Br)C 1626a_100000102301_200012920551 [0,2,0,0,0,0|2,0,0]=4 15043 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)Br)C 240690a_100000102301_200012920551 [0,2,0,0,0,0|2,0,0]=4 15044 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)Br)C 527a_100000102301_200012920551 [0,2,0,0,0,0|2,0,0]=4 15045 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)C)C 11a_100000102301_200000701928 [0,2,0,0,0,0|2,0,0]=4 15046 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)C)C 1626a_100000102301_200000701928 [0,2,0,0,0,0|2,0,0]=4 15047 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)C)C 240690a_100000102301_200000701928 [0,2,0,0,0,0|2,0,0]=4 15048 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)C)C 527a_100000102301_200000701928 [0,2,0,0,0,0|2,0,0]=4 15049 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)F)F 11a_100000102301_100010209673 [0,2,0,0,0,0|2,0,0]=4 15050 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)F)F 1626a_100000102301_100010209673 [0,2,0,0,0,0|2,0,0]=4 15051 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)F)F 240690a_100000102301_100010209673 [0,2,0,0,0,0|2,0,0]=4 15052 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Br)F)F 527a_100000102301_100010209673 [0,2,0,0,0,0|2,0,0]=4 15053 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)Br 11a_100000102301_100012356187 [0,2,0,0,0,0|2,0,0]=4 15054 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)Br 240690a_100000102301_100012356187 [0,2,0,0,0,0|2,0,0]=4 15055 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)Br 527a_100000102301_100012356187 [0,2,0,0,0,0|2,0,0]=4 15056 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)F 11a_100000102301_100012347597 [0,2,0,0,0,0|2,0,0]=4 15057 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)F 1626a_100000102301_100012347597 [0,2,0,0,0,0|2,0,0]=4 15058 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)F 240690a_100000102301_100012347597 [0,2,0,0,0,0|2,0,0]=4 15059 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Br)F 527a_100000102301_100012347597 [0,2,0,0,0,0|2,0,0]=4 15060 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)C)Br 11a_100000102301_100012920495 [0,2,0,0,0,0|2,0,0]=4 15061 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)C)Br 1626a_100000102301_100012920495 [0,2,0,0,0,0|2,0,0]=4 15062 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)C)Br 240690a_100000102301_100012920495 [0,2,0,0,0,0|2,0,0]=4 15063 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)C)Br 527a_100000102301_100012920495 [0,2,0,0,0,0|2,0,0]=4 15064 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)Br 11a_100000102301_100012921640 [0,2,0,0,0,0|2,0,0]=4 15065 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)Br 1626a_100000102301_100012921640 [0,2,0,0,0,0|2,0,0]=4 15066 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)Br 240690a_100000102301_100012921640 [0,2,0,0,0,0|2,0,0]=4 15067 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)Br 527a_100000102301_100012921640 [0,2,0,0,0,0|2,0,0]=4 15068 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)F 11a_100000102301_100012177191 [0,2,0,0,0,0|2,0,0]=4 15069 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)F 1626a_100000102301_100012177191 [0,2,0,0,0,0|2,0,0]=4 15070 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)F 240690a_100000102301_100012177191 [0,2,0,0,0,0|2,0,0]=4 15071 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)Cl)F 527a_100000102301_100012177191 [0,2,0,0,0,0|2,0,0]=4 15072 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)F)Br 11a_100000102301_100010768523 [0,2,0,0,0,0|2,0,0]=4 15073 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)F)Br 1626a_100000102301_100010768523 [0,2,0,0,0,0|2,0,0]=4 15074 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)F)Br 240690a_100000102301_100010768523 [0,2,0,0,0,0|2,0,0]=4 15075 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)F)Br 527a_100000102301_100010768523 [0,2,0,0,0,0|2,0,0]=4 15076 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)O)Br 240690a_100000102301_100011101721 [0,2,0,0,0,0|2,0,0]=4 15077 B16R1.21863 CCCCNC(=O)c1cc(cc(c1C)O)Br 527a_100000102301_100011101721 [0,2,0,0,0,0|2,0,0]=4 15078 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)Cl 11a_100000102301_200012920481 [0,2,0,0,0,0|2,0,0]=4 15079 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)Cl 1626a_100000102301_200012920481 [0,2,0,0,0,0|2,0,0]=4 15080 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)Cl 240690a_100000102301_200012920481 [0,2,0,0,0,0|2,0,0]=4 15081 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)Cl 527a_100000102301_200012920481 [0,2,0,0,0,0|2,0,0]=4 15082 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)F 11a_100000102301_100011105905 [0,2,0,0,0,0|2,0,0]=4 15083 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)F 1626a_100000102301_100011105905 [0,2,0,0,0,0|2,0,0]=4 15084 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)F 240690a_100000102301_100011105905 [0,2,0,0,0,0|2,0,0]=4 15085 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Br)F 527a_100000102301_100011105905 [0,2,0,0,0,0|2,0,0]=4 15086 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)C)F 11a_100000102301_200010768536 [0,2,0,0,0,0|2,0,0]=4 15087 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)C)F 1626a_100000102301_200010768536 [0,2,0,0,0,0|2,0,0]=4 15088 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)C)F 240690a_100000102301_200010768536 [0,2,0,0,0,0|2,0,0]=4 15089 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)C)F 527a_100000102301_200010768536 [0,2,0,0,0,0|2,0,0]=4 15090 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)Cl 11a_100000102301_100011215521 [0,2,0,0,0,0|2,0,0]=4 15091 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)Cl 1626a_100000102301_100011215521 [0,2,0,0,0,0|2,0,0]=4 15092 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)Cl 240690a_100000102301_100011215521 [0,2,0,0,0,0|2,0,0]=4 15093 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)Cl 527a_100000102301_100011215521 [0,2,0,0,0,0|2,0,0]=4 15094 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)F 11a_100000102301_200010244589 [0,2,0,0,0,0|2,0,0]=4 15095 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)F 1626a_100000102301_200010244589 [0,2,0,0,0,0|2,0,0]=4 15096 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)F 240690a_100000102301_200010244589 [0,2,0,0,0,0|2,0,0]=4 15097 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)Cl)F 527a_100000102301_200010244589 [0,2,0,0,0,0|2,0,0]=4 15098 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)Cl 11a_100000102301_200012352169 [0,2,0,0,0,0|2,0,0]=4 15099 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)Cl 1626a_100000102301_200012352169 [0,2,0,0,0,0|2,0,0]=4 15100 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)Cl 240690a_100000102301_200012352169 [0,2,0,0,0,0|2,0,0]=4 15101 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)Cl 527a_100000102301_200012352169 [0,2,0,0,0,0|2,0,0]=4 15102 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)F 11a_100000102301_100009888511 [0,2,0,0,0,0|2,0,0]=4 15103 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)F 1626a_100000102301_100009888511 [0,2,0,0,0,0|2,0,0]=4 15104 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)F 240690a_100000102301_100009888511 [0,2,0,0,0,0|2,0,0]=4 15105 B16R1.21863 CCCCNC(=O)c1cc(cc(c1Cl)F)F 527a_100000102301_100009888511 [0,2,0,0,0,0|2,0,0]=4 15106 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)C 11a_100000102301_100009996753 [0,2,0,0,0,0|2,0,0]=4 15107 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)C 1626a_100000102301_100009996753 [0,2,0,0,0,0|2,0,0]=4 15108 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)C 240690a_100000102301_100009996753 [0,2,0,0,0,0|2,0,0]=4 15109 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)C 527a_100000102301_100009996753 [0,2,0,0,0,0|2,0,0]=4 15110 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)Cl 11a_100000102301_100000720295 [0,2,0,0,0,0|2,0,0]=4 15111 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)Cl 1626a_100000102301_100000720295 [0,2,0,0,0,0|2,0,0]=4 15112 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)Cl 240690a_100000102301_100000720295 [0,2,0,0,0,0|2,0,0]=4 15113 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)Cl 527a_100000102301_100000720295 [0,2,0,0,0,0|2,0,0]=4 15114 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)F 11a_100000102301_100012920464 [0,2,0,0,0,0|2,0,0]=4 15115 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)F 1626a_100000102301_100012920464 [0,2,0,0,0,0|2,0,0]=4 15116 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)F 240690a_100000102301_100012920464 [0,2,0,0,0,0|2,0,0]=4 15117 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Br)F 527a_100000102301_100012920464 [0,2,0,0,0,0|2,0,0]=4 15118 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)C)Br 11a_100000102301_100012928937 [0,2,0,0,0,0|2,0,0]=4 15119 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)C)Br 1626a_100000102301_100012928937 [0,2,0,0,0,0|2,0,0]=4 15120 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)C)Br 240690a_100000102301_100012928937 [0,2,0,0,0,0|2,0,0]=4 15121 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Cl)Br 11a_100000102301_100012920557 [0,2,0,0,0,0|2,0,0]=4 15122 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Cl)Br 1626a_100000102301_100012920557 [0,2,0,0,0,0|2,0,0]=4 15123 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Cl)Br 240690a_100000102301_100012920557 [0,2,0,0,0,0|2,0,0]=4 15124 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Cl)I 11a_100000102301_100012920558 [0,2,0,0,0,0|2,0,0]=4 15125 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Cl)I 1626a_100000102301_100012920558 [0,2,0,0,0,0|2,0,0]=4 15126 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)Cl)I 240690a_100000102301_100012920558 [0,2,0,0,0,0|2,0,0]=4 15127 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)Br 11a_100000102301_100012349847 [0,2,0,0,0,0|2,0,0]=4 15128 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)Br 1626a_100000102301_100012349847 [0,2,0,0,0,0|2,0,0]=4 15129 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)Br 240690a_100000102301_100012349847 [0,2,0,0,0,0|2,0,0]=4 15130 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)Br 527a_100000102301_100012349847 [0,2,0,0,0,0|2,0,0]=4 15131 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)C 11a_100000102301_100000094381 [0,2,0,0,0,0|2,0,0]=4 15132 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)C 1626a_100000102301_100000094381 [0,2,0,0,0,0|2,0,0]=4 15133 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)C 240690a_100000102301_100000094381 [0,2,0,0,0,0|2,0,0]=4 15134 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)C 527a_100000102301_100000094381 [0,2,0,0,0,0|2,0,0]=4 15135 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)F 11a_100000102301_100011217470 [0,2,0,0,0,0|2,0,0]=4 15136 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)F 1626a_100000102301_100011217470 [0,2,0,0,0,0|2,0,0]=4 15137 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)F 240690a_100000102301_100011217470 [0,2,0,0,0,0|2,0,0]=4 15138 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)F 527a_100000102301_100011217470 [0,2,0,0,0,0|2,0,0]=4 15139 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)I 11a_100000102301_100012344719 [0,2,0,0,0,0|2,0,0]=4 15140 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)I 1626a_100000102301_100012344719 [0,2,0,0,0,0|2,0,0]=4 15141 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)I 240690a_100000102301_100012344719 [0,2,0,0,0,0|2,0,0]=4 15142 B16R1.21863 CCCCNC(=O)c1cc(cc(c1F)F)I 527a_100000102301_100012344719 [0,2,0,0,0,0|2,0,0]=4 15143 B16R1.21863 CCCCNC(=O)c1cc(cc(c1I)I)I 11a_100000102301_100000211575 [0,2,0,0,0,0|2,0,0]=4 15144 B16R1.21863 CCCCNC(=O)c1cc(cc(c1I)I)I 1626a_100000102301_100000211575 [0,2,0,0,0,0|2,0,0]=4 15145 B16R1.21863 CCCCNC(=O)c1cc(cc(c1I)I)I 240690a_100000102301_100000211575 [0,2,0,0,0,0|2,0,0]=4 15146 B16R1.21863 CCCCNC(=O)c1cc(cc(c1I)I)I 527a_100000102301_100000211575 [0,2,0,0,0,0|2,0,0]=4 15147 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)Br)Br 240690a_100000102301_100000212120 [0,2,0,0,0,0|1,0,0]=3 15148 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)Br)Br 527a_100000102301_100000212120 [0,2,0,0,0,0|1,0,0]=3 15149 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100000102301_100000765379 [0,2,0,0,0,0|1,0,0]=3 15150 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)Br)Cl 527a_100000102301_100000765379 [0,2,0,0,0,0|1,0,0]=3 15151 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)C)Br 240690a_100000102301_100011825902 [0,2,0,0,0,0|1,0,0]=3 15152 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)C)Cl 240690a_100000102301_100011255218 [0,2,0,0,0,0|1,0,0]=3 15153 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)C)Cl 527a_100000102301_100011255218 [0,2,0,0,0,0|1,0,0]=3 15154 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100000102301_100000215963 [0,2,0,0,0,0|1,0,0]=3 15155 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100000102301_100000215963 [0,2,0,0,0,0|1,0,0]=3 15156 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)F)Br 240690a_100000102301_100011255233 [0,2,0,0,0,0|1,0,0]=3 15157 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)F)Br 527a_100000102301_100011255233 [0,2,0,0,0,0|1,0,0]=3 15158 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)F)F 240690a_100000102301_100011255242 [0,2,0,0,0,0|1,0,0]=3 15159 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)F)F 527a_100000102301_100011255242 [0,2,0,0,0,0|1,0,0]=3 15160 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)I)I 1626a_100000102301_100000748652 [0,2,0,0,0,0|1,0,0]=3 15161 B16R1.21863 CCCCNC(=O)c1cc(cc(c1O)I)I 240690a_100000102301_100000748652 [0,2,0,0,0,0|1,0,0]=3 15162 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)Br)Br 22a_100000740057_100000212120 [0,2,0,0,0,0|2,0,0]=4 15163 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)Br)Cl 22a_100000740057_100000765379 [0,2,0,0,0,0|2,0,0]=4 15164 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)C)Br 22a_100000740057_100011825902 [0,2,0,0,0,0|2,0,0]=4 15165 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)C)Cl 22a_100000740057_100011255218 [0,2,0,0,0,0|2,0,0]=4 15166 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)Cl)Cl 22a_100000740057_100000215963 [0,2,0,0,0,0|2,0,0]=4 15167 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)F)Br 22a_100000740057_100011255233 [0,2,0,0,0,0|2,0,0]=4 15168 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)F)F 22a_100000740057_100011255242 [0,2,0,0,0,0|2,0,0]=4 15169 B16R1.21863 CCCNNC(=O)c1cc(cc(c1O)I)I 22a_100000740057_100000748652 [0,2,0,0,0,0|2,0,0]=4 15170 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100011215890 [0,2,0,0,0,0|2,0,0]=4 15171 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100011215890 [0,2,0,0,0,0|2,0,0]=4 15172 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100011215890 [0,2,0,0,0,0|2,0,0]=4 15173 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100011215890 [0,2,0,0,0,0|2,0,0]=4 15174 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100011215890 [0,2,0,0,0,0|2,0,0]=4 15175 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100011215890 [0,2,0,0,0,0|2,0,0]=4 15176 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100011215890 [0,2,0,0,0,0|2,0,0]=4 15177 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100011215890 [0,2,0,0,0,0|2,0,0]=4 15178 B16R1.21863 CCOCCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100011215890 [0,2,0,0,0,0|2,0,0]=4 15179 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000757381 [0,2,0,0,0,0|2,0,0]=4 15180 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000757381 [0,2,0,0,0,0|2,0,0]=4 15181 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000757381 [0,2,0,0,0,0|2,0,0]=4 15182 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000757381 [0,2,0,0,0,0|2,0,0]=4 15183 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000757381 [0,2,0,0,0,0|2,0,0]=4 15184 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000757381 [0,2,0,0,0,0|2,0,0]=4 15185 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000757381 [0,2,0,0,0,0|2,0,0]=4 15186 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000757381 [0,2,0,0,0,0|2,0,0]=4 15187 B16R1.21863 CCSCCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000757381 [0,2,0,0,0,0|2,0,0]=4 15188 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000740836 [0,2,0,0,0,0|2,0,0]=4 15189 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000740836 [0,2,0,0,0,0|2,0,0]=4 15190 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000740836 [0,2,0,0,0,0|2,0,0]=4 15191 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000740836 [0,2,0,0,0,0|2,0,0]=4 15192 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000740836 [0,2,0,0,0,0|2,0,0]=4 15193 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000740836 [0,2,0,0,0,0|2,0,0]=4 15194 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000740836 [0,2,0,0,0,0|2,0,0]=4 15195 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000740836 [0,2,0,0,0,0|2,0,0]=4 15196 B16R1.21863 COCCCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000740836 [0,2,0,0,0,0|2,0,0]=4 15197 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)Br)Br 240690a_100000209980_100000212120 [0,2,0,0,0,0|2,0,0]=4 15198 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)Br)Br 527a_100000209980_100000212120 [0,2,0,0,0,0|2,0,0]=4 15199 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100000209980_100000765379 [0,2,0,0,0,0|2,0,0]=4 15200 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)Br)Cl 527a_100000209980_100000765379 [0,2,0,0,0,0|2,0,0]=4 15201 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)C)Br 240690a_100000209980_100011825902 [0,2,0,0,0,0|2,0,0]=4 15202 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)C)Cl 240690a_100000209980_100011255218 [0,2,0,0,0,0|2,0,0]=4 15203 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)C)Cl 527a_100000209980_100011255218 [0,2,0,0,0,0|2,0,0]=4 15204 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100000209980_100000215963 [0,2,0,0,0,0|2,0,0]=4 15205 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100000209980_100000215963 [0,2,0,0,0,0|2,0,0]=4 15206 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)F)Br 240690a_100000209980_100011255233 [0,2,0,0,0,0|2,0,0]=4 15207 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)F)Br 527a_100000209980_100011255233 [0,2,0,0,0,0|2,0,0]=4 15208 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)F)F 240690a_100000209980_100011255242 [0,2,0,0,0,0|2,0,0]=4 15209 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)F)F 527a_100000209980_100011255242 [0,2,0,0,0,0|2,0,0]=4 15210 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)I)I 1626a_100000209980_100000748652 [0,2,0,0,0,0|2,0,0]=4 15211 B16R1.21863 COCCNC(=O)c1cc(cc(c1O)I)I 240690a_100000209980_100000748652 [0,2,0,0,0,0|2,0,0]=4 15212 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)Br)Br 240690a_100020590264_100000212120 [0,2,0,0,0,0|2,0,0]=4 15213 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)Br)Br 527a_100020590264_100000212120 [0,2,0,0,0,0|2,0,0]=4 15214 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100020590264_100000765379 [0,2,0,0,0,0|2,0,0]=4 15215 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)Br)Cl 527a_100020590264_100000765379 [0,2,0,0,0,0|2,0,0]=4 15216 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)C)Br 240690a_100020590264_100011825902 [0,2,0,0,0,0|2,0,0]=4 15217 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)C)Cl 240690a_100020590264_100011255218 [0,2,0,0,0,0|2,0,0]=4 15218 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)C)Cl 527a_100020590264_100011255218 [0,2,0,0,0,0|2,0,0]=4 15219 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100020590264_100000215963 [0,2,0,0,0,0|2,0,0]=4 15220 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100020590264_100000215963 [0,2,0,0,0,0|2,0,0]=4 15221 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)F)Br 240690a_100020590264_100011255233 [0,2,0,0,0,0|2,0,0]=4 15222 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)F)Br 527a_100020590264_100011255233 [0,2,0,0,0,0|2,0,0]=4 15223 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)F)F 240690a_100020590264_100011255242 [0,2,0,0,0,0|2,0,0]=4 15224 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)F)F 527a_100020590264_100011255242 [0,2,0,0,0,0|2,0,0]=4 15225 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)I)I 1626a_100020590264_100000748652 [0,2,0,0,0,0|2,0,0]=4 15226 B16R1.21863 CSCCNC(=O)c1cc(cc(c1O)I)I 240690a_100020590264_100000748652 [0,2,0,0,0,0|2,0,0]=4 15227 B16R1.21863 Cc1cc(cc(c1O)C(=O)CCCCF)Br 1458a_100011825902_100000729493 [0,2,0,0,0,0|2,0,0]=4 15228 B16R1.21863 Cc1cc(cc(c1O)C(=O)CCCCF)Cl 1458a_100011255218_100000729493 [0,2,0,0,0,0|2,0,0]=4 15229 B16R1.21863 Cc1cc(cc(c1O)C(=O)CCCCO)Br 1458a_100011825902_100000210776 [0,2,0,0,0,0|2,0,0]=4 15230 B16R1.21863 Cc1cc(cc(c1O)C(=O)CCCCO)Cl 1458a_100011255218_100000210776 [0,2,0,0,0,0|2,0,0]=4 15231 B16R1.21863 Cc1cc(cc(c1O)C(=O)NCCCF)Br 240690a_100015189416_100011825902 [0,2,0,0,0,0|2,0,0]=4 15232 B16R1.21863 Cc1cc(cc(c1O)C(=O)NCCCF)Cl 240690a_100015189416_100011255218 [0,2,0,0,0,0|2,0,0]=4 15233 B16R1.21863 Cc1cc(cc(c1O)C(=O)NCCCF)Cl 527a_100015189416_100011255218 [0,2,0,0,0,0|2,0,0]=4 15234 B16R1.21863 Cc1cc(cc(c1O)C(=O)NCCCO)Br 240690a_100000182051_100011825902 [0,2,0,0,0,0|2,0,0]=4 15235 B16R1.21863 Cc1cc(cc(c1O)C(=O)NCCCO)Cl 240690a_100000182051_100011255218 [0,2,0,0,0,0|2,0,0]=4 15236 B16R1.21863 Cc1cc(cc(c1O)C(=O)NCCCO)Cl 527a_100000182051_100011255218 [0,2,0,0,0,0|2,0,0]=4 15237 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000729493 [0,2,0,0,0,0|2,0,0]=4 15238 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000729493 [0,2,0,0,0,0|2,0,0]=4 15239 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000729493 [0,2,0,0,0,0|2,0,0]=4 15240 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)F)Br 1458a_100011255233_100000729493 [0,2,0,0,0,0|2,0,0]=4 15241 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)F)F 1458a_100011255242_100000729493 [0,2,0,0,0,0|2,0,0]=4 15242 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)I)I 1458a_100000748652_100000729493 [0,2,0,0,0,0|2,0,0]=4 15243 B16R1.21863 O=C(CCCCF)c1cc(cc(c1O)O)Br 1458a_200010196872_100000729493 [0,2,0,0,0,0|2,0,0]=4 15244 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000210776 [0,2,0,0,0,0|2,0,0]=4 15245 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000210776 [0,2,0,0,0,0|2,0,0]=4 15246 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000210776 [0,2,0,0,0,0|2,0,0]=4 15247 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)F)Br 1458a_100011255233_100000210776 [0,2,0,0,0,0|2,0,0]=4 15248 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)F)F 1458a_100011255242_100000210776 [0,2,0,0,0,0|2,0,0]=4 15249 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)I)I 1458a_100000748652_100000210776 [0,2,0,0,0,0|2,0,0]=4 15250 B16R1.21863 O=C(CCCCO)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210776 [0,2,0,0,0,0|2,0,0]=4 15251 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)Br)Br 240690a_100015189416_100000212120 [0,2,0,0,0,0|2,0,0]=4 15252 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)Br)Br 527a_100015189416_100000212120 [0,2,0,0,0,0|2,0,0]=4 15253 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)Br)Cl 240690a_100015189416_100000765379 [0,2,0,0,0,0|2,0,0]=4 15254 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)Br)Cl 527a_100015189416_100000765379 [0,2,0,0,0,0|2,0,0]=4 15255 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)Cl)Cl 240690a_100015189416_100000215963 [0,2,0,0,0,0|2,0,0]=4 15256 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)Cl)Cl 527a_100015189416_100000215963 [0,2,0,0,0,0|2,0,0]=4 15257 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)F)Br 240690a_100015189416_100011255233 [0,2,0,0,0,0|2,0,0]=4 15258 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)F)Br 527a_100015189416_100011255233 [0,2,0,0,0,0|2,0,0]=4 15259 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)F)F 240690a_100015189416_100011255242 [0,2,0,0,0,0|2,0,0]=4 15260 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)F)F 527a_100015189416_100011255242 [0,2,0,0,0,0|2,0,0]=4 15261 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)I)I 1626a_100015189416_100000748652 [0,2,0,0,0,0|2,0,0]=4 15262 B16R1.21863 O=C(NCCCF)c1cc(cc(c1O)I)I 240690a_100015189416_100000748652 [0,2,0,0,0,0|2,0,0]=4 15263 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)Br)Br 240690a_100000182051_100000212120 [0,2,0,0,0,0|2,0,0]=4 15264 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)Br)Br 527a_100000182051_100000212120 [0,2,0,0,0,0|2,0,0]=4 15265 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)Br)Cl 240690a_100000182051_100000765379 [0,2,0,0,0,0|2,0,0]=4 15266 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)Br)Cl 527a_100000182051_100000765379 [0,2,0,0,0,0|2,0,0]=4 15267 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)Cl)Cl 240690a_100000182051_100000215963 [0,2,0,0,0,0|2,0,0]=4 15268 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)Cl)Cl 527a_100000182051_100000215963 [0,2,0,0,0,0|2,0,0]=4 15269 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)F)Br 240690a_100000182051_100011255233 [0,2,0,0,0,0|2,0,0]=4 15270 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)F)Br 527a_100000182051_100011255233 [0,2,0,0,0,0|2,0,0]=4 15271 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)F)F 240690a_100000182051_100011255242 [0,2,0,0,0,0|2,0,0]=4 15272 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)F)F 527a_100000182051_100011255242 [0,2,0,0,0,0|2,0,0]=4 15273 B16R1.21863 O=C(NCCCO)c1cc(cc(c1O)I)I 240690a_100000182051_100000748652 [0,2,0,0,0,0|2,0,0]=4 15274 B16R1.1697 C=Cc1ccc(cc1C(=O)NCCCC)F 271570a_100011290941_200000205868 [0,2,0,0,0,0|2,0,0]=4 15275 B16R1.1697 CCCCCC(=O)c1cc(ccc1C#N)F 1458a_100011217471_100000210326 [0,2,0,0,0,0|2,0,0]=4 15276 B16R1.1697 CCCCCC(=O)c1cc(ccc1CC)Br 1458a_100012343961_100000210326 [0,2,0,0,0,0|2,0,0]=4 15277 B16R1.1697 CCCCCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000210326 [0,2,0,0,0,0|1,0,0]=3 15278 B16R1.1697 CCCCCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000210326 [0,2,0,0,0,0|1,0,0]=3 15279 B16R1.1697 CCCCCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000210326 [0,2,0,0,0,0|1,0,0]=3 15280 B16R1.1697 CCCCCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000210326 [0,2,0,0,0,0|1,0,0]=3 15281 B16R1.1697 CCCCCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000210326 [0,2,0,0,0,0|1,0,0]=3 15282 B16R1.1697 CCCCCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000210326 [0,2,0,0,0,0|1,0,0]=3 15283 B16R1.1697 CCCCNC(=O)c1cc(ccc1C#N)F 11a_100000102301_100011217471 [0,2,0,0,0,0|2,0,0]=4 15284 B16R1.1697 CCCCNC(=O)c1cc(ccc1C#N)F 1626a_100000102301_100011217471 [0,2,0,0,0,0|2,0,0]=4 15285 B16R1.1697 CCCCNC(=O)c1cc(ccc1CC)Br 11a_100000102301_100012343961 [0,2,0,0,0,0|2,0,0]=4 15286 B16R1.1697 CCCCNC(=O)c1cc(ccc1CC)Br 1626a_100000102301_100012343961 [0,2,0,0,0,0|2,0,0]=4 15287 B16R1.1697 CCCCNC(=O)c1cc(ccc1CC)Br 240690a_100000102301_100012343961 [0,2,0,0,0,0|2,0,0]=4 15288 B16R1.1697 CCCCNC(=O)c1cc(ccc1CC)Br 527a_100000102301_100012343961 [0,2,0,0,0,0|2,0,0]=4 15289 B16R1.1697 CCCCNC(=O)c1cc(ccc1NC)F 27a_100102657272_200000205868 [0,2,0,0,0,0|2,0,0]=4 15290 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Br 11a_100000102301_100000188853 [0,2,0,0,0,0|1,0,0]=3 15291 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Br 1626a_100000102301_100000188853 [0,2,0,0,0,0|1,0,0]=3 15292 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Br 240690a_100000102301_100000188853 [0,2,0,0,0,0|1,0,0]=3 15293 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Br 527a_100000102301_100000188853 [0,2,0,0,0,0|1,0,0]=3 15294 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)C 11a_100000102301_100000204667 [0,2,0,0,0,0|1,0,0]=3 15295 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)C 1626a_100000102301_100000204667 [0,2,0,0,0,0|1,0,0]=3 15296 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)C 240690a_100000102301_100000204667 [0,2,0,0,0,0|1,0,0]=3 15297 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)C 527a_100000102301_100000204667 [0,2,0,0,0,0|1,0,0]=3 15298 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Cl 11a_100000102301_100000211409 [0,2,0,0,0,0|1,0,0]=3 15299 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Cl 1626a_100000102301_100000211409 [0,2,0,0,0,0|1,0,0]=3 15300 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Cl 240690a_100000102301_100000211409 [0,2,0,0,0,0|1,0,0]=3 15301 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)Cl 527a_100000102301_100000211409 [0,2,0,0,0,0|1,0,0]=3 15302 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)F 11a_100000102301_100000735445 [0,2,0,0,0,0|1,0,0]=3 15303 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)F 1626a_100000102301_100000735445 [0,2,0,0,0,0|1,0,0]=3 15304 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)F 240690a_100000102301_100000735445 [0,2,0,0,0,0|1,0,0]=3 15305 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)F 527a_100000102301_100000735445 [0,2,0,0,0,0|1,0,0]=3 15306 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)I 11a_100000102301_100000230898 [0,2,0,0,0,0|1,0,0]=3 15307 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)I 1626a_100000102301_100000230898 [0,2,0,0,0,0|1,0,0]=3 15308 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)I 240690a_100000102301_100000230898 [0,2,0,0,0,0|1,0,0]=3 15309 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)I 527a_100000102301_100000230898 [0,2,0,0,0,0|1,0,0]=3 15310 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)O 240690a_100000102301_200000100057 [0,2,0,0,0,0|1,0,0]=3 15311 B16R1.1697 CCCCNC(=O)c1cc(ccc1OC)O 527a_100000102301_200000100057 [0,2,0,0,0,0|1,0,0]=3 15312 B16R1.1697 CCCCNC(=O)c1cc(ccc1SC)F 62a_200000205868_200000210301 [0,2,0,0,0,0|1,1,0]=4 15313 B16R1.1697 CCCCNC(=O)c1cc(ccc1SC)F 62a_200000210301_200000205868 [0,2,0,0,0,0|1,1,0]=4 15314 B16R1.1697 CCCCNC(=O)c1cc(ccc1S[13CH3])F 62a_200000205868_200025704644 [0,2,0,0,0,0|1,1,0]=4 15315 B16R1.1697 CCCCNC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_200000205868 [0,2,0,0,0,0|1,1,0]=4 15316 B16R1.1697 CCCCOC(C)c1cc(ccc1OC)Cl 34a_100011598618_100000210210 [0,2,0,0,0,0|1,0,1]=4 15317 B16R1.1697 CCCCOC(C)c1cc(ccc1OC)Cl 7a_100011598618_100000210211 [0,2,0,0,0,0|1,0,1]=4 15318 B16R1.1697 CCCCOC(C)c1cc(ccc1OC)F 34a_100011305292_100000210210 [0,2,0,0,0,0|1,0,1]=4 15319 B16R1.1697 CCCCOC(C)c1cc(ccc1OC)F 7a_100011305292_100000210211 [0,2,0,0,0,0|1,0,1]=4 15320 B16R1.1697 CCCNNC(=O)c1cc(ccc1OC)Br 22a_100000740057_100000188853 [0,2,0,0,0,0|2,0,0]=4 15321 B16R1.1697 CCCNNC(=O)c1cc(ccc1OC)C 22a_100000740057_100000204667 [0,2,0,0,0,0|2,0,0]=4 15322 B16R1.1697 CCCNNC(=O)c1cc(ccc1OC)Cl 22a_100000740057_100000211409 [0,2,0,0,0,0|2,0,0]=4 15323 B16R1.1697 CCCNNC(=O)c1cc(ccc1OC)F 22a_100000740057_100000735445 [0,2,0,0,0,0|2,0,0]=4 15324 B16R1.1697 CCCNNC(=O)c1cc(ccc1OC)I 22a_100000740057_100000230898 [0,2,0,0,0,0|2,0,0]=4 15325 B16R1.1697 CCCNNC(=O)c1cc(ccc1OC)O 22a_100000740057_200000100057 [0,2,0,0,0,0|2,0,0]=4 15326 B16R1.1697 CCCOCC(=O)c1cc(ccc1OC)Br 34a_100000210258_200000749383 [0,2,0,0,0,0|2,0,0]=4 15327 B16R1.1697 CCCOCC(=O)c1cc(ccc1OC)F 34a_100000210258_100000737820 [0,2,0,0,0,0|2,0,0]=4 15328 B16R1.1697 CCCSCC(=O)c1cc(ccc1OC)Br 62a_200000749383_100000210303 [0,2,0,0,0,0|2,0,0]=4 15329 B16R1.1697 CCCSCC(=O)c1cc(ccc1OC)Cl 62a_100012340060_100000210303 [0,2,0,0,0,0|2,0,0]=4 15330 B16R1.1697 CCCSCC(=O)c1cc(ccc1OC)F 62a_100000737820_100000210303 [0,2,0,0,0,0|2,0,0]=4 15331 B16R1.1697 CCOCCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100011215890 [0,2,0,0,0,0|2,0,0]=4 15332 B16R1.1697 CCOCCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100011215890 [0,2,0,0,0,0|2,0,0]=4 15333 B16R1.1697 CCOCCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100011215890 [0,2,0,0,0,0|2,0,0]=4 15334 B16R1.1697 CCOCCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100011215890 [0,2,0,0,0,0|2,0,0]=4 15335 B16R1.1697 CCOCCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100011215890 [0,2,0,0,0,0|2,0,0]=4 15336 B16R1.1697 CCOCCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100011215890 [0,2,0,0,0,0|2,0,0]=4 15337 B16R1.1697 CCSCCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000757381 [0,2,0,0,0,0|2,0,0]=4 15338 B16R1.1697 CCSCCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000757381 [0,2,0,0,0,0|2,0,0]=4 15339 B16R1.1697 CCSCCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000757381 [0,2,0,0,0,0|2,0,0]=4 15340 B16R1.1697 CCSCCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000757381 [0,2,0,0,0,0|2,0,0]=4 15341 B16R1.1697 CCSCCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000757381 [0,2,0,0,0,0|2,0,0]=4 15342 B16R1.1697 CCSCCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000757381 [0,2,0,0,0,0|2,0,0]=4 15343 B16R1.1697 COCCCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000740836 [0,2,0,0,0,0|2,0,0]=4 15344 B16R1.1697 COCCCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000740836 [0,2,0,0,0,0|2,0,0]=4 15345 B16R1.1697 COCCCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000740836 [0,2,0,0,0,0|2,0,0]=4 15346 B16R1.1697 COCCCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000740836 [0,2,0,0,0,0|2,0,0]=4 15347 B16R1.1697 COCCCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000740836 [0,2,0,0,0,0|2,0,0]=4 15348 B16R1.1697 COCCCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000740836 [0,2,0,0,0,0|2,0,0]=4 15349 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)Br 1626a_100000209980_100000188853 [0,2,0,0,0,0|2,0,0]=4 15350 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)Br 240690a_100000209980_100000188853 [0,2,0,0,0,0|2,0,0]=4 15351 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)Br 527a_100000209980_100000188853 [0,2,0,0,0,0|2,0,0]=4 15352 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)C 1626a_100000209980_100000204667 [0,2,0,0,0,0|2,0,0]=4 15353 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)C 240690a_100000209980_100000204667 [0,2,0,0,0,0|2,0,0]=4 15354 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)C 527a_100000209980_100000204667 [0,2,0,0,0,0|2,0,0]=4 15355 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)Cl 1626a_100000209980_100000211409 [0,2,0,0,0,0|2,0,0]=4 15356 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)Cl 240690a_100000209980_100000211409 [0,2,0,0,0,0|2,0,0]=4 15357 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)Cl 527a_100000209980_100000211409 [0,2,0,0,0,0|2,0,0]=4 15358 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)F 1626a_100000209980_100000735445 [0,2,0,0,0,0|2,0,0]=4 15359 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)F 240690a_100000209980_100000735445 [0,2,0,0,0,0|2,0,0]=4 15360 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)F 527a_100000209980_100000735445 [0,2,0,0,0,0|2,0,0]=4 15361 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)I 1626a_100000209980_100000230898 [0,2,0,0,0,0|2,0,0]=4 15362 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)I 240690a_100000209980_100000230898 [0,2,0,0,0,0|2,0,0]=4 15363 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)I 527a_100000209980_100000230898 [0,2,0,0,0,0|2,0,0]=4 15364 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)O 240690a_100000209980_200000100057 [0,2,0,0,0,0|2,0,0]=4 15365 B16R1.1697 COCCNC(=O)c1cc(ccc1OC)O 527a_100000209980_200000100057 [0,2,0,0,0,0|2,0,0]=4 15366 B16R1.1697 COc1ccc(cc1C(=O)CCCCF)Br 1458a_100000188853_100000729493 [0,2,0,0,0,0|2,0,0]=4 15367 B16R1.1697 COc1ccc(cc1C(=O)CCCCF)C 1458a_100000204667_100000729493 [0,2,0,0,0,0|2,0,0]=4 15368 B16R1.1697 COc1ccc(cc1C(=O)CCCCF)Cl 1458a_100000211409_100000729493 [0,2,0,0,0,0|2,0,0]=4 15369 B16R1.1697 COc1ccc(cc1C(=O)CCCCF)F 1458a_100000735445_100000729493 [0,2,0,0,0,0|2,0,0]=4 15370 B16R1.1697 COc1ccc(cc1C(=O)CCCCF)I 1458a_100000230898_100000729493 [0,2,0,0,0,0|2,0,0]=4 15371 B16R1.1697 COc1ccc(cc1C(=O)CCCCF)O 1458a_200000100057_100000729493 [0,2,0,0,0,0|2,0,0]=4 15372 B16R1.1697 COc1ccc(cc1C(=O)CCCCO)Br 1458a_100000188853_100000210776 [0,2,0,0,0,0|2,0,0]=4 15373 B16R1.1697 COc1ccc(cc1C(=O)CCCCO)C 1458a_100000204667_100000210776 [0,2,0,0,0,0|2,0,0]=4 15374 B16R1.1697 COc1ccc(cc1C(=O)CCCCO)Cl 1458a_100000211409_100000210776 [0,2,0,0,0,0|2,0,0]=4 15375 B16R1.1697 COc1ccc(cc1C(=O)CCCCO)F 1458a_100000735445_100000210776 [0,2,0,0,0,0|2,0,0]=4 15376 B16R1.1697 COc1ccc(cc1C(=O)CCCCO)I 1458a_100000230898_100000210776 [0,2,0,0,0,0|2,0,0]=4 15377 B16R1.1697 COc1ccc(cc1C(=O)CCCCO)O 1458a_200000100057_100000210776 [0,2,0,0,0,0|2,0,0]=4 15378 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Br 11a_100015189416_100000188853 [0,2,0,0,0,0|2,0,0]=4 15379 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Br 1626a_100015189416_100000188853 [0,2,0,0,0,0|2,0,0]=4 15380 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Br 240690a_100015189416_100000188853 [0,2,0,0,0,0|2,0,0]=4 15381 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Br 527a_100015189416_100000188853 [0,2,0,0,0,0|2,0,0]=4 15382 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)C 11a_100015189416_100000204667 [0,2,0,0,0,0|2,0,0]=4 15383 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)C 1626a_100015189416_100000204667 [0,2,0,0,0,0|2,0,0]=4 15384 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)C 240690a_100015189416_100000204667 [0,2,0,0,0,0|2,0,0]=4 15385 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)C 527a_100015189416_100000204667 [0,2,0,0,0,0|2,0,0]=4 15386 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Cl 11a_100015189416_100000211409 [0,2,0,0,0,0|2,0,0]=4 15387 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Cl 1626a_100015189416_100000211409 [0,2,0,0,0,0|2,0,0]=4 15388 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Cl 240690a_100015189416_100000211409 [0,2,0,0,0,0|2,0,0]=4 15389 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)Cl 527a_100015189416_100000211409 [0,2,0,0,0,0|2,0,0]=4 15390 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)F 11a_100015189416_100000735445 [0,2,0,0,0,0|2,0,0]=4 15391 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)F 1626a_100015189416_100000735445 [0,2,0,0,0,0|2,0,0]=4 15392 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)F 240690a_100015189416_100000735445 [0,2,0,0,0,0|2,0,0]=4 15393 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)F 527a_100015189416_100000735445 [0,2,0,0,0,0|2,0,0]=4 15394 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)I 11a_100015189416_100000230898 [0,2,0,0,0,0|2,0,0]=4 15395 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)I 1626a_100015189416_100000230898 [0,2,0,0,0,0|2,0,0]=4 15396 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)I 240690a_100015189416_100000230898 [0,2,0,0,0,0|2,0,0]=4 15397 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)I 527a_100015189416_100000230898 [0,2,0,0,0,0|2,0,0]=4 15398 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)O 240690a_100015189416_200000100057 [0,2,0,0,0,0|2,0,0]=4 15399 B16R1.1697 COc1ccc(cc1C(=O)NCCCF)O 527a_100015189416_200000100057 [0,2,0,0,0,0|2,0,0]=4 15400 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)Br 240690a_100000182051_100000188853 [0,2,0,0,0,0|2,0,0]=4 15401 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)Br 527a_100000182051_100000188853 [0,2,0,0,0,0|2,0,0]=4 15402 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)C 240690a_100000182051_100000204667 [0,2,0,0,0,0|2,0,0]=4 15403 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)C 527a_100000182051_100000204667 [0,2,0,0,0,0|2,0,0]=4 15404 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)Cl 240690a_100000182051_100000211409 [0,2,0,0,0,0|2,0,0]=4 15405 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)Cl 527a_100000182051_100000211409 [0,2,0,0,0,0|2,0,0]=4 15406 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)F 240690a_100000182051_100000735445 [0,2,0,0,0,0|2,0,0]=4 15407 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)F 527a_100000182051_100000735445 [0,2,0,0,0,0|2,0,0]=4 15408 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)I 240690a_100000182051_100000230898 [0,2,0,0,0,0|2,0,0]=4 15409 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)I 527a_100000182051_100000230898 [0,2,0,0,0,0|2,0,0]=4 15410 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)O 240690a_100000182051_200000100057 [0,2,0,0,0,0|2,0,0]=4 15411 B16R1.1697 COc1ccc(cc1C(=O)NCCCO)O 527a_100000182051_200000100057 [0,2,0,0,0,0|2,0,0]=4 15412 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Br 11a_100020590264_100000188853 [0,2,0,0,0,0|2,0,0]=4 15413 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Br 1626a_100020590264_100000188853 [0,2,0,0,0,0|2,0,0]=4 15414 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Br 240690a_100020590264_100000188853 [0,2,0,0,0,0|2,0,0]=4 15415 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Br 527a_100020590264_100000188853 [0,2,0,0,0,0|2,0,0]=4 15416 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)C 11a_100020590264_100000204667 [0,2,0,0,0,0|2,0,0]=4 15417 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)C 1626a_100020590264_100000204667 [0,2,0,0,0,0|2,0,0]=4 15418 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)C 240690a_100020590264_100000204667 [0,2,0,0,0,0|2,0,0]=4 15419 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)C 527a_100020590264_100000204667 [0,2,0,0,0,0|2,0,0]=4 15420 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Cl 11a_100020590264_100000211409 [0,2,0,0,0,0|2,0,0]=4 15421 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Cl 1626a_100020590264_100000211409 [0,2,0,0,0,0|2,0,0]=4 15422 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Cl 240690a_100020590264_100000211409 [0,2,0,0,0,0|2,0,0]=4 15423 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)Cl 527a_100020590264_100000211409 [0,2,0,0,0,0|2,0,0]=4 15424 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)F 11a_100020590264_100000735445 [0,2,0,0,0,0|2,0,0]=4 15425 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)F 1626a_100020590264_100000735445 [0,2,0,0,0,0|2,0,0]=4 15426 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)F 240690a_100020590264_100000735445 [0,2,0,0,0,0|2,0,0]=4 15427 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)F 527a_100020590264_100000735445 [0,2,0,0,0,0|2,0,0]=4 15428 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)I 11a_100020590264_100000230898 [0,2,0,0,0,0|2,0,0]=4 15429 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)I 1626a_100020590264_100000230898 [0,2,0,0,0,0|2,0,0]=4 15430 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)I 240690a_100020590264_100000230898 [0,2,0,0,0,0|2,0,0]=4 15431 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)I 527a_100020590264_100000230898 [0,2,0,0,0,0|2,0,0]=4 15432 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)O 240690a_100020590264_200000100057 [0,2,0,0,0,0|2,0,0]=4 15433 B16R1.1697 COc1ccc(cc1C(=O)NCCSC)O 527a_100020590264_200000100057 [0,2,0,0,0,0|2,0,0]=4 15434 B16R1.1699 CCCCCC(=O)c1cc(ccc1Br)C#N 1458a_100012361338_100000210326 [0,2,0,0,0,0|2,0,0]=4 15435 B16R1.1699 CCCCCC(=O)c1cc(ccc1Br)CO 1458a_100010259715_100000210326 [0,2,0,0,0,0|2,0,0]=4 15436 B16R1.1699 CCCCCC(=O)c1cc(ccc1Br)OC 1458a_100000211723_100000210326 [0,2,0,0,0,0|2,0,0]=4 15437 B16R1.1699 CCCCCC(=O)c1cc(ccc1C)C#N 1458a_200012187059_100000210326 [0,2,0,0,0,0|2,0,0]=4 15438 B16R1.1699 CCCCCC(=O)c1cc(ccc1C)OC 1458a_100011399813_100000210326 [0,2,0,0,0,0|2,0,0]=4 15439 B16R1.1699 CCCCCC(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_100000210326 [0,2,0,0,0,0|2,0,0]=4 15440 B16R1.1699 CCCCCC(=O)c1cc(ccc1Cl)OC 1458a_100000763818_100000210326 [0,2,0,0,0,0|2,0,0]=4 15441 B16R1.1699 CCCCCC(=O)c1cc(ccc1Cl)SC 1458a_100000212015_100000210326 [0,2,0,0,0,0|2,0,0]=4 15442 B16R1.1699 CCCCCC(=O)c1cc(ccc1F)C#N 1458a_100011218479_100000210326 [0,2,0,0,0,0|2,0,0]=4 15443 B16R1.1699 CCCCCC(=O)c1cc(ccc1F)OC 1458a_100011217016_100000210326 [0,2,0,0,0,0|2,0,0]=4 15444 B16R1.1699 CCCCCC(=O)c1cc(ccc1F)SC 1458a_200012183283_100000210326 [0,2,0,0,0,0|2,0,0]=4 15445 B16R1.1699 CCCCCC(=O)c1cc(ccc1I)C#N 1458a_200010191847_100000210326 [0,2,0,0,0,0|2,0,0]=4 15446 B16R1.1699 CCCCCC(=O)c1cc(ccc1I)OC 1458a_100012339533_100000210326 [0,2,0,0,0,0|2,0,0]=4 15447 B16R1.1699 CCCCCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000210326 [0,2,0,0,0,0|1,0,0]=3 15448 B16R1.1699 CCCCCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000210326 [0,2,0,0,0,0|1,0,0]=3 15449 B16R1.1699 CCCCCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000210326 [0,2,0,0,0,0|1,0,0]=3 15450 B16R1.1699 CCCCCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000210326 [0,2,0,0,0,0|1,0,0]=3 15451 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)C#N 11a_100000102301_100012361338 [0,2,0,0,0,0|2,0,0]=4 15452 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)C#N 1626a_100000102301_100012361338 [0,2,0,0,0,0|2,0,0]=4 15453 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)C#N 240690a_100000102301_100012361338 [0,2,0,0,0,0|2,0,0]=4 15454 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)C#N 527a_100000102301_100012361338 [0,2,0,0,0,0|2,0,0]=4 15455 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)CO 240690a_100000102301_100010259715 [0,2,0,0,0,0|2,0,0]=4 15456 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)OC 11a_100000102301_100000211723 [0,2,0,0,0,0|2,0,0]=4 15457 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)OC 1626a_100000102301_100000211723 [0,2,0,0,0,0|2,0,0]=4 15458 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)OC 240690a_100000102301_100000211723 [0,2,0,0,0,0|2,0,0]=4 15459 B16R1.1699 CCCCNC(=O)c1cc(ccc1Br)OC 527a_100000102301_100000211723 [0,2,0,0,0,0|2,0,0]=4 15460 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)C#N 11a_100000102301_200012187059 [0,2,0,0,0,0|2,0,0]=4 15461 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)C#N 1626a_100000102301_200012187059 [0,2,0,0,0,0|2,0,0]=4 15462 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)C#N 240690a_100000102301_200012187059 [0,2,0,0,0,0|2,0,0]=4 15463 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)C#N 527a_100000102301_200012187059 [0,2,0,0,0,0|2,0,0]=4 15464 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)OC 11a_100000102301_100011399813 [0,2,0,0,0,0|2,0,0]=4 15465 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)OC 1626a_100000102301_100011399813 [0,2,0,0,0,0|2,0,0]=4 15466 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)OC 240690a_100000102301_100011399813 [0,2,0,0,0,0|2,0,0]=4 15467 B16R1.1699 CCCCNC(=O)c1cc(ccc1C)OC 527a_100000102301_100011399813 [0,2,0,0,0,0|2,0,0]=4 15468 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)C#N 11a_100000102301_100000729836 [0,2,0,0,0,0|2,0,0]=4 15469 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)C#N 1626a_100000102301_100000729836 [0,2,0,0,0,0|2,0,0]=4 15470 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)C#N 240690a_100000102301_100000729836 [0,2,0,0,0,0|2,0,0]=4 15471 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)C#N 527a_100000102301_100000729836 [0,2,0,0,0,0|2,0,0]=4 15472 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)OC 11a_100000102301_100000763818 [0,2,0,0,0,0|2,0,0]=4 15473 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)OC 1626a_100000102301_100000763818 [0,2,0,0,0,0|2,0,0]=4 15474 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)OC 240690a_100000102301_100000763818 [0,2,0,0,0,0|2,0,0]=4 15475 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)OC 527a_100000102301_100000763818 [0,2,0,0,0,0|2,0,0]=4 15476 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)SC 11a_100000102301_100000212015 [0,2,0,0,0,0|2,0,0]=4 15477 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)SC 1626a_100000102301_100000212015 [0,2,0,0,0,0|2,0,0]=4 15478 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)SC 240690a_100000102301_100000212015 [0,2,0,0,0,0|2,0,0]=4 15479 B16R1.1699 CCCCNC(=O)c1cc(ccc1Cl)SC 527a_100000102301_100000212015 [0,2,0,0,0,0|2,0,0]=4 15480 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)C#N 11a_100000102301_100011218479 [0,2,0,0,0,0|2,0,0]=4 15481 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)C#N 1626a_100000102301_100011218479 [0,2,0,0,0,0|2,0,0]=4 15482 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)C#N 240690a_100000102301_100011218479 [0,2,0,0,0,0|2,0,0]=4 15483 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)OC 11a_100000102301_100011217016 [0,2,0,0,0,0|2,0,0]=4 15484 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)OC 1626a_100000102301_100011217016 [0,2,0,0,0,0|2,0,0]=4 15485 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)OC 240690a_100000102301_100011217016 [0,2,0,0,0,0|2,0,0]=4 15486 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)OC 527a_100000102301_100011217016 [0,2,0,0,0,0|2,0,0]=4 15487 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)SC 11a_100000102301_200012183283 [0,2,0,0,0,0|2,0,0]=4 15488 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)SC 1626a_100000102301_200012183283 [0,2,0,0,0,0|2,0,0]=4 15489 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)SC 240690a_100000102301_200012183283 [0,2,0,0,0,0|2,0,0]=4 15490 B16R1.1699 CCCCNC(=O)c1cc(ccc1F)SC 527a_100000102301_200012183283 [0,2,0,0,0,0|2,0,0]=4 15491 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)C#N 11a_100000102301_200010191847 [0,2,0,0,0,0|2,0,0]=4 15492 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)C#N 1626a_100000102301_200010191847 [0,2,0,0,0,0|2,0,0]=4 15493 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)C#N 240690a_100000102301_200010191847 [0,2,0,0,0,0|2,0,0]=4 15494 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)OC 11a_100000102301_100012339533 [0,2,0,0,0,0|2,0,0]=4 15495 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)OC 1626a_100000102301_100012339533 [0,2,0,0,0,0|2,0,0]=4 15496 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)OC 240690a_100000102301_100012339533 [0,2,0,0,0,0|2,0,0]=4 15497 B16R1.1699 CCCCNC(=O)c1cc(ccc1I)OC 527a_100000102301_100012339533 [0,2,0,0,0,0|2,0,0]=4 15498 B16R1.1699 CCCCNC(=O)c1cc(ccc1O)C#N 240690a_100000102301_100000719980 [0,2,0,0,0,0|1,0,0]=3 15499 B16R1.1699 CCCCNC(=O)c1cc(ccc1O)CC 240690a_100000102301_200000748397 [0,2,0,0,0,0|1,0,0]=3 15500 B16R1.1699 CCCCNC(=O)c1cc(ccc1O)CC 527a_100000102301_200000748397 [0,2,0,0,0,0|1,0,0]=3 15501 B16R1.1699 CCCCNC(=O)c1cc(ccc1O)CO 240690a_100000102301_200000045694 [0,2,0,0,0,0|1,0,0]=3 15502 B16R1.1699 CCCCNC(=O)c1cc(ccc1O)OC 240690a_100000102301_100000211986 [0,2,0,0,0,0|1,0,0]=3 15503 B16R1.1699 CCCCNC(=O)c1cc(ccc1O)OC 527a_100000102301_100000211986 [0,2,0,0,0,0|1,0,0]=3 15504 B16R1.1699 CCCCOC(=O)c1cc(ccc1F)OC 34a_100022593774_200000210301 [0,2,0,0,0,0|1,0,0]=3 15505 B16R1.1699 CCCCOC(=O)c1cc(ccc1F)OC 7a_100022593774_200000210301 [0,2,0,0,0,0|1,0,0]=3 15506 B16R1.1699 CCCCOC(=O)c1cc(ccc1F)O[13CH3] 34a_100022593774_200025704644 [0,2,0,0,0,0|1,0,0]=3 15507 B16R1.1699 CCCCOC(=O)c1cc(ccc1F)O[13CH3] 7a_100022593774_200025704644 [0,2,0,0,0,0|1,0,0]=3 15508 B16R1.1699 CCCNNC(=O)c1cc(ccc1O)CC 22a_100000740057_200000748397 [0,2,0,0,0,0|2,0,0]=4 15509 B16R1.1699 CCCNNC(=O)c1cc(ccc1O)OC 22a_100000740057_100000211986 [0,2,0,0,0,0|2,0,0]=4 15510 B16R1.1699 CCOCCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100011215890 [0,2,0,0,0,0|2,0,0]=4 15511 B16R1.1699 CCOCCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100011215890 [0,2,0,0,0,0|2,0,0]=4 15512 B16R1.1699 CCOCCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100011215890 [0,2,0,0,0,0|2,0,0]=4 15513 B16R1.1699 CCOCCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100011215890 [0,2,0,0,0,0|2,0,0]=4 15514 B16R1.1699 CCSCCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000757381 [0,2,0,0,0,0|2,0,0]=4 15515 B16R1.1699 CCSCCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000757381 [0,2,0,0,0,0|2,0,0]=4 15516 B16R1.1699 CCSCCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000757381 [0,2,0,0,0,0|2,0,0]=4 15517 B16R1.1699 CCSCCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000757381 [0,2,0,0,0,0|2,0,0]=4 15518 B16R1.1699 CCc1ccc(c(c1)C(=O)CCCCF)O 1458a_200000748397_100000729493 [0,2,0,0,0,0|2,0,0]=4 15519 B16R1.1699 CCc1ccc(c(c1)C(=O)CCCCO)O 1458a_200000748397_100000210776 [0,2,0,0,0,0|2,0,0]=4 15520 B16R1.1699 CCc1ccc(c(c1)C(=O)CCCOC)O 1458a_200000748397_100000740836 [0,2,0,0,0,0|2,0,0]=4 15521 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCCF)O 240690a_100015189416_200000748397 [0,2,0,0,0,0|2,0,0]=4 15522 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCCF)O 527a_100015189416_200000748397 [0,2,0,0,0,0|2,0,0]=4 15523 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCCO)O 240690a_100000182051_200000748397 [0,2,0,0,0,0|2,0,0]=4 15524 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCCO)O 527a_100000182051_200000748397 [0,2,0,0,0,0|2,0,0]=4 15525 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCOC)O 240690a_100000209980_200000748397 [0,2,0,0,0,0|2,0,0]=4 15526 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCOC)O 527a_100000209980_200000748397 [0,2,0,0,0,0|2,0,0]=4 15527 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCSC)O 240690a_100020590264_200000748397 [0,2,0,0,0,0|2,0,0]=4 15528 B16R1.1699 CCc1ccc(c(c1)C(=O)NCCSC)O 527a_100020590264_200000748397 [0,2,0,0,0,0|2,0,0]=4 15529 B16R1.1699 COCCCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000740836 [0,2,0,0,0,0|2,0,0]=4 15530 B16R1.1699 COCCCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000740836 [0,2,0,0,0,0|2,0,0]=4 15531 B16R1.1699 COCCCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000740836 [0,2,0,0,0,0|2,0,0]=4 15532 B16R1.1699 COCCNC(=O)c1cc(ccc1O)C#N 240690a_100000209980_100000719980 [0,2,0,0,0,0|2,0,0]=4 15533 B16R1.1699 COCCNC(=O)c1cc(ccc1O)CO 240690a_100000209980_200000045694 [0,2,0,0,0,0|2,0,0]=4 15534 B16R1.1699 COCCNC(=O)c1cc(ccc1O)OC 240690a_100000209980_100000211986 [0,2,0,0,0,0|2,0,0]=4 15535 B16R1.1699 COCCNC(=O)c1cc(ccc1O)OC 527a_100000209980_100000211986 [0,2,0,0,0,0|2,0,0]=4 15536 B16R1.1699 COc1ccc(c(c1)C(=O)CCCCF)O 1458a_100000211986_100000729493 [0,2,0,0,0,0|2,0,0]=4 15537 B16R1.1699 COc1ccc(c(c1)C(=O)CCCCO)O 1458a_100000211986_100000210776 [0,2,0,0,0,0|2,0,0]=4 15538 B16R1.1699 COc1ccc(c(c1)C(=O)NCCCF)O 240690a_100015189416_100000211986 [0,2,0,0,0,0|2,0,0]=4 15539 B16R1.1699 COc1ccc(c(c1)C(=O)NCCCF)O 527a_100015189416_100000211986 [0,2,0,0,0,0|2,0,0]=4 15540 B16R1.1699 COc1ccc(c(c1)C(=O)NCCCO)O 240690a_100000182051_100000211986 [0,2,0,0,0,0|2,0,0]=4 15541 B16R1.1699 COc1ccc(c(c1)C(=O)NCCCO)O 527a_100000182051_100000211986 [0,2,0,0,0,0|2,0,0]=4 15542 B16R1.1699 COc1ccc(c(c1)C(=O)NCCSC)O 240690a_100020590264_100000211986 [0,2,0,0,0,0|2,0,0]=4 15543 B16R1.1699 COc1ccc(c(c1)C(=O)NCCSC)O 527a_100020590264_100000211986 [0,2,0,0,0,0|2,0,0]=4 15544 B16R1.1699 CSCCNC(=O)c1cc(ccc1O)C#N 240690a_100020590264_100000719980 [0,2,0,0,0,0|2,0,0]=4 15545 B16R1.1699 CSCCNC(=O)c1cc(ccc1O)CO 240690a_100020590264_200000045694 [0,2,0,0,0,0|2,0,0]=4 15546 B16R1.1699 N#Cc1ccc(c(c1)C(=O)CCCCF)O 1458a_100000719980_100000729493 [0,2,0,0,0,0|2,0,0]=4 15547 B16R1.1699 N#Cc1ccc(c(c1)C(=O)CCCCO)O 1458a_100000719980_100000210776 [0,2,0,0,0,0|2,0,0]=4 15548 B16R1.1699 N#Cc1ccc(c(c1)C(=O)NCCCF)O 240690a_100015189416_100000719980 [0,2,0,0,0,0|2,0,0]=4 15549 B16R1.1699 N#Cc1ccc(c(c1)C(=O)NCCCO)O 240690a_100000182051_100000719980 [0,2,0,0,0,0|2,0,0]=4 15550 B16R1.1699 O=C(CCCCF)c1cc(ccc1O)CO 1458a_200000045694_100000729493 [0,2,0,0,0,0|2,0,0]=4 15551 B16R1.1699 O=C(CCCCO)c1cc(ccc1O)CO 1458a_200000045694_100000210776 [0,2,0,0,0,0|2,0,0]=4 15552 B16R1.1699 O=C(NCCCF)c1cc(ccc1O)CO 240690a_100015189416_200000045694 [0,2,0,0,0,0|2,0,0]=4 15553 B16R1.1699 O=C(NCCCO)c1cc(ccc1O)CO 240690a_100000182051_200000045694 [0,2,0,0,0,0|2,0,0]=4 15554 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_100000210326 [0,2,0,0,0,0|2,0,0]=4 15555 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_100000210326 [0,2,0,0,0,0|2,0,0]=4 15556 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100000210326 [0,2,0,0,0,0|2,0,0]=4 15557 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_100000210326 [0,2,0,0,0,0|2,0,0]=4 15558 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_100000210326 [0,2,0,0,0,0|2,0,0]=4 15559 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_100000210326 [0,2,0,0,0,0|2,0,0]=4 15560 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_100000210326 [0,2,0,0,0,0|2,0,0]=4 15561 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_100000210326 [0,2,0,0,0,0|2,0,0]=4 15562 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_100000210326 [0,2,0,0,0,0|2,0,0]=4 15563 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210326 [0,2,0,0,0,0|2,0,0]=4 15564 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_100000210326 [0,2,0,0,0,0|2,0,0]=4 15565 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_100000210326 [0,2,0,0,0,0|2,0,0]=4 15566 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_100000210326 [0,2,0,0,0,0|2,0,0]=4 15567 B16R1.3573 CCCCCC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_100000210326 [0,2,0,0,0,0|2,0,0]=4 15568 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100000210326 [0,2,0,0,0,0|2,0,0]=4 15569 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100000210326 [0,2,0,0,0,0|2,0,0]=4 15570 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_100000210326 [0,2,0,0,0,0|2,0,0]=4 15571 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_100000210326 [0,2,0,0,0,0|2,0,0]=4 15572 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100000210326 [0,2,0,0,0,0|2,0,0]=4 15573 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100000210326 [0,2,0,0,0,0|2,0,0]=4 15574 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_100000210326 [0,2,0,0,0,0|2,0,0]=4 15575 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_100000210326 [0,2,0,0,0,0|2,0,0]=4 15576 B16R1.3573 CCCCCC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_100000210326 [0,2,0,0,0,0|2,0,0]=4 15577 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_100000210326 [0,2,0,0,0,0|2,0,0]=4 15578 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_100000210326 [0,2,0,0,0,0|2,0,0]=4 15579 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100000210326 [0,2,0,0,0,0|2,0,0]=4 15580 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_100000210326 [0,2,0,0,0,0|2,0,0]=4 15581 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_100000210326 [0,2,0,0,0,0|2,0,0]=4 15582 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_100000210326 [0,2,0,0,0,0|2,0,0]=4 15583 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_100000210326 [0,2,0,0,0,0|2,0,0]=4 15584 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_100000210326 [0,2,0,0,0,0|2,0,0]=4 15585 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210326 [0,2,0,0,0,0|2,0,0]=4 15586 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100000210326 [0,2,0,0,0,0|2,0,0]=4 15587 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_100000210326 [0,2,0,0,0,0|2,0,0]=4 15588 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_100000210326 [0,2,0,0,0,0|2,0,0]=4 15589 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_100000210326 [0,2,0,0,0,0|2,0,0]=4 15590 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_100000210326 [0,2,0,0,0,0|2,0,0]=4 15591 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_100000210326 [0,2,0,0,0,0|2,0,0]=4 15592 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_100000210326 [0,2,0,0,0,0|2,0,0]=4 15593 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_100000210326 [0,2,0,0,0,0|2,0,0]=4 15594 B16R1.3573 CCCCCC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_100000210326 [0,2,0,0,0,0|2,0,0]=4 15595 B16R1.3573 CCCCCC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_100000210326 [0,2,0,0,0,0|2,0,0]=4 15596 B16R1.3573 CCCCCC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_100000210326 [0,2,0,0,0,0|2,0,0]=4 15597 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000210326 [0,2,0,0,0,0|1,0,0]=3 15598 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000210326 [0,2,0,0,0,0|1,0,0]=3 15599 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000210326 [0,2,0,0,0,0|1,0,0]=3 15600 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210326 [0,2,0,0,0,0|1,0,0]=3 15601 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000210326 [0,2,0,0,0,0|1,0,0]=3 15602 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000210326 [0,2,0,0,0,0|1,0,0]=3 15603 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000210326 [0,2,0,0,0,0|1,0,0]=3 15604 B16R1.3573 CCCCCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210326 [0,2,0,0,0,0|1,0,0]=3 15605 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)C)F 11a_100000102301_200012355688 [0,2,0,0,0,0|2,0,0]=4 15606 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)C)F 1626a_100000102301_200012355688 [0,2,0,0,0,0|2,0,0]=4 15607 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)C)F 240690a_100000102301_200012355688 [0,2,0,0,0,0|2,0,0]=4 15608 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)C)F 527a_100000102301_200012355688 [0,2,0,0,0,0|2,0,0]=4 15609 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)C 11a_100000102301_100010204433 [0,2,0,0,0,0|2,0,0]=4 15610 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)C 1626a_100000102301_100010204433 [0,2,0,0,0,0|2,0,0]=4 15611 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)C 240690a_100000102301_100010204433 [0,2,0,0,0,0|2,0,0]=4 15612 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)C 527a_100000102301_100010204433 [0,2,0,0,0,0|2,0,0]=4 15613 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)Cl 11a_100000102301_100012921620 [0,2,0,0,0,0|2,0,0]=4 15614 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)Cl 1626a_100000102301_100012921620 [0,2,0,0,0,0|2,0,0]=4 15615 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)Cl 240690a_100000102301_100012921620 [0,2,0,0,0,0|2,0,0]=4 15616 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)Cl 527a_100000102301_100012921620 [0,2,0,0,0,0|2,0,0]=4 15617 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)F 11a_100000102301_100000685074 [0,2,0,0,0,0|2,0,0]=4 15618 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)F 1626a_100000102301_100000685074 [0,2,0,0,0,0|2,0,0]=4 15619 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)F 240690a_100000102301_100000685074 [0,2,0,0,0,0|2,0,0]=4 15620 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Br)F)F 527a_100000102301_100000685074 [0,2,0,0,0,0|2,0,0]=4 15621 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)C 11a_100000102301_100000695896 [0,2,0,0,0,0|2,0,0]=4 15622 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)C 1626a_100000102301_100000695896 [0,2,0,0,0,0|2,0,0]=4 15623 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)C 240690a_100000102301_100000695896 [0,2,0,0,0,0|2,0,0]=4 15624 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)C 527a_100000102301_100000695896 [0,2,0,0,0,0|2,0,0]=4 15625 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)F 11a_100000102301_100012344525 [0,2,0,0,0,0|2,0,0]=4 15626 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)F 1626a_100000102301_100012344525 [0,2,0,0,0,0|2,0,0]=4 15627 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)F 240690a_100000102301_100012344525 [0,2,0,0,0,0|2,0,0]=4 15628 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Br)F 527a_100000102301_100012344525 [0,2,0,0,0,0|2,0,0]=4 15629 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)Br 11a_100000102301_100012920494 [0,2,0,0,0,0|2,0,0]=4 15630 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)Br 1626a_100000102301_100012920494 [0,2,0,0,0,0|2,0,0]=4 15631 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)Br 240690a_100000102301_100012920494 [0,2,0,0,0,0|2,0,0]=4 15632 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)Br 527a_100000102301_100012920494 [0,2,0,0,0,0|2,0,0]=4 15633 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)C 11a_100000102301_100011216168 [0,2,0,0,0,0|2,0,0]=4 15634 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)C 1626a_100000102301_100011216168 [0,2,0,0,0,0|2,0,0]=4 15635 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)C 240690a_100000102301_100011216168 [0,2,0,0,0,0|2,0,0]=4 15636 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)C 527a_100000102301_100011216168 [0,2,0,0,0,0|2,0,0]=4 15637 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)I 11a_100000102301_100000723791 [0,2,0,0,0,0|2,0,0]=4 15638 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)I 1626a_100000102301_100000723791 [0,2,0,0,0,0|2,0,0]=4 15639 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)I 240690a_100000102301_100000723791 [0,2,0,0,0,0|2,0,0]=4 15640 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)C)I 527a_100000102301_100000723791 [0,2,0,0,0,0|2,0,0]=4 15641 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)Cl 11a_100000102301_100010439669 [0,2,0,0,0,0|2,0,0]=4 15642 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100000102301_100010439669 [0,2,0,0,0,0|2,0,0]=4 15643 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100000102301_100010439669 [0,2,0,0,0,0|2,0,0]=4 15644 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100000102301_100010439669 [0,2,0,0,0,0|2,0,0]=4 15645 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)F 11a_100000102301_200010768543 [0,2,0,0,0,0|2,0,0]=4 15646 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)F 1626a_100000102301_200010768543 [0,2,0,0,0,0|2,0,0]=4 15647 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)F 240690a_100000102301_200010768543 [0,2,0,0,0,0|2,0,0]=4 15648 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)Cl)F 527a_100000102301_200010768543 [0,2,0,0,0,0|2,0,0]=4 15649 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)Br 11a_100000102301_100000724332 [0,2,0,0,0,0|2,0,0]=4 15650 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)Br 1626a_100000102301_100000724332 [0,2,0,0,0,0|2,0,0]=4 15651 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)Br 240690a_100000102301_100000724332 [0,2,0,0,0,0|2,0,0]=4 15652 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)Br 527a_100000102301_100000724332 [0,2,0,0,0,0|2,0,0]=4 15653 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)F 11a_100000102301_100000062099 [0,2,0,0,0,0|2,0,0]=4 15654 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)F 1626a_100000102301_100000062099 [0,2,0,0,0,0|2,0,0]=4 15655 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)F 240690a_100000102301_100000062099 [0,2,0,0,0,0|2,0,0]=4 15656 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)F 527a_100000102301_100000062099 [0,2,0,0,0,0|2,0,0]=4 15657 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)I 11a_100000102301_100013328184 [0,2,0,0,0,0|2,0,0]=4 15658 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)I 1626a_100000102301_100013328184 [0,2,0,0,0,0|2,0,0]=4 15659 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)I 240690a_100000102301_100013328184 [0,2,0,0,0,0|2,0,0]=4 15660 B16R1.3573 CCCCNC(=O)c1cc(c(cc1C)F)I 527a_100000102301_100013328184 [0,2,0,0,0,0|2,0,0]=4 15661 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)Cl 11a_100000102301_100000246132 [0,2,0,0,0,0|2,0,0]=4 15662 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)Cl 1626a_100000102301_100000246132 [0,2,0,0,0,0|2,0,0]=4 15663 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)Cl 240690a_100000102301_100000246132 [0,2,0,0,0,0|2,0,0]=4 15664 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)Cl 527a_100000102301_100000246132 [0,2,0,0,0,0|2,0,0]=4 15665 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)F 11a_100000102301_100000724438 [0,2,0,0,0,0|2,0,0]=4 15666 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)F 1626a_100000102301_100000724438 [0,2,0,0,0,0|2,0,0]=4 15667 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)F 240690a_100000102301_100000724438 [0,2,0,0,0,0|2,0,0]=4 15668 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Br)F 527a_100000102301_100000724438 [0,2,0,0,0,0|2,0,0]=4 15669 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)Cl 11a_100000102301_100013033594 [0,2,0,0,0,0|2,0,0]=4 15670 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)Cl 1626a_100000102301_100013033594 [0,2,0,0,0,0|2,0,0]=4 15671 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)Cl 240690a_100000102301_100013033594 [0,2,0,0,0,0|2,0,0]=4 15672 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)Cl 527a_100000102301_100013033594 [0,2,0,0,0,0|2,0,0]=4 15673 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)F 11a_100000102301_100009857485 [0,2,0,0,0,0|2,0,0]=4 15674 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)F 1626a_100000102301_100009857485 [0,2,0,0,0,0|2,0,0]=4 15675 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)F 240690a_100000102301_100009857485 [0,2,0,0,0,0|2,0,0]=4 15676 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)C)F 527a_100000102301_100009857485 [0,2,0,0,0,0|2,0,0]=4 15677 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_100000102301_100011934218 [0,2,0,0,0,0|2,0,0]=4 15678 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100000102301_100011934218 [0,2,0,0,0,0|2,0,0]=4 15679 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100000102301_100011934218 [0,2,0,0,0,0|2,0,0]=4 15680 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100000102301_100011934218 [0,2,0,0,0,0|2,0,0]=4 15681 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)F 11a_100000102301_100000212284 [0,2,0,0,0,0|2,0,0]=4 15682 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100000102301_100000212284 [0,2,0,0,0,0|2,0,0]=4 15683 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100000102301_100000212284 [0,2,0,0,0,0|2,0,0]=4 15684 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100000102301_100000212284 [0,2,0,0,0,0|2,0,0]=4 15685 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)C 11a_100000102301_100000687843 [0,2,0,0,0,0|2,0,0]=4 15686 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)C 1626a_100000102301_100000687843 [0,2,0,0,0,0|2,0,0]=4 15687 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)C 240690a_100000102301_100000687843 [0,2,0,0,0,0|2,0,0]=4 15688 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)C 527a_100000102301_100000687843 [0,2,0,0,0,0|2,0,0]=4 15689 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)F 11a_100000102301_100025704182 [0,2,0,0,0,0|2,0,0]=4 15690 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)F 1626a_100000102301_100025704182 [0,2,0,0,0,0|2,0,0]=4 15691 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)F 240690a_100000102301_100025704182 [0,2,0,0,0,0|2,0,0]=4 15692 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)F 527a_100000102301_100025704182 [0,2,0,0,0,0|2,0,0]=4 15693 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)I 11a_100000102301_100012920486 [0,2,0,0,0,0|2,0,0]=4 15694 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)I 1626a_100000102301_100012920486 [0,2,0,0,0,0|2,0,0]=4 15695 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)I 240690a_100000102301_100012920486 [0,2,0,0,0,0|2,0,0]=4 15696 B16R1.3573 CCCCNC(=O)c1cc(c(cc1Cl)F)I 527a_100000102301_100012920486 [0,2,0,0,0,0|2,0,0]=4 15697 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Br 11a_100000102301_200011217225 [0,2,0,0,0,0|2,0,0]=4 15698 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Br 1626a_100000102301_200011217225 [0,2,0,0,0,0|2,0,0]=4 15699 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Br 240690a_100000102301_200011217225 [0,2,0,0,0,0|2,0,0]=4 15700 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Br 527a_100000102301_200011217225 [0,2,0,0,0,0|2,0,0]=4 15701 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)C 11a_100000102301_100012354683 [0,2,0,0,0,0|2,0,0]=4 15702 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)C 1626a_100000102301_100012354683 [0,2,0,0,0,0|2,0,0]=4 15703 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)C 240690a_100000102301_100012354683 [0,2,0,0,0,0|2,0,0]=4 15704 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)C 527a_100000102301_100012354683 [0,2,0,0,0,0|2,0,0]=4 15705 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Cl 11a_100000102301_100012347732 [0,2,0,0,0,0|2,0,0]=4 15706 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Cl 1626a_100000102301_100012347732 [0,2,0,0,0,0|2,0,0]=4 15707 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Cl 240690a_100000102301_100012347732 [0,2,0,0,0,0|2,0,0]=4 15708 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)Cl 527a_100000102301_100012347732 [0,2,0,0,0,0|2,0,0]=4 15709 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)F 11a_100000102301_100012024349 [0,2,0,0,0,0|2,0,0]=4 15710 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)F 1626a_100000102301_100012024349 [0,2,0,0,0,0|2,0,0]=4 15711 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)F 240690a_100000102301_100012024349 [0,2,0,0,0,0|2,0,0]=4 15712 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Br)F 527a_100000102301_100012024349 [0,2,0,0,0,0|2,0,0]=4 15713 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Br 11a_100000102301_100012920545 [0,2,0,0,0,0|2,0,0]=4 15714 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Br 1626a_100000102301_100012920545 [0,2,0,0,0,0|2,0,0]=4 15715 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Br 240690a_100000102301_100012920545 [0,2,0,0,0,0|2,0,0]=4 15716 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Br 527a_100000102301_100012920545 [0,2,0,0,0,0|2,0,0]=4 15717 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Cl 11a_100000102301_100012180961 [0,2,0,0,0,0|2,0,0]=4 15718 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Cl 1626a_100000102301_100012180961 [0,2,0,0,0,0|2,0,0]=4 15719 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Cl 240690a_100000102301_100012180961 [0,2,0,0,0,0|2,0,0]=4 15720 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)Cl 527a_100000102301_100012180961 [0,2,0,0,0,0|2,0,0]=4 15721 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)F 11a_100000102301_100000686409 [0,2,0,0,0,0|2,0,0]=4 15722 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)F 1626a_100000102301_100000686409 [0,2,0,0,0,0|2,0,0]=4 15723 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)F 240690a_100000102301_100000686409 [0,2,0,0,0,0|2,0,0]=4 15724 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)F 527a_100000102301_100000686409 [0,2,0,0,0,0|2,0,0]=4 15725 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)C)O 240690a_100000102301_100009839767 [0,2,0,0,0,0|2,0,0]=4 15726 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Br 11a_100000102301_100011217226 [0,2,0,0,0,0|2,0,0]=4 15727 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100000102301_100011217226 [0,2,0,0,0,0|2,0,0]=4 15728 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100000102301_100011217226 [0,2,0,0,0,0|2,0,0]=4 15729 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Br 527a_100000102301_100011217226 [0,2,0,0,0,0|2,0,0]=4 15730 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Cl 11a_100000102301_100011217469 [0,2,0,0,0,0|2,0,0]=4 15731 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100000102301_100011217469 [0,2,0,0,0,0|2,0,0]=4 15732 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100000102301_100011217469 [0,2,0,0,0,0|2,0,0]=4 15733 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100000102301_100011217469 [0,2,0,0,0,0|2,0,0]=4 15734 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)F 11a_100000102301_100000690020 [0,2,0,0,0,0|2,0,0]=4 15735 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)F 1626a_100000102301_100000690020 [0,2,0,0,0,0|2,0,0]=4 15736 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)F 240690a_100000102301_100000690020 [0,2,0,0,0,0|2,0,0]=4 15737 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)F 527a_100000102301_100000690020 [0,2,0,0,0,0|2,0,0]=4 15738 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)I 11a_100000102301_100012920488 [0,2,0,0,0,0|2,0,0]=4 15739 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)I 1626a_100000102301_100012920488 [0,2,0,0,0,0|2,0,0]=4 15740 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)I 240690a_100000102301_100012920488 [0,2,0,0,0,0|2,0,0]=4 15741 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)Cl)I 527a_100000102301_100012920488 [0,2,0,0,0,0|2,0,0]=4 15742 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Br 11a_100000102301_100000718434 [0,2,0,0,0,0|2,0,0]=4 15743 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Br 1626a_100000102301_100000718434 [0,2,0,0,0,0|2,0,0]=4 15744 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Br 240690a_100000102301_100000718434 [0,2,0,0,0,0|2,0,0]=4 15745 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Br 527a_100000102301_100000718434 [0,2,0,0,0,0|2,0,0]=4 15746 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)C 11a_100000102301_100000767126 [0,2,0,0,0,0|2,0,0]=4 15747 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)C 1626a_100000102301_100000767126 [0,2,0,0,0,0|2,0,0]=4 15748 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)C 240690a_100000102301_100000767126 [0,2,0,0,0,0|2,0,0]=4 15749 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)C 527a_100000102301_100000767126 [0,2,0,0,0,0|2,0,0]=4 15750 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Cl 11a_100000102301_100011997751 [0,2,0,0,0,0|2,0,0]=4 15751 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Cl 1626a_100000102301_100011997751 [0,2,0,0,0,0|2,0,0]=4 15752 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Cl 240690a_100000102301_100011997751 [0,2,0,0,0,0|2,0,0]=4 15753 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)Cl 527a_100000102301_100011997751 [0,2,0,0,0,0|2,0,0]=4 15754 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)F 11a_100000102301_100000687535 [0,2,0,0,0,0|2,0,0]=4 15755 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)F 1626a_100000102301_100000687535 [0,2,0,0,0,0|2,0,0]=4 15756 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)F 240690a_100000102301_100000687535 [0,2,0,0,0,0|2,0,0]=4 15757 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)F 527a_100000102301_100000687535 [0,2,0,0,0,0|2,0,0]=4 15758 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)I 11a_100000102301_100000691139 [0,2,0,0,0,0|2,0,0]=4 15759 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)I 1626a_100000102301_100000691139 [0,2,0,0,0,0|2,0,0]=4 15760 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)I 240690a_100000102301_100000691139 [0,2,0,0,0,0|2,0,0]=4 15761 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)F)I 527a_100000102301_100000691139 [0,2,0,0,0,0|2,0,0]=4 15762 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)O)Cl 240690a_100000102301_200009924051 [0,2,0,0,0,0|2,0,0]=4 15763 B16R1.3573 CCCCNC(=O)c1cc(c(cc1F)O)Cl 527a_100000102301_200009924051 [0,2,0,0,0,0|2,0,0]=4 15764 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)C)C 11a_100000102301_100010184404 [0,2,0,0,0,0|2,0,0]=4 15765 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)C)C 1626a_100000102301_100010184404 [0,2,0,0,0,0|2,0,0]=4 15766 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)C)C 240690a_100000102301_100010184404 [0,2,0,0,0,0|2,0,0]=4 15767 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)C)C 527a_100000102301_100010184404 [0,2,0,0,0,0|2,0,0]=4 15768 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)F)F 11a_100000102301_100000688017 [0,2,0,0,0,0|2,0,0]=4 15769 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)F)F 1626a_100000102301_100000688017 [0,2,0,0,0,0|2,0,0]=4 15770 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)F)F 240690a_100000102301_100000688017 [0,2,0,0,0,0|2,0,0]=4 15771 B16R1.3573 CCCCNC(=O)c1cc(c(cc1I)F)F 527a_100000102301_100000688017 [0,2,0,0,0,0|2,0,0]=4 15772 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)Br)F 240690a_100000102301_100010827371 [0,2,0,0,0,0|1,0,0]=3 15773 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)Br)F 527a_100000102301_100010827371 [0,2,0,0,0,0|1,0,0]=3 15774 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)C)Br 240690a_100000102301_100010233826 [0,2,0,0,0,0|1,0,0]=3 15775 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)C)Br 527a_100000102301_100010233826 [0,2,0,0,0,0|1,0,0]=3 15776 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)C)C 240690a_100000102301_100009831561 [0,2,0,0,0,0|1,0,0]=3 15777 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)C)C 527a_100000102301_100009831561 [0,2,0,0,0,0|1,0,0]=3 15778 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100000102301_200009814723 [0,2,0,0,0,0|1,0,0]=3 15779 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100000102301_200009814723 [0,2,0,0,0,0|1,0,0]=3 15780 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)F)Br 240690a_100000102301_100010188153 [0,2,0,0,0,0|1,0,0]=3 15781 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)F)Br 527a_100000102301_100010188153 [0,2,0,0,0,0|1,0,0]=3 15782 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)F)Cl 240690a_100000102301_100009910333 [0,2,0,0,0,0|1,0,0]=3 15783 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)F)Cl 527a_100000102301_100009910333 [0,2,0,0,0,0|1,0,0]=3 15784 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)F)F 240690a_100000102301_100012182723 [0,2,0,0,0,0|1,0,0]=3 15785 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)F)F 527a_100000102301_100012182723 [0,2,0,0,0,0|1,0,0]=3 15786 B16R1.3573 CCCCNC(=O)c1cc(c(cc1O)O)Br 527a_100000102301_100009813906 [0,2,0,0,0,0|1,0,0]=3 15787 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)Br)F 22a_100000740057_100010827371 [0,2,0,0,0,0|2,0,0]=4 15788 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)C)Br 22a_100000740057_100010233826 [0,2,0,0,0,0|2,0,0]=4 15789 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)C)C 22a_100000740057_100009831561 [0,2,0,0,0,0|2,0,0]=4 15790 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)Cl)Br 22a_100000740057_200009814723 [0,2,0,0,0,0|2,0,0]=4 15791 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)F)Br 22a_100000740057_100010188153 [0,2,0,0,0,0|2,0,0]=4 15792 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)F)Cl 22a_100000740057_100009910333 [0,2,0,0,0,0|2,0,0]=4 15793 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)F)F 22a_100000740057_100012182723 [0,2,0,0,0,0|2,0,0]=4 15794 B16R1.3573 CCCNNC(=O)c1cc(c(cc1O)O)Br 22a_100000740057_100009813906 [0,2,0,0,0,0|2,0,0]=4 15795 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100011215890 [0,2,0,0,0,0|2,0,0]=4 15796 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100011215890 [0,2,0,0,0,0|2,0,0]=4 15797 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100011215890 [0,2,0,0,0,0|2,0,0]=4 15798 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100011215890 [0,2,0,0,0,0|2,0,0]=4 15799 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100011215890 [0,2,0,0,0,0|2,0,0]=4 15800 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100011215890 [0,2,0,0,0,0|2,0,0]=4 15801 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100011215890 [0,2,0,0,0,0|2,0,0]=4 15802 B16R1.3573 CCOCCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100011215890 [0,2,0,0,0,0|2,0,0]=4 15803 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000757381 [0,2,0,0,0,0|2,0,0]=4 15804 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000757381 [0,2,0,0,0,0|2,0,0]=4 15805 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000757381 [0,2,0,0,0,0|2,0,0]=4 15806 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000757381 [0,2,0,0,0,0|2,0,0]=4 15807 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000757381 [0,2,0,0,0,0|2,0,0]=4 15808 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000757381 [0,2,0,0,0,0|2,0,0]=4 15809 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000757381 [0,2,0,0,0,0|2,0,0]=4 15810 B16R1.3573 CCSCCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000757381 [0,2,0,0,0,0|2,0,0]=4 15811 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000740836 [0,2,0,0,0,0|2,0,0]=4 15812 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000740836 [0,2,0,0,0,0|2,0,0]=4 15813 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000740836 [0,2,0,0,0,0|2,0,0]=4 15814 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000740836 [0,2,0,0,0,0|2,0,0]=4 15815 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000740836 [0,2,0,0,0,0|2,0,0]=4 15816 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000740836 [0,2,0,0,0,0|2,0,0]=4 15817 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000740836 [0,2,0,0,0,0|2,0,0]=4 15818 B16R1.3573 COCCCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000740836 [0,2,0,0,0,0|2,0,0]=4 15819 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)Br)F 240690a_100000209980_100010827371 [0,2,0,0,0,0|2,0,0]=4 15820 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)Br)F 527a_100000209980_100010827371 [0,2,0,0,0,0|2,0,0]=4 15821 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)C)Br 240690a_100000209980_100010233826 [0,2,0,0,0,0|2,0,0]=4 15822 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)C)Br 527a_100000209980_100010233826 [0,2,0,0,0,0|2,0,0]=4 15823 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)C)C 240690a_100000209980_100009831561 [0,2,0,0,0,0|2,0,0]=4 15824 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)C)C 527a_100000209980_100009831561 [0,2,0,0,0,0|2,0,0]=4 15825 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100000209980_200009814723 [0,2,0,0,0,0|2,0,0]=4 15826 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100000209980_200009814723 [0,2,0,0,0,0|2,0,0]=4 15827 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)F)Br 240690a_100000209980_100010188153 [0,2,0,0,0,0|2,0,0]=4 15828 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)F)Br 527a_100000209980_100010188153 [0,2,0,0,0,0|2,0,0]=4 15829 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)F)Cl 240690a_100000209980_100009910333 [0,2,0,0,0,0|2,0,0]=4 15830 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)F)Cl 527a_100000209980_100009910333 [0,2,0,0,0,0|2,0,0]=4 15831 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)F)F 240690a_100000209980_100012182723 [0,2,0,0,0,0|2,0,0]=4 15832 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)F)F 527a_100000209980_100012182723 [0,2,0,0,0,0|2,0,0]=4 15833 B16R1.3573 COCCNC(=O)c1cc(c(cc1O)O)Br 527a_100000209980_100009813906 [0,2,0,0,0,0|2,0,0]=4 15834 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)Br)F 240690a_100020590264_100010827371 [0,2,0,0,0,0|2,0,0]=4 15835 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)Br)F 527a_100020590264_100010827371 [0,2,0,0,0,0|2,0,0]=4 15836 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)C)Br 240690a_100020590264_100010233826 [0,2,0,0,0,0|2,0,0]=4 15837 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)C)Br 527a_100020590264_100010233826 [0,2,0,0,0,0|2,0,0]=4 15838 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)C)C 240690a_100020590264_100009831561 [0,2,0,0,0,0|2,0,0]=4 15839 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)C)C 527a_100020590264_100009831561 [0,2,0,0,0,0|2,0,0]=4 15840 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100020590264_200009814723 [0,2,0,0,0,0|2,0,0]=4 15841 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100020590264_200009814723 [0,2,0,0,0,0|2,0,0]=4 15842 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)F)Br 240690a_100020590264_100010188153 [0,2,0,0,0,0|2,0,0]=4 15843 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)F)Br 527a_100020590264_100010188153 [0,2,0,0,0,0|2,0,0]=4 15844 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)F)Cl 240690a_100020590264_100009910333 [0,2,0,0,0,0|2,0,0]=4 15845 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)F)Cl 527a_100020590264_100009910333 [0,2,0,0,0,0|2,0,0]=4 15846 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)F)F 240690a_100020590264_100012182723 [0,2,0,0,0,0|2,0,0]=4 15847 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)F)F 527a_100020590264_100012182723 [0,2,0,0,0,0|2,0,0]=4 15848 B16R1.3573 CSCCNC(=O)c1cc(c(cc1O)O)Br 527a_100020590264_100009813906 [0,2,0,0,0,0|2,0,0]=4 15849 B16R1.3573 Cc1cc(c(cc1Br)C(=O)CCCCF)O 1458a_100010233826_100000729493 [0,2,0,0,0,0|2,0,0]=4 15850 B16R1.3573 Cc1cc(c(cc1Br)C(=O)CCCCO)O 1458a_100010233826_100000210776 [0,2,0,0,0,0|2,0,0]=4 15851 B16R1.3573 Cc1cc(c(cc1Br)C(=O)NCCCF)O 240690a_100015189416_100010233826 [0,2,0,0,0,0|2,0,0]=4 15852 B16R1.3573 Cc1cc(c(cc1Br)C(=O)NCCCF)O 527a_100015189416_100010233826 [0,2,0,0,0,0|2,0,0]=4 15853 B16R1.3573 Cc1cc(c(cc1Br)C(=O)NCCCO)O 240690a_100000182051_100010233826 [0,2,0,0,0,0|2,0,0]=4 15854 B16R1.3573 Cc1cc(c(cc1Br)C(=O)NCCCO)O 527a_100000182051_100010233826 [0,2,0,0,0,0|2,0,0]=4 15855 B16R1.3573 Cc1cc(c(cc1C)C(=O)CCCCF)O 1458a_100009831561_100000729493 [0,2,0,0,0,0|2,0,0]=4 15856 B16R1.3573 Cc1cc(c(cc1C)C(=O)CCCCO)O 1458a_100009831561_100000210776 [0,2,0,0,0,0|2,0,0]=4 15857 B16R1.3573 Cc1cc(c(cc1C)C(=O)NCCCF)O 240690a_100015189416_100009831561 [0,2,0,0,0,0|2,0,0]=4 15858 B16R1.3573 Cc1cc(c(cc1C)C(=O)NCCCF)O 527a_100015189416_100009831561 [0,2,0,0,0,0|2,0,0]=4 15859 B16R1.3573 Cc1cc(c(cc1C)C(=O)NCCCO)O 240690a_100000182051_100009831561 [0,2,0,0,0,0|2,0,0]=4 15860 B16R1.3573 Cc1cc(c(cc1C)C(=O)NCCCO)O 527a_100000182051_100009831561 [0,2,0,0,0,0|2,0,0]=4 15861 B16R1.3573 O=C(CCCCF)c1cc(c(cc1O)Br)F 1458a_100010827371_100000729493 [0,2,0,0,0,0|2,0,0]=4 15862 B16R1.3573 O=C(CCCCF)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000729493 [0,2,0,0,0,0|2,0,0]=4 15863 B16R1.3573 O=C(CCCCF)c1cc(c(cc1O)F)Br 1458a_100010188153_100000729493 [0,2,0,0,0,0|2,0,0]=4 15864 B16R1.3573 O=C(CCCCF)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000729493 [0,2,0,0,0,0|2,0,0]=4 15865 B16R1.3573 O=C(CCCCF)c1cc(c(cc1O)F)F 1458a_100012182723_100000729493 [0,2,0,0,0,0|2,0,0]=4 15866 B16R1.3573 O=C(CCCCF)c1cc(c(cc1O)O)Br 1458a_100009813906_100000729493 [0,2,0,0,0,0|2,0,0]=4 15867 B16R1.3573 O=C(CCCCO)c1cc(c(cc1O)Br)F 1458a_100010827371_100000210776 [0,2,0,0,0,0|2,0,0]=4 15868 B16R1.3573 O=C(CCCCO)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210776 [0,2,0,0,0,0|2,0,0]=4 15869 B16R1.3573 O=C(CCCCO)c1cc(c(cc1O)F)Br 1458a_100010188153_100000210776 [0,2,0,0,0,0|2,0,0]=4 15870 B16R1.3573 O=C(CCCCO)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000210776 [0,2,0,0,0,0|2,0,0]=4 15871 B16R1.3573 O=C(CCCCO)c1cc(c(cc1O)F)F 1458a_100012182723_100000210776 [0,2,0,0,0,0|2,0,0]=4 15872 B16R1.3573 O=C(CCCCO)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210776 [0,2,0,0,0,0|2,0,0]=4 15873 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)Br)F 240690a_100015189416_100010827371 [0,2,0,0,0,0|2,0,0]=4 15874 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)Br)F 527a_100015189416_100010827371 [0,2,0,0,0,0|2,0,0]=4 15875 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)Cl)Br 240690a_100015189416_200009814723 [0,2,0,0,0,0|2,0,0]=4 15876 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)Cl)Br 527a_100015189416_200009814723 [0,2,0,0,0,0|2,0,0]=4 15877 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)F)Br 240690a_100015189416_100010188153 [0,2,0,0,0,0|2,0,0]=4 15878 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)F)Br 527a_100015189416_100010188153 [0,2,0,0,0,0|2,0,0]=4 15879 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)F)Cl 240690a_100015189416_100009910333 [0,2,0,0,0,0|2,0,0]=4 15880 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)F)Cl 527a_100015189416_100009910333 [0,2,0,0,0,0|2,0,0]=4 15881 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)F)F 240690a_100015189416_100012182723 [0,2,0,0,0,0|2,0,0]=4 15882 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)F)F 527a_100015189416_100012182723 [0,2,0,0,0,0|2,0,0]=4 15883 B16R1.3573 O=C(NCCCF)c1cc(c(cc1O)O)Br 527a_100015189416_100009813906 [0,2,0,0,0,0|2,0,0]=4 15884 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)Br)F 240690a_100000182051_100010827371 [0,2,0,0,0,0|2,0,0]=4 15885 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)Br)F 527a_100000182051_100010827371 [0,2,0,0,0,0|2,0,0]=4 15886 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)Cl)Br 240690a_100000182051_200009814723 [0,2,0,0,0,0|2,0,0]=4 15887 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)Cl)Br 527a_100000182051_200009814723 [0,2,0,0,0,0|2,0,0]=4 15888 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)F)Br 240690a_100000182051_100010188153 [0,2,0,0,0,0|2,0,0]=4 15889 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)F)Br 527a_100000182051_100010188153 [0,2,0,0,0,0|2,0,0]=4 15890 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)F)Cl 240690a_100000182051_100009910333 [0,2,0,0,0,0|2,0,0]=4 15891 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)F)Cl 527a_100000182051_100009910333 [0,2,0,0,0,0|2,0,0]=4 15892 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)F)F 240690a_100000182051_100012182723 [0,2,0,0,0,0|2,0,0]=4 15893 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)F)F 527a_100000182051_100012182723 [0,2,0,0,0,0|2,0,0]=4 15894 B16R1.3573 O=C(NCCCO)c1cc(c(cc1O)O)Br 527a_100000182051_100009813906 [0,2,0,0,0,0|2,0,0]=4 15895 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000211992_200009828000 [0,2,0,0,0,0|1,0,1]=4 15896 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000747444 [0,2,0,0,0,0|1,0,1]=4 15897 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)C 1458a_100000229998_100000747444 [0,2,0,0,0,0|1,0,1]=4 15898 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000211992_200009816716 [0,2,0,0,0,0|1,0,1]=4 15899 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000747444 [0,2,0,0,0,0|1,0,1]=4 15900 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)F 1458a_100000211992_100000047744 [0,2,0,0,0,0|1,0,1]=4 15901 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100000747444 [0,2,0,0,0,0|1,0,1]=4 15902 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100000747444 [0,2,0,0,0,0|1,0,1]=4 15903 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000211992_100009814097 [0,2,0,0,0,0|1,0,1]=4 15904 B16R1.4212 CCCC(=O)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100000747444 [0,2,0,0,0,0|1,0,1]=4 15905 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011216630 [0,2,0,0,0,0|2,0,0]=4 15906 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Br)C 1458a_100000689033_100011216630 [0,2,0,0,0,0|2,0,0]=4 15907 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011216630 [0,2,0,0,0,0|2,0,0]=4 15908 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011216630 [0,2,0,0,0,0|2,0,0]=4 15909 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011216630 [0,2,0,0,0,0|2,0,0]=4 15910 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011216630 [0,2,0,0,0,0|2,0,0]=4 15911 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1C)Br 1458a_100000759961_100011216630 [0,2,0,0,0,0|2,0,0]=4 15912 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1C)C 1458a_100000195421_100011216630 [0,2,0,0,0,0|2,0,0]=4 15913 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100011216630 [0,2,0,0,0,0|2,0,0]=4 15914 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1C)F 1458a_100000240043_100011216630 [0,2,0,0,0,0|2,0,0]=4 15915 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1C)I 1458a_100000688012_100011216630 [0,2,0,0,0,0|2,0,0]=4 15916 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1C)O 1458a_100000687834_100011216630 [0,2,0,0,0,0|2,0,0]=4 15917 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011216630 [0,2,0,0,0,0|2,0,0]=4 15918 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100011216630 [0,2,0,0,0,0|2,0,0]=4 15919 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011216630 [0,2,0,0,0,0|2,0,0]=4 15920 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011216630 [0,2,0,0,0,0|2,0,0]=4 15921 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011216630 [0,2,0,0,0,0|2,0,0]=4 15922 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011216630 [0,2,0,0,0,0|2,0,0]=4 15923 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011216630 [0,2,0,0,0,0|2,0,0]=4 15924 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1F)C 1458a_100000749327_100011216630 [0,2,0,0,0,0|2,0,0]=4 15925 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011216630 [0,2,0,0,0,0|2,0,0]=4 15926 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1F)F 1458a_100000198512_100011216630 [0,2,0,0,0,0|2,0,0]=4 15927 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1F)I 1458a_100000688014_100011216630 [0,2,0,0,0,0|2,0,0]=4 15928 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1F)O 1458a_100000037260_100011216630 [0,2,0,0,0,0|2,0,0]=4 15929 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011216630 [0,2,0,0,0,0|2,0,0]=4 15930 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1I)C 1458a_100000057929_100011216630 [0,2,0,0,0,0|2,0,0]=4 15931 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011216630 [0,2,0,0,0,0|2,0,0]=4 15932 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1I)F 1458a_100000748905_100011216630 [0,2,0,0,0,0|2,0,0]=4 15933 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1I)I 1458a_100000750460_100011216630 [0,2,0,0,0,0|2,0,0]=4 15934 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1I)O 1458a_200009995701_100011216630 [0,2,0,0,0,0|2,0,0]=4 15935 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011216630 [0,2,0,0,0,0|1,0,0]=3 15936 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1O)C 1458a_100000229998_100011216630 [0,2,0,0,0,0|1,0,0]=3 15937 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011216630 [0,2,0,0,0,0|1,0,0]=3 15938 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1O)F 1458a_100000742286_100011216630 [0,2,0,0,0,0|1,0,0]=3 15939 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1O)I 1458a_100000212111_100011216630 [0,2,0,0,0,0|1,0,0]=3 15940 B16R1.4212 CCCC(C)CC(=O)c1cc(ccc1O)O 1458a_100000758025_100011216630 [0,2,0,0,0,0|1,0,0]=3 15941 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Br 11a_100000741246_100000690610 [0,2,0,0,0,0|2,0,0]=4 15942 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Br 1626a_100000741246_100000690610 [0,2,0,0,0,0|2,0,0]=4 15943 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Br 240690a_100000741246_100000690610 [0,2,0,0,0,0|2,0,0]=4 15944 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Br 527a_100000741246_100000690610 [0,2,0,0,0,0|2,0,0]=4 15945 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)C 11a_100000741246_100000689033 [0,2,0,0,0,0|2,0,0]=4 15946 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)C 1626a_100000741246_100000689033 [0,2,0,0,0,0|2,0,0]=4 15947 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)C 240690a_100000741246_100000689033 [0,2,0,0,0,0|2,0,0]=4 15948 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)C 527a_100000741246_100000689033 [0,2,0,0,0,0|2,0,0]=4 15949 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Cl 11a_100000741246_100000736951 [0,2,0,0,0,0|2,0,0]=4 15950 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Cl 1626a_100000741246_100000736951 [0,2,0,0,0,0|2,0,0]=4 15951 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Cl 240690a_100000741246_100000736951 [0,2,0,0,0,0|2,0,0]=4 15952 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)Cl 527a_100000741246_100000736951 [0,2,0,0,0,0|2,0,0]=4 15953 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)F 11a_100000741246_100000212315 [0,2,0,0,0,0|2,0,0]=4 15954 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)F 1626a_100000741246_100000212315 [0,2,0,0,0,0|2,0,0]=4 15955 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)F 240690a_100000741246_100000212315 [0,2,0,0,0,0|2,0,0]=4 15956 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)F 527a_100000741246_100000212315 [0,2,0,0,0,0|2,0,0]=4 15957 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)I 11a_100000741246_100000698340 [0,2,0,0,0,0|2,0,0]=4 15958 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)I 1626a_100000741246_100000698340 [0,2,0,0,0,0|2,0,0]=4 15959 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)I 240690a_100000741246_100000698340 [0,2,0,0,0,0|2,0,0]=4 15960 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)I 527a_100000741246_100000698340 [0,2,0,0,0,0|2,0,0]=4 15961 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)O 240690a_100000741246_100012352043 [0,2,0,0,0,0|2,0,0]=4 15962 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Br)O 527a_100000741246_100012352043 [0,2,0,0,0,0|2,0,0]=4 15963 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Br 11a_100000741246_100000759961 [0,2,0,0,0,0|2,0,0]=4 15964 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Br 1626a_100000741246_100000759961 [0,2,0,0,0,0|2,0,0]=4 15965 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Br 240690a_100000741246_100000759961 [0,2,0,0,0,0|2,0,0]=4 15966 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Br 527a_100000741246_100000759961 [0,2,0,0,0,0|2,0,0]=4 15967 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)C 11a_100000741246_100000195421 [0,2,0,0,0,0|2,0,0]=4 15968 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)C 1626a_100000741246_100000195421 [0,2,0,0,0,0|2,0,0]=4 15969 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)C 240690a_100000741246_100000195421 [0,2,0,0,0,0|2,0,0]=4 15970 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)C 527a_100000741246_100000195421 [0,2,0,0,0,0|2,0,0]=4 15971 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Cl 11a_100000741246_100000692595 [0,2,0,0,0,0|2,0,0]=4 15972 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Cl 1626a_100000741246_100000692595 [0,2,0,0,0,0|2,0,0]=4 15973 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Cl 240690a_100000741246_100000692595 [0,2,0,0,0,0|2,0,0]=4 15974 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)Cl 527a_100000741246_100000692595 [0,2,0,0,0,0|2,0,0]=4 15975 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)F 11a_100000741246_100000240043 [0,2,0,0,0,0|2,0,0]=4 15976 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)F 1626a_100000741246_100000240043 [0,2,0,0,0,0|2,0,0]=4 15977 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)F 240690a_100000741246_100000240043 [0,2,0,0,0,0|2,0,0]=4 15978 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)F 527a_100000741246_100000240043 [0,2,0,0,0,0|2,0,0]=4 15979 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)I 11a_100000741246_100000688012 [0,2,0,0,0,0|2,0,0]=4 15980 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)I 1626a_100000741246_100000688012 [0,2,0,0,0,0|2,0,0]=4 15981 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)I 240690a_100000741246_100000688012 [0,2,0,0,0,0|2,0,0]=4 15982 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)I 527a_100000741246_100000688012 [0,2,0,0,0,0|2,0,0]=4 15983 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1C)O 240690a_100000741246_100000687834 [0,2,0,0,0,0|2,0,0]=4 15984 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Br 11a_100000741246_100000211212 [0,2,0,0,0,0|2,0,0]=4 15985 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Br 1626a_100000741246_100000211212 [0,2,0,0,0,0|2,0,0]=4 15986 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Br 240690a_100000741246_100000211212 [0,2,0,0,0,0|2,0,0]=4 15987 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Br 527a_100000741246_100000211212 [0,2,0,0,0,0|2,0,0]=4 15988 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)C 11a_100000741246_100011290873 [0,2,0,0,0,0|2,0,0]=4 15989 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)C 1626a_100000741246_100011290873 [0,2,0,0,0,0|2,0,0]=4 15990 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)C 240690a_100000741246_100011290873 [0,2,0,0,0,0|2,0,0]=4 15991 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)C 527a_100000741246_100011290873 [0,2,0,0,0,0|2,0,0]=4 15992 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Cl 11a_100000741246_100000210642 [0,2,0,0,0,0|2,0,0]=4 15993 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Cl 1626a_100000741246_100000210642 [0,2,0,0,0,0|2,0,0]=4 15994 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Cl 240690a_100000741246_100000210642 [0,2,0,0,0,0|2,0,0]=4 15995 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)Cl 527a_100000741246_100000210642 [0,2,0,0,0,0|2,0,0]=4 15996 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)F 11a_100000741246_100011219680 [0,2,0,0,0,0|2,0,0]=4 15997 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)F 1626a_100000741246_100011219680 [0,2,0,0,0,0|2,0,0]=4 15998 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)F 240690a_100000741246_100011219680 [0,2,0,0,0,0|2,0,0]=4 15999 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)F 527a_100000741246_100011219680 [0,2,0,0,0,0|2,0,0]=4 16000 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)I 11a_100000741246_100000688013 [0,2,0,0,0,0|2,0,0]=4 16001 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)I 1626a_100000741246_100000688013 [0,2,0,0,0,0|2,0,0]=4 16002 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)I 240690a_100000741246_100000688013 [0,2,0,0,0,0|2,0,0]=4 16003 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)I 527a_100000741246_100000688013 [0,2,0,0,0,0|2,0,0]=4 16004 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)O 240690a_100000741246_100000719527 [0,2,0,0,0,0|2,0,0]=4 16005 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1Cl)O 527a_100000741246_100000719527 [0,2,0,0,0,0|2,0,0]=4 16006 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Br 11a_100000741246_100000212322 [0,2,0,0,0,0|2,0,0]=4 16007 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Br 1626a_100000741246_100000212322 [0,2,0,0,0,0|2,0,0]=4 16008 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Br 240690a_100000741246_100000212322 [0,2,0,0,0,0|2,0,0]=4 16009 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Br 527a_100000741246_100000212322 [0,2,0,0,0,0|2,0,0]=4 16010 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)C 11a_100000741246_100000749327 [0,2,0,0,0,0|2,0,0]=4 16011 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)C 1626a_100000741246_100000749327 [0,2,0,0,0,0|2,0,0]=4 16012 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)C 240690a_100000741246_100000749327 [0,2,0,0,0,0|2,0,0]=4 16013 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)C 527a_100000741246_100000749327 [0,2,0,0,0,0|2,0,0]=4 16014 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Cl 11a_100000741246_100000214954 [0,2,0,0,0,0|2,0,0]=4 16015 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Cl 1626a_100000741246_100000214954 [0,2,0,0,0,0|2,0,0]=4 16016 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Cl 240690a_100000741246_100000214954 [0,2,0,0,0,0|2,0,0]=4 16017 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)Cl 527a_100000741246_100000214954 [0,2,0,0,0,0|2,0,0]=4 16018 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)F 11a_100000741246_100000198512 [0,2,0,0,0,0|2,0,0]=4 16019 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)F 1626a_100000741246_100000198512 [0,2,0,0,0,0|2,0,0]=4 16020 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)F 240690a_100000741246_100000198512 [0,2,0,0,0,0|2,0,0]=4 16021 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)F 527a_100000741246_100000198512 [0,2,0,0,0,0|2,0,0]=4 16022 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)I 11a_100000741246_100000688014 [0,2,0,0,0,0|2,0,0]=4 16023 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)I 1626a_100000741246_100000688014 [0,2,0,0,0,0|2,0,0]=4 16024 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)I 240690a_100000741246_100000688014 [0,2,0,0,0,0|2,0,0]=4 16025 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)I 527a_100000741246_100000688014 [0,2,0,0,0,0|2,0,0]=4 16026 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)O 240690a_100000741246_100000037260 [0,2,0,0,0,0|2,0,0]=4 16027 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1F)O 527a_100000741246_100000037260 [0,2,0,0,0,0|2,0,0]=4 16028 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Br 11a_100000741246_100000183945 [0,2,0,0,0,0|2,0,0]=4 16029 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Br 1626a_100000741246_100000183945 [0,2,0,0,0,0|2,0,0]=4 16030 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Br 240690a_100000741246_100000183945 [0,2,0,0,0,0|2,0,0]=4 16031 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)C 11a_100000741246_100000057929 [0,2,0,0,0,0|2,0,0]=4 16032 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)C 1626a_100000741246_100000057929 [0,2,0,0,0,0|2,0,0]=4 16033 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)C 240690a_100000741246_100000057929 [0,2,0,0,0,0|2,0,0]=4 16034 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)C 527a_100000741246_100000057929 [0,2,0,0,0,0|2,0,0]=4 16035 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Cl 11a_100000741246_100000739379 [0,2,0,0,0,0|2,0,0]=4 16036 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Cl 1626a_100000741246_100000739379 [0,2,0,0,0,0|2,0,0]=4 16037 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Cl 240690a_100000741246_100000739379 [0,2,0,0,0,0|2,0,0]=4 16038 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)Cl 527a_100000741246_100000739379 [0,2,0,0,0,0|2,0,0]=4 16039 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)F 11a_100000741246_100000748905 [0,2,0,0,0,0|2,0,0]=4 16040 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)F 1626a_100000741246_100000748905 [0,2,0,0,0,0|2,0,0]=4 16041 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)F 240690a_100000741246_100000748905 [0,2,0,0,0,0|2,0,0]=4 16042 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)F 527a_100000741246_100000748905 [0,2,0,0,0,0|2,0,0]=4 16043 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)I 11a_100000741246_100000750460 [0,2,0,0,0,0|2,0,0]=4 16044 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)I 1626a_100000741246_100000750460 [0,2,0,0,0,0|2,0,0]=4 16045 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)I 240690a_100000741246_100000750460 [0,2,0,0,0,0|2,0,0]=4 16046 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)I 527a_100000741246_100000750460 [0,2,0,0,0,0|2,0,0]=4 16047 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)O 1626a_100000741246_200009995701 [0,2,0,0,0,0|2,0,0]=4 16048 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)O 240690a_100000741246_200009995701 [0,2,0,0,0,0|2,0,0]=4 16049 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1I)O 527a_100000741246_200009995701 [0,2,0,0,0,0|2,0,0]=4 16050 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Br 1626a_100000741246_100000212140 [0,2,0,0,0,0|1,0,0]=3 16051 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Br 240690a_100000741246_100000212140 [0,2,0,0,0,0|1,0,0]=3 16052 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Br 527a_100000741246_100000212140 [0,2,0,0,0,0|1,0,0]=3 16053 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)C 240690a_100000741246_100000229998 [0,2,0,0,0,0|1,0,0]=3 16054 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)C 527a_100000741246_100000229998 [0,2,0,0,0,0|1,0,0]=3 16055 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Cl 11a_100000741246_100000212143 [0,2,0,0,0,0|1,0,0]=3 16056 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Cl 1626a_100000741246_100000212143 [0,2,0,0,0,0|1,0,0]=3 16057 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Cl 240690a_100000741246_100000212143 [0,2,0,0,0,0|1,0,0]=3 16058 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)Cl 527a_100000741246_100000212143 [0,2,0,0,0,0|1,0,0]=3 16059 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)F 240690a_100000741246_100000742286 [0,2,0,0,0,0|1,0,0]=3 16060 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)F 527a_100000741246_100000742286 [0,2,0,0,0,0|1,0,0]=3 16061 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)I 240690a_100000741246_100000212111 [0,2,0,0,0,0|1,0,0]=3 16062 B16R1.4212 CCCC(C)NC(=O)c1cc(ccc1O)I 527a_100000741246_100000212111 [0,2,0,0,0,0|1,0,0]=3 16063 B16R1.4212 CCCN(C)CC(=O)c1cc(ccc1O)Br 269982a_100000747261_200009828000 [0,2,0,0,0,0|2,0,0]=4 16064 B16R1.4212 CCCN(C)CC(=O)c1cc(ccc1O)Cl 269982a_100000747261_200009816716 [0,2,0,0,0,0|2,0,0]=4 16065 B16R1.4212 CCCN(C)CC(=O)c1cc(ccc1O)F 269982a_100000747261_100009814381 [0,2,0,0,0,0|2,0,0]=4 16066 B16R1.4212 CCCN(C)CC(=O)c1cc(ccc1O)O 269982a_100000747261_100009814097 [0,2,0,0,0,0|2,0,0]=4 16067 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Br 1626a_100000764878_100000212140 [0,2,0,0,0,0|2,0,0]=4 16068 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Br 240690a_100000764878_100000212140 [0,2,0,0,0,0|2,0,0]=4 16069 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Br 527a_100000764878_100000212140 [0,2,0,0,0,0|2,0,0]=4 16070 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)C 240690a_100000764878_100000229998 [0,2,0,0,0,0|2,0,0]=4 16071 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)C 527a_100000764878_100000229998 [0,2,0,0,0,0|2,0,0]=4 16072 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Cl 11a_100000764878_100000212143 [0,2,0,0,0,0|2,0,0]=4 16073 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Cl 1626a_100000764878_100000212143 [0,2,0,0,0,0|2,0,0]=4 16074 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Cl 240690a_100000764878_100000212143 [0,2,0,0,0,0|2,0,0]=4 16075 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)Cl 527a_100000764878_100000212143 [0,2,0,0,0,0|2,0,0]=4 16076 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)F 240690a_100000764878_100000742286 [0,2,0,0,0,0|2,0,0]=4 16077 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)F 527a_100000764878_100000742286 [0,2,0,0,0,0|2,0,0]=4 16078 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)I 240690a_100000764878_100000212111 [0,2,0,0,0,0|2,0,0]=4 16079 B16R1.4212 COC[C@@H](C)NC(=O)c1cc(ccc1O)I 527a_100000764878_100000212111 [0,2,0,0,0,0|2,0,0]=4 16080 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)Br 240690a_100000706166_100000212140 [0,2,0,0,0,0|2,0,0]=4 16081 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)Br 527a_100000706166_100000212140 [0,2,0,0,0,0|2,0,0]=4 16082 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)Cl 240690a_100000706166_100000212143 [0,2,0,0,0,0|2,0,0]=4 16083 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)Cl 527a_100000706166_100000212143 [0,2,0,0,0,0|2,0,0]=4 16084 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)F 240690a_100000706166_100000742286 [0,2,0,0,0,0|2,0,0]=4 16085 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)F 527a_100000706166_100000742286 [0,2,0,0,0,0|2,0,0]=4 16086 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)I 240690a_100000706166_100000212111 [0,2,0,0,0,0|2,0,0]=4 16087 B16R1.4212 C[C@H](CCO)NC(=O)c1cc(ccc1O)I 527a_100000706166_100000212111 [0,2,0,0,0,0|2,0,0]=4 16088 B16R1.4212 Cc1ccc(c(c1)C(=O)N[C@H](C)CCO)O 240690a_100000706166_100000229998 [0,2,0,0,0,0|2,0,0]=4 16089 B16R1.4212 Cc1ccc(c(c1)C(=O)N[C@H](C)CCO)O 527a_100000706166_100000229998 [0,2,0,0,0,0|2,0,0]=4 16090 B16R1.4595 C#CCCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100010269958 [0,2,0,0,0,0|1,0,1]=4 16091 B16R1.4595 C#CCCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100010269958 [0,2,0,0,0,0|1,0,1]=4 16092 B16R1.4595 C#CCCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100010269958 [0,2,0,0,0,0|1,0,1]=4 16093 B16R1.4595 C#CCCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100010269958 [0,2,0,0,0,0|1,0,1]=4 16094 B16R1.4595 C#CCCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100010269958 [0,2,0,0,0,0|1,0,1]=4 16095 B16R1.4595 C#CCCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100010269958 [0,2,0,0,0,0|1,0,1]=4 16096 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Br 1626a_100000718082_100000212140 [0,2,0,0,0,0|1,0,1]=4 16097 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Br 240690a_100000718082_100000212140 [0,2,0,0,0,0|1,0,1]=4 16098 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Br 527a_100000718082_100000212140 [0,2,0,0,0,0|1,0,1]=4 16099 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)C 240690a_100000718082_100000229998 [0,2,0,0,0,0|1,0,1]=4 16100 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)C 527a_100000718082_100000229998 [0,2,0,0,0,0|1,0,1]=4 16101 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Cl 11a_100000718082_100000212143 [0,2,0,0,0,0|1,0,1]=4 16102 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Cl 1626a_100000718082_100000212143 [0,2,0,0,0,0|1,0,1]=4 16103 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Cl 240690a_100000718082_100000212143 [0,2,0,0,0,0|1,0,1]=4 16104 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)Cl 527a_100000718082_100000212143 [0,2,0,0,0,0|1,0,1]=4 16105 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)F 240690a_100000718082_100000742286 [0,2,0,0,0,0|1,0,1]=4 16106 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)F 527a_100000718082_100000742286 [0,2,0,0,0,0|1,0,1]=4 16107 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)I 240690a_100000718082_100000212111 [0,2,0,0,0,0|1,0,1]=4 16108 B16R1.4595 C#CCCCNC(=O)c1cc(ccc1O)I 527a_100000718082_100000212111 [0,2,0,0,0,0|1,0,1]=4 16109 B16R1.4595 C#CCCOCC(=O)c1cc(ccc1O)Br 34a_100011215631_200009828000 [0,2,0,0,0,0|0,0,2]=4 16110 B16R1.4595 C#CCCOCC(=O)c1cc(ccc1O)F 34a_100011215631_100009814381 [0,2,0,0,0,0|0,0,2]=4 16111 B16R1.4595 C#CCCOCC(=O)c1cc(ccc1O)O 34a_100011215631_100009814097 [0,2,0,0,0,0|0,0,2]=4 16112 B16R1.4595 C/C=C/COCC(=O)c1cc(ccc1O)Br 34a_100016270725_200009828000 [0,2,0,0,0,0|0,0,2]=4 16113 B16R1.4595 C/C=C/COCC(=O)c1cc(ccc1O)F 34a_100016270725_100009814381 [0,2,0,0,0,0|0,0,2]=4 16114 B16R1.4595 C/C=C/COCC(=O)c1cc(ccc1O)O 34a_100016270725_100009814097 [0,2,0,0,0,0|0,0,2]=4 16115 B16R1.4595 C=CCCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215482 [0,2,0,0,0,0|1,0,1]=4 16116 B16R1.4595 C=CCCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100011215482 [0,2,0,0,0,0|1,0,1]=4 16117 B16R1.4595 C=CCCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215482 [0,2,0,0,0,0|1,0,1]=4 16118 B16R1.4595 C=CCCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215482 [0,2,0,0,0,0|1,0,1]=4 16119 B16R1.4595 C=CCCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215482 [0,2,0,0,0,0|1,0,1]=4 16120 B16R1.4595 C=CCCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215482 [0,2,0,0,0,0|1,0,1]=4 16121 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Br 1626a_100000700776_100000212140 [0,2,0,0,0,0|1,0,1]=4 16122 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Br 240690a_100000700776_100000212140 [0,2,0,0,0,0|1,0,1]=4 16123 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Br 527a_100000700776_100000212140 [0,2,0,0,0,0|1,0,1]=4 16124 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)C 240690a_100000700776_100000229998 [0,2,0,0,0,0|1,0,1]=4 16125 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)C 527a_100000700776_100000229998 [0,2,0,0,0,0|1,0,1]=4 16126 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Cl 11a_100000700776_100000212143 [0,2,0,0,0,0|1,0,1]=4 16127 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Cl 1626a_100000700776_100000212143 [0,2,0,0,0,0|1,0,1]=4 16128 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Cl 240690a_100000700776_100000212143 [0,2,0,0,0,0|1,0,1]=4 16129 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)Cl 527a_100000700776_100000212143 [0,2,0,0,0,0|1,0,1]=4 16130 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)F 240690a_100000700776_100000742286 [0,2,0,0,0,0|1,0,1]=4 16131 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)F 527a_100000700776_100000742286 [0,2,0,0,0,0|1,0,1]=4 16132 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)I 240690a_100000700776_100000212111 [0,2,0,0,0,0|1,0,1]=4 16133 B16R1.4595 C=CCCCNC(=O)c1cc(ccc1O)I 527a_100000700776_100000212111 [0,2,0,0,0,0|1,0,1]=4 16134 B16R1.4595 C=CCCOCC(=O)c1cc(ccc1O)Br 34a_100011205117_200009828000 [0,2,0,0,0,0|0,0,2]=4 16135 B16R1.4595 C=CCCOCC(=O)c1cc(ccc1O)F 34a_100011205117_100009814381 [0,2,0,0,0,0|0,0,2]=4 16136 B16R1.4595 C=CCCOCC(=O)c1cc(ccc1O)O 34a_100011205117_100009814097 [0,2,0,0,0,0|0,0,2]=4 16137 B16R1.4595 CC#CCOCC(=O)c1cc(ccc1O)Br 34a_100000761923_200009828000 [0,2,0,0,0,0|0,0,2]=4 16138 B16R1.4595 CC#CCOCC(=O)c1cc(ccc1O)F 34a_100000761923_100009814381 [0,2,0,0,0,0|0,0,2]=4 16139 B16R1.4595 CC#CCOCC(=O)c1cc(ccc1O)O 34a_100000761923_100009814097 [0,2,0,0,0,0|0,0,2]=4 16140 B16R1.4595 CC/C=C\CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100015370543 [0,2,0,0,0,0|1,0,1]=4 16141 B16R1.4595 CC/C=C\CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100015370543 [0,2,0,0,0,0|1,0,1]=4 16142 B16R1.4595 CC/C=C\CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100015370543 [0,2,0,0,0,0|1,0,1]=4 16143 B16R1.4595 CC/C=C\CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100015370543 [0,2,0,0,0,0|1,0,1]=4 16144 B16R1.4595 CC/C=C\CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100015370543 [0,2,0,0,0,0|1,0,1]=4 16145 B16R1.4595 CC/C=C\CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100015370543 [0,2,0,0,0,0|1,0,1]=4 16146 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210757 [0,2,0,0,0,0|2,0,0]=4 16147 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210757 [0,2,0,0,0,0|2,0,0]=4 16148 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210757 [0,2,0,0,0,0|2,0,0]=4 16149 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210757 [0,2,0,0,0,0|2,0,0]=4 16150 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210757 [0,2,0,0,0,0|2,0,0]=4 16151 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210757 [0,2,0,0,0,0|2,0,0]=4 16152 B16R1.4595 CCCCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210757 [0,2,0,0,0,0|2,0,0]=4 16153 B16R1.4595 CCCCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210757 [0,2,0,0,0,0|2,0,0]=4 16154 B16R1.4595 CCCCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210757 [0,2,0,0,0,0|2,0,0]=4 16155 B16R1.4595 CCCCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210757 [0,2,0,0,0,0|2,0,0]=4 16156 B16R1.4595 CCCCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210757 [0,2,0,0,0,0|2,0,0]=4 16157 B16R1.4595 CCCCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210757 [0,2,0,0,0,0|2,0,0]=4 16158 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210757 [0,2,0,0,0,0|2,0,0]=4 16159 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210757 [0,2,0,0,0,0|2,0,0]=4 16160 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210757 [0,2,0,0,0,0|2,0,0]=4 16161 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210757 [0,2,0,0,0,0|2,0,0]=4 16162 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210757 [0,2,0,0,0,0|2,0,0]=4 16163 B16R1.4595 CCCCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210757 [0,2,0,0,0,0|2,0,0]=4 16164 B16R1.4595 CCCCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210757 [0,2,0,0,0,0|2,0,0]=4 16165 B16R1.4595 CCCCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210757 [0,2,0,0,0,0|2,0,0]=4 16166 B16R1.4595 CCCCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210757 [0,2,0,0,0,0|2,0,0]=4 16167 B16R1.4595 CCCCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210757 [0,2,0,0,0,0|2,0,0]=4 16168 B16R1.4595 CCCCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210757 [0,2,0,0,0,0|2,0,0]=4 16169 B16R1.4595 CCCCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210757 [0,2,0,0,0,0|2,0,0]=4 16170 B16R1.4595 CCCCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210757 [0,2,0,0,0,0|2,0,0]=4 16171 B16R1.4595 CCCCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210757 [0,2,0,0,0,0|2,0,0]=4 16172 B16R1.4595 CCCCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210757 [0,2,0,0,0,0|2,0,0]=4 16173 B16R1.4595 CCCCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210757 [0,2,0,0,0,0|2,0,0]=4 16174 B16R1.4595 CCCCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210757 [0,2,0,0,0,0|2,0,0]=4 16175 B16R1.4595 CCCCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210757 [0,2,0,0,0,0|2,0,0]=4 16176 B16R1.4595 CCCCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210757 [0,2,0,0,0,0|1,0,0]=3 16177 B16R1.4595 CCCCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210757 [0,2,0,0,0,0|1,0,0]=3 16178 B16R1.4595 CCCCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210757 [0,2,0,0,0,0|1,0,0]=3 16179 B16R1.4595 CCCCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210757 [0,2,0,0,0,0|1,0,0]=3 16180 B16R1.4595 CCCCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210757 [0,2,0,0,0,0|1,0,0]=3 16181 B16R1.4595 CCCCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210757 [0,2,0,0,0,0|1,0,0]=3 16182 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Br 11a_100000209983_100000690610 [0,2,0,0,0,0|2,0,0]=4 16183 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Br 1626a_100000209983_100000690610 [0,2,0,0,0,0|2,0,0]=4 16184 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Br 240690a_100000209983_100000690610 [0,2,0,0,0,0|2,0,0]=4 16185 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Br 527a_100000209983_100000690610 [0,2,0,0,0,0|2,0,0]=4 16186 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)C 11a_100000209983_100000689033 [0,2,0,0,0,0|2,0,0]=4 16187 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)C 1626a_100000209983_100000689033 [0,2,0,0,0,0|2,0,0]=4 16188 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)C 240690a_100000209983_100000689033 [0,2,0,0,0,0|2,0,0]=4 16189 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)C 527a_100000209983_100000689033 [0,2,0,0,0,0|2,0,0]=4 16190 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Cl 11a_100000209983_100000736951 [0,2,0,0,0,0|2,0,0]=4 16191 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Cl 1626a_100000209983_100000736951 [0,2,0,0,0,0|2,0,0]=4 16192 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Cl 240690a_100000209983_100000736951 [0,2,0,0,0,0|2,0,0]=4 16193 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)Cl 527a_100000209983_100000736951 [0,2,0,0,0,0|2,0,0]=4 16194 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)F 11a_100000209983_100000212315 [0,2,0,0,0,0|2,0,0]=4 16195 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)F 1626a_100000209983_100000212315 [0,2,0,0,0,0|2,0,0]=4 16196 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)F 240690a_100000209983_100000212315 [0,2,0,0,0,0|2,0,0]=4 16197 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)F 527a_100000209983_100000212315 [0,2,0,0,0,0|2,0,0]=4 16198 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)I 11a_100000209983_100000698340 [0,2,0,0,0,0|2,0,0]=4 16199 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)I 1626a_100000209983_100000698340 [0,2,0,0,0,0|2,0,0]=4 16200 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)I 240690a_100000209983_100000698340 [0,2,0,0,0,0|2,0,0]=4 16201 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)I 527a_100000209983_100000698340 [0,2,0,0,0,0|2,0,0]=4 16202 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)O 240690a_100000209983_100012352043 [0,2,0,0,0,0|2,0,0]=4 16203 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Br)O 527a_100000209983_100012352043 [0,2,0,0,0,0|2,0,0]=4 16204 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Br 11a_100000209983_100000759961 [0,2,0,0,0,0|2,0,0]=4 16205 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Br 1626a_100000209983_100000759961 [0,2,0,0,0,0|2,0,0]=4 16206 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Br 240690a_100000209983_100000759961 [0,2,0,0,0,0|2,0,0]=4 16207 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Br 527a_100000209983_100000759961 [0,2,0,0,0,0|2,0,0]=4 16208 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)C 11a_100000209983_100000195421 [0,2,0,0,0,0|2,0,0]=4 16209 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)C 1626a_100000209983_100000195421 [0,2,0,0,0,0|2,0,0]=4 16210 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)C 240690a_100000209983_100000195421 [0,2,0,0,0,0|2,0,0]=4 16211 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)C 527a_100000209983_100000195421 [0,2,0,0,0,0|2,0,0]=4 16212 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Cl 11a_100000209983_100000692595 [0,2,0,0,0,0|2,0,0]=4 16213 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Cl 1626a_100000209983_100000692595 [0,2,0,0,0,0|2,0,0]=4 16214 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Cl 240690a_100000209983_100000692595 [0,2,0,0,0,0|2,0,0]=4 16215 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)Cl 527a_100000209983_100000692595 [0,2,0,0,0,0|2,0,0]=4 16216 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)F 11a_100000209983_100000240043 [0,2,0,0,0,0|2,0,0]=4 16217 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)F 1626a_100000209983_100000240043 [0,2,0,0,0,0|2,0,0]=4 16218 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)F 240690a_100000209983_100000240043 [0,2,0,0,0,0|2,0,0]=4 16219 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)F 527a_100000209983_100000240043 [0,2,0,0,0,0|2,0,0]=4 16220 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)I 11a_100000209983_100000688012 [0,2,0,0,0,0|2,0,0]=4 16221 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)I 1626a_100000209983_100000688012 [0,2,0,0,0,0|2,0,0]=4 16222 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)I 240690a_100000209983_100000688012 [0,2,0,0,0,0|2,0,0]=4 16223 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)I 527a_100000209983_100000688012 [0,2,0,0,0,0|2,0,0]=4 16224 B16R1.4595 CCCCCNC(=O)c1cc(ccc1C)O 240690a_100000209983_100000687834 [0,2,0,0,0,0|2,0,0]=4 16225 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Br 11a_100000209983_100000211212 [0,2,0,0,0,0|2,0,0]=4 16226 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Br 1626a_100000209983_100000211212 [0,2,0,0,0,0|2,0,0]=4 16227 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Br 240690a_100000209983_100000211212 [0,2,0,0,0,0|2,0,0]=4 16228 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Br 527a_100000209983_100000211212 [0,2,0,0,0,0|2,0,0]=4 16229 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)C 11a_100000209983_100011290873 [0,2,0,0,0,0|2,0,0]=4 16230 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)C 1626a_100000209983_100011290873 [0,2,0,0,0,0|2,0,0]=4 16231 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)C 240690a_100000209983_100011290873 [0,2,0,0,0,0|2,0,0]=4 16232 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)C 527a_100000209983_100011290873 [0,2,0,0,0,0|2,0,0]=4 16233 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Cl 11a_100000209983_100000210642 [0,2,0,0,0,0|2,0,0]=4 16234 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100000209983_100000210642 [0,2,0,0,0,0|2,0,0]=4 16235 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000209983_100000210642 [0,2,0,0,0,0|2,0,0]=4 16236 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)Cl 527a_100000209983_100000210642 [0,2,0,0,0,0|2,0,0]=4 16237 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)F 11a_100000209983_100011219680 [0,2,0,0,0,0|2,0,0]=4 16238 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)F 1626a_100000209983_100011219680 [0,2,0,0,0,0|2,0,0]=4 16239 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)F 240690a_100000209983_100011219680 [0,2,0,0,0,0|2,0,0]=4 16240 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)F 527a_100000209983_100011219680 [0,2,0,0,0,0|2,0,0]=4 16241 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)I 11a_100000209983_100000688013 [0,2,0,0,0,0|2,0,0]=4 16242 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)I 1626a_100000209983_100000688013 [0,2,0,0,0,0|2,0,0]=4 16243 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)I 240690a_100000209983_100000688013 [0,2,0,0,0,0|2,0,0]=4 16244 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)I 527a_100000209983_100000688013 [0,2,0,0,0,0|2,0,0]=4 16245 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)O 240690a_100000209983_100000719527 [0,2,0,0,0,0|2,0,0]=4 16246 B16R1.4595 CCCCCNC(=O)c1cc(ccc1Cl)O 527a_100000209983_100000719527 [0,2,0,0,0,0|2,0,0]=4 16247 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Br 11a_100000209983_100000212322 [0,2,0,0,0,0|2,0,0]=4 16248 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Br 1626a_100000209983_100000212322 [0,2,0,0,0,0|2,0,0]=4 16249 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Br 240690a_100000209983_100000212322 [0,2,0,0,0,0|2,0,0]=4 16250 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Br 527a_100000209983_100000212322 [0,2,0,0,0,0|2,0,0]=4 16251 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)C 11a_100000209983_100000749327 [0,2,0,0,0,0|2,0,0]=4 16252 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)C 1626a_100000209983_100000749327 [0,2,0,0,0,0|2,0,0]=4 16253 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)C 240690a_100000209983_100000749327 [0,2,0,0,0,0|2,0,0]=4 16254 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)C 527a_100000209983_100000749327 [0,2,0,0,0,0|2,0,0]=4 16255 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Cl 11a_100000209983_100000214954 [0,2,0,0,0,0|2,0,0]=4 16256 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Cl 1626a_100000209983_100000214954 [0,2,0,0,0,0|2,0,0]=4 16257 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Cl 240690a_100000209983_100000214954 [0,2,0,0,0,0|2,0,0]=4 16258 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)Cl 527a_100000209983_100000214954 [0,2,0,0,0,0|2,0,0]=4 16259 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)F 11a_100000209983_100000198512 [0,2,0,0,0,0|2,0,0]=4 16260 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)F 1626a_100000209983_100000198512 [0,2,0,0,0,0|2,0,0]=4 16261 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)F 240690a_100000209983_100000198512 [0,2,0,0,0,0|2,0,0]=4 16262 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)F 527a_100000209983_100000198512 [0,2,0,0,0,0|2,0,0]=4 16263 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)I 11a_100000209983_100000688014 [0,2,0,0,0,0|2,0,0]=4 16264 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)I 1626a_100000209983_100000688014 [0,2,0,0,0,0|2,0,0]=4 16265 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)I 240690a_100000209983_100000688014 [0,2,0,0,0,0|2,0,0]=4 16266 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)I 527a_100000209983_100000688014 [0,2,0,0,0,0|2,0,0]=4 16267 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)O 240690a_100000209983_100000037260 [0,2,0,0,0,0|2,0,0]=4 16268 B16R1.4595 CCCCCNC(=O)c1cc(ccc1F)O 527a_100000209983_100000037260 [0,2,0,0,0,0|2,0,0]=4 16269 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Br 11a_100000209983_100000183945 [0,2,0,0,0,0|2,0,0]=4 16270 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Br 1626a_100000209983_100000183945 [0,2,0,0,0,0|2,0,0]=4 16271 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Br 240690a_100000209983_100000183945 [0,2,0,0,0,0|2,0,0]=4 16272 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)C 11a_100000209983_100000057929 [0,2,0,0,0,0|2,0,0]=4 16273 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)C 1626a_100000209983_100000057929 [0,2,0,0,0,0|2,0,0]=4 16274 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)C 240690a_100000209983_100000057929 [0,2,0,0,0,0|2,0,0]=4 16275 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)C 527a_100000209983_100000057929 [0,2,0,0,0,0|2,0,0]=4 16276 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Cl 11a_100000209983_100000739379 [0,2,0,0,0,0|2,0,0]=4 16277 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Cl 1626a_100000209983_100000739379 [0,2,0,0,0,0|2,0,0]=4 16278 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Cl 240690a_100000209983_100000739379 [0,2,0,0,0,0|2,0,0]=4 16279 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)Cl 527a_100000209983_100000739379 [0,2,0,0,0,0|2,0,0]=4 16280 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)F 11a_100000209983_100000748905 [0,2,0,0,0,0|2,0,0]=4 16281 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)F 1626a_100000209983_100000748905 [0,2,0,0,0,0|2,0,0]=4 16282 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)F 240690a_100000209983_100000748905 [0,2,0,0,0,0|2,0,0]=4 16283 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)F 527a_100000209983_100000748905 [0,2,0,0,0,0|2,0,0]=4 16284 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)I 11a_100000209983_100000750460 [0,2,0,0,0,0|2,0,0]=4 16285 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)I 1626a_100000209983_100000750460 [0,2,0,0,0,0|2,0,0]=4 16286 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)I 240690a_100000209983_100000750460 [0,2,0,0,0,0|2,0,0]=4 16287 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)I 527a_100000209983_100000750460 [0,2,0,0,0,0|2,0,0]=4 16288 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)O 1626a_100000209983_200009995701 [0,2,0,0,0,0|2,0,0]=4 16289 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)O 240690a_100000209983_200009995701 [0,2,0,0,0,0|2,0,0]=4 16290 B16R1.4595 CCCCCNC(=O)c1cc(ccc1I)O 527a_100000209983_200009995701 [0,2,0,0,0,0|2,0,0]=4 16291 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Br 1626a_100000209983_100000212140 [0,2,0,0,0,0|1,0,0]=3 16292 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Br 240690a_100000209983_100000212140 [0,2,0,0,0,0|1,0,0]=3 16293 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Br 527a_100000209983_100000212140 [0,2,0,0,0,0|1,0,0]=3 16294 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)C 240690a_100000209983_100000229998 [0,2,0,0,0,0|1,0,0]=3 16295 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)C 527a_100000209983_100000229998 [0,2,0,0,0,0|1,0,0]=3 16296 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Cl 11a_100000209983_100000212143 [0,2,0,0,0,0|1,0,0]=3 16297 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Cl 1626a_100000209983_100000212143 [0,2,0,0,0,0|1,0,0]=3 16298 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Cl 240690a_100000209983_100000212143 [0,2,0,0,0,0|1,0,0]=3 16299 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)Cl 527a_100000209983_100000212143 [0,2,0,0,0,0|1,0,0]=3 16300 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)F 240690a_100000209983_100000742286 [0,2,0,0,0,0|1,0,0]=3 16301 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)F 527a_100000209983_100000742286 [0,2,0,0,0,0|1,0,0]=3 16302 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)I 240690a_100000209983_100000212111 [0,2,0,0,0,0|1,0,0]=3 16303 B16R1.4595 CCCCCNC(=O)c1cc(ccc1O)I 527a_100000209983_100000212111 [0,2,0,0,0,0|1,0,0]=3 16304 B16R1.4595 CCCCNCC(=O)c1cc(ccc1Br)Cl 2230a_100000102301_100012361344 [0,2,0,0,0,0|2,0,0]=4 16305 B16R1.4595 CCCCNCC(=O)c1cc(ccc1C)C 2230a_100000102301_100000183774 [0,2,0,0,0,0|2,0,0]=4 16306 B16R1.4595 CCCCNCC(=O)c1cc(ccc1C)C 7a_106832991798_100000183774 [0,2,0,0,0,0|2,0,0]=4 16307 B16R1.4595 CCCCNCC(=O)c1cc(ccc1Cl)Cl 2230a_100000102301_100000183120 [0,2,0,0,0,0|2,0,0]=4 16308 B16R1.4595 CCCCNCC(=O)c1cc(ccc1F)F 7a_106832991798_100000211571 [0,2,0,0,0,0|2,0,0]=4 16309 B16R1.4595 CCCCNCC(=O)c1cc(ccc1O)Br 7a_106832991798_200009828000 [0,2,0,0,0,0|1,0,0]=3 16310 B16R1.4595 CCCCNCC(=O)c1cc(ccc1O)F 7a_106832991798_100000047744 [0,2,0,0,0,0|1,0,0]=3 16311 B16R1.4595 CCCCNCC(=O)c1cc(ccc1O)O 7a_106832991798_100009814097 [0,2,0,0,0,0|1,0,0]=3 16312 B16R1.4595 CCCCNN=C(C)c1cc(ccc1O)Br 4a_100025702795_100000212127 [0,2,0,0,0,0|2,0,0]=4 16313 B16R1.4595 CCCCNN=C(C)c1cc(ccc1O)C 4a_100025702795_100000195442 [0,2,0,0,0,0|2,0,0]=4 16314 B16R1.4595 CCCCNN=C(C)c1cc(ccc1O)Cl 4a_100025702795_100000185566 [0,2,0,0,0,0|2,0,0]=4 16315 B16R1.4595 CCCCNN=C(C)c1cc(ccc1O)F 4a_100025702795_100000182812 [0,2,0,0,0,0|2,0,0]=4 16316 B16R1.4595 CCCCNN=C(C)c1cc(ccc1O)I 4a_100025702795_100010712555 [0,2,0,0,0,0|2,0,0]=4 16317 B16R1.4595 CCCCNN=C(C)c1cc(ccc1O)O 4a_100025702795_100000183313 [0,2,0,0,0,0|2,0,0]=4 16318 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Br)Br 22a_100025702795_100000690610 [0,2,0,0,0,0|2,0,0]=4 16319 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Br)C 22a_100025702795_100000689033 [0,2,0,0,0,0|2,0,0]=4 16320 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Br)Cl 22a_100025702795_100000736951 [0,2,0,0,0,0|2,0,0]=4 16321 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Br)F 22a_100025702795_100000212315 [0,2,0,0,0,0|2,0,0]=4 16322 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Br)I 22a_100025702795_100000698340 [0,2,0,0,0,0|2,0,0]=4 16323 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Br)O 22a_100025702795_100012352043 [0,2,0,0,0,0|2,0,0]=4 16324 B16R1.4595 CCCCNNC(=O)c1cc(ccc1C)Br 22a_100025702795_100000759961 [0,2,0,0,0,0|2,0,0]=4 16325 B16R1.4595 CCCCNNC(=O)c1cc(ccc1C)C 22a_100025702795_100000195421 [0,2,0,0,0,0|2,0,0]=4 16326 B16R1.4595 CCCCNNC(=O)c1cc(ccc1C)Cl 22a_100025702795_100000692595 [0,2,0,0,0,0|2,0,0]=4 16327 B16R1.4595 CCCCNNC(=O)c1cc(ccc1C)F 22a_100025702795_100000240043 [0,2,0,0,0,0|2,0,0]=4 16328 B16R1.4595 CCCCNNC(=O)c1cc(ccc1C)I 22a_100025702795_100000688012 [0,2,0,0,0,0|2,0,0]=4 16329 B16R1.4595 CCCCNNC(=O)c1cc(ccc1C)O 22a_100025702795_100000687834 [0,2,0,0,0,0|2,0,0]=4 16330 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Cl)Br 22a_100025702795_100000211212 [0,2,0,0,0,0|2,0,0]=4 16331 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Cl)C 22a_100025702795_100011290873 [0,2,0,0,0,0|2,0,0]=4 16332 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Cl)Cl 22a_100025702795_100000210642 [0,2,0,0,0,0|2,0,0]=4 16333 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Cl)F 22a_100025702795_100011219680 [0,2,0,0,0,0|2,0,0]=4 16334 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Cl)I 22a_100025702795_100000688013 [0,2,0,0,0,0|2,0,0]=4 16335 B16R1.4595 CCCCNNC(=O)c1cc(ccc1Cl)O 22a_100025702795_100000719527 [0,2,0,0,0,0|2,0,0]=4 16336 B16R1.4595 CCCCNNC(=O)c1cc(ccc1F)Br 22a_100025702795_100000212322 [0,2,0,0,0,0|2,0,0]=4 16337 B16R1.4595 CCCCNNC(=O)c1cc(ccc1F)C 22a_100025702795_100000749327 [0,2,0,0,0,0|2,0,0]=4 16338 B16R1.4595 CCCCNNC(=O)c1cc(ccc1F)Cl 22a_100025702795_100000214954 [0,2,0,0,0,0|2,0,0]=4 16339 B16R1.4595 CCCCNNC(=O)c1cc(ccc1F)F 22a_100025702795_100000198512 [0,2,0,0,0,0|2,0,0]=4 16340 B16R1.4595 CCCCNNC(=O)c1cc(ccc1F)I 22a_100025702795_100000688014 [0,2,0,0,0,0|2,0,0]=4 16341 B16R1.4595 CCCCNNC(=O)c1cc(ccc1F)O 22a_100025702795_100000037260 [0,2,0,0,0,0|2,0,0]=4 16342 B16R1.4595 CCCCNNC(=O)c1cc(ccc1I)Br 22a_100025702795_100000183945 [0,2,0,0,0,0|2,0,0]=4 16343 B16R1.4595 CCCCNNC(=O)c1cc(ccc1I)C 22a_100025702795_100000057929 [0,2,0,0,0,0|2,0,0]=4 16344 B16R1.4595 CCCCNNC(=O)c1cc(ccc1I)Cl 22a_100025702795_100000739379 [0,2,0,0,0,0|2,0,0]=4 16345 B16R1.4595 CCCCNNC(=O)c1cc(ccc1I)F 22a_100025702795_100000748905 [0,2,0,0,0,0|2,0,0]=4 16346 B16R1.4595 CCCCNNC(=O)c1cc(ccc1I)I 22a_100025702795_100000750460 [0,2,0,0,0,0|2,0,0]=4 16347 B16R1.4595 CCCCNNC(=O)c1cc(ccc1I)O 22a_100025702795_200009995701 [0,2,0,0,0,0|2,0,0]=4 16348 B16R1.4595 CCCCNNC(=O)c1cc(ccc1O)Br 22a_100025702795_100000212140 [0,2,0,0,0,0|1,0,0]=3 16349 B16R1.4595 CCCCNNC(=O)c1cc(ccc1O)C 22a_100025702795_100000229998 [0,2,0,0,0,0|1,0,0]=3 16350 B16R1.4595 CCCCNNC(=O)c1cc(ccc1O)Cl 22a_100025702795_100000212143 [0,2,0,0,0,0|1,0,0]=3 16351 B16R1.4595 CCCCNNC(=O)c1cc(ccc1O)F 22a_100025702795_100000742286 [0,2,0,0,0,0|1,0,0]=3 16352 B16R1.4595 CCCCNNC(=O)c1cc(ccc1O)I 22a_100025702795_100000212111 [0,2,0,0,0,0|1,0,0]=3 16353 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011995733 [0,2,0,0,0,0|1,0,0]=3 16354 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100011995733 [0,2,0,0,0,0|1,0,0]=3 16355 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011995733 [0,2,0,0,0,0|1,0,0]=3 16356 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)Cl 34a_100000210227_100012361344 [0,2,0,0,0,0|1,0,0]=3 16357 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011995733 [0,2,0,0,0,0|1,0,0]=3 16358 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011995733 [0,2,0,0,0,0|1,0,0]=3 16359 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011995733 [0,2,0,0,0,0|1,0,0]=3 16360 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100011995733 [0,2,0,0,0,0|1,0,0]=3 16361 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)C 1458a_100000195421_100011995733 [0,2,0,0,0,0|1,0,0]=3 16362 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)C 34a_100000210227_100000183774 [0,2,0,0,0,0|1,0,0]=3 16363 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)C 7a_100000210227_100000183774 [0,2,0,0,0,0|1,0,0]=3 16364 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100011995733 [0,2,0,0,0,0|1,0,0]=3 16365 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)F 1458a_100000240043_100011995733 [0,2,0,0,0,0|1,0,0]=3 16366 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)I 1458a_100000688012_100011995733 [0,2,0,0,0,0|1,0,0]=3 16367 B16R1.4595 CCCCOCC(=O)c1cc(ccc1C)O 1458a_100000687834_100011995733 [0,2,0,0,0,0|1,0,0]=3 16368 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011995733 [0,2,0,0,0,0|1,0,0]=3 16369 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100011995733 [0,2,0,0,0,0|1,0,0]=3 16370 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011995733 [0,2,0,0,0,0|1,0,0]=3 16371 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011995733 [0,2,0,0,0,0|1,0,0]=3 16372 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)F 34a_100000210227_200010187420 [0,2,0,0,0,0|1,0,0]=3 16373 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011995733 [0,2,0,0,0,0|1,0,0]=3 16374 B16R1.4595 CCCCOCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011995733 [0,2,0,0,0,0|1,0,0]=3 16375 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011995733 [0,2,0,0,0,0|1,0,0]=3 16376 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)C 1458a_100000749327_100011995733 [0,2,0,0,0,0|1,0,0]=3 16377 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011995733 [0,2,0,0,0,0|1,0,0]=3 16378 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)F 1458a_100000198512_100011995733 [0,2,0,0,0,0|1,0,0]=3 16379 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)F 34a_100000210227_100000211571 [0,2,0,0,0,0|1,0,0]=3 16380 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)F 7a_100000210227_100000211571 [0,2,0,0,0,0|1,0,0]=3 16381 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)I 1458a_100000688014_100011995733 [0,2,0,0,0,0|1,0,0]=3 16382 B16R1.4595 CCCCOCC(=O)c1cc(ccc1F)O 1458a_100000037260_100011995733 [0,2,0,0,0,0|1,0,0]=3 16383 B16R1.4595 CCCCOCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011995733 [0,2,0,0,0,0|1,0,0]=3 16384 B16R1.4595 CCCCOCC(=O)c1cc(ccc1I)C 1458a_100000057929_100011995733 [0,2,0,0,0,0|1,0,0]=3 16385 B16R1.4595 CCCCOCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011995733 [0,2,0,0,0,0|1,0,0]=3 16386 B16R1.4595 CCCCOCC(=O)c1cc(ccc1I)F 1458a_100000748905_100011995733 [0,2,0,0,0,0|1,0,0]=3 16387 B16R1.4595 CCCCOCC(=O)c1cc(ccc1I)I 1458a_100000750460_100011995733 [0,2,0,0,0,0|1,0,0]=3 16388 B16R1.4595 CCCCOCC(=O)c1cc(ccc1I)O 1458a_200009995701_100011995733 [0,2,0,0,0,0|1,0,0]=3 16389 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011995733 [0,2,0,0,0,0|0,0,0]=2 16390 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)Br 34a_100000210227_200009828000 [0,2,0,0,0,0|0,0,0]=2 16391 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)Br 7a_100000210227_200009828000 [0,2,0,0,0,0|0,0,0]=2 16392 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)C 1458a_100000229998_100011995733 [0,2,0,0,0,0|0,0,0]=2 16393 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011995733 [0,2,0,0,0,0|0,0,0]=2 16394 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011995733 [0,2,0,0,0,0|0,0,0]=2 16395 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)F 34a_100000210227_100009814381 [0,2,0,0,0,0|0,0,0]=2 16396 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)F 7a_100000210227_100000047744 [0,2,0,0,0,0|0,0,0]=2 16397 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011995733 [0,2,0,0,0,0|0,0,0]=2 16398 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011995733 [0,2,0,0,0,0|0,0,0]=2 16399 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)O 34a_100000210227_100009814097 [0,2,0,0,0,0|0,0,0]=2 16400 B16R1.4595 CCCCOCC(=O)c1cc(ccc1O)O 7a_100000210227_100009814097 [0,2,0,0,0,0|0,0,0]=2 16401 B16R1.4595 CCCCSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_100000210210 [0,2,0,0,0,0|1,1,0]=4 16402 B16R1.4595 CCCCSCC(=O)c1cc(ccc1C)C 62a_100000183774_100000210210 [0,2,0,0,0,0|1,1,0]=4 16403 B16R1.4595 CCCCSCC(=O)c1cc(ccc1C)C 62a_100000210211_100000183774 [0,2,0,0,0,0|1,1,0]=4 16404 B16R1.4595 CCCCSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_100000210210 [0,2,0,0,0,0|1,1,0]=4 16405 B16R1.4595 CCCCSCC(=O)c1cc(ccc1Cl)F 62a_100000210211_200010187420 [0,2,0,0,0,0|1,1,0]=4 16406 B16R1.4595 CCCCSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_100000210210 [0,2,0,0,0,0|1,1,0]=4 16407 B16R1.4595 CCCCSCC(=O)c1cc(ccc1F)F 62a_100000210211_100000211571 [0,2,0,0,0,0|1,1,0]=4 16408 B16R1.4595 CCCCSCC(=O)c1cc(ccc1F)F 62a_100000211571_100000210210 [0,2,0,0,0,0|1,1,0]=4 16409 B16R1.4595 CCCCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000210210 [0,2,0,0,0,0|0,1,0]=3 16410 B16R1.4595 CCCCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000210210 [0,2,0,0,0,0|0,1,0]=3 16411 B16R1.4595 CCCCSCC(=O)c1cc(ccc1O)F 62a_100000210211_100009814381 [0,2,0,0,0,0|0,1,0]=3 16412 B16R1.4595 CCCCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000210210 [0,2,0,0,0,0|0,1,0]=3 16413 B16R1.4595 CCCCSCC(=O)c1cc(ccc1O)O 62a_100000210211_100009814097 [0,2,0,0,0,0|0,1,0]=3 16414 B16R1.4595 CCCCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000210210 [0,2,0,0,0,0|0,1,0]=3 16415 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011215938 [0,2,0,0,0,0|2,0,0]=4 16416 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100011215938 [0,2,0,0,0,0|2,0,0]=4 16417 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011215938 [0,2,0,0,0,0|2,0,0]=4 16418 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011215938 [0,2,0,0,0,0|2,0,0]=4 16419 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011215938 [0,2,0,0,0,0|2,0,0]=4 16420 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011215938 [0,2,0,0,0,0|2,0,0]=4 16421 B16R1.4595 CCCOCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100011215938 [0,2,0,0,0,0|2,0,0]=4 16422 B16R1.4595 CCCOCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100011215938 [0,2,0,0,0,0|2,0,0]=4 16423 B16R1.4595 CCCOCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100011215938 [0,2,0,0,0,0|2,0,0]=4 16424 B16R1.4595 CCCOCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100011215938 [0,2,0,0,0,0|2,0,0]=4 16425 B16R1.4595 CCCOCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100011215938 [0,2,0,0,0,0|2,0,0]=4 16426 B16R1.4595 CCCOCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100011215938 [0,2,0,0,0,0|2,0,0]=4 16427 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011215938 [0,2,0,0,0,0|2,0,0]=4 16428 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100011215938 [0,2,0,0,0,0|2,0,0]=4 16429 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011215938 [0,2,0,0,0,0|2,0,0]=4 16430 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011215938 [0,2,0,0,0,0|2,0,0]=4 16431 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011215938 [0,2,0,0,0,0|2,0,0]=4 16432 B16R1.4595 CCCOCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011215938 [0,2,0,0,0,0|2,0,0]=4 16433 B16R1.4595 CCCOCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011215938 [0,2,0,0,0,0|2,0,0]=4 16434 B16R1.4595 CCCOCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100011215938 [0,2,0,0,0,0|2,0,0]=4 16435 B16R1.4595 CCCOCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011215938 [0,2,0,0,0,0|2,0,0]=4 16436 B16R1.4595 CCCOCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100011215938 [0,2,0,0,0,0|2,0,0]=4 16437 B16R1.4595 CCCOCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100011215938 [0,2,0,0,0,0|2,0,0]=4 16438 B16R1.4595 CCCOCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100011215938 [0,2,0,0,0,0|2,0,0]=4 16439 B16R1.4595 CCCOCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011215938 [0,2,0,0,0,0|2,0,0]=4 16440 B16R1.4595 CCCOCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100011215938 [0,2,0,0,0,0|2,0,0]=4 16441 B16R1.4595 CCCOCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011215938 [0,2,0,0,0,0|2,0,0]=4 16442 B16R1.4595 CCCOCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100011215938 [0,2,0,0,0,0|2,0,0]=4 16443 B16R1.4595 CCCOCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100011215938 [0,2,0,0,0,0|2,0,0]=4 16444 B16R1.4595 CCCOCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100011215938 [0,2,0,0,0,0|2,0,0]=4 16445 B16R1.4595 CCCOCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215938 [0,2,0,0,0,0|1,0,0]=3 16446 B16R1.4595 CCCOCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100011215938 [0,2,0,0,0,0|1,0,0]=3 16447 B16R1.4595 CCCOCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215938 [0,2,0,0,0,0|1,0,0]=3 16448 B16R1.4595 CCCOCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215938 [0,2,0,0,0,0|1,0,0]=3 16449 B16R1.4595 CCCOCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215938 [0,2,0,0,0,0|1,0,0]=3 16450 B16R1.4595 CCCOCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215938 [0,2,0,0,0,0|1,0,0]=3 16451 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100012232248 [0,2,0,0,0,0|2,0,0]=4 16452 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100012232248 [0,2,0,0,0,0|2,0,0]=4 16453 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100012232248 [0,2,0,0,0,0|2,0,0]=4 16454 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100012232248 [0,2,0,0,0,0|2,0,0]=4 16455 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100012232248 [0,2,0,0,0,0|2,0,0]=4 16456 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100012232248 [0,2,0,0,0,0|2,0,0]=4 16457 B16R1.4595 CCOCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100012232248 [0,2,0,0,0,0|2,0,0]=4 16458 B16R1.4595 CCOCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100012232248 [0,2,0,0,0,0|2,0,0]=4 16459 B16R1.4595 CCOCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100012232248 [0,2,0,0,0,0|2,0,0]=4 16460 B16R1.4595 CCOCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100012232248 [0,2,0,0,0,0|2,0,0]=4 16461 B16R1.4595 CCOCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100012232248 [0,2,0,0,0,0|2,0,0]=4 16462 B16R1.4595 CCOCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100012232248 [0,2,0,0,0,0|2,0,0]=4 16463 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100012232248 [0,2,0,0,0,0|2,0,0]=4 16464 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100012232248 [0,2,0,0,0,0|2,0,0]=4 16465 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100012232248 [0,2,0,0,0,0|2,0,0]=4 16466 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100012232248 [0,2,0,0,0,0|2,0,0]=4 16467 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100012232248 [0,2,0,0,0,0|2,0,0]=4 16468 B16R1.4595 CCOCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100012232248 [0,2,0,0,0,0|2,0,0]=4 16469 B16R1.4595 CCOCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100012232248 [0,2,0,0,0,0|2,0,0]=4 16470 B16R1.4595 CCOCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100012232248 [0,2,0,0,0,0|2,0,0]=4 16471 B16R1.4595 CCOCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100012232248 [0,2,0,0,0,0|2,0,0]=4 16472 B16R1.4595 CCOCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100012232248 [0,2,0,0,0,0|2,0,0]=4 16473 B16R1.4595 CCOCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100012232248 [0,2,0,0,0,0|2,0,0]=4 16474 B16R1.4595 CCOCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100012232248 [0,2,0,0,0,0|2,0,0]=4 16475 B16R1.4595 CCOCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100012232248 [0,2,0,0,0,0|2,0,0]=4 16476 B16R1.4595 CCOCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100012232248 [0,2,0,0,0,0|2,0,0]=4 16477 B16R1.4595 CCOCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100012232248 [0,2,0,0,0,0|2,0,0]=4 16478 B16R1.4595 CCOCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100012232248 [0,2,0,0,0,0|2,0,0]=4 16479 B16R1.4595 CCOCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100012232248 [0,2,0,0,0,0|2,0,0]=4 16480 B16R1.4595 CCOCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100012232248 [0,2,0,0,0,0|2,0,0]=4 16481 B16R1.4595 CCOCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100012232248 [0,2,0,0,0,0|1,0,0]=3 16482 B16R1.4595 CCOCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100012232248 [0,2,0,0,0,0|1,0,0]=3 16483 B16R1.4595 CCOCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100012232248 [0,2,0,0,0,0|1,0,0]=3 16484 B16R1.4595 CCOCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100012232248 [0,2,0,0,0,0|1,0,0]=3 16485 B16R1.4595 CCOCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100012232248 [0,2,0,0,0,0|1,0,0]=3 16486 B16R1.4595 CCOCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100012232248 [0,2,0,0,0,0|1,0,0]=3 16487 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Br 11a_100011200944_100000690610 [0,2,0,0,0,0|2,0,0]=4 16488 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Br 1626a_102516460346_100000690610 [0,2,0,0,0,0|2,0,0]=4 16489 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Br 240690a_100011200944_100000690610 [0,2,0,0,0,0|2,0,0]=4 16490 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Br 527a_100011200944_100000690610 [0,2,0,0,0,0|2,0,0]=4 16491 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)C 11a_100011200944_100000689033 [0,2,0,0,0,0|2,0,0]=4 16492 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)C 1626a_102516460346_100000689033 [0,2,0,0,0,0|2,0,0]=4 16493 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)C 240690a_100011200944_100000689033 [0,2,0,0,0,0|2,0,0]=4 16494 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)C 527a_100011200944_100000689033 [0,2,0,0,0,0|2,0,0]=4 16495 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Cl 11a_100011200944_100000736951 [0,2,0,0,0,0|2,0,0]=4 16496 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Cl 1626a_102516460346_100000736951 [0,2,0,0,0,0|2,0,0]=4 16497 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Cl 240690a_100011200944_100000736951 [0,2,0,0,0,0|2,0,0]=4 16498 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)Cl 527a_100011200944_100000736951 [0,2,0,0,0,0|2,0,0]=4 16499 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)F 11a_100011200944_100000212315 [0,2,0,0,0,0|2,0,0]=4 16500 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)F 1626a_102516460346_100000212315 [0,2,0,0,0,0|2,0,0]=4 16501 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)F 240690a_100011200944_100000212315 [0,2,0,0,0,0|2,0,0]=4 16502 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)F 34a_200000206141_100000210202 [0,2,0,0,0,0|2,0,0]=4 16503 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)F 527a_100011200944_100000212315 [0,2,0,0,0,0|2,0,0]=4 16504 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)F 7a_200000206141_100000210202 [0,2,0,0,0,0|2,0,0]=4 16505 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)I 11a_100011200944_100000698340 [0,2,0,0,0,0|2,0,0]=4 16506 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)I 1626a_102516460346_100000698340 [0,2,0,0,0,0|2,0,0]=4 16507 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)I 240690a_100011200944_100000698340 [0,2,0,0,0,0|2,0,0]=4 16508 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)I 527a_100011200944_100000698340 [0,2,0,0,0,0|2,0,0]=4 16509 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)O 240690a_100011200944_100012352043 [0,2,0,0,0,0|2,0,0]=4 16510 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Br)O 527a_100011200944_100012352043 [0,2,0,0,0,0|2,0,0]=4 16511 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Br 11a_100011200944_100000759961 [0,2,0,0,0,0|2,0,0]=4 16512 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Br 1626a_102516460346_100000759961 [0,2,0,0,0,0|2,0,0]=4 16513 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Br 240690a_100011200944_100000759961 [0,2,0,0,0,0|2,0,0]=4 16514 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Br 527a_100011200944_100000759961 [0,2,0,0,0,0|2,0,0]=4 16515 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)C 11a_100011200944_100000195421 [0,2,0,0,0,0|2,0,0]=4 16516 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)C 1626a_102516460346_100000195421 [0,2,0,0,0,0|2,0,0]=4 16517 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)C 240690a_100011200944_100000195421 [0,2,0,0,0,0|2,0,0]=4 16518 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)C 527a_100011200944_100000195421 [0,2,0,0,0,0|2,0,0]=4 16519 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Cl 11a_100011200944_100000692595 [0,2,0,0,0,0|2,0,0]=4 16520 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Cl 1626a_102516460346_100000692595 [0,2,0,0,0,0|2,0,0]=4 16521 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Cl 240690a_100011200944_100000692595 [0,2,0,0,0,0|2,0,0]=4 16522 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)Cl 527a_100011200944_100000692595 [0,2,0,0,0,0|2,0,0]=4 16523 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)F 11a_100011200944_100000240043 [0,2,0,0,0,0|2,0,0]=4 16524 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)F 1626a_102516460346_100000240043 [0,2,0,0,0,0|2,0,0]=4 16525 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)F 240690a_100011200944_100000240043 [0,2,0,0,0,0|2,0,0]=4 16526 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)F 527a_100011200944_100000240043 [0,2,0,0,0,0|2,0,0]=4 16527 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)I 11a_100011200944_100000688012 [0,2,0,0,0,0|2,0,0]=4 16528 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)I 1626a_102516460346_100000688012 [0,2,0,0,0,0|2,0,0]=4 16529 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)I 240690a_100011200944_100000688012 [0,2,0,0,0,0|2,0,0]=4 16530 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)I 527a_100011200944_100000688012 [0,2,0,0,0,0|2,0,0]=4 16531 B16R1.4595 CCOCCNC(=O)c1cc(ccc1C)O 240690a_100011200944_100000687834 [0,2,0,0,0,0|2,0,0]=4 16532 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Br 11a_100011200944_100000211212 [0,2,0,0,0,0|2,0,0]=4 16533 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Br 1626a_102516460346_100000211212 [0,2,0,0,0,0|2,0,0]=4 16534 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Br 240690a_100011200944_100000211212 [0,2,0,0,0,0|2,0,0]=4 16535 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Br 527a_100011200944_100000211212 [0,2,0,0,0,0|2,0,0]=4 16536 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)C 11a_100011200944_100011290873 [0,2,0,0,0,0|2,0,0]=4 16537 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)C 1626a_102516460346_100011290873 [0,2,0,0,0,0|2,0,0]=4 16538 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)C 240690a_100011200944_100011290873 [0,2,0,0,0,0|2,0,0]=4 16539 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)C 527a_100011200944_100011290873 [0,2,0,0,0,0|2,0,0]=4 16540 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Cl 11a_100011200944_100000210642 [0,2,0,0,0,0|2,0,0]=4 16541 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Cl 1626a_102516460346_100000210642 [0,2,0,0,0,0|2,0,0]=4 16542 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100011200944_100000210642 [0,2,0,0,0,0|2,0,0]=4 16543 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)Cl 527a_100011200944_100000210642 [0,2,0,0,0,0|2,0,0]=4 16544 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)F 11a_100011200944_100011219680 [0,2,0,0,0,0|2,0,0]=4 16545 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)F 1626a_102516460346_100011219680 [0,2,0,0,0,0|2,0,0]=4 16546 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)F 240690a_100011200944_100011219680 [0,2,0,0,0,0|2,0,0]=4 16547 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)F 527a_100011200944_100011219680 [0,2,0,0,0,0|2,0,0]=4 16548 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)I 11a_100011200944_100000688013 [0,2,0,0,0,0|2,0,0]=4 16549 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)I 1626a_102516460346_100000688013 [0,2,0,0,0,0|2,0,0]=4 16550 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)I 240690a_100011200944_100000688013 [0,2,0,0,0,0|2,0,0]=4 16551 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)I 527a_100011200944_100000688013 [0,2,0,0,0,0|2,0,0]=4 16552 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)O 240690a_100011200944_100000719527 [0,2,0,0,0,0|2,0,0]=4 16553 B16R1.4595 CCOCCNC(=O)c1cc(ccc1Cl)O 527a_100011200944_100000719527 [0,2,0,0,0,0|2,0,0]=4 16554 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Br 11a_100011200944_100000212322 [0,2,0,0,0,0|2,0,0]=4 16555 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Br 1626a_102516460346_100000212322 [0,2,0,0,0,0|2,0,0]=4 16556 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Br 240690a_100011200944_100000212322 [0,2,0,0,0,0|2,0,0]=4 16557 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Br 527a_100011200944_100000212322 [0,2,0,0,0,0|2,0,0]=4 16558 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)C 11a_100011200944_100000749327 [0,2,0,0,0,0|2,0,0]=4 16559 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)C 1626a_102516460346_100000749327 [0,2,0,0,0,0|2,0,0]=4 16560 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)C 240690a_100011200944_100000749327 [0,2,0,0,0,0|2,0,0]=4 16561 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)C 527a_100011200944_100000749327 [0,2,0,0,0,0|2,0,0]=4 16562 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Cl 11a_100011200944_100000214954 [0,2,0,0,0,0|2,0,0]=4 16563 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Cl 1626a_102516460346_100000214954 [0,2,0,0,0,0|2,0,0]=4 16564 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Cl 240690a_100011200944_100000214954 [0,2,0,0,0,0|2,0,0]=4 16565 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)Cl 527a_100011200944_100000214954 [0,2,0,0,0,0|2,0,0]=4 16566 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)F 11a_100011200944_100000198512 [0,2,0,0,0,0|2,0,0]=4 16567 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)F 1626a_102516460346_100000198512 [0,2,0,0,0,0|2,0,0]=4 16568 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)F 240690a_100011200944_100000198512 [0,2,0,0,0,0|2,0,0]=4 16569 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)F 527a_100011200944_100000198512 [0,2,0,0,0,0|2,0,0]=4 16570 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)I 11a_100011200944_100000688014 [0,2,0,0,0,0|2,0,0]=4 16571 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)I 1626a_102516460346_100000688014 [0,2,0,0,0,0|2,0,0]=4 16572 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)I 240690a_100011200944_100000688014 [0,2,0,0,0,0|2,0,0]=4 16573 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)I 527a_100011200944_100000688014 [0,2,0,0,0,0|2,0,0]=4 16574 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)O 240690a_100011200944_100000037260 [0,2,0,0,0,0|2,0,0]=4 16575 B16R1.4595 CCOCCNC(=O)c1cc(ccc1F)O 527a_100011200944_100000037260 [0,2,0,0,0,0|2,0,0]=4 16576 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Br 11a_100011200944_100000183945 [0,2,0,0,0,0|2,0,0]=4 16577 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Br 1626a_102516460346_100000183945 [0,2,0,0,0,0|2,0,0]=4 16578 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Br 240690a_100011200944_100000183945 [0,2,0,0,0,0|2,0,0]=4 16579 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)C 11a_100011200944_100000057929 [0,2,0,0,0,0|2,0,0]=4 16580 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)C 1626a_102516460346_100000057929 [0,2,0,0,0,0|2,0,0]=4 16581 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)C 240690a_100011200944_100000057929 [0,2,0,0,0,0|2,0,0]=4 16582 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)C 527a_100011200944_100000057929 [0,2,0,0,0,0|2,0,0]=4 16583 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Cl 11a_100011200944_100000739379 [0,2,0,0,0,0|2,0,0]=4 16584 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Cl 1626a_102516460346_100000739379 [0,2,0,0,0,0|2,0,0]=4 16585 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Cl 240690a_100011200944_100000739379 [0,2,0,0,0,0|2,0,0]=4 16586 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)Cl 527a_100011200944_100000739379 [0,2,0,0,0,0|2,0,0]=4 16587 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)F 11a_100011200944_100000748905 [0,2,0,0,0,0|2,0,0]=4 16588 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)F 1626a_102516460346_100000748905 [0,2,0,0,0,0|2,0,0]=4 16589 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)F 240690a_100011200944_100000748905 [0,2,0,0,0,0|2,0,0]=4 16590 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)F 527a_100011200944_100000748905 [0,2,0,0,0,0|2,0,0]=4 16591 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)I 11a_100011200944_100000750460 [0,2,0,0,0,0|2,0,0]=4 16592 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)I 1626a_102516460346_100000750460 [0,2,0,0,0,0|2,0,0]=4 16593 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)I 240690a_100011200944_100000750460 [0,2,0,0,0,0|2,0,0]=4 16594 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)I 527a_100011200944_100000750460 [0,2,0,0,0,0|2,0,0]=4 16595 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)O 1626a_102516460346_200009995701 [0,2,0,0,0,0|2,0,0]=4 16596 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)O 240690a_100011200944_200009995701 [0,2,0,0,0,0|2,0,0]=4 16597 B16R1.4595 CCOCCNC(=O)c1cc(ccc1I)O 527a_100011200944_200009995701 [0,2,0,0,0,0|2,0,0]=4 16598 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Br 1626a_102516460346_100000212140 [0,2,0,0,0,0|1,0,0]=3 16599 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Br 240690a_100011200944_100000212140 [0,2,0,0,0,0|1,0,0]=3 16600 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Br 527a_100011200944_100000212140 [0,2,0,0,0,0|1,0,0]=3 16601 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)C 240690a_100011200944_100000229998 [0,2,0,0,0,0|1,0,0]=3 16602 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)C 527a_100011200944_100000229998 [0,2,0,0,0,0|1,0,0]=3 16603 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Cl 11a_100011200944_100000212143 [0,2,0,0,0,0|1,0,0]=3 16604 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Cl 1626a_102516460346_100000212143 [0,2,0,0,0,0|1,0,0]=3 16605 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Cl 240690a_100011200944_100000212143 [0,2,0,0,0,0|1,0,0]=3 16606 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)Cl 527a_100011200944_100000212143 [0,2,0,0,0,0|1,0,0]=3 16607 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)F 240690a_100011200944_100000742286 [0,2,0,0,0,0|1,0,0]=3 16608 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)F 527a_100011200944_100000742286 [0,2,0,0,0,0|1,0,0]=3 16609 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)I 240690a_100011200944_100000212111 [0,2,0,0,0,0|1,0,0]=3 16610 B16R1.4595 CCOCCNC(=O)c1cc(ccc1O)I 527a_100011200944_100000212111 [0,2,0,0,0,0|1,0,0]=3 16611 B16R1.4595 CCOCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000739092 [0,2,0,0,0,0|1,1,0]=4 16612 B16R1.4595 CCOCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000739092 [0,2,0,0,0,0|1,1,0]=4 16613 B16R1.4595 CCOCSCC(=O)c1cc(ccc1O)F 62a_100000739092_100009814381 [0,2,0,0,0,0|1,1,0]=4 16614 B16R1.4595 CCOCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000739092 [0,2,0,0,0,0|1,1,0]=4 16615 B16R1.4595 CCOCSCC(=O)c1cc(ccc1O)O 62a_100000739092_100009814097 [0,2,0,0,0,0|1,1,0]=4 16616 B16R1.4595 CCOCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000739092 [0,2,0,0,0,0|1,1,0]=4 16617 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Br 11a_100000106463_100000690610 [0,2,0,0,0,0|2,0,0]=4 16618 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Br 1626a_100000106463_100000690610 [0,2,0,0,0,0|2,0,0]=4 16619 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Br 240690a_100000106463_100000690610 [0,2,0,0,0,0|2,0,0]=4 16620 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Br 527a_100000106463_100000690610 [0,2,0,0,0,0|2,0,0]=4 16621 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)C 11a_100000106463_100000689033 [0,2,0,0,0,0|2,0,0]=4 16622 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)C 1626a_100000106463_100000689033 [0,2,0,0,0,0|2,0,0]=4 16623 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)C 240690a_100000106463_100000689033 [0,2,0,0,0,0|2,0,0]=4 16624 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)C 527a_100000106463_100000689033 [0,2,0,0,0,0|2,0,0]=4 16625 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Cl 11a_100000106463_100000736951 [0,2,0,0,0,0|2,0,0]=4 16626 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Cl 1626a_100000106463_100000736951 [0,2,0,0,0,0|2,0,0]=4 16627 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Cl 240690a_100000106463_100000736951 [0,2,0,0,0,0|2,0,0]=4 16628 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)Cl 527a_100000106463_100000736951 [0,2,0,0,0,0|2,0,0]=4 16629 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)F 11a_100000106463_100000212315 [0,2,0,0,0,0|2,0,0]=4 16630 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)F 1626a_100000106463_100000212315 [0,2,0,0,0,0|2,0,0]=4 16631 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)F 240690a_100000106463_100000212315 [0,2,0,0,0,0|2,0,0]=4 16632 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)F 527a_100000106463_100000212315 [0,2,0,0,0,0|2,0,0]=4 16633 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)I 11a_100000106463_100000698340 [0,2,0,0,0,0|2,0,0]=4 16634 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)I 1626a_100000106463_100000698340 [0,2,0,0,0,0|2,0,0]=4 16635 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)I 240690a_100000106463_100000698340 [0,2,0,0,0,0|2,0,0]=4 16636 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)I 527a_100000106463_100000698340 [0,2,0,0,0,0|2,0,0]=4 16637 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)O 240690a_100000106463_100012352043 [0,2,0,0,0,0|2,0,0]=4 16638 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Br)O 527a_100000106463_100012352043 [0,2,0,0,0,0|2,0,0]=4 16639 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Br 11a_100000106463_100000759961 [0,2,0,0,0,0|2,0,0]=4 16640 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Br 1626a_100000106463_100000759961 [0,2,0,0,0,0|2,0,0]=4 16641 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Br 240690a_100000106463_100000759961 [0,2,0,0,0,0|2,0,0]=4 16642 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Br 527a_100000106463_100000759961 [0,2,0,0,0,0|2,0,0]=4 16643 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)C 11a_100000106463_100000195421 [0,2,0,0,0,0|2,0,0]=4 16644 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)C 1626a_100000106463_100000195421 [0,2,0,0,0,0|2,0,0]=4 16645 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)C 240690a_100000106463_100000195421 [0,2,0,0,0,0|2,0,0]=4 16646 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)C 527a_100000106463_100000195421 [0,2,0,0,0,0|2,0,0]=4 16647 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Cl 11a_100000106463_100000692595 [0,2,0,0,0,0|2,0,0]=4 16648 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Cl 1626a_100000106463_100000692595 [0,2,0,0,0,0|2,0,0]=4 16649 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Cl 240690a_100000106463_100000692595 [0,2,0,0,0,0|2,0,0]=4 16650 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)Cl 527a_100000106463_100000692595 [0,2,0,0,0,0|2,0,0]=4 16651 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)F 11a_100000106463_100000240043 [0,2,0,0,0,0|2,0,0]=4 16652 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)F 1626a_100000106463_100000240043 [0,2,0,0,0,0|2,0,0]=4 16653 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)F 240690a_100000106463_100000240043 [0,2,0,0,0,0|2,0,0]=4 16654 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)F 527a_100000106463_100000240043 [0,2,0,0,0,0|2,0,0]=4 16655 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)I 11a_100000106463_100000688012 [0,2,0,0,0,0|2,0,0]=4 16656 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)I 1626a_100000106463_100000688012 [0,2,0,0,0,0|2,0,0]=4 16657 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)I 240690a_100000106463_100000688012 [0,2,0,0,0,0|2,0,0]=4 16658 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)I 527a_100000106463_100000688012 [0,2,0,0,0,0|2,0,0]=4 16659 B16R1.4595 CCSCCNC(=O)c1cc(ccc1C)O 240690a_100000106463_100000687834 [0,2,0,0,0,0|2,0,0]=4 16660 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Br 11a_100000106463_100000211212 [0,2,0,0,0,0|2,0,0]=4 16661 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Br 1626a_100000106463_100000211212 [0,2,0,0,0,0|2,0,0]=4 16662 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Br 240690a_100000106463_100000211212 [0,2,0,0,0,0|2,0,0]=4 16663 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Br 527a_100000106463_100000211212 [0,2,0,0,0,0|2,0,0]=4 16664 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)C 11a_100000106463_100011290873 [0,2,0,0,0,0|2,0,0]=4 16665 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)C 1626a_100000106463_100011290873 [0,2,0,0,0,0|2,0,0]=4 16666 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)C 240690a_100000106463_100011290873 [0,2,0,0,0,0|2,0,0]=4 16667 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)C 527a_100000106463_100011290873 [0,2,0,0,0,0|2,0,0]=4 16668 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Cl 11a_100000106463_100000210642 [0,2,0,0,0,0|2,0,0]=4 16669 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100000106463_100000210642 [0,2,0,0,0,0|2,0,0]=4 16670 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000106463_100000210642 [0,2,0,0,0,0|2,0,0]=4 16671 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)Cl 527a_100000106463_100000210642 [0,2,0,0,0,0|2,0,0]=4 16672 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)F 11a_100000106463_100011219680 [0,2,0,0,0,0|2,0,0]=4 16673 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)F 1626a_100000106463_100011219680 [0,2,0,0,0,0|2,0,0]=4 16674 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)F 240690a_100000106463_100011219680 [0,2,0,0,0,0|2,0,0]=4 16675 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)F 527a_100000106463_100011219680 [0,2,0,0,0,0|2,0,0]=4 16676 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)I 11a_100000106463_100000688013 [0,2,0,0,0,0|2,0,0]=4 16677 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)I 1626a_100000106463_100000688013 [0,2,0,0,0,0|2,0,0]=4 16678 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)I 240690a_100000106463_100000688013 [0,2,0,0,0,0|2,0,0]=4 16679 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)I 527a_100000106463_100000688013 [0,2,0,0,0,0|2,0,0]=4 16680 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)O 240690a_100000106463_100000719527 [0,2,0,0,0,0|2,0,0]=4 16681 B16R1.4595 CCSCCNC(=O)c1cc(ccc1Cl)O 527a_100000106463_100000719527 [0,2,0,0,0,0|2,0,0]=4 16682 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Br 11a_100000106463_100000212322 [0,2,0,0,0,0|2,0,0]=4 16683 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Br 1626a_100000106463_100000212322 [0,2,0,0,0,0|2,0,0]=4 16684 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Br 240690a_100000106463_100000212322 [0,2,0,0,0,0|2,0,0]=4 16685 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Br 527a_100000106463_100000212322 [0,2,0,0,0,0|2,0,0]=4 16686 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)C 11a_100000106463_100000749327 [0,2,0,0,0,0|2,0,0]=4 16687 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)C 1626a_100000106463_100000749327 [0,2,0,0,0,0|2,0,0]=4 16688 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)C 240690a_100000106463_100000749327 [0,2,0,0,0,0|2,0,0]=4 16689 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)C 527a_100000106463_100000749327 [0,2,0,0,0,0|2,0,0]=4 16690 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Cl 11a_100000106463_100000214954 [0,2,0,0,0,0|2,0,0]=4 16691 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Cl 1626a_100000106463_100000214954 [0,2,0,0,0,0|2,0,0]=4 16692 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Cl 240690a_100000106463_100000214954 [0,2,0,0,0,0|2,0,0]=4 16693 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)Cl 527a_100000106463_100000214954 [0,2,0,0,0,0|2,0,0]=4 16694 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)F 11a_100000106463_100000198512 [0,2,0,0,0,0|2,0,0]=4 16695 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)F 1626a_100000106463_100000198512 [0,2,0,0,0,0|2,0,0]=4 16696 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)F 240690a_100000106463_100000198512 [0,2,0,0,0,0|2,0,0]=4 16697 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)F 527a_100000106463_100000198512 [0,2,0,0,0,0|2,0,0]=4 16698 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)I 11a_100000106463_100000688014 [0,2,0,0,0,0|2,0,0]=4 16699 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)I 1626a_100000106463_100000688014 [0,2,0,0,0,0|2,0,0]=4 16700 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)I 240690a_100000106463_100000688014 [0,2,0,0,0,0|2,0,0]=4 16701 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)I 527a_100000106463_100000688014 [0,2,0,0,0,0|2,0,0]=4 16702 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)O 240690a_100000106463_100000037260 [0,2,0,0,0,0|2,0,0]=4 16703 B16R1.4595 CCSCCNC(=O)c1cc(ccc1F)O 527a_100000106463_100000037260 [0,2,0,0,0,0|2,0,0]=4 16704 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Br 11a_100000106463_100000183945 [0,2,0,0,0,0|2,0,0]=4 16705 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Br 1626a_100000106463_100000183945 [0,2,0,0,0,0|2,0,0]=4 16706 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Br 240690a_100000106463_100000183945 [0,2,0,0,0,0|2,0,0]=4 16707 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)C 11a_100000106463_100000057929 [0,2,0,0,0,0|2,0,0]=4 16708 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)C 1626a_100000106463_100000057929 [0,2,0,0,0,0|2,0,0]=4 16709 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)C 240690a_100000106463_100000057929 [0,2,0,0,0,0|2,0,0]=4 16710 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)C 527a_100000106463_100000057929 [0,2,0,0,0,0|2,0,0]=4 16711 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Cl 11a_100000106463_100000739379 [0,2,0,0,0,0|2,0,0]=4 16712 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Cl 1626a_100000106463_100000739379 [0,2,0,0,0,0|2,0,0]=4 16713 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Cl 240690a_100000106463_100000739379 [0,2,0,0,0,0|2,0,0]=4 16714 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)Cl 527a_100000106463_100000739379 [0,2,0,0,0,0|2,0,0]=4 16715 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)F 11a_100000106463_100000748905 [0,2,0,0,0,0|2,0,0]=4 16716 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)F 1626a_100000106463_100000748905 [0,2,0,0,0,0|2,0,0]=4 16717 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)F 240690a_100000106463_100000748905 [0,2,0,0,0,0|2,0,0]=4 16718 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)F 527a_100000106463_100000748905 [0,2,0,0,0,0|2,0,0]=4 16719 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)I 11a_100000106463_100000750460 [0,2,0,0,0,0|2,0,0]=4 16720 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)I 1626a_100000106463_100000750460 [0,2,0,0,0,0|2,0,0]=4 16721 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)I 240690a_100000106463_100000750460 [0,2,0,0,0,0|2,0,0]=4 16722 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)I 527a_100000106463_100000750460 [0,2,0,0,0,0|2,0,0]=4 16723 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)O 1626a_100000106463_200009995701 [0,2,0,0,0,0|2,0,0]=4 16724 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)O 240690a_100000106463_200009995701 [0,2,0,0,0,0|2,0,0]=4 16725 B16R1.4595 CCSCCNC(=O)c1cc(ccc1I)O 527a_100000106463_200009995701 [0,2,0,0,0,0|2,0,0]=4 16726 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Br 1626a_100000106463_100000212140 [0,2,0,0,0,0|1,0,0]=3 16727 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Br 240690a_100000106463_100000212140 [0,2,0,0,0,0|1,0,0]=3 16728 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Br 527a_100000106463_100000212140 [0,2,0,0,0,0|1,0,0]=3 16729 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)C 240690a_100000106463_100000229998 [0,2,0,0,0,0|1,0,0]=3 16730 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)C 527a_100000106463_100000229998 [0,2,0,0,0,0|1,0,0]=3 16731 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Cl 11a_100000106463_100000212143 [0,2,0,0,0,0|1,0,0]=3 16732 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Cl 1626a_100000106463_100000212143 [0,2,0,0,0,0|1,0,0]=3 16733 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Cl 240690a_100000106463_100000212143 [0,2,0,0,0,0|1,0,0]=3 16734 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)Cl 527a_100000106463_100000212143 [0,2,0,0,0,0|1,0,0]=3 16735 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)F 240690a_100000106463_100000742286 [0,2,0,0,0,0|1,0,0]=3 16736 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)F 527a_100000106463_100000742286 [0,2,0,0,0,0|1,0,0]=3 16737 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)I 240690a_100000106463_100000212111 [0,2,0,0,0,0|1,0,0]=3 16738 B16R1.4595 CCSCCNC(=O)c1cc(ccc1O)I 527a_100000106463_100000212111 [0,2,0,0,0,0|1,0,0]=3 16739 B16R1.4595 COCCCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000755781 [0,2,0,0,0,0|2,0,0]=4 16740 B16R1.4595 COCCCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000755781 [0,2,0,0,0,0|2,0,0]=4 16741 B16R1.4595 COCCCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000755781 [0,2,0,0,0,0|2,0,0]=4 16742 B16R1.4595 COCCCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000755781 [0,2,0,0,0,0|2,0,0]=4 16743 B16R1.4595 COCCCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000755781 [0,2,0,0,0,0|2,0,0]=4 16744 B16R1.4595 COCCCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000755781 [0,2,0,0,0,0|2,0,0]=4 16745 B16R1.4595 COCCCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000755781 [0,2,0,0,0,0|2,0,0]=4 16746 B16R1.4595 COCCCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000755781 [0,2,0,0,0,0|2,0,0]=4 16747 B16R1.4595 COCCCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000755781 [0,2,0,0,0,0|2,0,0]=4 16748 B16R1.4595 COCCCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000755781 [0,2,0,0,0,0|2,0,0]=4 16749 B16R1.4595 COCCCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000755781 [0,2,0,0,0,0|2,0,0]=4 16750 B16R1.4595 COCCCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000755781 [0,2,0,0,0,0|2,0,0]=4 16751 B16R1.4595 COCCCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000755781 [0,2,0,0,0,0|2,0,0]=4 16752 B16R1.4595 COCCCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000755781 [0,2,0,0,0,0|2,0,0]=4 16753 B16R1.4595 COCCCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000755781 [0,2,0,0,0,0|2,0,0]=4 16754 B16R1.4595 COCCCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000755781 [0,2,0,0,0,0|2,0,0]=4 16755 B16R1.4595 COCCCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000755781 [0,2,0,0,0,0|2,0,0]=4 16756 B16R1.4595 COCCCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000755781 [0,2,0,0,0,0|2,0,0]=4 16757 B16R1.4595 COCCCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000755781 [0,2,0,0,0,0|2,0,0]=4 16758 B16R1.4595 COCCCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000755781 [0,2,0,0,0,0|2,0,0]=4 16759 B16R1.4595 COCCCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000755781 [0,2,0,0,0,0|2,0,0]=4 16760 B16R1.4595 COCCCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000755781 [0,2,0,0,0,0|2,0,0]=4 16761 B16R1.4595 COCCCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000755781 [0,2,0,0,0,0|2,0,0]=4 16762 B16R1.4595 COCCCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000755781 [0,2,0,0,0,0|2,0,0]=4 16763 B16R1.4595 COCCCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000755781 [0,2,0,0,0,0|2,0,0]=4 16764 B16R1.4595 COCCCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000755781 [0,2,0,0,0,0|2,0,0]=4 16765 B16R1.4595 COCCCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000755781 [0,2,0,0,0,0|2,0,0]=4 16766 B16R1.4595 COCCCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000755781 [0,2,0,0,0,0|2,0,0]=4 16767 B16R1.4595 COCCCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000755781 [0,2,0,0,0,0|2,0,0]=4 16768 B16R1.4595 COCCCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000755781 [0,2,0,0,0,0|2,0,0]=4 16769 B16R1.4595 COCCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000755781 [0,2,0,0,0,0|1,0,0]=3 16770 B16R1.4595 COCCCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000755781 [0,2,0,0,0,0|1,0,0]=3 16771 B16R1.4595 COCCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000755781 [0,2,0,0,0,0|1,0,0]=3 16772 B16R1.4595 COCCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000755781 [0,2,0,0,0,0|1,0,0]=3 16773 B16R1.4595 COCCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000755781 [0,2,0,0,0,0|1,0,0]=3 16774 B16R1.4595 COCCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000755781 [0,2,0,0,0,0|1,0,0]=3 16775 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)Br 1626a_100150723488_100000690610 [0,2,0,0,0,0|2,0,0]=4 16776 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)Br 240690a_100150723488_100000690610 [0,2,0,0,0,0|2,0,0]=4 16777 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)Br 527a_100150723488_100000690610 [0,2,0,0,0,0|2,0,0]=4 16778 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)C 1626a_100150723488_100000689033 [0,2,0,0,0,0|2,0,0]=4 16779 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)C 240690a_100150723488_100000689033 [0,2,0,0,0,0|2,0,0]=4 16780 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)C 527a_100150723488_100000689033 [0,2,0,0,0,0|2,0,0]=4 16781 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)Cl 1626a_100150723488_100000736951 [0,2,0,0,0,0|2,0,0]=4 16782 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)Cl 240690a_100150723488_100000736951 [0,2,0,0,0,0|2,0,0]=4 16783 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)Cl 527a_100150723488_100000736951 [0,2,0,0,0,0|2,0,0]=4 16784 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)F 1626a_100150723488_100000212315 [0,2,0,0,0,0|2,0,0]=4 16785 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)F 240690a_100150723488_100000212315 [0,2,0,0,0,0|2,0,0]=4 16786 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)F 527a_100150723488_100000212315 [0,2,0,0,0,0|2,0,0]=4 16787 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)I 1626a_100150723488_100000698340 [0,2,0,0,0,0|2,0,0]=4 16788 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)I 240690a_100150723488_100000698340 [0,2,0,0,0,0|2,0,0]=4 16789 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)I 527a_100150723488_100000698340 [0,2,0,0,0,0|2,0,0]=4 16790 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)O 240690a_100150723488_100012352043 [0,2,0,0,0,0|2,0,0]=4 16791 B16R1.4595 COCCCNC(=O)c1cc(ccc1Br)O 527a_100150723488_100012352043 [0,2,0,0,0,0|2,0,0]=4 16792 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)Br 1626a_100150723488_100000759961 [0,2,0,0,0,0|2,0,0]=4 16793 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)Br 240690a_100150723488_100000759961 [0,2,0,0,0,0|2,0,0]=4 16794 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)Br 527a_100150723488_100000759961 [0,2,0,0,0,0|2,0,0]=4 16795 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)C 1626a_100150723488_100000195421 [0,2,0,0,0,0|2,0,0]=4 16796 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)C 240690a_100150723488_100000195421 [0,2,0,0,0,0|2,0,0]=4 16797 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)C 527a_100150723488_100000195421 [0,2,0,0,0,0|2,0,0]=4 16798 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)Cl 1626a_100150723488_100000692595 [0,2,0,0,0,0|2,0,0]=4 16799 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)Cl 240690a_100150723488_100000692595 [0,2,0,0,0,0|2,0,0]=4 16800 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)Cl 527a_100150723488_100000692595 [0,2,0,0,0,0|2,0,0]=4 16801 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)F 1626a_100150723488_100000240043 [0,2,0,0,0,0|2,0,0]=4 16802 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)F 240690a_100150723488_100000240043 [0,2,0,0,0,0|2,0,0]=4 16803 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)F 527a_100150723488_100000240043 [0,2,0,0,0,0|2,0,0]=4 16804 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)I 1626a_100150723488_100000688012 [0,2,0,0,0,0|2,0,0]=4 16805 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)I 240690a_100150723488_100000688012 [0,2,0,0,0,0|2,0,0]=4 16806 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)I 527a_100150723488_100000688012 [0,2,0,0,0,0|2,0,0]=4 16807 B16R1.4595 COCCCNC(=O)c1cc(ccc1C)O 240690a_100150723488_100000687834 [0,2,0,0,0,0|2,0,0]=4 16808 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)Br 1626a_100150723488_100000211212 [0,2,0,0,0,0|2,0,0]=4 16809 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)Br 240690a_100150723488_100000211212 [0,2,0,0,0,0|2,0,0]=4 16810 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)Br 527a_100150723488_100000211212 [0,2,0,0,0,0|2,0,0]=4 16811 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)C 1626a_100150723488_100011290873 [0,2,0,0,0,0|2,0,0]=4 16812 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)C 240690a_100150723488_100011290873 [0,2,0,0,0,0|2,0,0]=4 16813 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)C 527a_100150723488_100011290873 [0,2,0,0,0,0|2,0,0]=4 16814 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100150723488_100000210642 [0,2,0,0,0,0|2,0,0]=4 16815 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100150723488_100000210642 [0,2,0,0,0,0|2,0,0]=4 16816 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)Cl 527a_100150723488_100000210642 [0,2,0,0,0,0|2,0,0]=4 16817 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)F 1626a_100150723488_100011219680 [0,2,0,0,0,0|2,0,0]=4 16818 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)F 240690a_100150723488_100011219680 [0,2,0,0,0,0|2,0,0]=4 16819 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)F 527a_100150723488_100011219680 [0,2,0,0,0,0|2,0,0]=4 16820 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)I 1626a_100150723488_100000688013 [0,2,0,0,0,0|2,0,0]=4 16821 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)I 240690a_100150723488_100000688013 [0,2,0,0,0,0|2,0,0]=4 16822 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)I 527a_100150723488_100000688013 [0,2,0,0,0,0|2,0,0]=4 16823 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)O 240690a_100150723488_100000719527 [0,2,0,0,0,0|2,0,0]=4 16824 B16R1.4595 COCCCNC(=O)c1cc(ccc1Cl)O 527a_100150723488_100000719527 [0,2,0,0,0,0|2,0,0]=4 16825 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)Br 1626a_100150723488_100000212322 [0,2,0,0,0,0|2,0,0]=4 16826 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)Br 240690a_100150723488_100000212322 [0,2,0,0,0,0|2,0,0]=4 16827 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)Br 527a_100150723488_100000212322 [0,2,0,0,0,0|2,0,0]=4 16828 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)C 1626a_100150723488_100000749327 [0,2,0,0,0,0|2,0,0]=4 16829 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)C 240690a_100150723488_100000749327 [0,2,0,0,0,0|2,0,0]=4 16830 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)C 527a_100150723488_100000749327 [0,2,0,0,0,0|2,0,0]=4 16831 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)Cl 1626a_100150723488_100000214954 [0,2,0,0,0,0|2,0,0]=4 16832 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)Cl 240690a_100150723488_100000214954 [0,2,0,0,0,0|2,0,0]=4 16833 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)Cl 527a_100150723488_100000214954 [0,2,0,0,0,0|2,0,0]=4 16834 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)F 1626a_100150723488_100000198512 [0,2,0,0,0,0|2,0,0]=4 16835 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)F 240690a_100150723488_100000198512 [0,2,0,0,0,0|2,0,0]=4 16836 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)F 527a_100150723488_100000198512 [0,2,0,0,0,0|2,0,0]=4 16837 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)I 1626a_100150723488_100000688014 [0,2,0,0,0,0|2,0,0]=4 16838 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)I 240690a_100150723488_100000688014 [0,2,0,0,0,0|2,0,0]=4 16839 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)I 527a_100150723488_100000688014 [0,2,0,0,0,0|2,0,0]=4 16840 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)O 240690a_100150723488_100000037260 [0,2,0,0,0,0|2,0,0]=4 16841 B16R1.4595 COCCCNC(=O)c1cc(ccc1F)O 527a_100150723488_100000037260 [0,2,0,0,0,0|2,0,0]=4 16842 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)Br 1626a_100150723488_100000183945 [0,2,0,0,0,0|2,0,0]=4 16843 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)Br 240690a_100150723488_100000183945 [0,2,0,0,0,0|2,0,0]=4 16844 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)C 1626a_100150723488_100000057929 [0,2,0,0,0,0|2,0,0]=4 16845 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)C 240690a_100150723488_100000057929 [0,2,0,0,0,0|2,0,0]=4 16846 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)C 527a_100150723488_100000057929 [0,2,0,0,0,0|2,0,0]=4 16847 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)Cl 1626a_100150723488_100000739379 [0,2,0,0,0,0|2,0,0]=4 16848 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)Cl 240690a_100150723488_100000739379 [0,2,0,0,0,0|2,0,0]=4 16849 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)Cl 527a_100150723488_100000739379 [0,2,0,0,0,0|2,0,0]=4 16850 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)F 1626a_100150723488_100000748905 [0,2,0,0,0,0|2,0,0]=4 16851 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)F 240690a_100150723488_100000748905 [0,2,0,0,0,0|2,0,0]=4 16852 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)F 527a_100150723488_100000748905 [0,2,0,0,0,0|2,0,0]=4 16853 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)I 1626a_100150723488_100000750460 [0,2,0,0,0,0|2,0,0]=4 16854 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)I 240690a_100150723488_100000750460 [0,2,0,0,0,0|2,0,0]=4 16855 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)I 527a_100150723488_100000750460 [0,2,0,0,0,0|2,0,0]=4 16856 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)O 1626a_100150723488_200009995701 [0,2,0,0,0,0|2,0,0]=4 16857 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)O 240690a_100150723488_200009995701 [0,2,0,0,0,0|2,0,0]=4 16858 B16R1.4595 COCCCNC(=O)c1cc(ccc1I)O 527a_100150723488_200009995701 [0,2,0,0,0,0|2,0,0]=4 16859 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)Br 1626a_100150723488_100000212140 [0,2,0,0,0,0|1,0,0]=3 16860 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)Br 240690a_100150723488_100000212140 [0,2,0,0,0,0|1,0,0]=3 16861 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)Br 527a_100150723488_100000212140 [0,2,0,0,0,0|1,0,0]=3 16862 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)C 240690a_100150723488_100000229998 [0,2,0,0,0,0|1,0,0]=3 16863 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)C 527a_100150723488_100000229998 [0,2,0,0,0,0|1,0,0]=3 16864 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)Cl 1626a_100150723488_100000212143 [0,2,0,0,0,0|1,0,0]=3 16865 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)Cl 240690a_100150723488_100000212143 [0,2,0,0,0,0|1,0,0]=3 16866 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)Cl 527a_100150723488_100000212143 [0,2,0,0,0,0|1,0,0]=3 16867 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)F 240690a_100150723488_100000742286 [0,2,0,0,0,0|1,0,0]=3 16868 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)F 527a_100150723488_100000742286 [0,2,0,0,0,0|1,0,0]=3 16869 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)I 240690a_100150723488_100000212111 [0,2,0,0,0,0|1,0,0]=3 16870 B16R1.4595 COCCCNC(=O)c1cc(ccc1O)I 527a_100150723488_100000212111 [0,2,0,0,0,0|1,0,0]=3 16871 B16R1.4595 COCCNNC(=O)c1cc(ccc1O)Br 22a_100000741390_100000212140 [0,2,0,0,0,0|2,0,0]=4 16872 B16R1.4595 COCCNNC(=O)c1cc(ccc1O)C 22a_100000741390_100000229998 [0,2,0,0,0,0|2,0,0]=4 16873 B16R1.4595 COCCNNC(=O)c1cc(ccc1O)Cl 22a_100000741390_100000212143 [0,2,0,0,0,0|2,0,0]=4 16874 B16R1.4595 COCCNNC(=O)c1cc(ccc1O)F 22a_100000741390_100000742286 [0,2,0,0,0,0|2,0,0]=4 16875 B16R1.4595 COCCNNC(=O)c1cc(ccc1O)I 22a_100000741390_100000212111 [0,2,0,0,0,0|2,0,0]=4 16876 B16R1.4595 COCCOCC(=O)c1cc(ccc1Br)Cl 34a_100000210237_100012361344 [0,2,0,0,0,0|2,0,0]=4 16877 B16R1.4595 COCCOCC(=O)c1cc(ccc1C)C 34a_100000210237_100000183774 [0,2,0,0,0,0|2,0,0]=4 16878 B16R1.4595 COCCOCC(=O)c1cc(ccc1Cl)F 34a_100000210237_200010187420 [0,2,0,0,0,0|2,0,0]=4 16879 B16R1.4595 COCCOCC(=O)c1cc(ccc1F)F 34a_100000210237_100000211571 [0,2,0,0,0,0|2,0,0]=4 16880 B16R1.4595 COCCOCC(=O)c1cc(ccc1O)Br 34a_100000210237_200009828000 [0,2,0,0,0,0|1,0,0]=3 16881 B16R1.4595 COCCOCC(=O)c1cc(ccc1O)F 34a_100000210237_100009814381 [0,2,0,0,0,0|1,0,0]=3 16882 B16R1.4595 COCCOCC(=O)c1cc(ccc1O)O 34a_100000210237_100009814097 [0,2,0,0,0,0|1,0,0]=3 16883 B16R1.4595 COCCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000233755 [0,2,0,0,0,0|1,1,0]=4 16884 B16R1.4595 COCCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000233755 [0,2,0,0,0,0|1,1,0]=4 16885 B16R1.4595 COCCSCC(=O)c1cc(ccc1O)F 62a_100000233755_100009814381 [0,2,0,0,0,0|1,1,0]=4 16886 B16R1.4595 COCCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000233755 [0,2,0,0,0,0|1,1,0]=4 16887 B16R1.4595 COCCSCC(=O)c1cc(ccc1O)O 62a_100000233755_100009814097 [0,2,0,0,0,0|1,1,0]=4 16888 B16R1.4595 COCCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000233755 [0,2,0,0,0,0|1,1,0]=4 16889 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Br 11a_100000749238_100000690610 [0,2,0,0,0,0|2,0,0]=4 16890 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Br 1626a_100000749238_100000690610 [0,2,0,0,0,0|2,0,0]=4 16891 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Br 240690a_100000749238_100000690610 [0,2,0,0,0,0|2,0,0]=4 16892 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Br 527a_100000749238_100000690610 [0,2,0,0,0,0|2,0,0]=4 16893 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)C 11a_100000749238_100000689033 [0,2,0,0,0,0|2,0,0]=4 16894 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)C 1626a_100000749238_100000689033 [0,2,0,0,0,0|2,0,0]=4 16895 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)C 240690a_100000749238_100000689033 [0,2,0,0,0,0|2,0,0]=4 16896 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)C 527a_100000749238_100000689033 [0,2,0,0,0,0|2,0,0]=4 16897 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Cl 11a_100000749238_100000736951 [0,2,0,0,0,0|2,0,0]=4 16898 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Cl 1626a_100000749238_100000736951 [0,2,0,0,0,0|2,0,0]=4 16899 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Cl 240690a_100000749238_100000736951 [0,2,0,0,0,0|2,0,0]=4 16900 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)Cl 527a_100000749238_100000736951 [0,2,0,0,0,0|2,0,0]=4 16901 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)F 11a_100000749238_100000212315 [0,2,0,0,0,0|2,0,0]=4 16902 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)F 1626a_100000749238_100000212315 [0,2,0,0,0,0|2,0,0]=4 16903 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)F 240690a_100000749238_100000212315 [0,2,0,0,0,0|2,0,0]=4 16904 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)F 527a_100000749238_100000212315 [0,2,0,0,0,0|2,0,0]=4 16905 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)I 11a_100000749238_100000698340 [0,2,0,0,0,0|2,0,0]=4 16906 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)I 1626a_100000749238_100000698340 [0,2,0,0,0,0|2,0,0]=4 16907 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)I 240690a_100000749238_100000698340 [0,2,0,0,0,0|2,0,0]=4 16908 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)I 527a_100000749238_100000698340 [0,2,0,0,0,0|2,0,0]=4 16909 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)O 240690a_100000749238_100012352043 [0,2,0,0,0,0|2,0,0]=4 16910 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Br)O 527a_100000749238_100012352043 [0,2,0,0,0,0|2,0,0]=4 16911 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Br 11a_100000749238_100000759961 [0,2,0,0,0,0|2,0,0]=4 16912 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Br 1626a_100000749238_100000759961 [0,2,0,0,0,0|2,0,0]=4 16913 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Br 240690a_100000749238_100000759961 [0,2,0,0,0,0|2,0,0]=4 16914 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Br 527a_100000749238_100000759961 [0,2,0,0,0,0|2,0,0]=4 16915 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)C 11a_100000749238_100000195421 [0,2,0,0,0,0|2,0,0]=4 16916 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)C 1626a_100000749238_100000195421 [0,2,0,0,0,0|2,0,0]=4 16917 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)C 240690a_100000749238_100000195421 [0,2,0,0,0,0|2,0,0]=4 16918 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)C 527a_100000749238_100000195421 [0,2,0,0,0,0|2,0,0]=4 16919 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Cl 11a_100000749238_100000692595 [0,2,0,0,0,0|2,0,0]=4 16920 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Cl 1626a_100000749238_100000692595 [0,2,0,0,0,0|2,0,0]=4 16921 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Cl 240690a_100000749238_100000692595 [0,2,0,0,0,0|2,0,0]=4 16922 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)Cl 527a_100000749238_100000692595 [0,2,0,0,0,0|2,0,0]=4 16923 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)F 11a_100000749238_100000240043 [0,2,0,0,0,0|2,0,0]=4 16924 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)F 1626a_100000749238_100000240043 [0,2,0,0,0,0|2,0,0]=4 16925 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)F 240690a_100000749238_100000240043 [0,2,0,0,0,0|2,0,0]=4 16926 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)F 527a_100000749238_100000240043 [0,2,0,0,0,0|2,0,0]=4 16927 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)I 11a_100000749238_100000688012 [0,2,0,0,0,0|2,0,0]=4 16928 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)I 1626a_100000749238_100000688012 [0,2,0,0,0,0|2,0,0]=4 16929 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)I 240690a_100000749238_100000688012 [0,2,0,0,0,0|2,0,0]=4 16930 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)I 527a_100000749238_100000688012 [0,2,0,0,0,0|2,0,0]=4 16931 B16R1.4595 CSCCCNC(=O)c1cc(ccc1C)O 240690a_100000749238_100000687834 [0,2,0,0,0,0|2,0,0]=4 16932 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Br 11a_100000749238_100000211212 [0,2,0,0,0,0|2,0,0]=4 16933 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Br 1626a_100000749238_100000211212 [0,2,0,0,0,0|2,0,0]=4 16934 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Br 240690a_100000749238_100000211212 [0,2,0,0,0,0|2,0,0]=4 16935 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Br 527a_100000749238_100000211212 [0,2,0,0,0,0|2,0,0]=4 16936 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)C 11a_100000749238_100011290873 [0,2,0,0,0,0|2,0,0]=4 16937 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)C 1626a_100000749238_100011290873 [0,2,0,0,0,0|2,0,0]=4 16938 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)C 240690a_100000749238_100011290873 [0,2,0,0,0,0|2,0,0]=4 16939 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)C 527a_100000749238_100011290873 [0,2,0,0,0,0|2,0,0]=4 16940 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Cl 11a_100000749238_100000210642 [0,2,0,0,0,0|2,0,0]=4 16941 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Cl 1626a_100000749238_100000210642 [0,2,0,0,0,0|2,0,0]=4 16942 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000749238_100000210642 [0,2,0,0,0,0|2,0,0]=4 16943 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)Cl 527a_100000749238_100000210642 [0,2,0,0,0,0|2,0,0]=4 16944 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)F 11a_100000749238_100011219680 [0,2,0,0,0,0|2,0,0]=4 16945 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)F 1626a_100000749238_100011219680 [0,2,0,0,0,0|2,0,0]=4 16946 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)F 240690a_100000749238_100011219680 [0,2,0,0,0,0|2,0,0]=4 16947 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)F 527a_100000749238_100011219680 [0,2,0,0,0,0|2,0,0]=4 16948 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)I 11a_100000749238_100000688013 [0,2,0,0,0,0|2,0,0]=4 16949 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)I 1626a_100000749238_100000688013 [0,2,0,0,0,0|2,0,0]=4 16950 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)I 240690a_100000749238_100000688013 [0,2,0,0,0,0|2,0,0]=4 16951 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)I 527a_100000749238_100000688013 [0,2,0,0,0,0|2,0,0]=4 16952 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)O 240690a_100000749238_100000719527 [0,2,0,0,0,0|2,0,0]=4 16953 B16R1.4595 CSCCCNC(=O)c1cc(ccc1Cl)O 527a_100000749238_100000719527 [0,2,0,0,0,0|2,0,0]=4 16954 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Br 11a_100000749238_100000212322 [0,2,0,0,0,0|2,0,0]=4 16955 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Br 1626a_100000749238_100000212322 [0,2,0,0,0,0|2,0,0]=4 16956 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Br 240690a_100000749238_100000212322 [0,2,0,0,0,0|2,0,0]=4 16957 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Br 527a_100000749238_100000212322 [0,2,0,0,0,0|2,0,0]=4 16958 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)C 11a_100000749238_100000749327 [0,2,0,0,0,0|2,0,0]=4 16959 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)C 1626a_100000749238_100000749327 [0,2,0,0,0,0|2,0,0]=4 16960 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)C 240690a_100000749238_100000749327 [0,2,0,0,0,0|2,0,0]=4 16961 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)C 527a_100000749238_100000749327 [0,2,0,0,0,0|2,0,0]=4 16962 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Cl 11a_100000749238_100000214954 [0,2,0,0,0,0|2,0,0]=4 16963 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Cl 1626a_100000749238_100000214954 [0,2,0,0,0,0|2,0,0]=4 16964 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Cl 240690a_100000749238_100000214954 [0,2,0,0,0,0|2,0,0]=4 16965 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)Cl 527a_100000749238_100000214954 [0,2,0,0,0,0|2,0,0]=4 16966 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)F 11a_100000749238_100000198512 [0,2,0,0,0,0|2,0,0]=4 16967 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)F 1626a_100000749238_100000198512 [0,2,0,0,0,0|2,0,0]=4 16968 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)F 240690a_100000749238_100000198512 [0,2,0,0,0,0|2,0,0]=4 16969 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)F 527a_100000749238_100000198512 [0,2,0,0,0,0|2,0,0]=4 16970 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)I 11a_100000749238_100000688014 [0,2,0,0,0,0|2,0,0]=4 16971 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)I 1626a_100000749238_100000688014 [0,2,0,0,0,0|2,0,0]=4 16972 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)I 240690a_100000749238_100000688014 [0,2,0,0,0,0|2,0,0]=4 16973 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)I 527a_100000749238_100000688014 [0,2,0,0,0,0|2,0,0]=4 16974 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)O 240690a_100000749238_100000037260 [0,2,0,0,0,0|2,0,0]=4 16975 B16R1.4595 CSCCCNC(=O)c1cc(ccc1F)O 527a_100000749238_100000037260 [0,2,0,0,0,0|2,0,0]=4 16976 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Br 11a_100000749238_100000183945 [0,2,0,0,0,0|2,0,0]=4 16977 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Br 1626a_100000749238_100000183945 [0,2,0,0,0,0|2,0,0]=4 16978 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Br 240690a_100000749238_100000183945 [0,2,0,0,0,0|2,0,0]=4 16979 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)C 11a_100000749238_100000057929 [0,2,0,0,0,0|2,0,0]=4 16980 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)C 1626a_100000749238_100000057929 [0,2,0,0,0,0|2,0,0]=4 16981 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)C 240690a_100000749238_100000057929 [0,2,0,0,0,0|2,0,0]=4 16982 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)C 527a_100000749238_100000057929 [0,2,0,0,0,0|2,0,0]=4 16983 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Cl 11a_100000749238_100000739379 [0,2,0,0,0,0|2,0,0]=4 16984 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Cl 1626a_100000749238_100000739379 [0,2,0,0,0,0|2,0,0]=4 16985 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Cl 240690a_100000749238_100000739379 [0,2,0,0,0,0|2,0,0]=4 16986 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)Cl 527a_100000749238_100000739379 [0,2,0,0,0,0|2,0,0]=4 16987 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)F 11a_100000749238_100000748905 [0,2,0,0,0,0|2,0,0]=4 16988 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)F 1626a_100000749238_100000748905 [0,2,0,0,0,0|2,0,0]=4 16989 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)F 240690a_100000749238_100000748905 [0,2,0,0,0,0|2,0,0]=4 16990 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)F 527a_100000749238_100000748905 [0,2,0,0,0,0|2,0,0]=4 16991 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)I 11a_100000749238_100000750460 [0,2,0,0,0,0|2,0,0]=4 16992 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)I 1626a_100000749238_100000750460 [0,2,0,0,0,0|2,0,0]=4 16993 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)I 240690a_100000749238_100000750460 [0,2,0,0,0,0|2,0,0]=4 16994 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)I 527a_100000749238_100000750460 [0,2,0,0,0,0|2,0,0]=4 16995 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)O 1626a_100000749238_200009995701 [0,2,0,0,0,0|2,0,0]=4 16996 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)O 240690a_100000749238_200009995701 [0,2,0,0,0,0|2,0,0]=4 16997 B16R1.4595 CSCCCNC(=O)c1cc(ccc1I)O 527a_100000749238_200009995701 [0,2,0,0,0,0|2,0,0]=4 16998 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Br 1626a_100000749238_100000212140 [0,2,0,0,0,0|1,0,0]=3 16999 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Br 240690a_100000749238_100000212140 [0,2,0,0,0,0|1,0,0]=3 17000 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Br 527a_100000749238_100000212140 [0,2,0,0,0,0|1,0,0]=3 17001 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)C 240690a_100000749238_100000229998 [0,2,0,0,0,0|1,0,0]=3 17002 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)C 527a_100000749238_100000229998 [0,2,0,0,0,0|1,0,0]=3 17003 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Cl 11a_100000749238_100000212143 [0,2,0,0,0,0|1,0,0]=3 17004 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Cl 1626a_100000749238_100000212143 [0,2,0,0,0,0|1,0,0]=3 17005 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Cl 240690a_100000749238_100000212143 [0,2,0,0,0,0|1,0,0]=3 17006 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)Cl 527a_100000749238_100000212143 [0,2,0,0,0,0|1,0,0]=3 17007 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)F 240690a_100000749238_100000742286 [0,2,0,0,0,0|1,0,0]=3 17008 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)F 527a_100000749238_100000742286 [0,2,0,0,0,0|1,0,0]=3 17009 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)I 240690a_100000749238_100000212111 [0,2,0,0,0,0|1,0,0]=3 17010 B16R1.4595 CSCCCNC(=O)c1cc(ccc1O)I 527a_100000749238_100000212111 [0,2,0,0,0,0|1,0,0]=3 17011 B16R1.4595 CSCCOCC(=O)c1cc(ccc1Br)Cl 34a_100000230434_100012361344 [0,2,0,0,0,0|2,0,0]=4 17012 B16R1.4595 CSCCOCC(=O)c1cc(ccc1C)C 34a_100000230434_100000183774 [0,2,0,0,0,0|2,0,0]=4 17013 B16R1.4595 CSCCOCC(=O)c1cc(ccc1C)C 7a_100000230434_100000183774 [0,2,0,0,0,0|2,0,0]=4 17014 B16R1.4595 CSCCOCC(=O)c1cc(ccc1Cl)F 34a_100000230434_200010187420 [0,2,0,0,0,0|2,0,0]=4 17015 B16R1.4595 CSCCOCC(=O)c1cc(ccc1F)F 34a_100000230434_100000211571 [0,2,0,0,0,0|2,0,0]=4 17016 B16R1.4595 CSCCOCC(=O)c1cc(ccc1F)F 7a_100000230434_100000211571 [0,2,0,0,0,0|2,0,0]=4 17017 B16R1.4595 CSCCOCC(=O)c1cc(ccc1O)Br 34a_100000230434_200009828000 [0,2,0,0,0,0|1,0,0]=3 17018 B16R1.4595 CSCCOCC(=O)c1cc(ccc1O)Br 7a_100000230434_200009828000 [0,2,0,0,0,0|1,0,0]=3 17019 B16R1.4595 CSCCOCC(=O)c1cc(ccc1O)F 34a_100000230434_100009814381 [0,2,0,0,0,0|1,0,0]=3 17020 B16R1.4595 CSCCOCC(=O)c1cc(ccc1O)F 7a_100000230434_100000047744 [0,2,0,0,0,0|1,0,0]=3 17021 B16R1.4595 CSCCOCC(=O)c1cc(ccc1O)O 34a_100000230434_100009814097 [0,2,0,0,0,0|1,0,0]=3 17022 B16R1.4595 CSCCOCC(=O)c1cc(ccc1O)O 7a_100000230434_100009814097 [0,2,0,0,0,0|1,0,0]=3 17023 B16R1.4595 CSCCSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000751147 [0,2,0,0,0,0|1,1,0]=4 17024 B16R1.4595 CSCCSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000751147 [0,2,0,0,0,0|1,1,0]=4 17025 B16R1.4595 CSCCSCC(=O)c1cc(ccc1O)F 62a_100000212216_100009814381 [0,2,0,0,0,0|1,1,0]=4 17026 B16R1.4595 CSCCSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000751147 [0,2,0,0,0,0|1,1,0]=4 17027 B16R1.4595 CSCCSCC(=O)c1cc(ccc1O)O 62a_100000212216_100009814097 [0,2,0,0,0,0|1,1,0]=4 17028 B16R1.4595 CSCCSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000751147 [0,2,0,0,0,0|1,1,0]=4 17029 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCC#N)O 1458a_100000229998_100000211819 [0,2,0,0,0,0|1,0,1]=4 17030 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCF)Br 1458a_100000689033_100000729378 [0,2,0,0,0,0|2,0,0]=4 17031 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCF)C 1458a_100000195421_100000729378 [0,2,0,0,0,0|2,0,0]=4 17032 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCF)Cl 1458a_100011290873_100000729378 [0,2,0,0,0,0|2,0,0]=4 17033 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCF)F 1458a_100000749327_100000729378 [0,2,0,0,0,0|2,0,0]=4 17034 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCF)I 1458a_100000057929_100000729378 [0,2,0,0,0,0|2,0,0]=4 17035 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCF)O 1458a_100000229998_100000729378 [0,2,0,0,0,0|1,0,0]=3 17036 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCO)Br 1458a_100000689033_100000746330 [0,2,0,0,0,0|2,0,0]=4 17037 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCO)C 1458a_100000195421_100000746330 [0,2,0,0,0,0|2,0,0]=4 17038 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCO)Cl 1458a_100011290873_100000746330 [0,2,0,0,0,0|2,0,0]=4 17039 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCO)F 1458a_100000749327_100000746330 [0,2,0,0,0,0|2,0,0]=4 17040 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCO)I 1458a_100000057929_100000746330 [0,2,0,0,0,0|2,0,0]=4 17041 B16R1.4595 Cc1ccc(c(c1)C(=O)CCCCCO)O 1458a_100000229998_100000746330 [0,2,0,0,0,0|1,0,0]=3 17042 B16R1.4595 Cc1ccc(c(c1)C(=O)CCOCCO)O 1458a_100000229998_100011215305 [0,2,0,0,0,0|2,0,0]=4 17043 B16R1.4595 Cc1ccc(c(c1)C(=O)COCCCBr)C 34a_100011217188_100000183774 [0,2,0,0,0,0|2,0,0]=4 17044 B16R1.4595 Cc1ccc(c(c1)C(=O)COCCCCl)C 34a_100000230001_100000183774 [0,2,0,0,0,0|2,0,0]=4 17045 B16R1.4595 Cc1ccc(c(c1)C(=O)COCCCF)C 34a_100000759539_100000183774 [0,2,0,0,0,0|2,0,0]=4 17046 B16R1.4595 Cc1ccc(c(c1)C(=O)COCCCN)C 34a_100000182051_100000183774 [0,2,0,0,0,0|2,0,0]=4 17047 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)Br 240690a_100000750430_100000689033 [0,2,0,0,0,0|2,0,0]=4 17048 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)Br 527a_100000750430_100000689033 [0,2,0,0,0,0|2,0,0]=4 17049 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)C 240690a_100000750430_100000195421 [0,2,0,0,0,0|2,0,0]=4 17050 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)C 527a_100000750430_100000195421 [0,2,0,0,0,0|2,0,0]=4 17051 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)Cl 240690a_100000750430_100011290873 [0,2,0,0,0,0|2,0,0]=4 17052 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)Cl 527a_100000750430_100011290873 [0,2,0,0,0,0|2,0,0]=4 17053 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)F 240690a_100000750430_100000749327 [0,2,0,0,0,0|2,0,0]=4 17054 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)F 527a_100000750430_100000749327 [0,2,0,0,0,0|2,0,0]=4 17055 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)I 240690a_100000750430_100000057929 [0,2,0,0,0,0|2,0,0]=4 17056 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)I 527a_100000750430_100000057929 [0,2,0,0,0,0|2,0,0]=4 17057 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)O 240690a_100000750430_100000229998 [0,2,0,0,0,0|1,0,0]=3 17058 B16R1.4595 Cc1ccc(c(c1)C(=O)NCCCCO)O 527a_100000750430_100000229998 [0,2,0,0,0,0|1,0,0]=3 17059 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCF)Br 1458a_100000759961_100000729378 [0,2,0,0,0,0|2,0,0]=4 17060 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCF)Cl 1458a_100000692595_100000729378 [0,2,0,0,0,0|2,0,0]=4 17061 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCF)F 1458a_100000240043_100000729378 [0,2,0,0,0,0|2,0,0]=4 17062 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCF)I 1458a_100000688012_100000729378 [0,2,0,0,0,0|2,0,0]=4 17063 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCF)O 1458a_100000687834_100000729378 [0,2,0,0,0,0|2,0,0]=4 17064 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCO)Br 1458a_100000759961_100000746330 [0,2,0,0,0,0|2,0,0]=4 17065 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCO)Cl 1458a_100000692595_100000746330 [0,2,0,0,0,0|2,0,0]=4 17066 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCO)F 1458a_100000240043_100000746330 [0,2,0,0,0,0|2,0,0]=4 17067 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCO)I 1458a_100000688012_100000746330 [0,2,0,0,0,0|2,0,0]=4 17068 B16R1.4595 Cc1ccc(cc1C(=O)CCCCCO)O 1458a_100000687834_100000746330 [0,2,0,0,0,0|2,0,0]=4 17069 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)Br 240690a_100000750430_100000759961 [0,2,0,0,0,0|2,0,0]=4 17070 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)Br 527a_100000750430_100000759961 [0,2,0,0,0,0|2,0,0]=4 17071 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)Cl 240690a_100000750430_100000692595 [0,2,0,0,0,0|2,0,0]=4 17072 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)Cl 527a_100000750430_100000692595 [0,2,0,0,0,0|2,0,0]=4 17073 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)F 240690a_100000750430_100000240043 [0,2,0,0,0,0|2,0,0]=4 17074 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)F 527a_100000750430_100000240043 [0,2,0,0,0,0|2,0,0]=4 17075 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)I 240690a_100000750430_100000688012 [0,2,0,0,0,0|2,0,0]=4 17076 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)I 527a_100000750430_100000688012 [0,2,0,0,0,0|2,0,0]=4 17077 B16R1.4595 Cc1ccc(cc1C(=O)NCCCCO)O 240690a_100000750430_100000687834 [0,2,0,0,0,0|2,0,0]=4 17078 B16R1.4595 N#CCCCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000211819 [0,2,0,0,0,0|1,0,1]=4 17079 B16R1.4595 N#CCCCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000211819 [0,2,0,0,0,0|1,0,1]=4 17080 B16R1.4595 N#CCCCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000211819 [0,2,0,0,0,0|1,0,1]=4 17081 B16R1.4595 N#CCCCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000211819 [0,2,0,0,0,0|1,0,1]=4 17082 B16R1.4595 N#CCCCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000211819 [0,2,0,0,0,0|1,0,1]=4 17083 B16R1.4595 NCCCOCC(=O)c1cc(ccc1Br)Cl 34a_100000182051_100012361344 [0,2,0,0,0,0|2,0,0]=4 17084 B16R1.4595 NCCCOCC(=O)c1cc(ccc1Cl)F 34a_100000182051_200010187420 [0,2,0,0,0,0|2,0,0]=4 17085 B16R1.4595 NCCCOCC(=O)c1cc(ccc1F)F 34a_100000182051_100000211571 [0,2,0,0,0,0|2,0,0]=4 17086 B16R1.4595 NCCCOCC(=O)c1cc(ccc1O)Br 34a_100000182051_200009828000 [0,2,0,0,0,0|1,0,0]=3 17087 B16R1.4595 NCCCOCC(=O)c1cc(ccc1O)F 34a_100000182051_100009814381 [0,2,0,0,0,0|1,0,0]=3 17088 B16R1.4595 NCCCOCC(=O)c1cc(ccc1O)O 34a_100000182051_100009814097 [0,2,0,0,0,0|1,0,0]=3 17089 B16R1.4595 NOCCOCC(=O)c1cc(ccc1O)Br 34a_100000700252_200009828000 [0,2,0,0,0,0|2,0,0]=4 17090 B16R1.4595 NOCCOCC(=O)c1cc(ccc1O)F 34a_100000700252_100009814381 [0,2,0,0,0,0|2,0,0]=4 17091 B16R1.4595 NOCCOCC(=O)c1cc(ccc1O)O 34a_100000700252_100009814097 [0,2,0,0,0,0|2,0,0]=4 17092 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Br)Br 1458a_100000690610_100000729378 [0,2,0,0,0,0|2,0,0]=4 17093 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Br)Cl 1458a_100000736951_100000729378 [0,2,0,0,0,0|2,0,0]=4 17094 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Br)F 1458a_100000212315_100000729378 [0,2,0,0,0,0|2,0,0]=4 17095 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Br)I 1458a_100000698340_100000729378 [0,2,0,0,0,0|2,0,0]=4 17096 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Br)O 1458a_100012352043_100000729378 [0,2,0,0,0,0|2,0,0]=4 17097 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Cl)Br 1458a_100000211212_100000729378 [0,2,0,0,0,0|2,0,0]=4 17098 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100000729378 [0,2,0,0,0,0|2,0,0]=4 17099 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Cl)F 1458a_100011219680_100000729378 [0,2,0,0,0,0|2,0,0]=4 17100 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Cl)I 1458a_100000688013_100000729378 [0,2,0,0,0,0|2,0,0]=4 17101 B16R1.4595 O=C(CCCCCF)c1cc(ccc1Cl)O 1458a_100000719527_100000729378 [0,2,0,0,0,0|2,0,0]=4 17102 B16R1.4595 O=C(CCCCCF)c1cc(ccc1F)Br 1458a_100000212322_100000729378 [0,2,0,0,0,0|2,0,0]=4 17103 B16R1.4595 O=C(CCCCCF)c1cc(ccc1F)Cl 1458a_100000214954_100000729378 [0,2,0,0,0,0|2,0,0]=4 17104 B16R1.4595 O=C(CCCCCF)c1cc(ccc1F)F 1458a_100000198512_100000729378 [0,2,0,0,0,0|2,0,0]=4 17105 B16R1.4595 O=C(CCCCCF)c1cc(ccc1F)I 1458a_100000688014_100000729378 [0,2,0,0,0,0|2,0,0]=4 17106 B16R1.4595 O=C(CCCCCF)c1cc(ccc1F)O 1458a_100000037260_100000729378 [0,2,0,0,0,0|2,0,0]=4 17107 B16R1.4595 O=C(CCCCCF)c1cc(ccc1I)Br 1458a_100000183945_100000729378 [0,2,0,0,0,0|2,0,0]=4 17108 B16R1.4595 O=C(CCCCCF)c1cc(ccc1I)Cl 1458a_100000739379_100000729378 [0,2,0,0,0,0|2,0,0]=4 17109 B16R1.4595 O=C(CCCCCF)c1cc(ccc1I)F 1458a_100000748905_100000729378 [0,2,0,0,0,0|2,0,0]=4 17110 B16R1.4595 O=C(CCCCCF)c1cc(ccc1I)I 1458a_100000750460_100000729378 [0,2,0,0,0,0|2,0,0]=4 17111 B16R1.4595 O=C(CCCCCF)c1cc(ccc1I)O 1458a_200009995701_100000729378 [0,2,0,0,0,0|2,0,0]=4 17112 B16R1.4595 O=C(CCCCCF)c1cc(ccc1O)Br 1458a_100000212140_100000729378 [0,2,0,0,0,0|1,0,0]=3 17113 B16R1.4595 O=C(CCCCCF)c1cc(ccc1O)Cl 1458a_100000212143_100000729378 [0,2,0,0,0,0|1,0,0]=3 17114 B16R1.4595 O=C(CCCCCF)c1cc(ccc1O)F 1458a_100000742286_100000729378 [0,2,0,0,0,0|1,0,0]=3 17115 B16R1.4595 O=C(CCCCCF)c1cc(ccc1O)I 1458a_100000212111_100000729378 [0,2,0,0,0,0|1,0,0]=3 17116 B16R1.4595 O=C(CCCCCF)c1cc(ccc1O)O 1458a_100000758025_100000729378 [0,2,0,0,0,0|1,0,0]=3 17117 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Br)Br 1458a_100000690610_100000746330 [0,2,0,0,0,0|2,0,0]=4 17118 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Br)Cl 1458a_100000736951_100000746330 [0,2,0,0,0,0|2,0,0]=4 17119 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Br)F 1458a_100000212315_100000746330 [0,2,0,0,0,0|2,0,0]=4 17120 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Br)I 1458a_100000698340_100000746330 [0,2,0,0,0,0|2,0,0]=4 17121 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Br)O 1458a_100012352043_100000746330 [0,2,0,0,0,0|2,0,0]=4 17122 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Cl)Br 1458a_100000211212_100000746330 [0,2,0,0,0,0|2,0,0]=4 17123 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100000746330 [0,2,0,0,0,0|2,0,0]=4 17124 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Cl)F 1458a_100011219680_100000746330 [0,2,0,0,0,0|2,0,0]=4 17125 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Cl)I 1458a_100000688013_100000746330 [0,2,0,0,0,0|2,0,0]=4 17126 B16R1.4595 O=C(CCCCCO)c1cc(ccc1Cl)O 1458a_100000719527_100000746330 [0,2,0,0,0,0|2,0,0]=4 17127 B16R1.4595 O=C(CCCCCO)c1cc(ccc1F)Br 1458a_100000212322_100000746330 [0,2,0,0,0,0|2,0,0]=4 17128 B16R1.4595 O=C(CCCCCO)c1cc(ccc1F)Cl 1458a_100000214954_100000746330 [0,2,0,0,0,0|2,0,0]=4 17129 B16R1.4595 O=C(CCCCCO)c1cc(ccc1F)F 1458a_100000198512_100000746330 [0,2,0,0,0,0|2,0,0]=4 17130 B16R1.4595 O=C(CCCCCO)c1cc(ccc1F)I 1458a_100000688014_100000746330 [0,2,0,0,0,0|2,0,0]=4 17131 B16R1.4595 O=C(CCCCCO)c1cc(ccc1F)O 1458a_100000037260_100000746330 [0,2,0,0,0,0|2,0,0]=4 17132 B16R1.4595 O=C(CCCCCO)c1cc(ccc1I)Br 1458a_100000183945_100000746330 [0,2,0,0,0,0|2,0,0]=4 17133 B16R1.4595 O=C(CCCCCO)c1cc(ccc1I)Cl 1458a_100000739379_100000746330 [0,2,0,0,0,0|2,0,0]=4 17134 B16R1.4595 O=C(CCCCCO)c1cc(ccc1I)F 1458a_100000748905_100000746330 [0,2,0,0,0,0|2,0,0]=4 17135 B16R1.4595 O=C(CCCCCO)c1cc(ccc1I)I 1458a_100000750460_100000746330 [0,2,0,0,0,0|2,0,0]=4 17136 B16R1.4595 O=C(CCCCCO)c1cc(ccc1I)O 1458a_200009995701_100000746330 [0,2,0,0,0,0|2,0,0]=4 17137 B16R1.4595 O=C(CCCCCO)c1cc(ccc1O)Br 1458a_100000212140_100000746330 [0,2,0,0,0,0|1,0,0]=3 17138 B16R1.4595 O=C(CCCCCO)c1cc(ccc1O)Cl 1458a_100000212143_100000746330 [0,2,0,0,0,0|1,0,0]=3 17139 B16R1.4595 O=C(CCCCCO)c1cc(ccc1O)F 1458a_100000742286_100000746330 [0,2,0,0,0,0|1,0,0]=3 17140 B16R1.4595 O=C(CCCCCO)c1cc(ccc1O)I 1458a_100000212111_100000746330 [0,2,0,0,0,0|1,0,0]=3 17141 B16R1.4595 O=C(CCCCCO)c1cc(ccc1O)O 1458a_100000758025_100000746330 [0,2,0,0,0,0|1,0,0]=3 17142 B16R1.4595 O=C(CCOCCO)c1cc(ccc1O)Br 1458a_100000212140_100011215305 [0,2,0,0,0,0|2,0,0]=4 17143 B16R1.4595 O=C(CCOCCO)c1cc(ccc1O)Cl 1458a_100000212143_100011215305 [0,2,0,0,0,0|2,0,0]=4 17144 B16R1.4595 O=C(CCOCCO)c1cc(ccc1O)F 1458a_100000742286_100011215305 [0,2,0,0,0,0|2,0,0]=4 17145 B16R1.4595 O=C(CCOCCO)c1cc(ccc1O)I 1458a_100000212111_100011215305 [0,2,0,0,0,0|2,0,0]=4 17146 B16R1.4595 O=C(CCOCCO)c1cc(ccc1O)O 1458a_100000758025_100011215305 [0,2,0,0,0,0|2,0,0]=4 17147 B16R1.4595 O=C(CNCCCF)c1cc(ccc1O)Br 34a_100015189416_200009828000 [0,2,0,0,0,0|2,0,0]=4 17148 B16R1.4595 O=C(CNCCCF)c1cc(ccc1O)F 34a_100015189416_100009814381 [0,2,0,0,0,0|2,0,0]=4 17149 B16R1.4595 O=C(CNCCCF)c1cc(ccc1O)O 34a_100015189416_100009814097 [0,2,0,0,0,0|2,0,0]=4 17150 B16R1.4595 O=C(COCCCBr)c1cc(ccc1Br)Cl 34a_100011217188_100012361344 [0,2,0,0,0,0|2,0,0]=4 17151 B16R1.4595 O=C(COCCCBr)c1cc(ccc1Cl)F 34a_100011217188_200010187420 [0,2,0,0,0,0|2,0,0]=4 17152 B16R1.4595 O=C(COCCCBr)c1cc(ccc1F)F 34a_100011217188_100000211571 [0,2,0,0,0,0|2,0,0]=4 17153 B16R1.4595 O=C(COCCCBr)c1cc(ccc1O)Br 34a_100011217188_200009828000 [0,2,0,0,0,0|1,0,0]=3 17154 B16R1.4595 O=C(COCCCBr)c1cc(ccc1O)F 34a_100011217188_100009814381 [0,2,0,0,0,0|1,0,0]=3 17155 B16R1.4595 O=C(COCCCBr)c1cc(ccc1O)O 34a_100011217188_100009814097 [0,2,0,0,0,0|1,0,0]=3 17156 B16R1.4595 O=C(COCCCCl)c1cc(ccc1Br)Cl 34a_100000230001_100012361344 [0,2,0,0,0,0|2,0,0]=4 17157 B16R1.4595 O=C(COCCCCl)c1cc(ccc1Cl)F 34a_100000230001_200010187420 [0,2,0,0,0,0|2,0,0]=4 17158 B16R1.4595 O=C(COCCCCl)c1cc(ccc1F)F 34a_100000230001_100000211571 [0,2,0,0,0,0|2,0,0]=4 17159 B16R1.4595 O=C(COCCCCl)c1cc(ccc1O)Br 34a_100000230001_200009828000 [0,2,0,0,0,0|1,0,0]=3 17160 B16R1.4595 O=C(COCCCCl)c1cc(ccc1O)F 34a_100000230001_100009814381 [0,2,0,0,0,0|1,0,0]=3 17161 B16R1.4595 O=C(COCCCCl)c1cc(ccc1O)O 34a_100000230001_100009814097 [0,2,0,0,0,0|1,0,0]=3 17162 B16R1.4595 O=C(COCCCF)c1cc(ccc1Br)Cl 34a_100000759539_100012361344 [0,2,0,0,0,0|2,0,0]=4 17163 B16R1.4595 O=C(COCCCF)c1cc(ccc1Cl)F 34a_100000759539_200010187420 [0,2,0,0,0,0|2,0,0]=4 17164 B16R1.4595 O=C(COCCCF)c1cc(ccc1F)F 34a_100000759539_100000211571 [0,2,0,0,0,0|2,0,0]=4 17165 B16R1.4595 O=C(COCCCF)c1cc(ccc1O)Br 34a_100000759539_200009828000 [0,2,0,0,0,0|1,0,0]=3 17166 B16R1.4595 O=C(COCCCF)c1cc(ccc1O)F 34a_100000759539_100009814381 [0,2,0,0,0,0|1,0,0]=3 17167 B16R1.4595 O=C(COCCCF)c1cc(ccc1O)O 34a_100000759539_100009814097 [0,2,0,0,0,0|1,0,0]=3 17168 B16R1.4595 O=C(CSCCCF)c1cc(ccc1O)Br 62a_200009828000_100011934791 [0,2,0,0,0,0|1,1,0]=4 17169 B16R1.4595 O=C(CSCCCF)c1cc(ccc1O)Cl 62a_200009816716_100011934791 [0,2,0,0,0,0|1,1,0]=4 17170 B16R1.4595 O=C(CSCCCF)c1cc(ccc1O)F 62a_100009814381_100011934791 [0,2,0,0,0,0|1,1,0]=4 17171 B16R1.4595 O=C(CSCCCF)c1cc(ccc1O)F 62a_100011934791_100009814381 [0,2,0,0,0,0|1,1,0]=4 17172 B16R1.4595 O=C(CSCCCF)c1cc(ccc1O)O 62a_100009814097_100011934791 [0,2,0,0,0,0|1,1,0]=4 17173 B16R1.4595 O=C(CSCCCF)c1cc(ccc1O)O 62a_100011934791_100009814097 [0,2,0,0,0,0|1,1,0]=4 17174 B16R1.4595 O=C(CSCCCO)c1cc(ccc1O)Br 62a_200009828000_100011215043 [0,2,0,0,0,0|1,1,0]=4 17175 B16R1.4595 O=C(CSCCCO)c1cc(ccc1O)Cl 62a_200009816716_100011215043 [0,2,0,0,0,0|1,1,0]=4 17176 B16R1.4595 O=C(CSCCCO)c1cc(ccc1O)F 62a_100009814381_100011215043 [0,2,0,0,0,0|1,1,0]=4 17177 B16R1.4595 O=C(CSCCCO)c1cc(ccc1O)F 62a_100011215043_100009814381 [0,2,0,0,0,0|1,1,0]=4 17178 B16R1.4595 O=C(CSCCCO)c1cc(ccc1O)O 62a_100009814097_100011215043 [0,2,0,0,0,0|1,1,0]=4 17179 B16R1.4595 O=C(CSCCCO)c1cc(ccc1O)O 62a_100011215043_100009814097 [0,2,0,0,0,0|1,1,0]=4 17180 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)Br 240690a_100000750430_100000690610 [0,2,0,0,0,0|2,0,0]=4 17181 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)Br 527a_100000750430_100000690610 [0,2,0,0,0,0|2,0,0]=4 17182 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)Cl 240690a_100000750430_100000736951 [0,2,0,0,0,0|2,0,0]=4 17183 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)Cl 527a_100000750430_100000736951 [0,2,0,0,0,0|2,0,0]=4 17184 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)F 240690a_100000750430_100000212315 [0,2,0,0,0,0|2,0,0]=4 17185 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)F 527a_100000750430_100000212315 [0,2,0,0,0,0|2,0,0]=4 17186 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)I 240690a_100000750430_100000698340 [0,2,0,0,0,0|2,0,0]=4 17187 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)I 527a_100000750430_100000698340 [0,2,0,0,0,0|2,0,0]=4 17188 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)O 240690a_100000750430_100012352043 [0,2,0,0,0,0|2,0,0]=4 17189 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Br)O 527a_100000750430_100012352043 [0,2,0,0,0,0|2,0,0]=4 17190 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)Br 240690a_100000750430_100000211212 [0,2,0,0,0,0|2,0,0]=4 17191 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)Br 527a_100000750430_100000211212 [0,2,0,0,0,0|2,0,0]=4 17192 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)Cl 240690a_100000750430_100000210642 [0,2,0,0,0,0|2,0,0]=4 17193 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)Cl 527a_100000750430_100000210642 [0,2,0,0,0,0|2,0,0]=4 17194 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)F 240690a_100000750430_100011219680 [0,2,0,0,0,0|2,0,0]=4 17195 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)F 527a_100000750430_100011219680 [0,2,0,0,0,0|2,0,0]=4 17196 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)I 240690a_100000750430_100000688013 [0,2,0,0,0,0|2,0,0]=4 17197 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)I 527a_100000750430_100000688013 [0,2,0,0,0,0|2,0,0]=4 17198 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)O 240690a_100000750430_100000719527 [0,2,0,0,0,0|2,0,0]=4 17199 B16R1.4595 O=C(NCCCCO)c1cc(ccc1Cl)O 527a_100000750430_100000719527 [0,2,0,0,0,0|2,0,0]=4 17200 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)Br 240690a_100000750430_100000212322 [0,2,0,0,0,0|2,0,0]=4 17201 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)Br 527a_100000750430_100000212322 [0,2,0,0,0,0|2,0,0]=4 17202 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)Cl 240690a_100000750430_100000214954 [0,2,0,0,0,0|2,0,0]=4 17203 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)Cl 527a_100000750430_100000214954 [0,2,0,0,0,0|2,0,0]=4 17204 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)F 240690a_100000750430_100000198512 [0,2,0,0,0,0|2,0,0]=4 17205 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)F 527a_100000750430_100000198512 [0,2,0,0,0,0|2,0,0]=4 17206 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)I 240690a_100000750430_100000688014 [0,2,0,0,0,0|2,0,0]=4 17207 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)I 527a_100000750430_100000688014 [0,2,0,0,0,0|2,0,0]=4 17208 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)O 240690a_100000750430_100000037260 [0,2,0,0,0,0|2,0,0]=4 17209 B16R1.4595 O=C(NCCCCO)c1cc(ccc1F)O 527a_100000750430_100000037260 [0,2,0,0,0,0|2,0,0]=4 17210 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)Br 240690a_100000750430_100000183945 [0,2,0,0,0,0|2,0,0]=4 17211 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)Cl 240690a_100000750430_100000739379 [0,2,0,0,0,0|2,0,0]=4 17212 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)Cl 527a_100000750430_100000739379 [0,2,0,0,0,0|2,0,0]=4 17213 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)F 240690a_100000750430_100000748905 [0,2,0,0,0,0|2,0,0]=4 17214 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)F 527a_100000750430_100000748905 [0,2,0,0,0,0|2,0,0]=4 17215 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)I 240690a_100000750430_100000750460 [0,2,0,0,0,0|2,0,0]=4 17216 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)I 527a_100000750430_100000750460 [0,2,0,0,0,0|2,0,0]=4 17217 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)O 240690a_100000750430_200009995701 [0,2,0,0,0,0|2,0,0]=4 17218 B16R1.4595 O=C(NCCCCO)c1cc(ccc1I)O 527a_100000750430_200009995701 [0,2,0,0,0,0|2,0,0]=4 17219 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)Br 240690a_100000750430_100000212140 [0,2,0,0,0,0|1,0,0]=3 17220 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)Br 527a_100000750430_100000212140 [0,2,0,0,0,0|1,0,0]=3 17221 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)Cl 240690a_100000750430_100000212143 [0,2,0,0,0,0|1,0,0]=3 17222 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)Cl 527a_100000750430_100000212143 [0,2,0,0,0,0|1,0,0]=3 17223 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)F 240690a_100000750430_100000742286 [0,2,0,0,0,0|1,0,0]=3 17224 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)F 527a_100000750430_100000742286 [0,2,0,0,0,0|1,0,0]=3 17225 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)I 240690a_100000750430_100000212111 [0,2,0,0,0,0|1,0,0]=3 17226 B16R1.4595 O=C(NCCCCO)c1cc(ccc1O)I 527a_100000750430_100000212111 [0,2,0,0,0,0|1,0,0]=3 17227 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)Br 240690a_100000744482_100000212140 [0,2,0,0,0,0|2,0,0]=4 17228 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)Br 527a_100000744482_100000212140 [0,2,0,0,0,0|2,0,0]=4 17229 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)Cl 240690a_100000744482_100000212143 [0,2,0,0,0,0|2,0,0]=4 17230 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)Cl 527a_100000744482_100000212143 [0,2,0,0,0,0|2,0,0]=4 17231 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)F 240690a_100000744482_100000742286 [0,2,0,0,0,0|2,0,0]=4 17232 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)F 527a_100000744482_100000742286 [0,2,0,0,0,0|2,0,0]=4 17233 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)I 240690a_100000744482_100000212111 [0,2,0,0,0,0|2,0,0]=4 17234 B16R1.7441 CC(CO)CNC(=O)c1cc(ccc1O)I 527a_100000744482_100000212111 [0,2,0,0,0,0|2,0,0]=4 17235 B16R1.7441 CCC(=O)CNC(=O)c1cc(ccc1O)O 1458a_100011219787_100000210202 [0,2,0,0,0,0|1,0,1]=4 17236 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Br 11a_100020588543_100000690610 [0,2,0,0,0,0|2,0,0]=4 17237 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Br 1626a_100020588543_100000690610 [0,2,0,0,0,0|2,0,0]=4 17238 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Br 240690a_100020588543_100000690610 [0,2,0,0,0,0|2,0,0]=4 17239 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Br 527a_100020588543_100000690610 [0,2,0,0,0,0|2,0,0]=4 17240 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)C 11a_100020588543_100000689033 [0,2,0,0,0,0|2,0,0]=4 17241 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)C 1626a_100020588543_100000689033 [0,2,0,0,0,0|2,0,0]=4 17242 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)C 240690a_100020588543_100000689033 [0,2,0,0,0,0|2,0,0]=4 17243 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)C 527a_100020588543_100000689033 [0,2,0,0,0,0|2,0,0]=4 17244 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Cl 11a_100020588543_100000736951 [0,2,0,0,0,0|2,0,0]=4 17245 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Cl 1626a_100020588543_100000736951 [0,2,0,0,0,0|2,0,0]=4 17246 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Cl 240690a_100020588543_100000736951 [0,2,0,0,0,0|2,0,0]=4 17247 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)Cl 527a_100020588543_100000736951 [0,2,0,0,0,0|2,0,0]=4 17248 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)F 11a_100020588543_100000212315 [0,2,0,0,0,0|2,0,0]=4 17249 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)F 1626a_100020588543_100000212315 [0,2,0,0,0,0|2,0,0]=4 17250 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)F 240690a_100020588543_100000212315 [0,2,0,0,0,0|2,0,0]=4 17251 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)F 527a_100020588543_100000212315 [0,2,0,0,0,0|2,0,0]=4 17252 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)I 11a_100020588543_100000698340 [0,2,0,0,0,0|2,0,0]=4 17253 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)I 1626a_100020588543_100000698340 [0,2,0,0,0,0|2,0,0]=4 17254 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)I 240690a_100020588543_100000698340 [0,2,0,0,0,0|2,0,0]=4 17255 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)I 527a_100020588543_100000698340 [0,2,0,0,0,0|2,0,0]=4 17256 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)O 240690a_100020588543_100012352043 [0,2,0,0,0,0|2,0,0]=4 17257 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Br)O 527a_100020588543_100012352043 [0,2,0,0,0,0|2,0,0]=4 17258 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Br 11a_100020588543_100000759961 [0,2,0,0,0,0|2,0,0]=4 17259 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Br 1626a_100020588543_100000759961 [0,2,0,0,0,0|2,0,0]=4 17260 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Br 240690a_100020588543_100000759961 [0,2,0,0,0,0|2,0,0]=4 17261 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Br 527a_100020588543_100000759961 [0,2,0,0,0,0|2,0,0]=4 17262 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)C 11a_100020588543_100000195421 [0,2,0,0,0,0|2,0,0]=4 17263 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)C 1626a_100020588543_100000195421 [0,2,0,0,0,0|2,0,0]=4 17264 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)C 240690a_100020588543_100000195421 [0,2,0,0,0,0|2,0,0]=4 17265 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)C 527a_100020588543_100000195421 [0,2,0,0,0,0|2,0,0]=4 17266 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Cl 11a_100020588543_100000692595 [0,2,0,0,0,0|2,0,0]=4 17267 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Cl 1626a_100020588543_100000692595 [0,2,0,0,0,0|2,0,0]=4 17268 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Cl 240690a_100020588543_100000692595 [0,2,0,0,0,0|2,0,0]=4 17269 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)Cl 527a_100020588543_100000692595 [0,2,0,0,0,0|2,0,0]=4 17270 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)F 11a_100020588543_100000240043 [0,2,0,0,0,0|2,0,0]=4 17271 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)F 1626a_100020588543_100000240043 [0,2,0,0,0,0|2,0,0]=4 17272 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)F 240690a_100020588543_100000240043 [0,2,0,0,0,0|2,0,0]=4 17273 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)F 527a_100020588543_100000240043 [0,2,0,0,0,0|2,0,0]=4 17274 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)I 11a_100020588543_100000688012 [0,2,0,0,0,0|2,0,0]=4 17275 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)I 1626a_100020588543_100000688012 [0,2,0,0,0,0|2,0,0]=4 17276 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)I 240690a_100020588543_100000688012 [0,2,0,0,0,0|2,0,0]=4 17277 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)I 527a_100020588543_100000688012 [0,2,0,0,0,0|2,0,0]=4 17278 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1C)O 240690a_100020588543_100000687834 [0,2,0,0,0,0|2,0,0]=4 17279 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Br 11a_100020588543_100000211212 [0,2,0,0,0,0|2,0,0]=4 17280 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Br 1626a_100020588543_100000211212 [0,2,0,0,0,0|2,0,0]=4 17281 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Br 240690a_100020588543_100000211212 [0,2,0,0,0,0|2,0,0]=4 17282 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Br 527a_100020588543_100000211212 [0,2,0,0,0,0|2,0,0]=4 17283 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)C 11a_100020588543_100011290873 [0,2,0,0,0,0|2,0,0]=4 17284 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)C 1626a_100020588543_100011290873 [0,2,0,0,0,0|2,0,0]=4 17285 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)C 240690a_100020588543_100011290873 [0,2,0,0,0,0|2,0,0]=4 17286 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)C 527a_100020588543_100011290873 [0,2,0,0,0,0|2,0,0]=4 17287 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Cl 11a_100020588543_100000210642 [0,2,0,0,0,0|2,0,0]=4 17288 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Cl 1626a_100020588543_100000210642 [0,2,0,0,0,0|2,0,0]=4 17289 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Cl 240690a_100020588543_100000210642 [0,2,0,0,0,0|2,0,0]=4 17290 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)Cl 527a_100020588543_100000210642 [0,2,0,0,0,0|2,0,0]=4 17291 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)F 11a_100020588543_100011219680 [0,2,0,0,0,0|2,0,0]=4 17292 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)F 1626a_100020588543_100011219680 [0,2,0,0,0,0|2,0,0]=4 17293 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)F 240690a_100020588543_100011219680 [0,2,0,0,0,0|2,0,0]=4 17294 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)F 527a_100020588543_100011219680 [0,2,0,0,0,0|2,0,0]=4 17295 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)I 11a_100020588543_100000688013 [0,2,0,0,0,0|2,0,0]=4 17296 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)I 1626a_100020588543_100000688013 [0,2,0,0,0,0|2,0,0]=4 17297 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)I 240690a_100020588543_100000688013 [0,2,0,0,0,0|2,0,0]=4 17298 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)I 527a_100020588543_100000688013 [0,2,0,0,0,0|2,0,0]=4 17299 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)O 240690a_100020588543_100000719527 [0,2,0,0,0,0|2,0,0]=4 17300 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1Cl)O 527a_100020588543_100000719527 [0,2,0,0,0,0|2,0,0]=4 17301 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Br 11a_100020588543_100000212322 [0,2,0,0,0,0|2,0,0]=4 17302 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Br 1626a_100020588543_100000212322 [0,2,0,0,0,0|2,0,0]=4 17303 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Br 240690a_100020588543_100000212322 [0,2,0,0,0,0|2,0,0]=4 17304 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Br 527a_100020588543_100000212322 [0,2,0,0,0,0|2,0,0]=4 17305 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)C 11a_100020588543_100000749327 [0,2,0,0,0,0|2,0,0]=4 17306 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)C 1626a_100020588543_100000749327 [0,2,0,0,0,0|2,0,0]=4 17307 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)C 240690a_100020588543_100000749327 [0,2,0,0,0,0|2,0,0]=4 17308 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)C 527a_100020588543_100000749327 [0,2,0,0,0,0|2,0,0]=4 17309 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Cl 11a_100020588543_100000214954 [0,2,0,0,0,0|2,0,0]=4 17310 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Cl 1626a_100020588543_100000214954 [0,2,0,0,0,0|2,0,0]=4 17311 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Cl 240690a_100020588543_100000214954 [0,2,0,0,0,0|2,0,0]=4 17312 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)Cl 527a_100020588543_100000214954 [0,2,0,0,0,0|2,0,0]=4 17313 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)F 11a_100020588543_100000198512 [0,2,0,0,0,0|2,0,0]=4 17314 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)F 1626a_100020588543_100000198512 [0,2,0,0,0,0|2,0,0]=4 17315 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)F 240690a_100020588543_100000198512 [0,2,0,0,0,0|2,0,0]=4 17316 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)F 527a_100020588543_100000198512 [0,2,0,0,0,0|2,0,0]=4 17317 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)I 11a_100020588543_100000688014 [0,2,0,0,0,0|2,0,0]=4 17318 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)I 1626a_100020588543_100000688014 [0,2,0,0,0,0|2,0,0]=4 17319 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)I 240690a_100020588543_100000688014 [0,2,0,0,0,0|2,0,0]=4 17320 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)I 527a_100020588543_100000688014 [0,2,0,0,0,0|2,0,0]=4 17321 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)O 240690a_100020588543_100000037260 [0,2,0,0,0,0|2,0,0]=4 17322 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1F)O 527a_100020588543_100000037260 [0,2,0,0,0,0|2,0,0]=4 17323 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Br 11a_100020588543_100000183945 [0,2,0,0,0,0|2,0,0]=4 17324 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Br 1626a_100020588543_100000183945 [0,2,0,0,0,0|2,0,0]=4 17325 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Br 240690a_100020588543_100000183945 [0,2,0,0,0,0|2,0,0]=4 17326 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)C 11a_100020588543_100000057929 [0,2,0,0,0,0|2,0,0]=4 17327 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)C 1626a_100020588543_100000057929 [0,2,0,0,0,0|2,0,0]=4 17328 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)C 240690a_100020588543_100000057929 [0,2,0,0,0,0|2,0,0]=4 17329 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)C 527a_100020588543_100000057929 [0,2,0,0,0,0|2,0,0]=4 17330 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Cl 11a_100020588543_100000739379 [0,2,0,0,0,0|2,0,0]=4 17331 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Cl 1626a_100020588543_100000739379 [0,2,0,0,0,0|2,0,0]=4 17332 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Cl 240690a_100020588543_100000739379 [0,2,0,0,0,0|2,0,0]=4 17333 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)Cl 527a_100020588543_100000739379 [0,2,0,0,0,0|2,0,0]=4 17334 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)F 11a_100020588543_100000748905 [0,2,0,0,0,0|2,0,0]=4 17335 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)F 1626a_100020588543_100000748905 [0,2,0,0,0,0|2,0,0]=4 17336 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)F 240690a_100020588543_100000748905 [0,2,0,0,0,0|2,0,0]=4 17337 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)F 527a_100020588543_100000748905 [0,2,0,0,0,0|2,0,0]=4 17338 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)I 11a_100020588543_100000750460 [0,2,0,0,0,0|2,0,0]=4 17339 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)I 1626a_100020588543_100000750460 [0,2,0,0,0,0|2,0,0]=4 17340 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)I 240690a_100020588543_100000750460 [0,2,0,0,0,0|2,0,0]=4 17341 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)I 527a_100020588543_100000750460 [0,2,0,0,0,0|2,0,0]=4 17342 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)O 1626a_100020588543_200009995701 [0,2,0,0,0,0|2,0,0]=4 17343 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)O 240690a_100020588543_200009995701 [0,2,0,0,0,0|2,0,0]=4 17344 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1I)O 527a_100020588543_200009995701 [0,2,0,0,0,0|2,0,0]=4 17345 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Br 1626a_100020588543_100000212140 [0,2,0,0,0,0|1,0,0]=3 17346 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Br 240690a_100020588543_100000212140 [0,2,0,0,0,0|1,0,0]=3 17347 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Br 527a_100020588543_100000212140 [0,2,0,0,0,0|1,0,0]=3 17348 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)C 240690a_100020588543_100000229998 [0,2,0,0,0,0|1,0,0]=3 17349 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)C 527a_100020588543_100000229998 [0,2,0,0,0,0|1,0,0]=3 17350 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Cl 11a_100020588543_100000212143 [0,2,0,0,0,0|1,0,0]=3 17351 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Cl 1626a_100020588543_100000212143 [0,2,0,0,0,0|1,0,0]=3 17352 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Cl 240690a_100020588543_100000212143 [0,2,0,0,0,0|1,0,0]=3 17353 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)Cl 527a_100020588543_100000212143 [0,2,0,0,0,0|1,0,0]=3 17354 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)F 240690a_100020588543_100000742286 [0,2,0,0,0,0|1,0,0]=3 17355 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)F 527a_100020588543_100000742286 [0,2,0,0,0,0|1,0,0]=3 17356 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)I 240690a_100020588543_100000212111 [0,2,0,0,0,0|1,0,0]=3 17357 B16R1.7441 CCC(C)CNC(=O)c1cc(ccc1O)I 527a_100020588543_100000212111 [0,2,0,0,0,0|1,0,0]=3 17358 B16R1.7441 CCC(C)NNC(=O)c1cc(ccc1O)Br 22a_100000718999_100000212140 [0,2,0,0,0,0|2,0,0]=4 17359 B16R1.7441 CCC(C)NNC(=O)c1cc(ccc1O)C 22a_100000718999_100000229998 [0,2,0,0,0,0|2,0,0]=4 17360 B16R1.7441 CCC(C)NNC(=O)c1cc(ccc1O)Cl 22a_100000718999_100000212143 [0,2,0,0,0,0|2,0,0]=4 17361 B16R1.7441 CCC(C)NNC(=O)c1cc(ccc1O)F 22a_100000718999_100000742286 [0,2,0,0,0,0|2,0,0]=4 17362 B16R1.7441 CCC(C)NNC(=O)c1cc(ccc1O)I 22a_100000718999_100000212111 [0,2,0,0,0,0|2,0,0]=4 17363 B16R1.7441 CCC(C)OCC(=O)c1cc(ccc1O)Br 7a_100000210228_200009828000 [0,2,0,0,0,0|2,0,0]=4 17364 B16R1.7441 CCC(C)OCC(=O)c1cc(ccc1O)F 7a_100000210228_100000047744 [0,2,0,0,0,0|2,0,0]=4 17365 B16R1.7441 CCC(C)OCC(=O)c1cc(ccc1O)O 7a_100000210228_100009814097 [0,2,0,0,0,0|2,0,0]=4 17366 B16R1.7441 CCC(C)SCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000758301 [0,2,0,0,0,0|2,0,0]=4 17367 B16R1.7441 CCC(C)SCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000758301 [0,2,0,0,0,0|2,0,0]=4 17368 B16R1.7441 CCC(C)SCC(=O)c1cc(ccc1O)F 62a_100000758301_100009814381 [0,2,0,0,0,0|2,0,0]=4 17369 B16R1.7441 CCC(C)SCC(=O)c1cc(ccc1O)F 62a_100009814381_100000758301 [0,2,0,0,0,0|2,0,0]=4 17370 B16R1.7441 CCC(C)SCC(=O)c1cc(ccc1O)O 62a_100000758301_100009814097 [0,2,0,0,0,0|2,0,0]=4 17371 B16R1.7441 CCC(C)SCC(=O)c1cc(ccc1O)O 62a_100009814097_100000758301 [0,2,0,0,0,0|2,0,0]=4 17372 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)Br 11a_100011218483_100000690610 [0,2,0,0,0,0|2,0,0]=4 17373 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)Br 240690a_100011218483_100000690610 [0,2,0,0,0,0|2,0,0]=4 17374 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)Br 527a_100011218483_100000690610 [0,2,0,0,0,0|2,0,0]=4 17375 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)C 11a_100011218483_100000689033 [0,2,0,0,0,0|2,0,0]=4 17376 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)C 240690a_100011218483_100000689033 [0,2,0,0,0,0|2,0,0]=4 17377 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)C 527a_100011218483_100000689033 [0,2,0,0,0,0|2,0,0]=4 17378 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)Cl 11a_100011218483_100000736951 [0,2,0,0,0,0|2,0,0]=4 17379 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)Cl 240690a_100011218483_100000736951 [0,2,0,0,0,0|2,0,0]=4 17380 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)Cl 527a_100011218483_100000736951 [0,2,0,0,0,0|2,0,0]=4 17381 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)F 11a_100011218483_100000212315 [0,2,0,0,0,0|2,0,0]=4 17382 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)F 240690a_100011218483_100000212315 [0,2,0,0,0,0|2,0,0]=4 17383 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)F 527a_100011218483_100000212315 [0,2,0,0,0,0|2,0,0]=4 17384 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)I 11a_100011218483_100000698340 [0,2,0,0,0,0|2,0,0]=4 17385 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)I 240690a_100011218483_100000698340 [0,2,0,0,0,0|2,0,0]=4 17386 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)I 527a_100011218483_100000698340 [0,2,0,0,0,0|2,0,0]=4 17387 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)O 240690a_100011218483_100012352043 [0,2,0,0,0,0|2,0,0]=4 17388 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Br)O 527a_100011218483_100012352043 [0,2,0,0,0,0|2,0,0]=4 17389 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)Br 11a_100011218483_100000759961 [0,2,0,0,0,0|2,0,0]=4 17390 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)Br 240690a_100011218483_100000759961 [0,2,0,0,0,0|2,0,0]=4 17391 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)Br 527a_100011218483_100000759961 [0,2,0,0,0,0|2,0,0]=4 17392 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)C 11a_100011218483_100000195421 [0,2,0,0,0,0|2,0,0]=4 17393 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)C 240690a_100011218483_100000195421 [0,2,0,0,0,0|2,0,0]=4 17394 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)C 527a_100011218483_100000195421 [0,2,0,0,0,0|2,0,0]=4 17395 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)Cl 11a_100011218483_100000692595 [0,2,0,0,0,0|2,0,0]=4 17396 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)Cl 240690a_100011218483_100000692595 [0,2,0,0,0,0|2,0,0]=4 17397 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)Cl 527a_100011218483_100000692595 [0,2,0,0,0,0|2,0,0]=4 17398 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)F 11a_100011218483_100000240043 [0,2,0,0,0,0|2,0,0]=4 17399 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)F 240690a_100011218483_100000240043 [0,2,0,0,0,0|2,0,0]=4 17400 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)F 527a_100011218483_100000240043 [0,2,0,0,0,0|2,0,0]=4 17401 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)I 11a_100011218483_100000688012 [0,2,0,0,0,0|2,0,0]=4 17402 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)I 240690a_100011218483_100000688012 [0,2,0,0,0,0|2,0,0]=4 17403 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)I 527a_100011218483_100000688012 [0,2,0,0,0,0|2,0,0]=4 17404 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1C)O 240690a_100011218483_100000687834 [0,2,0,0,0,0|2,0,0]=4 17405 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)Br 11a_100011218483_100000211212 [0,2,0,0,0,0|2,0,0]=4 17406 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)Br 240690a_100011218483_100000211212 [0,2,0,0,0,0|2,0,0]=4 17407 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)Br 527a_100011218483_100000211212 [0,2,0,0,0,0|2,0,0]=4 17408 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)C 11a_100011218483_100011290873 [0,2,0,0,0,0|2,0,0]=4 17409 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)C 240690a_100011218483_100011290873 [0,2,0,0,0,0|2,0,0]=4 17410 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)C 527a_100011218483_100011290873 [0,2,0,0,0,0|2,0,0]=4 17411 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)Cl 11a_100011218483_100000210642 [0,2,0,0,0,0|2,0,0]=4 17412 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)Cl 240690a_100011218483_100000210642 [0,2,0,0,0,0|2,0,0]=4 17413 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)Cl 527a_100011218483_100000210642 [0,2,0,0,0,0|2,0,0]=4 17414 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)F 11a_100011218483_100011219680 [0,2,0,0,0,0|2,0,0]=4 17415 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)F 240690a_100011218483_100011219680 [0,2,0,0,0,0|2,0,0]=4 17416 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)F 527a_100011218483_100011219680 [0,2,0,0,0,0|2,0,0]=4 17417 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)I 11a_100011218483_100000688013 [0,2,0,0,0,0|2,0,0]=4 17418 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)I 240690a_100011218483_100000688013 [0,2,0,0,0,0|2,0,0]=4 17419 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)I 527a_100011218483_100000688013 [0,2,0,0,0,0|2,0,0]=4 17420 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)O 240690a_100011218483_100000719527 [0,2,0,0,0,0|2,0,0]=4 17421 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1Cl)O 527a_100011218483_100000719527 [0,2,0,0,0,0|2,0,0]=4 17422 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)Br 11a_100011218483_100000212322 [0,2,0,0,0,0|2,0,0]=4 17423 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)Br 240690a_100011218483_100000212322 [0,2,0,0,0,0|2,0,0]=4 17424 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)Br 527a_100011218483_100000212322 [0,2,0,0,0,0|2,0,0]=4 17425 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)C 11a_100011218483_100000749327 [0,2,0,0,0,0|2,0,0]=4 17426 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)C 240690a_100011218483_100000749327 [0,2,0,0,0,0|2,0,0]=4 17427 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)C 527a_100011218483_100000749327 [0,2,0,0,0,0|2,0,0]=4 17428 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)Cl 11a_100011218483_100000214954 [0,2,0,0,0,0|2,0,0]=4 17429 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)Cl 240690a_100011218483_100000214954 [0,2,0,0,0,0|2,0,0]=4 17430 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)Cl 527a_100011218483_100000214954 [0,2,0,0,0,0|2,0,0]=4 17431 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)F 11a_100011218483_100000198512 [0,2,0,0,0,0|2,0,0]=4 17432 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)F 240690a_100011218483_100000198512 [0,2,0,0,0,0|2,0,0]=4 17433 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)F 527a_100011218483_100000198512 [0,2,0,0,0,0|2,0,0]=4 17434 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)I 11a_100011218483_100000688014 [0,2,0,0,0,0|2,0,0]=4 17435 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)I 240690a_100011218483_100000688014 [0,2,0,0,0,0|2,0,0]=4 17436 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)I 527a_100011218483_100000688014 [0,2,0,0,0,0|2,0,0]=4 17437 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)O 240690a_100011218483_100000037260 [0,2,0,0,0,0|2,0,0]=4 17438 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1F)O 527a_100011218483_100000037260 [0,2,0,0,0,0|2,0,0]=4 17439 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)Br 11a_100011218483_100000183945 [0,2,0,0,0,0|2,0,0]=4 17440 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)Br 240690a_100011218483_100000183945 [0,2,0,0,0,0|2,0,0]=4 17441 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)C 11a_100011218483_100000057929 [0,2,0,0,0,0|2,0,0]=4 17442 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)C 240690a_100011218483_100000057929 [0,2,0,0,0,0|2,0,0]=4 17443 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)C 527a_100011218483_100000057929 [0,2,0,0,0,0|2,0,0]=4 17444 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)Cl 11a_100011218483_100000739379 [0,2,0,0,0,0|2,0,0]=4 17445 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)Cl 240690a_100011218483_100000739379 [0,2,0,0,0,0|2,0,0]=4 17446 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)Cl 527a_100011218483_100000739379 [0,2,0,0,0,0|2,0,0]=4 17447 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)F 11a_100011218483_100000748905 [0,2,0,0,0,0|2,0,0]=4 17448 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)F 240690a_100011218483_100000748905 [0,2,0,0,0,0|2,0,0]=4 17449 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)F 527a_100011218483_100000748905 [0,2,0,0,0,0|2,0,0]=4 17450 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)I 11a_100011218483_100000750460 [0,2,0,0,0,0|2,0,0]=4 17451 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)I 240690a_100011218483_100000750460 [0,2,0,0,0,0|2,0,0]=4 17452 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)I 527a_100011218483_100000750460 [0,2,0,0,0,0|2,0,0]=4 17453 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)O 240690a_100011218483_200009995701 [0,2,0,0,0,0|2,0,0]=4 17454 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1I)O 527a_100011218483_200009995701 [0,2,0,0,0,0|2,0,0]=4 17455 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)Br 240690a_100011218483_100000212140 [0,2,0,0,0,0|1,0,0]=3 17456 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)Br 527a_100011218483_100000212140 [0,2,0,0,0,0|1,0,0]=3 17457 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)C 240690a_100011218483_100000229998 [0,2,0,0,0,0|1,0,0]=3 17458 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)C 527a_100011218483_100000229998 [0,2,0,0,0,0|1,0,0]=3 17459 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)Cl 11a_100011218483_100000212143 [0,2,0,0,0,0|1,0,0]=3 17460 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)Cl 240690a_100011218483_100000212143 [0,2,0,0,0,0|1,0,0]=3 17461 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)Cl 527a_100011218483_100000212143 [0,2,0,0,0,0|1,0,0]=3 17462 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)F 240690a_100011218483_100000742286 [0,2,0,0,0,0|1,0,0]=3 17463 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)F 527a_100011218483_100000742286 [0,2,0,0,0,0|1,0,0]=3 17464 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)I 240690a_100011218483_100000212111 [0,2,0,0,0,0|1,0,0]=3 17465 B16R1.7441 CCC(O)CNC(=O)c1cc(ccc1O)I 527a_100011218483_100000212111 [0,2,0,0,0,0|1,0,0]=3 17466 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Br 1626a_100020591295_100000212140 [0,2,0,0,0,0|2,0,0]=4 17467 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Br 240690a_100020591295_100000212140 [0,2,0,0,0,0|2,0,0]=4 17468 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Br 527a_100020591295_100000212140 [0,2,0,0,0,0|2,0,0]=4 17469 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)C 240690a_100020591295_100000229998 [0,2,0,0,0,0|2,0,0]=4 17470 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)C 527a_100020591295_100000229998 [0,2,0,0,0,0|2,0,0]=4 17471 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Cl 11a_100020591295_100000212143 [0,2,0,0,0,0|2,0,0]=4 17472 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Cl 1626a_100020591295_100000212143 [0,2,0,0,0,0|2,0,0]=4 17473 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Cl 240690a_100020591295_100000212143 [0,2,0,0,0,0|2,0,0]=4 17474 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)Cl 527a_100020591295_100000212143 [0,2,0,0,0,0|2,0,0]=4 17475 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)F 240690a_100020591295_100000742286 [0,2,0,0,0,0|2,0,0]=4 17476 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)F 527a_100020591295_100000742286 [0,2,0,0,0,0|2,0,0]=4 17477 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)I 240690a_100020591295_100000212111 [0,2,0,0,0,0|2,0,0]=4 17478 B16R1.7441 CO[C@H](C)CNC(=O)c1cc(ccc1O)I 527a_100020591295_100000212111 [0,2,0,0,0,0|2,0,0]=4 17479 B16R1.7441 Cc1ccc(c(c1)C(=O)NCC(C)CO)O 240690a_100000744482_100000229998 [0,2,0,0,0,0|2,0,0]=4 17480 B16R1.7441 Cc1ccc(c(c1)C(=O)NCC(C)CO)O 527a_100000744482_100000229998 [0,2,0,0,0,0|2,0,0]=4 17481 B16R1.7441 Cc1ccc(c(c1)C(=O)NC[C@@H](F)CO)O 240690a_100015665980_100000229998 [0,2,0,0,0,0|2,0,0]=4 17482 B16R1.7441 Cc1ccc(c(c1)C(=O)NC[C@@H](F)CO)O 527a_100015665980_100000229998 [0,2,0,0,0,0|2,0,0]=4 17483 B16R1.7441 Cc1ccc(c(c1)C(=O)NC[C@H](O)CO)O 240690a_100020644852_100000229998 [0,2,0,0,0,0|2,0,0]=4 17484 B16R1.7441 Cc1ccc(c(c1)C(=O)NC[C@H](O)CO)O 527a_100020644852_100000229998 [0,2,0,0,0,0|2,0,0]=4 17485 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)Br 240690a_100015665980_100000212140 [0,2,0,0,0,0|2,0,0]=4 17486 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)Br 527a_100015665980_100000212140 [0,2,0,0,0,0|2,0,0]=4 17487 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)Cl 240690a_100015665980_100000212143 [0,2,0,0,0,0|2,0,0]=4 17488 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)Cl 527a_100015665980_100000212143 [0,2,0,0,0,0|2,0,0]=4 17489 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)F 240690a_100015665980_100000742286 [0,2,0,0,0,0|2,0,0]=4 17490 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)F 527a_100015665980_100000742286 [0,2,0,0,0,0|2,0,0]=4 17491 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)I 240690a_100015665980_100000212111 [0,2,0,0,0,0|2,0,0]=4 17492 B16R1.7441 O=C(NC[C@@H](F)CO)c1cc(ccc1O)I 527a_100015665980_100000212111 [0,2,0,0,0,0|2,0,0]=4 17493 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)Br 240690a_100020644852_100000212140 [0,2,0,0,0,0|2,0,0]=4 17494 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)Br 527a_100020644852_100000212140 [0,2,0,0,0,0|2,0,0]=4 17495 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)Cl 240690a_100020644852_100000212143 [0,2,0,0,0,0|2,0,0]=4 17496 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)Cl 527a_100020644852_100000212143 [0,2,0,0,0,0|2,0,0]=4 17497 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)F 240690a_100020644852_100000742286 [0,2,0,0,0,0|2,0,0]=4 17498 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)F 527a_100020644852_100000742286 [0,2,0,0,0,0|2,0,0]=4 17499 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)I 240690a_100020644852_100000212111 [0,2,0,0,0,0|2,0,0]=4 17500 B16R1.7441 O=C(NC[C@H](O)CO)c1cc(ccc1O)I 527a_100020644852_100000212111 [0,2,0,0,0,0|2,0,0]=4 17501 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011215641 [0,2,0,0,0,0|1,0,1]=4 17502 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100011215641 [0,2,0,0,0,0|1,0,1]=4 17503 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011215641 [0,2,0,0,0,0|1,0,1]=4 17504 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011215641 [0,2,0,0,0,0|1,0,1]=4 17505 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011215641 [0,2,0,0,0,0|1,0,1]=4 17506 B16R1.7492 CC(=O)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011215641 [0,2,0,0,0,0|1,0,1]=4 17507 B16R1.7492 CC(Br)COCC(=O)c1cc(ccc1O)Br 34a_100012180447_200009828000 [0,2,0,0,0,0|2,0,0]=4 17508 B16R1.7492 CC(Br)COCC(=O)c1cc(ccc1O)F 34a_100012180447_100009814381 [0,2,0,0,0,0|2,0,0]=4 17509 B16R1.7492 CC(Br)COCC(=O)c1cc(ccc1O)O 34a_100012180447_100009814097 [0,2,0,0,0,0|2,0,0]=4 17510 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011214892 [0,2,0,0,0,0|2,0,0]=4 17511 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011214892 [0,2,0,0,0,0|2,0,0]=4 17512 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011214892 [0,2,0,0,0,0|2,0,0]=4 17513 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011214892 [0,2,0,0,0,0|2,0,0]=4 17514 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011214892 [0,2,0,0,0,0|2,0,0]=4 17515 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011214892 [0,2,0,0,0,0|2,0,0]=4 17516 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011214892 [0,2,0,0,0,0|2,0,0]=4 17517 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011214892 [0,2,0,0,0,0|2,0,0]=4 17518 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011214892 [0,2,0,0,0,0|2,0,0]=4 17519 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011214892 [0,2,0,0,0,0|2,0,0]=4 17520 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011214892 [0,2,0,0,0,0|2,0,0]=4 17521 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011214892 [0,2,0,0,0,0|2,0,0]=4 17522 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100011214892 [0,2,0,0,0,0|2,0,0]=4 17523 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100011214892 [0,2,0,0,0,0|2,0,0]=4 17524 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100011214892 [0,2,0,0,0,0|2,0,0]=4 17525 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011214892 [0,2,0,0,0,0|2,0,0]=4 17526 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011214892 [0,2,0,0,0,0|2,0,0]=4 17527 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100011214892 [0,2,0,0,0,0|2,0,0]=4 17528 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100011214892 [0,2,0,0,0,0|2,0,0]=4 17529 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100011214892 [0,2,0,0,0,0|2,0,0]=4 17530 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011214892 [0,2,0,0,0,0|1,0,0]=3 17531 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011214892 [0,2,0,0,0,0|1,0,0]=3 17532 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011214892 [0,2,0,0,0,0|1,0,0]=3 17533 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011214892 [0,2,0,0,0,0|1,0,0]=3 17534 B16R1.7492 CC(C)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011214892 [0,2,0,0,0,0|1,0,0]=3 17535 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Br 11a_100000210545_100000690610 [0,2,0,0,0,0|2,0,0]=4 17536 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Br 1626a_100000210545_100000690610 [0,2,0,0,0,0|2,0,0]=4 17537 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Br 240690a_100000210545_100000690610 [0,2,0,0,0,0|2,0,0]=4 17538 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Br 527a_100000210545_100000690610 [0,2,0,0,0,0|2,0,0]=4 17539 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Cl 11a_100000210545_100000736951 [0,2,0,0,0,0|2,0,0]=4 17540 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Cl 1626a_100000210545_100000736951 [0,2,0,0,0,0|2,0,0]=4 17541 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Cl 240690a_100000210545_100000736951 [0,2,0,0,0,0|2,0,0]=4 17542 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)Cl 527a_100000210545_100000736951 [0,2,0,0,0,0|2,0,0]=4 17543 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)F 11a_100000210545_100000212315 [0,2,0,0,0,0|2,0,0]=4 17544 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)F 1626a_100000210545_100000212315 [0,2,0,0,0,0|2,0,0]=4 17545 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)F 240690a_100000210545_100000212315 [0,2,0,0,0,0|2,0,0]=4 17546 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)F 527a_100000210545_100000212315 [0,2,0,0,0,0|2,0,0]=4 17547 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)I 11a_100000210545_100000698340 [0,2,0,0,0,0|2,0,0]=4 17548 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)I 1626a_100000210545_100000698340 [0,2,0,0,0,0|2,0,0]=4 17549 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)I 240690a_100000210545_100000698340 [0,2,0,0,0,0|2,0,0]=4 17550 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)I 527a_100000210545_100000698340 [0,2,0,0,0,0|2,0,0]=4 17551 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)O 240690a_100000210545_100012352043 [0,2,0,0,0,0|2,0,0]=4 17552 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Br)O 527a_100000210545_100012352043 [0,2,0,0,0,0|2,0,0]=4 17553 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Br 11a_100000210545_100000211212 [0,2,0,0,0,0|2,0,0]=4 17554 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Br 1626a_100000210545_100000211212 [0,2,0,0,0,0|2,0,0]=4 17555 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Br 240690a_100000210545_100000211212 [0,2,0,0,0,0|2,0,0]=4 17556 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Br 527a_100000210545_100000211212 [0,2,0,0,0,0|2,0,0]=4 17557 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Cl 11a_100000210545_100000210642 [0,2,0,0,0,0|2,0,0]=4 17558 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Cl 1626a_100000210545_100000210642 [0,2,0,0,0,0|2,0,0]=4 17559 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Cl 240690a_100000210545_100000210642 [0,2,0,0,0,0|2,0,0]=4 17560 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)Cl 527a_100000210545_100000210642 [0,2,0,0,0,0|2,0,0]=4 17561 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)F 11a_100000210545_100011219680 [0,2,0,0,0,0|2,0,0]=4 17562 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)F 1626a_100000210545_100011219680 [0,2,0,0,0,0|2,0,0]=4 17563 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)F 240690a_100000210545_100011219680 [0,2,0,0,0,0|2,0,0]=4 17564 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)F 527a_100000210545_100011219680 [0,2,0,0,0,0|2,0,0]=4 17565 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)I 11a_100000210545_100000688013 [0,2,0,0,0,0|2,0,0]=4 17566 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)I 1626a_100000210545_100000688013 [0,2,0,0,0,0|2,0,0]=4 17567 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)I 240690a_100000210545_100000688013 [0,2,0,0,0,0|2,0,0]=4 17568 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)I 527a_100000210545_100000688013 [0,2,0,0,0,0|2,0,0]=4 17569 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)O 240690a_100000210545_100000719527 [0,2,0,0,0,0|2,0,0]=4 17570 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1Cl)O 527a_100000210545_100000719527 [0,2,0,0,0,0|2,0,0]=4 17571 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Br 11a_100000210545_100000212322 [0,2,0,0,0,0|2,0,0]=4 17572 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Br 1626a_100000210545_100000212322 [0,2,0,0,0,0|2,0,0]=4 17573 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Br 240690a_100000210545_100000212322 [0,2,0,0,0,0|2,0,0]=4 17574 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Br 527a_100000210545_100000212322 [0,2,0,0,0,0|2,0,0]=4 17575 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Cl 11a_100000210545_100000214954 [0,2,0,0,0,0|2,0,0]=4 17576 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Cl 1626a_100000210545_100000214954 [0,2,0,0,0,0|2,0,0]=4 17577 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Cl 240690a_100000210545_100000214954 [0,2,0,0,0,0|2,0,0]=4 17578 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)Cl 527a_100000210545_100000214954 [0,2,0,0,0,0|2,0,0]=4 17579 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)F 11a_100000210545_100000198512 [0,2,0,0,0,0|2,0,0]=4 17580 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)F 1626a_100000210545_100000198512 [0,2,0,0,0,0|2,0,0]=4 17581 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)F 240690a_100000210545_100000198512 [0,2,0,0,0,0|2,0,0]=4 17582 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)F 527a_100000210545_100000198512 [0,2,0,0,0,0|2,0,0]=4 17583 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)I 11a_100000210545_100000688014 [0,2,0,0,0,0|2,0,0]=4 17584 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)I 1626a_100000210545_100000688014 [0,2,0,0,0,0|2,0,0]=4 17585 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)I 240690a_100000210545_100000688014 [0,2,0,0,0,0|2,0,0]=4 17586 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)I 527a_100000210545_100000688014 [0,2,0,0,0,0|2,0,0]=4 17587 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)O 240690a_100000210545_100000037260 [0,2,0,0,0,0|2,0,0]=4 17588 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1F)O 527a_100000210545_100000037260 [0,2,0,0,0,0|2,0,0]=4 17589 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Br 11a_100000210545_100000183945 [0,2,0,0,0,0|2,0,0]=4 17590 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Br 1626a_100000210545_100000183945 [0,2,0,0,0,0|2,0,0]=4 17591 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Br 240690a_100000210545_100000183945 [0,2,0,0,0,0|2,0,0]=4 17592 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Cl 11a_100000210545_100000739379 [0,2,0,0,0,0|2,0,0]=4 17593 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Cl 1626a_100000210545_100000739379 [0,2,0,0,0,0|2,0,0]=4 17594 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Cl 240690a_100000210545_100000739379 [0,2,0,0,0,0|2,0,0]=4 17595 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)Cl 527a_100000210545_100000739379 [0,2,0,0,0,0|2,0,0]=4 17596 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)F 11a_100000210545_100000748905 [0,2,0,0,0,0|2,0,0]=4 17597 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)F 1626a_100000210545_100000748905 [0,2,0,0,0,0|2,0,0]=4 17598 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)F 240690a_100000210545_100000748905 [0,2,0,0,0,0|2,0,0]=4 17599 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)F 527a_100000210545_100000748905 [0,2,0,0,0,0|2,0,0]=4 17600 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)I 11a_100000210545_100000750460 [0,2,0,0,0,0|2,0,0]=4 17601 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)I 1626a_100000210545_100000750460 [0,2,0,0,0,0|2,0,0]=4 17602 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)I 240690a_100000210545_100000750460 [0,2,0,0,0,0|2,0,0]=4 17603 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)I 527a_100000210545_100000750460 [0,2,0,0,0,0|2,0,0]=4 17604 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)O 1626a_100000210545_200009995701 [0,2,0,0,0,0|2,0,0]=4 17605 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)O 240690a_100000210545_200009995701 [0,2,0,0,0,0|2,0,0]=4 17606 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1I)O 527a_100000210545_200009995701 [0,2,0,0,0,0|2,0,0]=4 17607 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Br 1626a_100000210545_100000212140 [0,2,0,0,0,0|1,0,0]=3 17608 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Br 240690a_100000210545_100000212140 [0,2,0,0,0,0|1,0,0]=3 17609 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Br 527a_100000210545_100000212140 [0,2,0,0,0,0|1,0,0]=3 17610 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Cl 11a_100000210545_100000212143 [0,2,0,0,0,0|1,0,0]=3 17611 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Cl 1626a_100000210545_100000212143 [0,2,0,0,0,0|1,0,0]=3 17612 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Cl 240690a_100000210545_100000212143 [0,2,0,0,0,0|1,0,0]=3 17613 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)Cl 527a_100000210545_100000212143 [0,2,0,0,0,0|1,0,0]=3 17614 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)F 240690a_100000210545_100000742286 [0,2,0,0,0,0|1,0,0]=3 17615 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)F 527a_100000210545_100000742286 [0,2,0,0,0,0|1,0,0]=3 17616 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)I 240690a_100000210545_100000212111 [0,2,0,0,0,0|1,0,0]=3 17617 B16R1.7492 CC(C)CCNC(=O)c1cc(ccc1O)I 527a_100000210545_100000212111 [0,2,0,0,0,0|1,0,0]=3 17618 B16R1.7492 CC(C)CNCC(=O)c1cc(ccc1O)Br 34a_100000210953_200009828000 [0,2,0,0,0,0|2,0,0]=4 17619 B16R1.7492 CC(C)CNCC(=O)c1cc(ccc1O)F 34a_100000210953_100009814381 [0,2,0,0,0,0|2,0,0]=4 17620 B16R1.7492 CC(C)CNCC(=O)c1cc(ccc1O)O 34a_100000210953_100009814097 [0,2,0,0,0,0|2,0,0]=4 17621 B16R1.7492 CC(C)CNNC(=O)c1cc(ccc1O)Br 22a_100000696102_100000212140 [0,2,0,0,0,0|2,0,0]=4 17622 B16R1.7492 CC(C)CNNC(=O)c1cc(ccc1O)Cl 22a_100000696102_100000212143 [0,2,0,0,0,0|2,0,0]=4 17623 B16R1.7492 CC(C)CNNC(=O)c1cc(ccc1O)F 22a_100000696102_100000742286 [0,2,0,0,0,0|2,0,0]=4 17624 B16R1.7492 CC(C)CNNC(=O)c1cc(ccc1O)I 22a_100000696102_100000212111 [0,2,0,0,0,0|2,0,0]=4 17625 B16R1.7492 CC(C)COCC(=O)c1cc(ccc1O)Br 34a_100000210257_200009828000 [0,2,0,0,0,0|2,0,0]=4 17626 B16R1.7492 CC(C)COCC(=O)c1cc(ccc1O)F 34a_100000210257_100009814381 [0,2,0,0,0,0|2,0,0]=4 17627 B16R1.7492 CC(C)COCC(=O)c1cc(ccc1O)O 34a_100000210257_100009814097 [0,2,0,0,0,0|2,0,0]=4 17628 B16R1.7492 CC(C)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100000210760 [0,2,0,0,0,0|2,0,0]=4 17629 B16R1.7492 CC(C)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100000210760 [0,2,0,0,0,0|2,0,0]=4 17630 B16R1.7492 CC(C)CSCC(=O)c1cc(ccc1O)F 62a_100000210624_100009814381 [0,2,0,0,0,0|2,0,0]=4 17631 B16R1.7492 CC(C)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100000210760 [0,2,0,0,0,0|2,0,0]=4 17632 B16R1.7492 CC(C)CSCC(=O)c1cc(ccc1O)O 62a_100000210624_100009814097 [0,2,0,0,0,0|2,0,0]=4 17633 B16R1.7492 CC(C)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100000210760 [0,2,0,0,0,0|2,0,0]=4 17634 B16R1.7492 CC(C)OCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000211751 [0,2,0,0,0,0|2,0,0]=4 17635 B16R1.7492 CC(C)OCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000211751 [0,2,0,0,0,0|2,0,0]=4 17636 B16R1.7492 CC(C)OCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000211751 [0,2,0,0,0,0|2,0,0]=4 17637 B16R1.7492 CC(C)OCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000211751 [0,2,0,0,0,0|2,0,0]=4 17638 B16R1.7492 CC(C)OCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000211751 [0,2,0,0,0,0|2,0,0]=4 17639 B16R1.7492 CC(C)SCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000730970 [0,2,0,0,0,0|2,0,0]=4 17640 B16R1.7492 CC(C)SCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000730970 [0,2,0,0,0,0|2,0,0]=4 17641 B16R1.7492 CC(C)SCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000730970 [0,2,0,0,0,0|2,0,0]=4 17642 B16R1.7492 CC(C)SCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000730970 [0,2,0,0,0,0|2,0,0]=4 17643 B16R1.7492 CC(C)SCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000730970 [0,2,0,0,0,0|2,0,0]=4 17644 B16R1.7492 CC(F)COCC(=O)c1cc(ccc1O)Br 34a_100015925927_200009828000 [0,2,0,0,0,0|2,0,0]=4 17645 B16R1.7492 CC(F)COCC(=O)c1cc(ccc1O)F 34a_100015925927_100009814381 [0,2,0,0,0,0|2,0,0]=4 17646 B16R1.7492 CC(F)COCC(=O)c1cc(ccc1O)O 34a_100015925927_100009814097 [0,2,0,0,0,0|2,0,0]=4 17647 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000718107 [0,2,0,0,0,0|2,0,0]=4 17648 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000718107 [0,2,0,0,0,0|2,0,0]=4 17649 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000718107 [0,2,0,0,0,0|2,0,0]=4 17650 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000718107 [0,2,0,0,0,0|2,0,0]=4 17651 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000718107 [0,2,0,0,0,0|2,0,0]=4 17652 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000718107 [0,2,0,0,0,0|2,0,0]=4 17653 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000718107 [0,2,0,0,0,0|2,0,0]=4 17654 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000718107 [0,2,0,0,0,0|2,0,0]=4 17655 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000718107 [0,2,0,0,0,0|2,0,0]=4 17656 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000718107 [0,2,0,0,0,0|2,0,0]=4 17657 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000718107 [0,2,0,0,0,0|2,0,0]=4 17658 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000718107 [0,2,0,0,0,0|2,0,0]=4 17659 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_200000718107 [0,2,0,0,0,0|2,0,0]=4 17660 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_200000718107 [0,2,0,0,0,0|2,0,0]=4 17661 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_200000718107 [0,2,0,0,0,0|2,0,0]=4 17662 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000718107 [0,2,0,0,0,0|2,0,0]=4 17663 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000718107 [0,2,0,0,0,0|2,0,0]=4 17664 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_200000718107 [0,2,0,0,0,0|2,0,0]=4 17665 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_200000718107 [0,2,0,0,0,0|2,0,0]=4 17666 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_200000718107 [0,2,0,0,0,0|2,0,0]=4 17667 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000718107 [0,2,0,0,0,0|1,0,0]=3 17668 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000718107 [0,2,0,0,0,0|1,0,0]=3 17669 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_200000718107 [0,2,0,0,0,0|1,0,0]=3 17670 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_200000718107 [0,2,0,0,0,0|1,0,0]=3 17671 B16R1.7492 CC(O)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_200000718107 [0,2,0,0,0,0|1,0,0]=3 17672 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)Br 240690a_200000755665_100000690610 [0,2,0,0,0,0|2,0,0]=4 17673 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)Br 527a_200000755665_100000690610 [0,2,0,0,0,0|2,0,0]=4 17674 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)Cl 240690a_200000755665_100000736951 [0,2,0,0,0,0|2,0,0]=4 17675 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)Cl 527a_200000755665_100000736951 [0,2,0,0,0,0|2,0,0]=4 17676 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)F 240690a_200000755665_100000212315 [0,2,0,0,0,0|2,0,0]=4 17677 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)F 527a_200000755665_100000212315 [0,2,0,0,0,0|2,0,0]=4 17678 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)I 240690a_200000755665_100000698340 [0,2,0,0,0,0|2,0,0]=4 17679 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)I 527a_200000755665_100000698340 [0,2,0,0,0,0|2,0,0]=4 17680 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)O 240690a_200000755665_100012352043 [0,2,0,0,0,0|2,0,0]=4 17681 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Br)O 527a_200000755665_100012352043 [0,2,0,0,0,0|2,0,0]=4 17682 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)Br 240690a_200000755665_100000211212 [0,2,0,0,0,0|2,0,0]=4 17683 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)Br 527a_200000755665_100000211212 [0,2,0,0,0,0|2,0,0]=4 17684 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)Cl 240690a_200000755665_100000210642 [0,2,0,0,0,0|2,0,0]=4 17685 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)Cl 527a_200000755665_100000210642 [0,2,0,0,0,0|2,0,0]=4 17686 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)F 240690a_200000755665_100011219680 [0,2,0,0,0,0|2,0,0]=4 17687 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)F 527a_200000755665_100011219680 [0,2,0,0,0,0|2,0,0]=4 17688 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)I 240690a_200000755665_100000688013 [0,2,0,0,0,0|2,0,0]=4 17689 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)I 527a_200000755665_100000688013 [0,2,0,0,0,0|2,0,0]=4 17690 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)O 240690a_200000755665_100000719527 [0,2,0,0,0,0|2,0,0]=4 17691 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1Cl)O 527a_200000755665_100000719527 [0,2,0,0,0,0|2,0,0]=4 17692 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)Br 240690a_200000755665_100000212322 [0,2,0,0,0,0|2,0,0]=4 17693 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)Br 527a_200000755665_100000212322 [0,2,0,0,0,0|2,0,0]=4 17694 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)Cl 240690a_200000755665_100000214954 [0,2,0,0,0,0|2,0,0]=4 17695 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)Cl 527a_200000755665_100000214954 [0,2,0,0,0,0|2,0,0]=4 17696 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)F 240690a_200000755665_100000198512 [0,2,0,0,0,0|2,0,0]=4 17697 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)F 527a_200000755665_100000198512 [0,2,0,0,0,0|2,0,0]=4 17698 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)I 240690a_200000755665_100000688014 [0,2,0,0,0,0|2,0,0]=4 17699 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)I 527a_200000755665_100000688014 [0,2,0,0,0,0|2,0,0]=4 17700 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)O 240690a_200000755665_100000037260 [0,2,0,0,0,0|2,0,0]=4 17701 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1F)O 527a_200000755665_100000037260 [0,2,0,0,0,0|2,0,0]=4 17702 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)Br 240690a_200000755665_100000183945 [0,2,0,0,0,0|2,0,0]=4 17703 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)Cl 240690a_200000755665_100000739379 [0,2,0,0,0,0|2,0,0]=4 17704 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)Cl 527a_200000755665_100000739379 [0,2,0,0,0,0|2,0,0]=4 17705 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)F 240690a_200000755665_100000748905 [0,2,0,0,0,0|2,0,0]=4 17706 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)F 527a_200000755665_100000748905 [0,2,0,0,0,0|2,0,0]=4 17707 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)I 240690a_200000755665_100000750460 [0,2,0,0,0,0|2,0,0]=4 17708 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)I 527a_200000755665_100000750460 [0,2,0,0,0,0|2,0,0]=4 17709 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)O 240690a_200000755665_200009995701 [0,2,0,0,0,0|2,0,0]=4 17710 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1I)O 527a_200000755665_200009995701 [0,2,0,0,0,0|2,0,0]=4 17711 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Br 240690a_200000755665_100000212140 [0,2,0,0,0,0|1,0,0]=3 17712 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Br 527a_200000755665_100000212140 [0,2,0,0,0,0|1,0,0]=3 17713 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Cl 240690a_200000755665_100000212143 [0,2,0,0,0,0|1,0,0]=3 17714 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)Cl 527a_200000755665_100000212143 [0,2,0,0,0,0|1,0,0]=3 17715 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)F 240690a_200000755665_100000742286 [0,2,0,0,0,0|1,0,0]=3 17716 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)F 527a_200000755665_100000742286 [0,2,0,0,0,0|1,0,0]=3 17717 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)I 240690a_200000755665_100000212111 [0,2,0,0,0,0|1,0,0]=3 17718 B16R1.7492 CC(O)CCNC(=O)c1cc(ccc1O)I 527a_200000755665_100000212111 [0,2,0,0,0,0|1,0,0]=3 17719 B16R1.7492 CC(O)CNCC(=O)c1cc(ccc1O)Br 34a_100000210904_200009828000 [0,2,0,0,0,0|2,0,0]=4 17720 B16R1.7492 CC(O)CNCC(=O)c1cc(ccc1O)F 34a_100000210904_100009814381 [0,2,0,0,0,0|2,0,0]=4 17721 B16R1.7492 CC(O)CNCC(=O)c1cc(ccc1O)O 34a_100000210904_100009814097 [0,2,0,0,0,0|2,0,0]=4 17722 B16R1.7492 CC(O)CNNC(=O)c1cc(ccc1O)Br 22a_200000730056_100000212140 [0,2,0,0,0,0|2,0,0]=4 17723 B16R1.7492 CC(O)CNNC(=O)c1cc(ccc1O)Cl 22a_200000730056_100000212143 [0,2,0,0,0,0|2,0,0]=4 17724 B16R1.7492 CC(O)CNNC(=O)c1cc(ccc1O)F 22a_200000730056_100000742286 [0,2,0,0,0,0|2,0,0]=4 17725 B16R1.7492 CC(O)CNNC(=O)c1cc(ccc1O)I 22a_200000730056_100000212111 [0,2,0,0,0,0|2,0,0]=4 17726 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100011218427 [0,2,0,0,0,0|2,0,0]=4 17727 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100011218427 [0,2,0,0,0,0|2,0,0]=4 17728 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100011218427 [0,2,0,0,0,0|2,0,0]=4 17729 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)F 62a_100011218427_100009814381 [0,2,0,0,0,0|2,0,0]=4 17730 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100011218427 [0,2,0,0,0,0|2,0,0]=4 17731 B16R1.7492 CC(O)CSCC(=O)c1cc(ccc1O)O 62a_100011218427_100009814097 [0,2,0,0,0,0|2,0,0]=4 17732 B16R1.7492 CN(C)CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000695564 [0,2,0,0,0,0|2,0,0]=4 17733 B16R1.7492 CN(C)CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000695564 [0,2,0,0,0,0|2,0,0]=4 17734 B16R1.7492 CN(C)CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000695564 [0,2,0,0,0,0|2,0,0]=4 17735 B16R1.7492 CN(C)CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000695564 [0,2,0,0,0,0|2,0,0]=4 17736 B16R1.7492 CN(C)CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000695564 [0,2,0,0,0,0|2,0,0]=4 17737 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)Br 240690a_100000210585_100000212140 [0,2,0,0,0,0|2,0,0]=4 17738 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)Br 527a_100000210585_100000212140 [0,2,0,0,0,0|2,0,0]=4 17739 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)Cl 240690a_100000210585_100000212143 [0,2,0,0,0,0|2,0,0]=4 17740 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)Cl 527a_100000210585_100000212143 [0,2,0,0,0,0|2,0,0]=4 17741 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)F 240690a_100000210585_100000742286 [0,2,0,0,0,0|2,0,0]=4 17742 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)F 527a_100000210585_100000742286 [0,2,0,0,0,0|2,0,0]=4 17743 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)I 240690a_100000210585_100000212111 [0,2,0,0,0,0|2,0,0]=4 17744 B16R1.7492 CN(C)CCNC(=O)c1cc(ccc1O)I 527a_100000210585_100000212111 [0,2,0,0,0,0|2,0,0]=4 17745 B16R1.7492 C[C@@H](Cl)COCC(=O)c1cc(ccc1O)Br 34a_100016084084_200009828000 [0,2,0,0,0,0|2,0,0]=4 17746 B16R1.7492 C[C@@H](Cl)COCC(=O)c1cc(ccc1O)F 34a_100016084084_100009814381 [0,2,0,0,0,0|2,0,0]=4 17747 B16R1.7492 C[C@@H](Cl)COCC(=O)c1cc(ccc1O)O 34a_100016084084_100009814097 [0,2,0,0,0,0|2,0,0]=4 17748 B16R1.7492 C[C@@H](N)COCC(=O)c1cc(ccc1O)Br 34a_100000737577_200009828000 [0,2,0,0,0,0|2,0,0]=4 17749 B16R1.7492 C[C@@H](N)COCC(=O)c1cc(ccc1O)F 34a_100000737577_100009814381 [0,2,0,0,0,0|2,0,0]=4 17750 B16R1.7492 C[C@@H](N)COCC(=O)c1cc(ccc1O)O 34a_100000737577_100009814097 [0,2,0,0,0,0|2,0,0]=4 17751 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_100009817552 [0,2,0,0,0,0|2,0,0]=4 17752 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_100009817552 [0,2,0,0,0,0|2,0,0]=4 17753 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)F 62a_100009814381_100009817552 [0,2,0,0,0,0|2,0,0]=4 17754 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)F 62a_100009817552_100009814381 [0,2,0,0,0,0|2,0,0]=4 17755 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)O 62a_100009814097_100009817552 [0,2,0,0,0,0|2,0,0]=4 17756 B16R1.7492 C[C@@H](O)CSCC(=O)c1cc(ccc1O)O 62a_100009817552_100009814097 [0,2,0,0,0,0|2,0,0]=4 17757 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)C)Br 1458a_100000689033_100011214892 [0,2,0,0,0,0|2,0,0]=4 17758 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)C)C 1458a_100000195421_100011214892 [0,2,0,0,0,0|2,0,0]=4 17759 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)C)Cl 1458a_100011290873_100011214892 [0,2,0,0,0,0|2,0,0]=4 17760 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)C)F 1458a_100000749327_100011214892 [0,2,0,0,0,0|2,0,0]=4 17761 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)C)I 1458a_100000057929_100011214892 [0,2,0,0,0,0|2,0,0]=4 17762 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)C)O 1458a_100000229998_100011214892 [0,2,0,0,0,0|1,0,0]=3 17763 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)Br 1458a_100000689033_200000718107 [0,2,0,0,0,0|2,0,0]=4 17764 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)C 1458a_100000195421_200000718107 [0,2,0,0,0,0|2,0,0]=4 17765 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)Cl 1458a_100011290873_200000718107 [0,2,0,0,0,0|2,0,0]=4 17766 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)F 1458a_100000749327_200000718107 [0,2,0,0,0,0|2,0,0]=4 17767 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)I 1458a_100000057929_200000718107 [0,2,0,0,0,0|2,0,0]=4 17768 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCC(C)O)O 1458a_100000229998_200000718107 [0,2,0,0,0,0|1,0,0]=3 17769 B16R1.7492 Cc1ccc(c(c1)C(=O)CCCN(C)C)O 1458a_100000229998_100000695564 [0,2,0,0,0,0|2,0,0]=4 17770 B16R1.7492 Cc1ccc(c(c1)C(=O)CCOC(C)C)O 1458a_100000229998_100000211751 [0,2,0,0,0,0|2,0,0]=4 17771 B16R1.7492 Cc1ccc(c(c1)C(=O)CCSC(C)C)O 1458a_100000229998_100000730970 [0,2,0,0,0,0|2,0,0]=4 17772 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Br 11a_100000210545_100000689033 [0,2,0,0,0,0|2,0,0]=4 17773 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Br 1626a_100000210545_100000689033 [0,2,0,0,0,0|2,0,0]=4 17774 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Br 240690a_100000210545_100000689033 [0,2,0,0,0,0|2,0,0]=4 17775 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Br 527a_100000210545_100000689033 [0,2,0,0,0,0|2,0,0]=4 17776 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)C 11a_100000210545_100000195421 [0,2,0,0,0,0|2,0,0]=4 17777 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)C 1626a_100000210545_100000195421 [0,2,0,0,0,0|2,0,0]=4 17778 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)C 240690a_100000210545_100000195421 [0,2,0,0,0,0|2,0,0]=4 17779 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)C 527a_100000210545_100000195421 [0,2,0,0,0,0|2,0,0]=4 17780 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Cl 11a_100000210545_100011290873 [0,2,0,0,0,0|2,0,0]=4 17781 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Cl 1626a_100000210545_100011290873 [0,2,0,0,0,0|2,0,0]=4 17782 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Cl 240690a_100000210545_100011290873 [0,2,0,0,0,0|2,0,0]=4 17783 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)Cl 527a_100000210545_100011290873 [0,2,0,0,0,0|2,0,0]=4 17784 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)F 11a_100000210545_100000749327 [0,2,0,0,0,0|2,0,0]=4 17785 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)F 1626a_100000210545_100000749327 [0,2,0,0,0,0|2,0,0]=4 17786 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)F 240690a_100000210545_100000749327 [0,2,0,0,0,0|2,0,0]=4 17787 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)F 527a_100000210545_100000749327 [0,2,0,0,0,0|2,0,0]=4 17788 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)I 11a_100000210545_100000057929 [0,2,0,0,0,0|2,0,0]=4 17789 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)I 1626a_100000210545_100000057929 [0,2,0,0,0,0|2,0,0]=4 17790 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)I 240690a_100000210545_100000057929 [0,2,0,0,0,0|2,0,0]=4 17791 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)I 527a_100000210545_100000057929 [0,2,0,0,0,0|2,0,0]=4 17792 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)O 240690a_100000210545_100000229998 [0,2,0,0,0,0|1,0,0]=3 17793 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)C)O 527a_100000210545_100000229998 [0,2,0,0,0,0|1,0,0]=3 17794 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)Br 240690a_200000755665_100000689033 [0,2,0,0,0,0|2,0,0]=4 17795 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)Br 527a_200000755665_100000689033 [0,2,0,0,0,0|2,0,0]=4 17796 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)C 240690a_200000755665_100000195421 [0,2,0,0,0,0|2,0,0]=4 17797 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)C 527a_200000755665_100000195421 [0,2,0,0,0,0|2,0,0]=4 17798 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)Cl 240690a_200000755665_100011290873 [0,2,0,0,0,0|2,0,0]=4 17799 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)Cl 527a_200000755665_100011290873 [0,2,0,0,0,0|2,0,0]=4 17800 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)F 240690a_200000755665_100000749327 [0,2,0,0,0,0|2,0,0]=4 17801 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)F 527a_200000755665_100000749327 [0,2,0,0,0,0|2,0,0]=4 17802 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)I 240690a_200000755665_100000057929 [0,2,0,0,0,0|2,0,0]=4 17803 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)I 527a_200000755665_100000057929 [0,2,0,0,0,0|2,0,0]=4 17804 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)O 240690a_200000755665_100000229998 [0,2,0,0,0,0|1,0,0]=3 17805 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCC(C)O)O 527a_200000755665_100000229998 [0,2,0,0,0,0|1,0,0]=3 17806 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCN(C)C)O 240690a_100000210585_100000229998 [0,2,0,0,0,0|2,0,0]=4 17807 B16R1.7492 Cc1ccc(c(c1)C(=O)NCCN(C)C)O 527a_100000210585_100000229998 [0,2,0,0,0,0|2,0,0]=4 17808 B16R1.7492 Cc1ccc(c(c1)C(=O)NNCC(C)C)O 22a_100000696102_100000229998 [0,2,0,0,0,0|2,0,0]=4 17809 B16R1.7492 Cc1ccc(c(c1)C(=O)NNCC(C)O)O 22a_200000730056_100000229998 [0,2,0,0,0,0|2,0,0]=4 17810 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)C)Br 1458a_100000759961_100011214892 [0,2,0,0,0,0|2,0,0]=4 17811 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)C)Cl 1458a_100000692595_100011214892 [0,2,0,0,0,0|2,0,0]=4 17812 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)C)F 1458a_100000240043_100011214892 [0,2,0,0,0,0|2,0,0]=4 17813 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)C)I 1458a_100000688012_100011214892 [0,2,0,0,0,0|2,0,0]=4 17814 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)C)O 1458a_100000687834_100011214892 [0,2,0,0,0,0|2,0,0]=4 17815 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)O)Br 1458a_100000759961_200000718107 [0,2,0,0,0,0|2,0,0]=4 17816 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)O)Cl 1458a_100000692595_200000718107 [0,2,0,0,0,0|2,0,0]=4 17817 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)O)F 1458a_100000240043_200000718107 [0,2,0,0,0,0|2,0,0]=4 17818 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)O)I 1458a_100000688012_200000718107 [0,2,0,0,0,0|2,0,0]=4 17819 B16R1.7492 Cc1ccc(cc1C(=O)CCCC(C)O)O 1458a_100000687834_200000718107 [0,2,0,0,0,0|2,0,0]=4 17820 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Br 11a_100000210545_100000759961 [0,2,0,0,0,0|2,0,0]=4 17821 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Br 1626a_100000210545_100000759961 [0,2,0,0,0,0|2,0,0]=4 17822 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Br 240690a_100000210545_100000759961 [0,2,0,0,0,0|2,0,0]=4 17823 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Br 527a_100000210545_100000759961 [0,2,0,0,0,0|2,0,0]=4 17824 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Cl 11a_100000210545_100000692595 [0,2,0,0,0,0|2,0,0]=4 17825 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000692595 [0,2,0,0,0,0|2,0,0]=4 17826 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000692595 [0,2,0,0,0,0|2,0,0]=4 17827 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)Cl 527a_100000210545_100000692595 [0,2,0,0,0,0|2,0,0]=4 17828 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)F 11a_100000210545_100000240043 [0,2,0,0,0,0|2,0,0]=4 17829 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)F 1626a_100000210545_100000240043 [0,2,0,0,0,0|2,0,0]=4 17830 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)F 240690a_100000210545_100000240043 [0,2,0,0,0,0|2,0,0]=4 17831 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)F 527a_100000210545_100000240043 [0,2,0,0,0,0|2,0,0]=4 17832 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)I 11a_100000210545_100000688012 [0,2,0,0,0,0|2,0,0]=4 17833 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)I 1626a_100000210545_100000688012 [0,2,0,0,0,0|2,0,0]=4 17834 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)I 240690a_100000210545_100000688012 [0,2,0,0,0,0|2,0,0]=4 17835 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)I 527a_100000210545_100000688012 [0,2,0,0,0,0|2,0,0]=4 17836 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)C)O 240690a_100000210545_100000687834 [0,2,0,0,0,0|2,0,0]=4 17837 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)Br 240690a_200000755665_100000759961 [0,2,0,0,0,0|2,0,0]=4 17838 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)Br 527a_200000755665_100000759961 [0,2,0,0,0,0|2,0,0]=4 17839 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)Cl 240690a_200000755665_100000692595 [0,2,0,0,0,0|2,0,0]=4 17840 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)Cl 527a_200000755665_100000692595 [0,2,0,0,0,0|2,0,0]=4 17841 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)F 240690a_200000755665_100000240043 [0,2,0,0,0,0|2,0,0]=4 17842 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)F 527a_200000755665_100000240043 [0,2,0,0,0,0|2,0,0]=4 17843 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)I 240690a_200000755665_100000688012 [0,2,0,0,0,0|2,0,0]=4 17844 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)I 527a_200000755665_100000688012 [0,2,0,0,0,0|2,0,0]=4 17845 B16R1.7492 Cc1ccc(cc1C(=O)NCCC(C)O)O 240690a_200000755665_100000687834 [0,2,0,0,0,0|2,0,0]=4 17846 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200011215066 [0,2,0,0,0,0|2,0,0]=4 17847 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Br)C 1458a_100000689033_200011215066 [0,2,0,0,0,0|2,0,0]=4 17848 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200011215066 [0,2,0,0,0,0|2,0,0]=4 17849 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Br)F 1458a_100000212315_200011215066 [0,2,0,0,0,0|2,0,0]=4 17850 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Br)I 1458a_100000698340_200011215066 [0,2,0,0,0,0|2,0,0]=4 17851 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Br)O 1458a_100012352043_200011215066 [0,2,0,0,0,0|2,0,0]=4 17852 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1C)Br 1458a_100000759961_200011215066 [0,2,0,0,0,0|2,0,0]=4 17853 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1C)C 1458a_100000195421_200011215066 [0,2,0,0,0,0|2,0,0]=4 17854 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1C)Cl 1458a_100000692595_200011215066 [0,2,0,0,0,0|2,0,0]=4 17855 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1C)F 1458a_100000240043_200011215066 [0,2,0,0,0,0|2,0,0]=4 17856 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1C)I 1458a_100000688012_200011215066 [0,2,0,0,0,0|2,0,0]=4 17857 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1C)O 1458a_100000687834_200011215066 [0,2,0,0,0,0|2,0,0]=4 17858 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200011215066 [0,2,0,0,0,0|2,0,0]=4 17859 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Cl)C 1458a_100011290873_200011215066 [0,2,0,0,0,0|2,0,0]=4 17860 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200011215066 [0,2,0,0,0,0|2,0,0]=4 17861 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200011215066 [0,2,0,0,0,0|2,0,0]=4 17862 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200011215066 [0,2,0,0,0,0|2,0,0]=4 17863 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200011215066 [0,2,0,0,0,0|2,0,0]=4 17864 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1F)Br 1458a_100000212322_200011215066 [0,2,0,0,0,0|2,0,0]=4 17865 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1F)C 1458a_100000749327_200011215066 [0,2,0,0,0,0|2,0,0]=4 17866 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200011215066 [0,2,0,0,0,0|2,0,0]=4 17867 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1F)F 1458a_100000198512_200011215066 [0,2,0,0,0,0|2,0,0]=4 17868 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1F)I 1458a_100000688014_200011215066 [0,2,0,0,0,0|2,0,0]=4 17869 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1F)O 1458a_100000037260_200011215066 [0,2,0,0,0,0|2,0,0]=4 17870 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1I)Br 1458a_100000183945_200011215066 [0,2,0,0,0,0|2,0,0]=4 17871 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1I)C 1458a_100000057929_200011215066 [0,2,0,0,0,0|2,0,0]=4 17872 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200011215066 [0,2,0,0,0,0|2,0,0]=4 17873 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1I)F 1458a_100000748905_200011215066 [0,2,0,0,0,0|2,0,0]=4 17874 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1I)I 1458a_100000750460_200011215066 [0,2,0,0,0,0|2,0,0]=4 17875 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1I)O 1458a_200009995701_200011215066 [0,2,0,0,0,0|2,0,0]=4 17876 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1O)Br 1458a_100000212140_200011215066 [0,2,0,0,0,0|1,0,0]=3 17877 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1O)C 1458a_100000229998_200011215066 [0,2,0,0,0,0|1,0,0]=3 17878 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200011215066 [0,2,0,0,0,0|1,0,0]=3 17879 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1O)F 1458a_100000742286_200011215066 [0,2,0,0,0,0|1,0,0]=3 17880 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1O)I 1458a_100000212111_200011215066 [0,2,0,0,0,0|1,0,0]=3 17881 B16R1.7497 CCCCC(C)C(=O)c1cc(ccc1O)O 1458a_100000758025_200011215066 [0,2,0,0,0,0|1,0,0]=3 17882 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Br 11a_100000207549_100000690610 [0,2,0,0,0,0|2,0,0]=4 17883 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Br 1626a_100000207549_100000690610 [0,2,0,0,0,0|2,0,0]=4 17884 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Br 240690a_100000207549_100000690610 [0,2,0,0,0,0|2,0,0]=4 17885 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Br 527a_100000207549_100000690610 [0,2,0,0,0,0|2,0,0]=4 17886 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)C 11a_100000207549_100000689033 [0,2,0,0,0,0|2,0,0]=4 17887 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)C 1626a_100000207549_100000689033 [0,2,0,0,0,0|2,0,0]=4 17888 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)C 240690a_100000207549_100000689033 [0,2,0,0,0,0|2,0,0]=4 17889 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)C 527a_100000207549_100000689033 [0,2,0,0,0,0|2,0,0]=4 17890 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Cl 11a_100000207549_100000736951 [0,2,0,0,0,0|2,0,0]=4 17891 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Cl 1626a_100000207549_100000736951 [0,2,0,0,0,0|2,0,0]=4 17892 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Cl 240690a_100000207549_100000736951 [0,2,0,0,0,0|2,0,0]=4 17893 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)Cl 527a_100000207549_100000736951 [0,2,0,0,0,0|2,0,0]=4 17894 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)F 11a_100000207549_100000212315 [0,2,0,0,0,0|2,0,0]=4 17895 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)F 1626a_100000207549_100000212315 [0,2,0,0,0,0|2,0,0]=4 17896 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)F 240690a_100000207549_100000212315 [0,2,0,0,0,0|2,0,0]=4 17897 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)F 527a_100000207549_100000212315 [0,2,0,0,0,0|2,0,0]=4 17898 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)I 11a_100000207549_100000698340 [0,2,0,0,0,0|2,0,0]=4 17899 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)I 1626a_100000207549_100000698340 [0,2,0,0,0,0|2,0,0]=4 17900 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)I 240690a_100000207549_100000698340 [0,2,0,0,0,0|2,0,0]=4 17901 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)I 527a_100000207549_100000698340 [0,2,0,0,0,0|2,0,0]=4 17902 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)O 240690a_100000207549_100012352043 [0,2,0,0,0,0|2,0,0]=4 17903 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Br)O 527a_100000207549_100012352043 [0,2,0,0,0,0|2,0,0]=4 17904 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Br 11a_100000207549_100000759961 [0,2,0,0,0,0|2,0,0]=4 17905 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Br 1626a_100000207549_100000759961 [0,2,0,0,0,0|2,0,0]=4 17906 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Br 240690a_100000207549_100000759961 [0,2,0,0,0,0|2,0,0]=4 17907 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Br 527a_100000207549_100000759961 [0,2,0,0,0,0|2,0,0]=4 17908 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)C 11a_100000207549_100000195421 [0,2,0,0,0,0|2,0,0]=4 17909 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)C 1626a_100000207549_100000195421 [0,2,0,0,0,0|2,0,0]=4 17910 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)C 240690a_100000207549_100000195421 [0,2,0,0,0,0|2,0,0]=4 17911 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)C 527a_100000207549_100000195421 [0,2,0,0,0,0|2,0,0]=4 17912 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Cl 11a_100000207549_100000692595 [0,2,0,0,0,0|2,0,0]=4 17913 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Cl 1626a_100000207549_100000692595 [0,2,0,0,0,0|2,0,0]=4 17914 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Cl 240690a_100000207549_100000692595 [0,2,0,0,0,0|2,0,0]=4 17915 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)Cl 527a_100000207549_100000692595 [0,2,0,0,0,0|2,0,0]=4 17916 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)F 11a_100000207549_100000240043 [0,2,0,0,0,0|2,0,0]=4 17917 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)F 1626a_100000207549_100000240043 [0,2,0,0,0,0|2,0,0]=4 17918 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)F 240690a_100000207549_100000240043 [0,2,0,0,0,0|2,0,0]=4 17919 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)F 527a_100000207549_100000240043 [0,2,0,0,0,0|2,0,0]=4 17920 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)I 11a_100000207549_100000688012 [0,2,0,0,0,0|2,0,0]=4 17921 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)I 1626a_100000207549_100000688012 [0,2,0,0,0,0|2,0,0]=4 17922 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)I 240690a_100000207549_100000688012 [0,2,0,0,0,0|2,0,0]=4 17923 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)I 527a_100000207549_100000688012 [0,2,0,0,0,0|2,0,0]=4 17924 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1C)O 240690a_100000207549_100000687834 [0,2,0,0,0,0|2,0,0]=4 17925 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Br 11a_100000207549_100000211212 [0,2,0,0,0,0|2,0,0]=4 17926 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Br 1626a_100000207549_100000211212 [0,2,0,0,0,0|2,0,0]=4 17927 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Br 240690a_100000207549_100000211212 [0,2,0,0,0,0|2,0,0]=4 17928 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Br 527a_100000207549_100000211212 [0,2,0,0,0,0|2,0,0]=4 17929 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)C 11a_100000207549_100011290873 [0,2,0,0,0,0|2,0,0]=4 17930 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)C 1626a_100000207549_100011290873 [0,2,0,0,0,0|2,0,0]=4 17931 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)C 240690a_100000207549_100011290873 [0,2,0,0,0,0|2,0,0]=4 17932 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)C 527a_100000207549_100011290873 [0,2,0,0,0,0|2,0,0]=4 17933 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Cl 11a_100000207549_100000210642 [0,2,0,0,0,0|2,0,0]=4 17934 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Cl 1626a_100000207549_100000210642 [0,2,0,0,0,0|2,0,0]=4 17935 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Cl 240690a_100000207549_100000210642 [0,2,0,0,0,0|2,0,0]=4 17936 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)Cl 527a_100000207549_100000210642 [0,2,0,0,0,0|2,0,0]=4 17937 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)F 11a_100000207549_100011219680 [0,2,0,0,0,0|2,0,0]=4 17938 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)F 1626a_100000207549_100011219680 [0,2,0,0,0,0|2,0,0]=4 17939 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)F 240690a_100000207549_100011219680 [0,2,0,0,0,0|2,0,0]=4 17940 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)F 527a_100000207549_100011219680 [0,2,0,0,0,0|2,0,0]=4 17941 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)I 11a_100000207549_100000688013 [0,2,0,0,0,0|2,0,0]=4 17942 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)I 1626a_100000207549_100000688013 [0,2,0,0,0,0|2,0,0]=4 17943 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)I 240690a_100000207549_100000688013 [0,2,0,0,0,0|2,0,0]=4 17944 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)I 527a_100000207549_100000688013 [0,2,0,0,0,0|2,0,0]=4 17945 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)O 240690a_100000207549_100000719527 [0,2,0,0,0,0|2,0,0]=4 17946 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1Cl)O 527a_100000207549_100000719527 [0,2,0,0,0,0|2,0,0]=4 17947 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Br 11a_100000207549_100000212322 [0,2,0,0,0,0|2,0,0]=4 17948 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Br 1626a_100000207549_100000212322 [0,2,0,0,0,0|2,0,0]=4 17949 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Br 240690a_100000207549_100000212322 [0,2,0,0,0,0|2,0,0]=4 17950 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Br 527a_100000207549_100000212322 [0,2,0,0,0,0|2,0,0]=4 17951 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)C 11a_100000207549_100000749327 [0,2,0,0,0,0|2,0,0]=4 17952 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)C 1626a_100000207549_100000749327 [0,2,0,0,0,0|2,0,0]=4 17953 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)C 240690a_100000207549_100000749327 [0,2,0,0,0,0|2,0,0]=4 17954 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)C 527a_100000207549_100000749327 [0,2,0,0,0,0|2,0,0]=4 17955 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Cl 11a_100000207549_100000214954 [0,2,0,0,0,0|2,0,0]=4 17956 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Cl 1626a_100000207549_100000214954 [0,2,0,0,0,0|2,0,0]=4 17957 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Cl 240690a_100000207549_100000214954 [0,2,0,0,0,0|2,0,0]=4 17958 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)Cl 527a_100000207549_100000214954 [0,2,0,0,0,0|2,0,0]=4 17959 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)F 11a_100000207549_100000198512 [0,2,0,0,0,0|2,0,0]=4 17960 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)F 1626a_100000207549_100000198512 [0,2,0,0,0,0|2,0,0]=4 17961 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)F 240690a_100000207549_100000198512 [0,2,0,0,0,0|2,0,0]=4 17962 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)F 527a_100000207549_100000198512 [0,2,0,0,0,0|2,0,0]=4 17963 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)I 11a_100000207549_100000688014 [0,2,0,0,0,0|2,0,0]=4 17964 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)I 1626a_100000207549_100000688014 [0,2,0,0,0,0|2,0,0]=4 17965 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)I 240690a_100000207549_100000688014 [0,2,0,0,0,0|2,0,0]=4 17966 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)I 527a_100000207549_100000688014 [0,2,0,0,0,0|2,0,0]=4 17967 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)O 240690a_100000207549_100000037260 [0,2,0,0,0,0|2,0,0]=4 17968 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1F)O 527a_100000207549_100000037260 [0,2,0,0,0,0|2,0,0]=4 17969 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Br 11a_100000207549_100000183945 [0,2,0,0,0,0|2,0,0]=4 17970 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Br 1626a_100000207549_100000183945 [0,2,0,0,0,0|2,0,0]=4 17971 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Br 240690a_100000207549_100000183945 [0,2,0,0,0,0|2,0,0]=4 17972 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)C 11a_100000207549_100000057929 [0,2,0,0,0,0|2,0,0]=4 17973 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)C 1626a_100000207549_100000057929 [0,2,0,0,0,0|2,0,0]=4 17974 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)C 240690a_100000207549_100000057929 [0,2,0,0,0,0|2,0,0]=4 17975 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)C 527a_100000207549_100000057929 [0,2,0,0,0,0|2,0,0]=4 17976 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Cl 11a_100000207549_100000739379 [0,2,0,0,0,0|2,0,0]=4 17977 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Cl 1626a_100000207549_100000739379 [0,2,0,0,0,0|2,0,0]=4 17978 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Cl 240690a_100000207549_100000739379 [0,2,0,0,0,0|2,0,0]=4 17979 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)Cl 527a_100000207549_100000739379 [0,2,0,0,0,0|2,0,0]=4 17980 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)F 11a_100000207549_100000748905 [0,2,0,0,0,0|2,0,0]=4 17981 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)F 1626a_100000207549_100000748905 [0,2,0,0,0,0|2,0,0]=4 17982 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)F 240690a_100000207549_100000748905 [0,2,0,0,0,0|2,0,0]=4 17983 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)F 527a_100000207549_100000748905 [0,2,0,0,0,0|2,0,0]=4 17984 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)I 11a_100000207549_100000750460 [0,2,0,0,0,0|2,0,0]=4 17985 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)I 1626a_100000207549_100000750460 [0,2,0,0,0,0|2,0,0]=4 17986 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)I 240690a_100000207549_100000750460 [0,2,0,0,0,0|2,0,0]=4 17987 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)I 527a_100000207549_100000750460 [0,2,0,0,0,0|2,0,0]=4 17988 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)O 1626a_100000207549_200009995701 [0,2,0,0,0,0|2,0,0]=4 17989 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)O 240690a_100000207549_200009995701 [0,2,0,0,0,0|2,0,0]=4 17990 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1I)O 527a_100000207549_200009995701 [0,2,0,0,0,0|2,0,0]=4 17991 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Br 1626a_100000207549_100000212140 [0,2,0,0,0,0|1,0,0]=3 17992 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Br 240690a_100000207549_100000212140 [0,2,0,0,0,0|1,0,0]=3 17993 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Br 527a_100000207549_100000212140 [0,2,0,0,0,0|1,0,0]=3 17994 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)C 240690a_100000207549_100000229998 [0,2,0,0,0,0|1,0,0]=3 17995 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)C 527a_100000207549_100000229998 [0,2,0,0,0,0|1,0,0]=3 17996 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Cl 11a_100000207549_100000212143 [0,2,0,0,0,0|1,0,0]=3 17997 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Cl 1626a_100000207549_100000212143 [0,2,0,0,0,0|1,0,0]=3 17998 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Cl 240690a_100000207549_100000212143 [0,2,0,0,0,0|1,0,0]=3 17999 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)Cl 527a_100000207549_100000212143 [0,2,0,0,0,0|1,0,0]=3 18000 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)F 240690a_100000207549_100000742286 [0,2,0,0,0,0|1,0,0]=3 18001 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)F 527a_100000207549_100000742286 [0,2,0,0,0,0|1,0,0]=3 18002 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)I 240690a_100000207549_100000212111 [0,2,0,0,0,0|1,0,0]=3 18003 B16R1.7497 CCCCN(C)C(=O)c1cc(ccc1O)I 527a_100000207549_100000212111 [0,2,0,0,0,0|1,0,0]=3 18004 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)Br 240690a_100000213112_100000212140 [0,2,0,0,0,0|2,0,0]=4 18005 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)Br 527a_100000213112_100000212140 [0,2,0,0,0,0|2,0,0]=4 18006 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)Cl 240690a_100000213112_100000212143 [0,2,0,0,0,0|2,0,0]=4 18007 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)Cl 527a_100000213112_100000212143 [0,2,0,0,0,0|2,0,0]=4 18008 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)F 240690a_100000213112_100000742286 [0,2,0,0,0,0|2,0,0]=4 18009 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)F 527a_100000213112_100000742286 [0,2,0,0,0,0|2,0,0]=4 18010 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)I 240690a_100000213112_100000212111 [0,2,0,0,0,0|2,0,0]=4 18011 B16R1.7497 CN(CCCO)C(=O)c1cc(ccc1O)I 527a_100000213112_100000212111 [0,2,0,0,0,0|2,0,0]=4 18012 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Br 1626a_100000743101_100000212140 [0,2,0,0,0,0|2,0,0]=4 18013 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Br 240690a_100000743101_100000212140 [0,2,0,0,0,0|2,0,0]=4 18014 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Br 527a_100000743101_100000212140 [0,2,0,0,0,0|2,0,0]=4 18015 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)C 240690a_100000743101_100000229998 [0,2,0,0,0,0|2,0,0]=4 18016 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)C 527a_100000743101_100000229998 [0,2,0,0,0,0|2,0,0]=4 18017 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Cl 11a_100000743101_100000212143 [0,2,0,0,0,0|2,0,0]=4 18018 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Cl 1626a_100000743101_100000212143 [0,2,0,0,0,0|2,0,0]=4 18019 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Cl 240690a_100000743101_100000212143 [0,2,0,0,0,0|2,0,0]=4 18020 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)Cl 527a_100000743101_100000212143 [0,2,0,0,0,0|2,0,0]=4 18021 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)F 240690a_100000743101_100000742286 [0,2,0,0,0,0|2,0,0]=4 18022 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)F 527a_100000743101_100000742286 [0,2,0,0,0,0|2,0,0]=4 18023 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)I 240690a_100000743101_100000212111 [0,2,0,0,0,0|2,0,0]=4 18024 B16R1.7497 COCCN(C)C(=O)c1cc(ccc1O)I 527a_100000743101_100000212111 [0,2,0,0,0,0|2,0,0]=4 18025 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Br 1626a_100000686725_100000212140 [0,2,0,0,0,0|2,0,0]=4 18026 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Br 240690a_100000686725_100000212140 [0,2,0,0,0,0|2,0,0]=4 18027 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Br 527a_100000686725_100000212140 [0,2,0,0,0,0|2,0,0]=4 18028 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)C 240690a_100000686725_100000229998 [0,2,0,0,0,0|2,0,0]=4 18029 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)C 527a_100000686725_100000229998 [0,2,0,0,0,0|2,0,0]=4 18030 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Cl 11a_100000686725_100000212143 [0,2,0,0,0,0|2,0,0]=4 18031 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Cl 1626a_100000686725_100000212143 [0,2,0,0,0,0|2,0,0]=4 18032 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Cl 240690a_100000686725_100000212143 [0,2,0,0,0,0|2,0,0]=4 18033 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)Cl 527a_100000686725_100000212143 [0,2,0,0,0,0|2,0,0]=4 18034 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)F 240690a_100000686725_100000742286 [0,2,0,0,0,0|2,0,0]=4 18035 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)F 527a_100000686725_100000742286 [0,2,0,0,0,0|2,0,0]=4 18036 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)I 240690a_100000686725_100000212111 [0,2,0,0,0,0|2,0,0]=4 18037 B16R1.7497 CSCCN(C)C(=O)c1cc(ccc1O)I 527a_100000686725_100000212111 [0,2,0,0,0,0|2,0,0]=4 18038 B16R1.7497 Cc1ccc(c(c1)C(=O)N(C)CCCO)O 240690a_100000213112_100000229998 [0,2,0,0,0,0|2,0,0]=4 18039 B16R1.7497 Cc1ccc(c(c1)C(=O)N(C)CCCO)O 527a_100000213112_100000229998 [0,2,0,0,0,0|2,0,0]=4 18040 B16R1.1730 C=C(C)c1ccccc1C(=O)NCCCC 271570a_100000694244_200000154865 [0,2,0,0,0,0|2,0,0]=4 18041 B16R1.1730 CCCCCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210326 [0,2,0,0,0,0|2,0,0]=4 18042 B16R1.1730 CCCCCC(=O)c1ccccc1C(F)F 1458a_100009872251_100000210326 [0,2,0,0,0,0|2,0,0]=4 18043 B16R1.1730 CCCCCC(=O)c1ccccc1I(=O)=O 1458a_100000061294_100000210326 [0,2,0,0,0,0|1,0,1]=4 18044 B16R1.1730 CCCCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210326 [0,2,0,0,0,0|2,0,0]=4 18045 B16R1.1730 CCCCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210326 [0,2,0,0,0,0|1,0,1]=4 18046 B16R1.1730 CCCCCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210326 [0,2,0,0,0,0|1,0,1]=4 18047 B16R1.1730 CCCCNC(=O)c1ccccc1C(C)C 11a_100000102301_100011941426 [0,2,0,0,0,0|2,0,0]=4 18048 B16R1.1730 CCCCNC(=O)c1ccccc1C(C)C 1626a_100000102301_100011941426 [0,2,0,0,0,0|2,0,0]=4 18049 B16R1.1730 CCCCNC(=O)c1ccccc1C(C)C 240690a_100000102301_100011941426 [0,2,0,0,0,0|2,0,0]=4 18050 B16R1.1730 CCCCNC(=O)c1ccccc1C(C)C 527a_100000102301_100011941426 [0,2,0,0,0,0|2,0,0]=4 18051 B16R1.1730 CCCCNC(=O)c1ccccc1C(F)F 11a_100000102301_100009872251 [0,2,0,0,0,0|2,0,0]=4 18052 B16R1.1730 CCCCNC(=O)c1ccccc1C(F)F 1626a_100000102301_100009872251 [0,2,0,0,0,0|2,0,0]=4 18053 B16R1.1730 CCCCNC(=O)c1ccccc1C(F)F 240690a_100000102301_100009872251 [0,2,0,0,0,0|2,0,0]=4 18054 B16R1.1730 CCCCNC(=O)c1ccccc1C(F)F 527a_100000102301_100009872251 [0,2,0,0,0,0|2,0,0]=4 18055 B16R1.1730 CCCCNC(=O)c1ccccc1I(=O)=O 1626a_100000102301_100000061294 [0,2,0,0,0,0|1,0,1]=4 18056 B16R1.1730 CCCCNC(=O)c1ccccc1I(=O)=O 240690a_100000102301_100000061294 [0,2,0,0,0,0|1,0,1]=4 18057 B16R1.1730 CCCCNC(=O)c1ccccc1N(C)C 11a_100000102301_100011218752 [0,2,0,0,0,0|2,0,0]=4 18058 B16R1.1730 CCCCNC(=O)c1ccccc1N(C)C 1626a_100000102301_100011218752 [0,2,0,0,0,0|2,0,0]=4 18059 B16R1.1730 CCCCNC(=O)c1ccccc1N(C)C 240690a_100000102301_100011218752 [0,2,0,0,0,0|2,0,0]=4 18060 B16R1.1730 CCCCNC(=O)c1ccccc1N(C)C 27a_100102631434_200000154865 [0,2,0,0,0,0|2,0,0]=4 18061 B16R1.1730 CCCCNC(=O)c1ccccc1N(C)C 527a_100000102301_100011218752 [0,2,0,0,0,0|2,0,0]=4 18062 B16R1.1730 CCCCNC(=O)c1ccccc1S(=O)C 1626a_100000102301_100000204632 [0,2,0,0,0,0|1,0,1]=4 18063 B16R1.1730 CCCCNC(=O)c1ccccc1S(=O)C 240690a_100000102301_100000204632 [0,2,0,0,0,0|1,0,1]=4 18064 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 11a_100000102301_100000188706 [0,2,0,0,0,0|1,0,1]=4 18065 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100000102301_100000188706 [0,2,0,0,0,0|1,0,1]=4 18066 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100000102301_100000188706 [0,2,0,0,0,0|1,0,1]=4 18067 B16R1.1730 CCCCNC(=O)c1ccccc1[N+](=O)[O-] 527a_100000102301_100000188706 [0,2,0,0,0,0|1,0,1]=4 18068 B16R1.1730 CCCCOC(=O)c1ccccc1C(=O)C 1458a_100000035225_200000210301 [0,2,0,0,0,0|0,0,1]=3 18069 B16R1.1730 CCCCOC(=O)c1ccccc1C(=O)[13CH3] 1458a_100000035225_200025704644 [0,2,0,0,0,0|0,0,1]=3 18070 B16R1.1731 C=C=Cc1ccccc1C(=O)NCCCC 271570a_100015277604_200000154865 [0,2,0,0,0,0|2,0,0]=4 18071 B16R1.1731 CC=Cc1ccccc1C(=O)NCCCC 271570a_100016259895_200000154865 [0,2,0,0,0,0|2,0,0]=4 18072 B16R1.1731 CCCCCC(=O)c1ccccc1CC#N 1458a_100000010604_100000210326 [0,2,0,0,0,0|2,0,0]=4 18073 B16R1.1731 CCCCCC(=O)c1ccccc1COC 1458a_100000737999_100000210326 [0,2,0,0,0,0|1,0,0]=3 18074 B16R1.1731 CCCCCC(=O)c1ccccc1N=[N+]=[N-] 1458a_100009827904_100000210326 [0,2,0,0,0,0|2,0,0]=4 18075 B16R1.1731 CCCCCC(=O)c1ccccc1OCC 1458a_100000211144_100000210326 [0,2,0,0,0,0|1,0,0]=3 18076 B16R1.1731 CCCCCC(=O)c1ccccc1SCC 1458a_100000195471_100000210326 [0,2,0,0,0,0|1,1,0]=4 18077 B16R1.1731 CCCCNC(=O)c1ccccc1CC#N 11a_100000102301_100000010604 [0,2,0,0,0,0|2,0,0]=4 18078 B16R1.1731 CCCCNC(=O)c1ccccc1CC#N 1626a_100000102301_100000010604 [0,2,0,0,0,0|2,0,0]=4 18079 B16R1.1731 CCCCNC(=O)c1ccccc1COC 11a_100000102301_100000737999 [0,2,0,0,0,0|1,0,0]=3 18080 B16R1.1731 CCCCNC(=O)c1ccccc1COC 1626a_100000102301_100000737999 [0,2,0,0,0,0|1,0,0]=3 18081 B16R1.1731 CCCCNC(=O)c1ccccc1COC 240690a_100000102301_100000737999 [0,2,0,0,0,0|1,0,0]=3 18082 B16R1.1731 CCCCNC(=O)c1ccccc1COC 527a_100000102301_100000737999 [0,2,0,0,0,0|1,0,0]=3 18083 B16R1.1731 CCCCNC(=O)c1ccccc1N=[N+]=[N-] 240690a_100000102301_100009827904 [0,2,0,0,0,0|2,0,0]=4 18084 B16R1.1731 CCCCNC(=O)c1ccccc1NCC 2230a_100000243867_100000210202 [0,2,0,0,0,0|2,0,0]=4 18085 B16R1.1731 CCCCNC(=O)c1ccccc1NCC 27a_100015525214_200000154865 [0,2,0,0,0,0|2,0,0]=4 18086 B16R1.1731 CCCCNC(=O)c1ccccc1NCC 34a_100000243867_100000210202 [0,2,0,0,0,0|2,0,0]=4 18087 B16R1.1731 CCCCNC(=O)c1ccccc1NCF 34a_100000243867_100015361967 [0,2,0,0,0,0|2,0,0]=4 18088 B16R1.1731 CCCCNC(=O)c1ccccc1OCC 11a_100000102301_100000211144 [0,2,0,0,0,0|1,0,0]=3 18089 B16R1.1731 CCCCNC(=O)c1ccccc1OCC 1626a_100000102301_100000211144 [0,2,0,0,0,0|1,0,0]=3 18090 B16R1.1731 CCCCNC(=O)c1ccccc1OCC 240690a_100000102301_100000211144 [0,2,0,0,0,0|1,0,0]=3 18091 B16R1.1731 CCCCNC(=O)c1ccccc1OCC 527a_100000102301_100000211144 [0,2,0,0,0,0|1,0,0]=3 18092 B16R1.1731 CCCCNC(=O)c1ccccc1SCC 11a_100000102301_100000195471 [0,2,0,0,0,0|1,1,0]=4 18093 B16R1.1731 CCCCNC(=O)c1ccccc1SCC 1626a_100000102301_100000195471 [0,2,0,0,0,0|1,1,0]=4 18094 B16R1.1731 CCCCNC(=O)c1ccccc1SCC 240690a_100000102301_100000195471 [0,2,0,0,0,0|1,1,0]=4 18095 B16R1.1731 CCCCNC(=O)c1ccccc1SCC 527a_100000102301_100000195471 [0,2,0,0,0,0|1,1,0]=4 18096 B16R1.1731 CCCCNC(=O)c1ccccc1SCC 62a_100000210202_200000154865 [0,2,0,0,0,0|1,1,0]=4 18097 B16R1.1731 CCCCNC(=O)c1ccccc1SCC 62a_200000154865_100000210202 [0,2,0,0,0,0|1,1,0]=4 18098 B16R1.1731 CCCCNC(=O)c1ccccc1SCF 62a_100015361967_200000154865 [0,2,0,0,0,0|1,1,0]=4 18099 B16R1.1731 CCCCNC(=O)c1ccccc1SCF 62a_200000154865_100015361967 [0,2,0,0,0,0|1,1,0]=4 18100 B16R1.1731 CCCCOC(=O)c1ccccc1OCC 7a_100011204317_100000210202 [0,2,0,0,0,0|0,0,0]=2 18101 B16R1.1731 CCCCOC(=O)c1ccccc1OCF 7a_100011204317_100015361967 [0,2,0,0,0,0|0,0,0]=2 18102 B16R1.1731 CCCCOC(C)c1ccccc1OCC 7a_100000246524_100000210211 [0,2,0,0,0,0|1,0,1]=4 18103 B16R1.1731 CCCNNC(=O)c1ccccc1COC 22a_100000740057_100000737999 [0,2,0,0,0,0|2,0,0]=4 18104 B16R1.1731 CCCNNC(=O)c1ccccc1OCC 22a_100000740057_100000211144 [0,2,0,0,0,0|2,0,0]=4 18105 B16R1.1731 CCOCCC(=O)c1ccccc1COC 1458a_100000737999_100011215890 [0,2,0,0,0,0|2,0,0]=4 18106 B16R1.1731 CCOCCC(=O)c1ccccc1OCC 1458a_100000211144_100011215890 [0,2,0,0,0,0|2,0,0]=4 18107 B16R1.1731 CCOc1ccccc1C(=O)CCCCF 1458a_100000211144_100000729493 [0,2,0,0,0,0|2,0,0]=4 18108 B16R1.1731 CCOc1ccccc1C(=O)CCCCO 1458a_100000211144_100000210776 [0,2,0,0,0,0|2,0,0]=4 18109 B16R1.1731 CCOc1ccccc1C(=O)CCCOC 1458a_100000211144_100000740836 [0,2,0,0,0,0|2,0,0]=4 18110 B16R1.1731 CCOc1ccccc1C(=O)CCSCC 1458a_100000211144_100000757381 [0,2,0,0,0,0|2,0,0]=4 18111 B16R1.1731 CCOc1ccccc1C(=O)NCCCF 11a_100015189416_100000211144 [0,2,0,0,0,0|2,0,0]=4 18112 B16R1.1731 CCOc1ccccc1C(=O)NCCCF 1626a_100015189416_100000211144 [0,2,0,0,0,0|2,0,0]=4 18113 B16R1.1731 CCOc1ccccc1C(=O)NCCCF 240690a_100015189416_100000211144 [0,2,0,0,0,0|2,0,0]=4 18114 B16R1.1731 CCOc1ccccc1C(=O)NCCCF 527a_100015189416_100000211144 [0,2,0,0,0,0|2,0,0]=4 18115 B16R1.1731 CCOc1ccccc1C(=O)NCCCO 240690a_100000182051_100000211144 [0,2,0,0,0,0|2,0,0]=4 18116 B16R1.1731 CCOc1ccccc1C(=O)NCCCO 527a_100000182051_100000211144 [0,2,0,0,0,0|2,0,0]=4 18117 B16R1.1731 CCOc1ccccc1C(=O)NCCOC 1626a_100000209980_100000211144 [0,2,0,0,0,0|2,0,0]=4 18118 B16R1.1731 CCOc1ccccc1C(=O)NCCOC 240690a_100000209980_100000211144 [0,2,0,0,0,0|2,0,0]=4 18119 B16R1.1731 CCOc1ccccc1C(=O)NCCOC 527a_100000209980_100000211144 [0,2,0,0,0,0|2,0,0]=4 18120 B16R1.1731 CCOc1ccccc1C(=O)NCCSC 11a_100020590264_100000211144 [0,2,0,0,0,0|2,0,0]=4 18121 B16R1.1731 CCOc1ccccc1C(=O)NCCSC 1626a_100020590264_100000211144 [0,2,0,0,0,0|2,0,0]=4 18122 B16R1.1731 CCOc1ccccc1C(=O)NCCSC 240690a_100020590264_100000211144 [0,2,0,0,0,0|2,0,0]=4 18123 B16R1.1731 CCOc1ccccc1C(=O)NCCSC 527a_100020590264_100000211144 [0,2,0,0,0,0|2,0,0]=4 18124 B16R1.1731 CCSCCC(=O)c1ccccc1COC 1458a_100000737999_100000757381 [0,2,0,0,0,0|2,0,0]=4 18125 B16R1.1731 COCCCC(=O)c1ccccc1COC 1458a_100000737999_100000740836 [0,2,0,0,0,0|2,0,0]=4 18126 B16R1.1731 COCCNC(=O)c1ccccc1COC 1626a_100000209980_100000737999 [0,2,0,0,0,0|2,0,0]=4 18127 B16R1.1731 COCCNC(=O)c1ccccc1COC 240690a_100000209980_100000737999 [0,2,0,0,0,0|2,0,0]=4 18128 B16R1.1731 COCCNC(=O)c1ccccc1COC 527a_100000209980_100000737999 [0,2,0,0,0,0|2,0,0]=4 18129 B16R1.1731 COCc1ccccc1C(=O)CCCCF 1458a_100000737999_100000729493 [0,2,0,0,0,0|2,0,0]=4 18130 B16R1.1731 COCc1ccccc1C(=O)CCCCO 1458a_100000737999_100000210776 [0,2,0,0,0,0|2,0,0]=4 18131 B16R1.1731 COCc1ccccc1C(=O)NCCCF 11a_100015189416_100000737999 [0,2,0,0,0,0|2,0,0]=4 18132 B16R1.1731 COCc1ccccc1C(=O)NCCCF 1626a_100015189416_100000737999 [0,2,0,0,0,0|2,0,0]=4 18133 B16R1.1731 COCc1ccccc1C(=O)NCCCF 240690a_100015189416_100000737999 [0,2,0,0,0,0|2,0,0]=4 18134 B16R1.1731 COCc1ccccc1C(=O)NCCCF 527a_100015189416_100000737999 [0,2,0,0,0,0|2,0,0]=4 18135 B16R1.1731 COCc1ccccc1C(=O)NCCCO 240690a_100000182051_100000737999 [0,2,0,0,0,0|2,0,0]=4 18136 B16R1.1731 COCc1ccccc1C(=O)NCCCO 527a_100000182051_100000737999 [0,2,0,0,0,0|2,0,0]=4 18137 B16R1.1731 COCc1ccccc1C(=O)NCCSC 11a_100020590264_100000737999 [0,2,0,0,0,0|2,0,0]=4 18138 B16R1.1731 COCc1ccccc1C(=O)NCCSC 1626a_100020590264_100000737999 [0,2,0,0,0,0|2,0,0]=4 18139 B16R1.1731 COCc1ccccc1C(=O)NCCSC 240690a_100020590264_100000737999 [0,2,0,0,0,0|2,0,0]=4 18140 B16R1.1731 COCc1ccccc1C(=O)NCCSC 527a_100020590264_100000737999 [0,2,0,0,0,0|2,0,0]=4 18141 B16R1.3539 CCCCCC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_100000210326 [0,2,0,0,0,0|2,0,0]=4 18142 B16R1.3539 CCCCCC(=O)c1ccc(cc1C#N)C 1458a_200012184421_100000210326 [0,2,0,0,0,0|2,0,0]=4 18143 B16R1.3539 CCCCCC(=O)c1ccc(cc1C#N)F 1458a_100012002388_100000210326 [0,2,0,0,0,0|2,0,0]=4 18144 B16R1.3539 CCCCCC(=O)c1ccc(cc1CC)Br 1458a_200012349896_100000210326 [0,2,0,0,0,0|2,0,0]=4 18145 B16R1.3539 CCCCCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210326 [0,2,0,0,0,0|1,0,0]=3 18146 B16R1.3539 CCCCCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210326 [0,2,0,0,0,0|1,0,0]=3 18147 B16R1.3539 CCCCCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000210326 [0,2,0,0,0,0|1,0,0]=3 18148 B16R1.3539 CCCCCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000210326 [0,2,0,0,0,0|1,0,0]=3 18149 B16R1.3539 CCCCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000210326 [0,2,0,0,0,0|1,0,0]=3 18150 B16R1.3539 CCCCCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000210326 [0,2,0,0,0,0|1,0,0]=3 18151 B16R1.3539 CCCCCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000210326 [0,2,0,0,0,0|1,0,0]=3 18152 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)Br 11a_100000102301_100012349539 [0,2,0,0,0,0|2,0,0]=4 18153 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)Br 240690a_100000102301_100012349539 [0,2,0,0,0,0|2,0,0]=4 18154 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)C 1626a_100000102301_200012184421 [0,2,0,0,0,0|2,0,0]=4 18155 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)C 240690a_100000102301_200012184421 [0,2,0,0,0,0|2,0,0]=4 18156 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)C 527a_100000102301_200012184421 [0,2,0,0,0,0|2,0,0]=4 18157 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)F 11a_100000102301_100012002388 [0,2,0,0,0,0|2,0,0]=4 18158 B16R1.3539 CCCCNC(=O)c1ccc(cc1C#N)F 1626a_100000102301_100012002388 [0,2,0,0,0,0|2,0,0]=4 18159 B16R1.3539 CCCCNC(=O)c1ccc(cc1CC)Br 11a_100000102301_200012349896 [0,2,0,0,0,0|2,0,0]=4 18160 B16R1.3539 CCCCNC(=O)c1ccc(cc1CC)Br 1626a_100000102301_200012349896 [0,2,0,0,0,0|2,0,0]=4 18161 B16R1.3539 CCCCNC(=O)c1ccc(cc1CC)Br 240690a_100000102301_200012349896 [0,2,0,0,0,0|2,0,0]=4 18162 B16R1.3539 CCCCNC(=O)c1ccc(cc1CC)Br 527a_100000102301_200012349896 [0,2,0,0,0,0|2,0,0]=4 18163 B16R1.3539 CCCCNC(=O)c1ccc(cc1CO)F 1626a_100000102301_100013035055 [0,2,0,0,0,0|1,0,0]=3 18164 B16R1.3539 CCCCNC(=O)c1ccc(cc1CO)F 240690a_100000102301_100013035055 [0,2,0,0,0,0|1,0,0]=3 18165 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Br 11a_100000102301_100000748230 [0,2,0,0,0,0|1,0,0]=3 18166 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Br 1626a_100000102301_100000748230 [0,2,0,0,0,0|1,0,0]=3 18167 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Br 240690a_100000102301_100000748230 [0,2,0,0,0,0|1,0,0]=3 18168 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Br 527a_100000102301_100000748230 [0,2,0,0,0,0|1,0,0]=3 18169 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)C 11a_100000102301_100000217210 [0,2,0,0,0,0|1,0,0]=3 18170 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)C 1626a_100000102301_100000217210 [0,2,0,0,0,0|1,0,0]=3 18171 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)C 240690a_100000102301_100000217210 [0,2,0,0,0,0|1,0,0]=3 18172 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)C 527a_100000102301_100000217210 [0,2,0,0,0,0|1,0,0]=3 18173 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Cl 11a_100000102301_100000217211 [0,2,0,0,0,0|1,0,0]=3 18174 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Cl 1626a_100000102301_100000217211 [0,2,0,0,0,0|1,0,0]=3 18175 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Cl 240690a_100000102301_100000217211 [0,2,0,0,0,0|1,0,0]=3 18176 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)Cl 527a_100000102301_100000217211 [0,2,0,0,0,0|1,0,0]=3 18177 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)F 11a_100000102301_100000239970 [0,2,0,0,0,0|1,0,0]=3 18178 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)F 1626a_100000102301_100000239970 [0,2,0,0,0,0|1,0,0]=3 18179 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)F 240690a_100000102301_100000239970 [0,2,0,0,0,0|1,0,0]=3 18180 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)F 527a_100000102301_100000239970 [0,2,0,0,0,0|1,0,0]=3 18181 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)I 11a_100000102301_100012353712 [0,2,0,0,0,0|1,0,0]=3 18182 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)I 1626a_100000102301_100012353712 [0,2,0,0,0,0|1,0,0]=3 18183 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)I 240690a_100000102301_100012353712 [0,2,0,0,0,0|1,0,0]=3 18184 B16R1.3539 CCCCNC(=O)c1ccc(cc1OC)I 527a_100000102301_100012353712 [0,2,0,0,0,0|1,0,0]=3 18185 B16R1.3539 CCCNNC(=O)c1ccc(cc1CO)Br 22a_100000740057_100010253900 [0,2,0,0,0,0|2,0,0]=4 18186 B16R1.3539 CCCNNC(=O)c1ccc(cc1OC)Br 22a_100000740057_100000748230 [0,2,0,0,0,0|2,0,0]=4 18187 B16R1.3539 CCCNNC(=O)c1ccc(cc1OC)C 22a_100000740057_100000217210 [0,2,0,0,0,0|2,0,0]=4 18188 B16R1.3539 CCCNNC(=O)c1ccc(cc1OC)Cl 22a_100000740057_100000217211 [0,2,0,0,0,0|2,0,0]=4 18189 B16R1.3539 CCCNNC(=O)c1ccc(cc1OC)F 22a_100000740057_100000239970 [0,2,0,0,0,0|2,0,0]=4 18190 B16R1.3539 CCCNNC(=O)c1ccc(cc1OC)I 22a_100000740057_100012353712 [0,2,0,0,0,0|2,0,0]=4 18191 B16R1.3539 CCCSCC(=O)c1ccc(cc1OC)Cl 62a_100012344415_100000210303 [0,2,0,0,0,0|2,0,0]=4 18192 B16R1.3539 CCOCCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100011215890 [0,2,0,0,0,0|2,0,0]=4 18193 B16R1.3539 CCOCCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100011215890 [0,2,0,0,0,0|2,0,0]=4 18194 B16R1.3539 CCOCCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100011215890 [0,2,0,0,0,0|2,0,0]=4 18195 B16R1.3539 CCOCCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100011215890 [0,2,0,0,0,0|2,0,0]=4 18196 B16R1.3539 CCOCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100011215890 [0,2,0,0,0,0|2,0,0]=4 18197 B16R1.3539 CCOCCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100011215890 [0,2,0,0,0,0|2,0,0]=4 18198 B16R1.3539 CCOCCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100011215890 [0,2,0,0,0,0|2,0,0]=4 18199 B16R1.3539 CCSCCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000757381 [0,2,0,0,0,0|2,0,0]=4 18200 B16R1.3539 CCSCCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000757381 [0,2,0,0,0,0|2,0,0]=4 18201 B16R1.3539 CCSCCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000757381 [0,2,0,0,0,0|2,0,0]=4 18202 B16R1.3539 CCSCCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000757381 [0,2,0,0,0,0|2,0,0]=4 18203 B16R1.3539 CCSCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000757381 [0,2,0,0,0,0|2,0,0]=4 18204 B16R1.3539 CCSCCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000757381 [0,2,0,0,0,0|2,0,0]=4 18205 B16R1.3539 CCSCCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000757381 [0,2,0,0,0,0|2,0,0]=4 18206 B16R1.3539 COCCCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000740836 [0,2,0,0,0,0|2,0,0]=4 18207 B16R1.3539 COCCCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000740836 [0,2,0,0,0,0|2,0,0]=4 18208 B16R1.3539 COCCCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000740836 [0,2,0,0,0,0|2,0,0]=4 18209 B16R1.3539 COCCCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000740836 [0,2,0,0,0,0|2,0,0]=4 18210 B16R1.3539 COCCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000740836 [0,2,0,0,0,0|2,0,0]=4 18211 B16R1.3539 COCCCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000740836 [0,2,0,0,0,0|2,0,0]=4 18212 B16R1.3539 COCCCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000740836 [0,2,0,0,0,0|2,0,0]=4 18213 B16R1.3539 COCCNC(=O)c1ccc(cc1CO)F 1626a_100000209980_100013035055 [0,2,0,0,0,0|2,0,0]=4 18214 B16R1.3539 COCCNC(=O)c1ccc(cc1CO)F 240690a_100000209980_100013035055 [0,2,0,0,0,0|2,0,0]=4 18215 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)Br 1626a_100000209980_100000748230 [0,2,0,0,0,0|2,0,0]=4 18216 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)Br 240690a_100000209980_100000748230 [0,2,0,0,0,0|2,0,0]=4 18217 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)Br 527a_100000209980_100000748230 [0,2,0,0,0,0|2,0,0]=4 18218 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)C 1626a_100000209980_100000217210 [0,2,0,0,0,0|2,0,0]=4 18219 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)C 240690a_100000209980_100000217210 [0,2,0,0,0,0|2,0,0]=4 18220 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)C 527a_100000209980_100000217210 [0,2,0,0,0,0|2,0,0]=4 18221 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)Cl 1626a_100000209980_100000217211 [0,2,0,0,0,0|2,0,0]=4 18222 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)Cl 240690a_100000209980_100000217211 [0,2,0,0,0,0|2,0,0]=4 18223 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)Cl 527a_100000209980_100000217211 [0,2,0,0,0,0|2,0,0]=4 18224 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)F 1626a_100000209980_100000239970 [0,2,0,0,0,0|2,0,0]=4 18225 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)F 240690a_100000209980_100000239970 [0,2,0,0,0,0|2,0,0]=4 18226 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)F 527a_100000209980_100000239970 [0,2,0,0,0,0|2,0,0]=4 18227 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)I 1626a_100000209980_100012353712 [0,2,0,0,0,0|2,0,0]=4 18228 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)I 240690a_100000209980_100012353712 [0,2,0,0,0,0|2,0,0]=4 18229 B16R1.3539 COCCNC(=O)c1ccc(cc1OC)I 527a_100000209980_100012353712 [0,2,0,0,0,0|2,0,0]=4 18230 B16R1.3539 COc1cc(ccc1C(=O)CCCCF)Br 1458a_100000748230_100000729493 [0,2,0,0,0,0|2,0,0]=4 18231 B16R1.3539 COc1cc(ccc1C(=O)CCCCF)C 1458a_100000217210_100000729493 [0,2,0,0,0,0|2,0,0]=4 18232 B16R1.3539 COc1cc(ccc1C(=O)CCCCF)Cl 1458a_100000217211_100000729493 [0,2,0,0,0,0|2,0,0]=4 18233 B16R1.3539 COc1cc(ccc1C(=O)CCCCF)F 1458a_100000239970_100000729493 [0,2,0,0,0,0|2,0,0]=4 18234 B16R1.3539 COc1cc(ccc1C(=O)CCCCF)I 1458a_100012353712_100000729493 [0,2,0,0,0,0|2,0,0]=4 18235 B16R1.3539 COc1cc(ccc1C(=O)CCCCO)Br 1458a_100000748230_100000210776 [0,2,0,0,0,0|2,0,0]=4 18236 B16R1.3539 COc1cc(ccc1C(=O)CCCCO)C 1458a_100000217210_100000210776 [0,2,0,0,0,0|2,0,0]=4 18237 B16R1.3539 COc1cc(ccc1C(=O)CCCCO)Cl 1458a_100000217211_100000210776 [0,2,0,0,0,0|2,0,0]=4 18238 B16R1.3539 COc1cc(ccc1C(=O)CCCCO)F 1458a_100000239970_100000210776 [0,2,0,0,0,0|2,0,0]=4 18239 B16R1.3539 COc1cc(ccc1C(=O)CCCCO)I 1458a_100012353712_100000210776 [0,2,0,0,0,0|2,0,0]=4 18240 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Br 11a_100015189416_100000748230 [0,2,0,0,0,0|2,0,0]=4 18241 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Br 1626a_100015189416_100000748230 [0,2,0,0,0,0|2,0,0]=4 18242 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Br 240690a_100015189416_100000748230 [0,2,0,0,0,0|2,0,0]=4 18243 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Br 527a_100015189416_100000748230 [0,2,0,0,0,0|2,0,0]=4 18244 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)C 11a_100015189416_100000217210 [0,2,0,0,0,0|2,0,0]=4 18245 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)C 1626a_100015189416_100000217210 [0,2,0,0,0,0|2,0,0]=4 18246 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)C 240690a_100015189416_100000217210 [0,2,0,0,0,0|2,0,0]=4 18247 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)C 527a_100015189416_100000217210 [0,2,0,0,0,0|2,0,0]=4 18248 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Cl 11a_100015189416_100000217211 [0,2,0,0,0,0|2,0,0]=4 18249 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Cl 1626a_100015189416_100000217211 [0,2,0,0,0,0|2,0,0]=4 18250 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Cl 240690a_100015189416_100000217211 [0,2,0,0,0,0|2,0,0]=4 18251 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)Cl 527a_100015189416_100000217211 [0,2,0,0,0,0|2,0,0]=4 18252 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)F 11a_100015189416_100000239970 [0,2,0,0,0,0|2,0,0]=4 18253 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)F 1626a_100015189416_100000239970 [0,2,0,0,0,0|2,0,0]=4 18254 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)F 240690a_100015189416_100000239970 [0,2,0,0,0,0|2,0,0]=4 18255 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)F 527a_100015189416_100000239970 [0,2,0,0,0,0|2,0,0]=4 18256 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)I 11a_100015189416_100012353712 [0,2,0,0,0,0|2,0,0]=4 18257 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)I 1626a_100015189416_100012353712 [0,2,0,0,0,0|2,0,0]=4 18258 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)I 240690a_100015189416_100012353712 [0,2,0,0,0,0|2,0,0]=4 18259 B16R1.3539 COc1cc(ccc1C(=O)NCCCF)I 527a_100015189416_100012353712 [0,2,0,0,0,0|2,0,0]=4 18260 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)Br 240690a_100000182051_100000748230 [0,2,0,0,0,0|2,0,0]=4 18261 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)Br 527a_100000182051_100000748230 [0,2,0,0,0,0|2,0,0]=4 18262 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)C 240690a_100000182051_100000217210 [0,2,0,0,0,0|2,0,0]=4 18263 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)C 527a_100000182051_100000217210 [0,2,0,0,0,0|2,0,0]=4 18264 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)Cl 240690a_100000182051_100000217211 [0,2,0,0,0,0|2,0,0]=4 18265 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)Cl 527a_100000182051_100000217211 [0,2,0,0,0,0|2,0,0]=4 18266 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)F 240690a_100000182051_100000239970 [0,2,0,0,0,0|2,0,0]=4 18267 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)F 527a_100000182051_100000239970 [0,2,0,0,0,0|2,0,0]=4 18268 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)I 240690a_100000182051_100012353712 [0,2,0,0,0,0|2,0,0]=4 18269 B16R1.3539 COc1cc(ccc1C(=O)NCCCO)I 527a_100000182051_100012353712 [0,2,0,0,0,0|2,0,0]=4 18270 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Br 11a_100020590264_100000748230 [0,2,0,0,0,0|2,0,0]=4 18271 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Br 1626a_100020590264_100000748230 [0,2,0,0,0,0|2,0,0]=4 18272 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Br 240690a_100020590264_100000748230 [0,2,0,0,0,0|2,0,0]=4 18273 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Br 527a_100020590264_100000748230 [0,2,0,0,0,0|2,0,0]=4 18274 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)C 11a_100020590264_100000217210 [0,2,0,0,0,0|2,0,0]=4 18275 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)C 1626a_100020590264_100000217210 [0,2,0,0,0,0|2,0,0]=4 18276 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)C 240690a_100020590264_100000217210 [0,2,0,0,0,0|2,0,0]=4 18277 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)C 527a_100020590264_100000217210 [0,2,0,0,0,0|2,0,0]=4 18278 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Cl 11a_100020590264_100000217211 [0,2,0,0,0,0|2,0,0]=4 18279 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Cl 1626a_100020590264_100000217211 [0,2,0,0,0,0|2,0,0]=4 18280 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Cl 240690a_100020590264_100000217211 [0,2,0,0,0,0|2,0,0]=4 18281 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)Cl 527a_100020590264_100000217211 [0,2,0,0,0,0|2,0,0]=4 18282 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)F 11a_100020590264_100000239970 [0,2,0,0,0,0|2,0,0]=4 18283 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)F 1626a_100020590264_100000239970 [0,2,0,0,0,0|2,0,0]=4 18284 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)F 240690a_100020590264_100000239970 [0,2,0,0,0,0|2,0,0]=4 18285 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)F 527a_100020590264_100000239970 [0,2,0,0,0,0|2,0,0]=4 18286 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)I 11a_100020590264_100012353712 [0,2,0,0,0,0|2,0,0]=4 18287 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)I 1626a_100020590264_100012353712 [0,2,0,0,0,0|2,0,0]=4 18288 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)I 240690a_100020590264_100012353712 [0,2,0,0,0,0|2,0,0]=4 18289 B16R1.3539 COc1cc(ccc1C(=O)NCCSC)I 527a_100020590264_100012353712 [0,2,0,0,0,0|2,0,0]=4 18290 B16R1.3539 CSCCNC(=O)c1ccc(cc1CO)F 1626a_100020590264_100013035055 [0,2,0,0,0,0|2,0,0]=4 18291 B16R1.3539 CSCCNC(=O)c1ccc(cc1CO)F 240690a_100020590264_100013035055 [0,2,0,0,0,0|2,0,0]=4 18292 B16R1.3539 O=C(CCCCF)c1ccc(cc1CO)Br 1458a_100010253900_100000729493 [0,2,0,0,0,0|2,0,0]=4 18293 B16R1.3539 O=C(CCCCF)c1ccc(cc1CO)F 1458a_100013035055_100000729493 [0,2,0,0,0,0|2,0,0]=4 18294 B16R1.3539 O=C(CCCCO)c1ccc(cc1CO)Br 1458a_100010253900_100000210776 [0,2,0,0,0,0|2,0,0]=4 18295 B16R1.3539 O=C(CCCCO)c1ccc(cc1CO)F 1458a_100013035055_100000210776 [0,2,0,0,0,0|2,0,0]=4 18296 B16R1.3539 O=C(NCCCF)c1ccc(cc1CO)F 1626a_100015189416_100013035055 [0,2,0,0,0,0|2,0,0]=4 18297 B16R1.3539 O=C(NCCCF)c1ccc(cc1CO)F 240690a_100015189416_100013035055 [0,2,0,0,0,0|2,0,0]=4 18298 B16R1.3539 O=C(NCCCO)c1ccc(cc1CO)F 240690a_100000182051_100013035055 [0,2,0,0,0,0|2,0,0]=4 18299 B16R1.3588 CCCCCC(=O)c1c(cccc1C#N)Br 1458a_200010145881_100000210326 [0,2,0,0,0,0|2,0,0]=4 18300 B16R1.3588 CCCCCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000210326 [0,2,0,0,0,0|1,0,0]=3 18301 B16R1.3588 CCCCCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000210326 [0,2,0,0,0,0|1,0,0]=3 18302 B16R1.3588 CCCCCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000210326 [0,2,0,0,0,0|1,0,0]=3 18303 B16R1.3588 CCCCCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000210326 [0,2,0,0,0,0|1,0,0]=3 18304 B16R1.3588 CCCCCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000210326 [0,2,0,0,0,0|1,0,0]=3 18305 B16R1.3588 CCCCCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000210326 [0,2,0,0,0,0|1,0,0]=3 18306 B16R1.3588 CCCCNC(=O)c1c(cccc1C#N)Br 240690a_100000102301_200010145881 [0,2,0,0,0,0|2,0,0]=4 18307 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Br 11a_100000102301_100011593405 [0,2,0,0,0,0|1,0,0]=3 18308 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Br 1626a_100000102301_100011593405 [0,2,0,0,0,0|1,0,0]=3 18309 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Br 240690a_100000102301_100011593405 [0,2,0,0,0,0|1,0,0]=3 18310 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Br 527a_100000102301_100011593405 [0,2,0,0,0,0|1,0,0]=3 18311 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)C 11a_100000102301_100000066212 [0,2,0,0,0,0|1,0,0]=3 18312 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)C 1626a_100000102301_100000066212 [0,2,0,0,0,0|1,0,0]=3 18313 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)C 240690a_100000102301_100000066212 [0,2,0,0,0,0|1,0,0]=3 18314 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Cl 11a_100000102301_100000743539 [0,2,0,0,0,0|1,0,0]=3 18315 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Cl 1626a_100000102301_100000743539 [0,2,0,0,0,0|1,0,0]=3 18316 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Cl 240690a_100000102301_100000743539 [0,2,0,0,0,0|1,0,0]=3 18317 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)Cl 527a_100000102301_100000743539 [0,2,0,0,0,0|1,0,0]=3 18318 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)F 11a_100000102301_100000759380 [0,2,0,0,0,0|1,0,0]=3 18319 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)F 1626a_100000102301_100000759380 [0,2,0,0,0,0|1,0,0]=3 18320 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)F 240690a_100000102301_100000759380 [0,2,0,0,0,0|1,0,0]=3 18321 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)F 527a_100000102301_100000759380 [0,2,0,0,0,0|1,0,0]=3 18322 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)I 11a_100000102301_100010179659 [0,2,0,0,0,0|1,0,0]=3 18323 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)I 1626a_100000102301_100010179659 [0,2,0,0,0,0|1,0,0]=3 18324 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)I 240690a_100000102301_100010179659 [0,2,0,0,0,0|1,0,0]=3 18325 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)I 527a_100000102301_100010179659 [0,2,0,0,0,0|1,0,0]=3 18326 B16R1.3588 CCCCNC(=O)c1c(cccc1OC)O 240690a_100000102301_100000043310 [0,2,0,0,0,0|1,0,0]=3 18327 B16R1.3588 CCCNNC(=O)c1c(cccc1OC)Br 22a_100000740057_100011593405 [0,2,0,0,0,0|2,0,0]=4 18328 B16R1.3588 CCCNNC(=O)c1c(cccc1OC)C 22a_100000740057_100000066212 [0,2,0,0,0,0|2,0,0]=4 18329 B16R1.3588 CCCNNC(=O)c1c(cccc1OC)Cl 22a_100000740057_100000743539 [0,2,0,0,0,0|2,0,0]=4 18330 B16R1.3588 CCCNNC(=O)c1c(cccc1OC)F 22a_100000740057_100000759380 [0,2,0,0,0,0|2,0,0]=4 18331 B16R1.3588 CCCNNC(=O)c1c(cccc1OC)I 22a_100000740057_100010179659 [0,2,0,0,0,0|2,0,0]=4 18332 B16R1.3588 CCCNNC(=O)c1c(cccc1OC)O 22a_100000740057_100000043310 [0,2,0,0,0,0|2,0,0]=4 18333 B16R1.3588 CCCOCC(=O)c1c(cccc1OC)Cl 34a_100000210258_100010768284 [0,2,0,0,0,0|2,0,0]=4 18334 B16R1.3588 CCCSCC(=O)c1c(cccc1OC)Cl 62a_100010768284_100000210303 [0,2,0,0,0,0|2,0,0]=4 18335 B16R1.3588 CCOCCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100011215890 [0,2,0,0,0,0|2,0,0]=4 18336 B16R1.3588 CCOCCC(=O)c1c(cccc1OC)C 1458a_100000066212_100011215890 [0,2,0,0,0,0|2,0,0]=4 18337 B16R1.3588 CCOCCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100011215890 [0,2,0,0,0,0|2,0,0]=4 18338 B16R1.3588 CCOCCC(=O)c1c(cccc1OC)F 1458a_100000759380_100011215890 [0,2,0,0,0,0|2,0,0]=4 18339 B16R1.3588 CCOCCC(=O)c1c(cccc1OC)I 1458a_100010179659_100011215890 [0,2,0,0,0,0|2,0,0]=4 18340 B16R1.3588 CCOCCC(=O)c1c(cccc1OC)O 1458a_100000043310_100011215890 [0,2,0,0,0,0|2,0,0]=4 18341 B16R1.3588 CCSCCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000757381 [0,2,0,0,0,0|2,0,0]=4 18342 B16R1.3588 CCSCCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000757381 [0,2,0,0,0,0|2,0,0]=4 18343 B16R1.3588 CCSCCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000757381 [0,2,0,0,0,0|2,0,0]=4 18344 B16R1.3588 CCSCCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000757381 [0,2,0,0,0,0|2,0,0]=4 18345 B16R1.3588 CCSCCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000757381 [0,2,0,0,0,0|2,0,0]=4 18346 B16R1.3588 CCSCCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000757381 [0,2,0,0,0,0|2,0,0]=4 18347 B16R1.3588 COCCCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000740836 [0,2,0,0,0,0|2,0,0]=4 18348 B16R1.3588 COCCCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000740836 [0,2,0,0,0,0|2,0,0]=4 18349 B16R1.3588 COCCCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000740836 [0,2,0,0,0,0|2,0,0]=4 18350 B16R1.3588 COCCCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000740836 [0,2,0,0,0,0|2,0,0]=4 18351 B16R1.3588 COCCCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000740836 [0,2,0,0,0,0|2,0,0]=4 18352 B16R1.3588 COCCCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000740836 [0,2,0,0,0,0|2,0,0]=4 18353 B16R1.3588 COCCNC(=O)c1c(cccc1OC)Br 1626a_100000209980_100011593405 [0,2,0,0,0,0|2,0,0]=4 18354 B16R1.3588 COCCNC(=O)c1c(cccc1OC)Br 240690a_100000209980_100011593405 [0,2,0,0,0,0|2,0,0]=4 18355 B16R1.3588 COCCNC(=O)c1c(cccc1OC)Br 527a_100000209980_100011593405 [0,2,0,0,0,0|2,0,0]=4 18356 B16R1.3588 COCCNC(=O)c1c(cccc1OC)C 1626a_100000209980_100000066212 [0,2,0,0,0,0|2,0,0]=4 18357 B16R1.3588 COCCNC(=O)c1c(cccc1OC)C 240690a_100000209980_100000066212 [0,2,0,0,0,0|2,0,0]=4 18358 B16R1.3588 COCCNC(=O)c1c(cccc1OC)Cl 1626a_100000209980_100000743539 [0,2,0,0,0,0|2,0,0]=4 18359 B16R1.3588 COCCNC(=O)c1c(cccc1OC)Cl 240690a_100000209980_100000743539 [0,2,0,0,0,0|2,0,0]=4 18360 B16R1.3588 COCCNC(=O)c1c(cccc1OC)Cl 527a_100000209980_100000743539 [0,2,0,0,0,0|2,0,0]=4 18361 B16R1.3588 COCCNC(=O)c1c(cccc1OC)F 1626a_100000209980_100000759380 [0,2,0,0,0,0|2,0,0]=4 18362 B16R1.3588 COCCNC(=O)c1c(cccc1OC)F 240690a_100000209980_100000759380 [0,2,0,0,0,0|2,0,0]=4 18363 B16R1.3588 COCCNC(=O)c1c(cccc1OC)F 527a_100000209980_100000759380 [0,2,0,0,0,0|2,0,0]=4 18364 B16R1.3588 COCCNC(=O)c1c(cccc1OC)I 1626a_100000209980_100010179659 [0,2,0,0,0,0|2,0,0]=4 18365 B16R1.3588 COCCNC(=O)c1c(cccc1OC)I 240690a_100000209980_100010179659 [0,2,0,0,0,0|2,0,0]=4 18366 B16R1.3588 COCCNC(=O)c1c(cccc1OC)I 527a_100000209980_100010179659 [0,2,0,0,0,0|2,0,0]=4 18367 B16R1.3588 COCCNC(=O)c1c(cccc1OC)O 240690a_100000209980_100000043310 [0,2,0,0,0,0|2,0,0]=4 18368 B16R1.3588 COc1cccc(c1C(=O)CCCCF)Br 1458a_100011593405_100000729493 [0,2,0,0,0,0|2,0,0]=4 18369 B16R1.3588 COc1cccc(c1C(=O)CCCCF)C 1458a_100000066212_100000729493 [0,2,0,0,0,0|2,0,0]=4 18370 B16R1.3588 COc1cccc(c1C(=O)CCCCF)Cl 1458a_100000743539_100000729493 [0,2,0,0,0,0|2,0,0]=4 18371 B16R1.3588 COc1cccc(c1C(=O)CCCCF)F 1458a_100000759380_100000729493 [0,2,0,0,0,0|2,0,0]=4 18372 B16R1.3588 COc1cccc(c1C(=O)CCCCF)I 1458a_100010179659_100000729493 [0,2,0,0,0,0|2,0,0]=4 18373 B16R1.3588 COc1cccc(c1C(=O)CCCCF)O 1458a_100000043310_100000729493 [0,2,0,0,0,0|2,0,0]=4 18374 B16R1.3588 COc1cccc(c1C(=O)CCCCO)Br 1458a_100011593405_100000210776 [0,2,0,0,0,0|2,0,0]=4 18375 B16R1.3588 COc1cccc(c1C(=O)CCCCO)C 1458a_100000066212_100000210776 [0,2,0,0,0,0|2,0,0]=4 18376 B16R1.3588 COc1cccc(c1C(=O)CCCCO)Cl 1458a_100000743539_100000210776 [0,2,0,0,0,0|2,0,0]=4 18377 B16R1.3588 COc1cccc(c1C(=O)CCCCO)F 1458a_100000759380_100000210776 [0,2,0,0,0,0|2,0,0]=4 18378 B16R1.3588 COc1cccc(c1C(=O)CCCCO)I 1458a_100010179659_100000210776 [0,2,0,0,0,0|2,0,0]=4 18379 B16R1.3588 COc1cccc(c1C(=O)CCCCO)O 1458a_100000043310_100000210776 [0,2,0,0,0,0|2,0,0]=4 18380 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Br 11a_100015189416_100011593405 [0,2,0,0,0,0|2,0,0]=4 18381 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Br 1626a_100015189416_100011593405 [0,2,0,0,0,0|2,0,0]=4 18382 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Br 240690a_100015189416_100011593405 [0,2,0,0,0,0|2,0,0]=4 18383 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Br 527a_100015189416_100011593405 [0,2,0,0,0,0|2,0,0]=4 18384 B16R1.3588 COc1cccc(c1C(=O)NCCCF)C 11a_100015189416_100000066212 [0,2,0,0,0,0|2,0,0]=4 18385 B16R1.3588 COc1cccc(c1C(=O)NCCCF)C 1626a_100015189416_100000066212 [0,2,0,0,0,0|2,0,0]=4 18386 B16R1.3588 COc1cccc(c1C(=O)NCCCF)C 240690a_100015189416_100000066212 [0,2,0,0,0,0|2,0,0]=4 18387 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Cl 11a_100015189416_100000743539 [0,2,0,0,0,0|2,0,0]=4 18388 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Cl 1626a_100015189416_100000743539 [0,2,0,0,0,0|2,0,0]=4 18389 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Cl 240690a_100015189416_100000743539 [0,2,0,0,0,0|2,0,0]=4 18390 B16R1.3588 COc1cccc(c1C(=O)NCCCF)Cl 527a_100015189416_100000743539 [0,2,0,0,0,0|2,0,0]=4 18391 B16R1.3588 COc1cccc(c1C(=O)NCCCF)F 11a_100015189416_100000759380 [0,2,0,0,0,0|2,0,0]=4 18392 B16R1.3588 COc1cccc(c1C(=O)NCCCF)F 1626a_100015189416_100000759380 [0,2,0,0,0,0|2,0,0]=4 18393 B16R1.3588 COc1cccc(c1C(=O)NCCCF)F 240690a_100015189416_100000759380 [0,2,0,0,0,0|2,0,0]=4 18394 B16R1.3588 COc1cccc(c1C(=O)NCCCF)F 527a_100015189416_100000759380 [0,2,0,0,0,0|2,0,0]=4 18395 B16R1.3588 COc1cccc(c1C(=O)NCCCF)I 11a_100015189416_100010179659 [0,2,0,0,0,0|2,0,0]=4 18396 B16R1.3588 COc1cccc(c1C(=O)NCCCF)I 1626a_100015189416_100010179659 [0,2,0,0,0,0|2,0,0]=4 18397 B16R1.3588 COc1cccc(c1C(=O)NCCCF)I 240690a_100015189416_100010179659 [0,2,0,0,0,0|2,0,0]=4 18398 B16R1.3588 COc1cccc(c1C(=O)NCCCF)I 527a_100015189416_100010179659 [0,2,0,0,0,0|2,0,0]=4 18399 B16R1.3588 COc1cccc(c1C(=O)NCCCF)O 240690a_100015189416_100000043310 [0,2,0,0,0,0|2,0,0]=4 18400 B16R1.3588 COc1cccc(c1C(=O)NCCCO)Br 240690a_100000182051_100011593405 [0,2,0,0,0,0|2,0,0]=4 18401 B16R1.3588 COc1cccc(c1C(=O)NCCCO)Br 527a_100000182051_100011593405 [0,2,0,0,0,0|2,0,0]=4 18402 B16R1.3588 COc1cccc(c1C(=O)NCCCO)C 240690a_100000182051_100000066212 [0,2,0,0,0,0|2,0,0]=4 18403 B16R1.3588 COc1cccc(c1C(=O)NCCCO)Cl 240690a_100000182051_100000743539 [0,2,0,0,0,0|2,0,0]=4 18404 B16R1.3588 COc1cccc(c1C(=O)NCCCO)Cl 527a_100000182051_100000743539 [0,2,0,0,0,0|2,0,0]=4 18405 B16R1.3588 COc1cccc(c1C(=O)NCCCO)F 240690a_100000182051_100000759380 [0,2,0,0,0,0|2,0,0]=4 18406 B16R1.3588 COc1cccc(c1C(=O)NCCCO)F 527a_100000182051_100000759380 [0,2,0,0,0,0|2,0,0]=4 18407 B16R1.3588 COc1cccc(c1C(=O)NCCCO)I 240690a_100000182051_100010179659 [0,2,0,0,0,0|2,0,0]=4 18408 B16R1.3588 COc1cccc(c1C(=O)NCCCO)I 527a_100000182051_100010179659 [0,2,0,0,0,0|2,0,0]=4 18409 B16R1.3588 COc1cccc(c1C(=O)NCCCO)O 240690a_100000182051_100000043310 [0,2,0,0,0,0|2,0,0]=4 18410 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Br 11a_100020590264_100011593405 [0,2,0,0,0,0|2,0,0]=4 18411 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Br 1626a_100020590264_100011593405 [0,2,0,0,0,0|2,0,0]=4 18412 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Br 240690a_100020590264_100011593405 [0,2,0,0,0,0|2,0,0]=4 18413 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Br 527a_100020590264_100011593405 [0,2,0,0,0,0|2,0,0]=4 18414 B16R1.3588 COc1cccc(c1C(=O)NCCSC)C 11a_100020590264_100000066212 [0,2,0,0,0,0|2,0,0]=4 18415 B16R1.3588 COc1cccc(c1C(=O)NCCSC)C 1626a_100020590264_100000066212 [0,2,0,0,0,0|2,0,0]=4 18416 B16R1.3588 COc1cccc(c1C(=O)NCCSC)C 240690a_100020590264_100000066212 [0,2,0,0,0,0|2,0,0]=4 18417 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Cl 11a_100020590264_100000743539 [0,2,0,0,0,0|2,0,0]=4 18418 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Cl 1626a_100020590264_100000743539 [0,2,0,0,0,0|2,0,0]=4 18419 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Cl 240690a_100020590264_100000743539 [0,2,0,0,0,0|2,0,0]=4 18420 B16R1.3588 COc1cccc(c1C(=O)NCCSC)Cl 527a_100020590264_100000743539 [0,2,0,0,0,0|2,0,0]=4 18421 B16R1.3588 COc1cccc(c1C(=O)NCCSC)F 11a_100020590264_100000759380 [0,2,0,0,0,0|2,0,0]=4 18422 B16R1.3588 COc1cccc(c1C(=O)NCCSC)F 1626a_100020590264_100000759380 [0,2,0,0,0,0|2,0,0]=4 18423 B16R1.3588 COc1cccc(c1C(=O)NCCSC)F 240690a_100020590264_100000759380 [0,2,0,0,0,0|2,0,0]=4 18424 B16R1.3588 COc1cccc(c1C(=O)NCCSC)F 527a_100020590264_100000759380 [0,2,0,0,0,0|2,0,0]=4 18425 B16R1.3588 COc1cccc(c1C(=O)NCCSC)I 11a_100020590264_100010179659 [0,2,0,0,0,0|2,0,0]=4 18426 B16R1.3588 COc1cccc(c1C(=O)NCCSC)I 1626a_100020590264_100010179659 [0,2,0,0,0,0|2,0,0]=4 18427 B16R1.3588 COc1cccc(c1C(=O)NCCSC)I 240690a_100020590264_100010179659 [0,2,0,0,0,0|2,0,0]=4 18428 B16R1.3588 COc1cccc(c1C(=O)NCCSC)I 527a_100020590264_100010179659 [0,2,0,0,0,0|2,0,0]=4 18429 B16R1.3588 COc1cccc(c1C(=O)NCCSC)O 240690a_100020590264_100000043310 [0,2,0,0,0,0|2,0,0]=4 18430 B16R1.4229 C#Cc1ccccc1C(=O)CC(C)CCC 1458a_100011243808_100011216630 [0,2,0,0,0,0|2,0,0]=4 18431 B16R1.4229 C#Cc1ccccc1C(=O)NC(C)CCC 527a_100000741246_100011243808 [0,2,0,0,0,0|2,0,0]=4 18432 B16R1.4229 C=Cc1ccccc1C(=O)CC(C)CCC 1458a_100011830265_100011216630 [0,2,0,0,0,0|2,0,0]=4 18433 B16R1.4229 C=Cc1ccccc1C(=O)NC(C)CCC 1626a_100000741246_100011830265 [0,2,0,0,0,0|2,0,0]=4 18434 B16R1.4229 CCCC(=O)CC(=O)c1ccccc1CO 1458a_100011301526_100000747444 [0,2,0,0,0,0|1,0,1]=4 18435 B16R1.4229 CCCC(=O)CC(=O)c1ccccc1OC 1458a_100000185835_100000747444 [0,2,0,0,0,0|1,0,1]=4 18436 B16R1.4229 CCCC(=O)CC(=O)c1ccccc1OC 1458a_100000211992_100000195505 [0,2,0,0,0,0|1,0,1]=4 18437 B16R1.4229 CCCC(C)CC(=O)c1ccccc1C#N 1458a_100000742908_100011216630 [0,2,0,0,0,0|2,0,0]=4 18438 B16R1.4229 CCCC(C)CC(=O)c1ccccc1CC 1458a_100000689120_100011216630 [0,2,0,0,0,0|2,0,0]=4 18439 B16R1.4229 CCCC(C)CC(=O)c1ccccc1CO 1458a_100011301526_100011216630 [0,2,0,0,0,0|1,0,0]=3 18440 B16R1.4229 CCCC(C)CC(=O)c1ccccc1I=O 1458a_100000032414_100011216630 [0,2,0,0,0,0|1,0,1]=4 18441 B16R1.4229 CCCC(C)CC(=O)c1ccccc1OC 1458a_100000185835_100011216630 [0,2,0,0,0,0|1,0,0]=3 18442 B16R1.4229 CCCC(C)CC(=O)c1ccccc1SC 1458a_100000183967_100011216630 [0,2,0,0,0,0|1,1,0]=4 18443 B16R1.4229 CCCC(C)NC(=O)c1ccccc1C#N 11a_100000741246_100000742908 [0,2,0,0,0,0|2,0,0]=4 18444 B16R1.4229 CCCC(C)NC(=O)c1ccccc1C#N 1626a_100000741246_100000742908 [0,2,0,0,0,0|2,0,0]=4 18445 B16R1.4229 CCCC(C)NC(=O)c1ccccc1C#N 527a_100000741246_100000742908 [0,2,0,0,0,0|2,0,0]=4 18446 B16R1.4229 CCCC(C)NC(=O)c1ccccc1CC 11a_100000741246_100000689120 [0,2,0,0,0,0|2,0,0]=4 18447 B16R1.4229 CCCC(C)NC(=O)c1ccccc1CC 1626a_100000741246_100000689120 [0,2,0,0,0,0|2,0,0]=4 18448 B16R1.4229 CCCC(C)NC(=O)c1ccccc1CC 240690a_100000741246_100000689120 [0,2,0,0,0,0|2,0,0]=4 18449 B16R1.4229 CCCC(C)NC(=O)c1ccccc1CC 527a_100000741246_100000689120 [0,2,0,0,0,0|2,0,0]=4 18450 B16R1.4229 CCCC(C)NC(=O)c1ccccc1I=O 1626a_100000741246_100000032414 [0,2,0,0,0,0|1,0,1]=4 18451 B16R1.4229 CCCC(C)NC(=O)c1ccccc1I=O 240690a_100000741246_100000032414 [0,2,0,0,0,0|1,0,1]=4 18452 B16R1.4229 CCCC(C)NC(=O)c1ccccc1I=O 527a_100000741246_100000032414 [0,2,0,0,0,0|1,0,1]=4 18453 B16R1.4229 CCCC(C)NC(=O)c1ccccc1OC 11a_100000741246_100000185835 [0,2,0,0,0,0|1,0,0]=3 18454 B16R1.4229 CCCC(C)NC(=O)c1ccccc1OC 1626a_100000741246_100000185835 [0,2,0,0,0,0|1,0,0]=3 18455 B16R1.4229 CCCC(C)NC(=O)c1ccccc1OC 240690a_100000741246_100000185835 [0,2,0,0,0,0|1,0,0]=3 18456 B16R1.4229 CCCC(C)NC(=O)c1ccccc1OC 527a_100000741246_100000185835 [0,2,0,0,0,0|1,0,0]=3 18457 B16R1.4229 CCCC(C)NC(=O)c1ccccc1SC 11a_100000741246_100000183967 [0,2,0,0,0,0|1,1,0]=4 18458 B16R1.4229 CCCC(C)NC(=O)c1ccccc1SC 1626a_100000741246_100000183967 [0,2,0,0,0,0|1,1,0]=4 18459 B16R1.4229 CCCC(C)NC(=O)c1ccccc1SC 240690a_100000741246_100000183967 [0,2,0,0,0,0|1,1,0]=4 18460 B16R1.4229 CCCC(C)NC(=O)c1ccccc1SC 527a_100000741246_100000183967 [0,2,0,0,0,0|1,1,0]=4 18461 B16R1.4229 CCCC(C)OC(C)c1ccccc1OC 7a_100000742714_100000766640 [0,2,0,0,0,0|1,0,1]=4 18462 B16R1.4229 CCCN(C)CC(=O)c1ccccc1OC 269982a_100000747261_100000195505 [0,2,0,0,0,0|2,0,0]=4 18463 B16R1.4229 COC[C@@H](C)NC(=O)c1ccccc1OC 11a_100000764878_100000185835 [0,2,0,0,0,0|2,0,0]=4 18464 B16R1.4229 COC[C@@H](C)NC(=O)c1ccccc1OC 1626a_100000764878_100000185835 [0,2,0,0,0,0|2,0,0]=4 18465 B16R1.4229 COC[C@@H](C)NC(=O)c1ccccc1OC 240690a_100000764878_100000185835 [0,2,0,0,0,0|2,0,0]=4 18466 B16R1.4229 COC[C@@H](C)NC(=O)c1ccccc1OC 527a_100000764878_100000185835 [0,2,0,0,0,0|2,0,0]=4 18467 B16R1.4229 COc1ccccc1C(=O)N[C@H](C)CCO 240690a_100000706166_100000185835 [0,2,0,0,0,0|2,0,0]=4 18468 B16R1.4229 COc1ccccc1C(=O)N[C@H](C)CCO 527a_100000706166_100000185835 [0,2,0,0,0,0|2,0,0]=4 18469 B16R1.4614 C#CCCCCC(=O)c1ccccc1CO 1458a_100011301526_100010269958 [0,2,0,0,0,0|1,0,1]=4 18470 B16R1.4614 C#CCCCCC(=O)c1ccccc1OC 1458a_100000185835_100010269958 [0,2,0,0,0,0|1,0,1]=4 18471 B16R1.4614 C#CCCCNC(=O)c1ccccc1OC 11a_100000718082_100000185835 [0,2,0,0,0,0|1,0,1]=4 18472 B16R1.4614 C#CCCCNC(=O)c1ccccc1OC 1626a_100000718082_100000185835 [0,2,0,0,0,0|1,0,1]=4 18473 B16R1.4614 C#CCCCNC(=O)c1ccccc1OC 240690a_100000718082_100000185835 [0,2,0,0,0,0|1,0,1]=4 18474 B16R1.4614 C#CCCCNC(=O)c1ccccc1OC 527a_100000718082_100000185835 [0,2,0,0,0,0|1,0,1]=4 18475 B16R1.4614 C#CCCOCC(=O)c1ccccc1OC 34a_100011215631_100000195505 [0,2,0,0,0,0|0,0,2]=4 18476 B16R1.4614 C#Cc1ccccc1C(=O)CCCCCC 1458a_100011243808_100000210757 [0,2,0,0,0,0|2,0,0]=4 18477 B16R1.4614 C#Cc1ccccc1C(=O)CCCCCF 1458a_100011243808_100000729378 [0,2,0,0,0,0|2,0,0]=4 18478 B16R1.4614 C#Cc1ccccc1C(=O)CCCCCO 1458a_100011243808_100000746330 [0,2,0,0,0,0|2,0,0]=4 18479 B16R1.4614 C#Cc1ccccc1C(=O)CCCCOC 1458a_100011243808_100000755781 [0,2,0,0,0,0|2,0,0]=4 18480 B16R1.4614 C#Cc1ccccc1C(=O)CCCOCC 1458a_100011243808_100012232248 [0,2,0,0,0,0|2,0,0]=4 18481 B16R1.4614 C#Cc1ccccc1C(=O)CCOCCC 1458a_100011243808_100011215938 [0,2,0,0,0,0|2,0,0]=4 18482 B16R1.4614 C#Cc1ccccc1C(=O)COCCCC 1458a_100011243808_100011995733 [0,2,0,0,0,0|1,0,0]=3 18483 B16R1.4614 C#Cc1ccccc1C(=O)NCCCCC 527a_100000209983_100011243808 [0,2,0,0,0,0|2,0,0]=4 18484 B16R1.4614 C#Cc1ccccc1C(=O)NCCCCO 527a_100000750430_100011243808 [0,2,0,0,0,0|2,0,0]=4 18485 B16R1.4614 C#Cc1ccccc1C(=O)NCCCOC 527a_100150723488_100011243808 [0,2,0,0,0,0|2,0,0]=4 18486 B16R1.4614 C#Cc1ccccc1C(=O)NCCCSC 527a_100000749238_100011243808 [0,2,0,0,0,0|2,0,0]=4 18487 B16R1.4614 C#Cc1ccccc1C(=O)NCCOCC 527a_100011200944_100011243808 [0,2,0,0,0,0|2,0,0]=4 18488 B16R1.4614 C#Cc1ccccc1C(=O)NCCSCC 527a_100000106463_100011243808 [0,2,0,0,0,0|2,0,0]=4 18489 B16R1.4614 C#Cc1ccccc1C(=O)NNCCCC 22a_100025702795_100011243808 [0,2,0,0,0,0|2,0,0]=4 18490 B16R1.4614 C/C=C/COCC(=O)c1ccccc1OC 34a_100016270725_100000195505 [0,2,0,0,0,0|0,0,2]=4 18491 B16R1.4614 C=CCCCCC(=O)c1ccccc1CO 1458a_100011301526_100011215482 [0,2,0,0,0,0|1,0,1]=4 18492 B16R1.4614 C=CCCCCC(=O)c1ccccc1OC 1458a_100000185835_100011215482 [0,2,0,0,0,0|1,0,1]=4 18493 B16R1.4614 C=CCCCNC(=O)c1ccccc1OC 11a_100000700776_100000185835 [0,2,0,0,0,0|1,0,1]=4 18494 B16R1.4614 C=CCCCNC(=O)c1ccccc1OC 1626a_100000700776_100000185835 [0,2,0,0,0,0|1,0,1]=4 18495 B16R1.4614 C=CCCCNC(=O)c1ccccc1OC 240690a_100000700776_100000185835 [0,2,0,0,0,0|1,0,1]=4 18496 B16R1.4614 C=CCCCNC(=O)c1ccccc1OC 527a_100000700776_100000185835 [0,2,0,0,0,0|1,0,1]=4 18497 B16R1.4614 C=CCCOCC(=O)c1ccccc1OC 34a_100011205117_100000195505 [0,2,0,0,0,0|0,0,2]=4 18498 B16R1.4614 C=Cc1ccccc1C(=O)CCCCCC 1458a_100011830265_100000210757 [0,2,0,0,0,0|2,0,0]=4 18499 B16R1.4614 C=Cc1ccccc1C(=O)CCCCCF 1458a_100011830265_100000729378 [0,2,0,0,0,0|2,0,0]=4 18500 B16R1.4614 C=Cc1ccccc1C(=O)CCCCCO 1458a_100011830265_100000746330 [0,2,0,0,0,0|2,0,0]=4 18501 B16R1.4614 C=Cc1ccccc1C(=O)CCCCOC 1458a_100011830265_100000755781 [0,2,0,0,0,0|2,0,0]=4 18502 B16R1.4614 C=Cc1ccccc1C(=O)CCCOCC 1458a_100011830265_100012232248 [0,2,0,0,0,0|2,0,0]=4 18503 B16R1.4614 C=Cc1ccccc1C(=O)CCOCCC 1458a_100011830265_100011215938 [0,2,0,0,0,0|2,0,0]=4 18504 B16R1.4614 C=Cc1ccccc1C(=O)COCCCC 1458a_100011830265_100011995733 [0,2,0,0,0,0|1,0,0]=3 18505 B16R1.4614 C=Cc1ccccc1C(=O)NCCCCC 1626a_100000209983_100011830265 [0,2,0,0,0,0|2,0,0]=4 18506 B16R1.4614 C=Cc1ccccc1C(=O)NCCCCC 271570a_100011290941_200000152840 [0,2,0,0,0,0|2,0,0]=4 18507 B16R1.4614 C=Cc1ccccc1C(=O)NCCCOC 1626a_100150723488_100011830265 [0,2,0,0,0,0|2,0,0]=4 18508 B16R1.4614 C=Cc1ccccc1C(=O)NCCCSC 1626a_100000749238_100011830265 [0,2,0,0,0,0|2,0,0]=4 18509 B16R1.4614 C=Cc1ccccc1C(=O)NCCOCC 1626a_102516460346_100011830265 [0,2,0,0,0,0|2,0,0]=4 18510 B16R1.4614 C=Cc1ccccc1C(=O)NCCSCC 1626a_100000106463_100011830265 [0,2,0,0,0,0|2,0,0]=4 18511 B16R1.4614 C=Cc1ccccc1C(=O)NNCCCC 22a_100025702795_100011830265 [0,2,0,0,0,0|2,0,0]=4 18512 B16R1.4614 CC#CCOCC(=O)c1ccccc1OC 34a_100000761923_100000195505 [0,2,0,0,0,0|0,0,2]=4 18513 B16R1.4614 CC/C=C\CCC(=O)c1ccccc1CO 1458a_100011301526_100015370543 [0,2,0,0,0,0|1,0,1]=4 18514 B16R1.4614 CC/C=C\CCC(=O)c1ccccc1OC 1458a_100000185835_100015370543 [0,2,0,0,0,0|1,0,1]=4 18515 B16R1.4614 CCCC=NNC(=O)c1ccccc1OC 4a_100000189102_100000185831 [0,2,0,0,0,0|1,0,1]=4 18516 B16R1.4614 CCCCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210757 [0,2,0,0,0,0|2,0,0]=4 18517 B16R1.4614 CCCCCCC(=O)c1ccccc1CC 1458a_100000689120_100000210757 [0,2,0,0,0,0|2,0,0]=4 18518 B16R1.4614 CCCCCCC(=O)c1ccccc1CO 1458a_100011301526_100000210757 [0,2,0,0,0,0|1,0,0]=3 18519 B16R1.4614 CCCCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210757 [0,2,0,0,0,0|1,0,1]=4 18520 B16R1.4614 CCCCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210757 [0,2,0,0,0,0|1,0,0]=3 18521 B16R1.4614 CCCCCCC(=O)c1ccccc1SC 1458a_100000183967_100000210757 [0,2,0,0,0,0|1,1,0]=4 18522 B16R1.4614 CCCCCNC(=O)c1ccccc1C#N 11a_100000209983_100000742908 [0,2,0,0,0,0|2,0,0]=4 18523 B16R1.4614 CCCCCNC(=O)c1ccccc1C#N 1626a_100000209983_100000742908 [0,2,0,0,0,0|2,0,0]=4 18524 B16R1.4614 CCCCCNC(=O)c1ccccc1C#N 527a_100000209983_100000742908 [0,2,0,0,0,0|2,0,0]=4 18525 B16R1.4614 CCCCCNC(=O)c1ccccc1CC 11a_100000209983_100000689120 [0,2,0,0,0,0|2,0,0]=4 18526 B16R1.4614 CCCCCNC(=O)c1ccccc1CC 1626a_100000209983_100000689120 [0,2,0,0,0,0|2,0,0]=4 18527 B16R1.4614 CCCCCNC(=O)c1ccccc1CC 240690a_100000209983_100000689120 [0,2,0,0,0,0|2,0,0]=4 18528 B16R1.4614 CCCCCNC(=O)c1ccccc1CC 527a_100000209983_100000689120 [0,2,0,0,0,0|2,0,0]=4 18529 B16R1.4614 CCCCCNC(=O)c1ccccc1I=O 1626a_100000209983_100000032414 [0,2,0,0,0,0|1,0,1]=4 18530 B16R1.4614 CCCCCNC(=O)c1ccccc1I=O 240690a_100000209983_100000032414 [0,2,0,0,0,0|1,0,1]=4 18531 B16R1.4614 CCCCCNC(=O)c1ccccc1I=O 527a_100000209983_100000032414 [0,2,0,0,0,0|1,0,1]=4 18532 B16R1.4614 CCCCCNC(=O)c1ccccc1NC 27a_100102657272_200000152840 [0,2,0,0,0,0|2,0,0]=4 18533 B16R1.4614 CCCCCNC(=O)c1ccccc1OC 11a_100000209983_100000185835 [0,2,0,0,0,0|1,0,0]=3 18534 B16R1.4614 CCCCCNC(=O)c1ccccc1OC 1626a_100000209983_100000185835 [0,2,0,0,0,0|1,0,0]=3 18535 B16R1.4614 CCCCCNC(=O)c1ccccc1OC 240690a_100000209983_100000185835 [0,2,0,0,0,0|1,0,0]=3 18536 B16R1.4614 CCCCCNC(=O)c1ccccc1OC 527a_100000209983_100000185835 [0,2,0,0,0,0|1,0,0]=3 18537 B16R1.4614 CCCCCNC(=O)c1ccccc1SC 11a_100000209983_100000183967 [0,2,0,0,0,0|1,1,0]=4 18538 B16R1.4614 CCCCCNC(=O)c1ccccc1SC 1626a_100000209983_100000183967 [0,2,0,0,0,0|1,1,0]=4 18539 B16R1.4614 CCCCCNC(=O)c1ccccc1SC 240690a_100000209983_100000183967 [0,2,0,0,0,0|1,1,0]=4 18540 B16R1.4614 CCCCCNC(=O)c1ccccc1SC 527a_100000209983_100000183967 [0,2,0,0,0,0|1,1,0]=4 18541 B16R1.4614 CCCCCNC(=O)c1ccccc1SC 62a_200000152840_200000210301 [0,2,0,0,0,0|1,1,0]=4 18542 B16R1.4614 CCCCCNC(=O)c1ccccc1SC 62a_200000210301_200000152840 [0,2,0,0,0,0|1,1,0]=4 18543 B16R1.4614 CCCCCNC(=O)c1ccccc1S[13CH3] 62a_200000152840_200025704644 [0,2,0,0,0,0|1,1,0]=4 18544 B16R1.4614 CCCCCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152840 [0,2,0,0,0,0|1,1,0]=4 18545 B16R1.4614 CCCCCOC(=O)c1ccccc1OC 7a_200000054040_200000210301 [0,2,0,0,0,0|0,0,0]=2 18546 B16R1.4614 CCCCCOC(=O)c1ccccc1O[13CH3] 7a_200000054040_200025704644 [0,2,0,0,0,0|0,0,0]=2 18547 B16R1.4614 CCCCCOC(C)c1ccccc1OC 7a_100000742714_100000210326 [0,2,0,0,0,0|1,0,1]=4 18548 B16R1.4614 CCCCNCC(=O)c1ccccc1OC 7a_106832991798_100000195505 [0,2,0,0,0,0|1,0,0]=3 18549 B16R1.4614 CCCCNN=C(C)c1ccccc1OC 4a_100025702795_100000173324 [0,2,0,0,0,0|2,0,0]=4 18550 B16R1.4614 CCCCNNC(=O)c1ccccc1C#N 22a_100025702795_100000742908 [0,2,0,0,0,0|2,0,0]=4 18551 B16R1.4614 CCCCNNC(=O)c1ccccc1CC 22a_100025702795_100000689120 [0,2,0,0,0,0|2,0,0]=4 18552 B16R1.4614 CCCCNNC(=O)c1ccccc1I=O 22a_100025702795_100000032414 [0,2,0,0,0,0|1,0,1]=4 18553 B16R1.4614 CCCCNNC(=O)c1ccccc1OC 22a_100025702795_100000185835 [0,2,0,0,0,0|1,0,0]=3 18554 B16R1.4614 CCCCNNC(=O)c1ccccc1SC 22a_100025702795_100000183967 [0,2,0,0,0,0|1,1,0]=4 18555 B16R1.4614 CCCCOCC(=O)c1ccccc1C#N 1458a_100000742908_100011995733 [0,2,0,0,0,0|1,0,0]=3 18556 B16R1.4614 CCCCOCC(=O)c1ccccc1CC 1458a_100000689120_100011995733 [0,2,0,0,0,0|1,0,0]=3 18557 B16R1.4614 CCCCOCC(=O)c1ccccc1CO 1458a_100011301526_100011995733 [0,2,0,0,0,0|0,0,0]=2 18558 B16R1.4614 CCCCOCC(=O)c1ccccc1I=O 1458a_100000032414_100011995733 [0,2,0,0,0,0|0,0,1]=3 18559 B16R1.4614 CCCCOCC(=O)c1ccccc1OC 1458a_100000185835_100011995733 [0,2,0,0,0,0|0,0,0]=2 18560 B16R1.4614 CCCCOCC(=O)c1ccccc1OC 34a_100000210227_100000195505 [0,2,0,0,0,0|0,0,0]=2 18561 B16R1.4614 CCCCOCC(=O)c1ccccc1OC 7a_100000210227_100000195505 [0,2,0,0,0,0|0,0,0]=2 18562 B16R1.4614 CCCCOCC(=O)c1ccccc1SC 1458a_100000183967_100011995733 [0,2,0,0,0,0|0,1,0]=3 18563 B16R1.4614 CCCCOCC(N)c1ccccc1OC 34a_100000756845_100000210210 [0,2,0,0,0,0|1,0,1]=4 18564 B16R1.4614 CCCCOCN(C)c1ccccc1OC 2230a_100000219746_100011995733 [0,2,0,0,0,0|2,0,0]=4 18565 B16R1.4614 CCCCOCN(C)c1ccccc1OC 269982a_100000219746_100011995733 [0,2,0,0,0,0|2,0,0]=4 18566 B16R1.4614 CCCCOCN(C)c1ccccc1OC 34a_100000219746_100011995733 [0,2,0,0,0,0|2,0,0]=4 18567 B16R1.4614 CCCCSCC(=O)c1ccccc1OC 62a_100000195505_100000210210 [0,2,0,0,0,0|0,1,0]=3 18568 B16R1.4614 CCCOCCC(=O)c1ccccc1C#N 1458a_100000742908_100011215938 [0,2,0,0,0,0|2,0,0]=4 18569 B16R1.4614 CCCOCCC(=O)c1ccccc1CC 1458a_100000689120_100011215938 [0,2,0,0,0,0|2,0,0]=4 18570 B16R1.4614 CCCOCCC(=O)c1ccccc1CO 1458a_100011301526_100011215938 [0,2,0,0,0,0|1,0,0]=3 18571 B16R1.4614 CCCOCCC(=O)c1ccccc1I=O 1458a_100000032414_100011215938 [0,2,0,0,0,0|1,0,1]=4 18572 B16R1.4614 CCCOCCC(=O)c1ccccc1OC 1458a_100000185835_100011215938 [0,2,0,0,0,0|1,0,0]=3 18573 B16R1.4614 CCCOCCC(=O)c1ccccc1SC 1458a_100000183967_100011215938 [0,2,0,0,0,0|1,1,0]=4 18574 B16R1.4614 CCOCCCC(=O)c1ccccc1C#N 1458a_100000742908_100012232248 [0,2,0,0,0,0|2,0,0]=4 18575 B16R1.4614 CCOCCCC(=O)c1ccccc1CC 1458a_100000689120_100012232248 [0,2,0,0,0,0|2,0,0]=4 18576 B16R1.4614 CCOCCCC(=O)c1ccccc1CO 1458a_100011301526_100012232248 [0,2,0,0,0,0|1,0,0]=3 18577 B16R1.4614 CCOCCCC(=O)c1ccccc1I=O 1458a_100000032414_100012232248 [0,2,0,0,0,0|1,0,1]=4 18578 B16R1.4614 CCOCCCC(=O)c1ccccc1OC 1458a_100000185835_100012232248 [0,2,0,0,0,0|1,0,0]=3 18579 B16R1.4614 CCOCCCC(=O)c1ccccc1SC 1458a_100000183967_100012232248 [0,2,0,0,0,0|1,1,0]=4 18580 B16R1.4614 CCOCCNC(=O)c1ccccc1C#N 11a_100011200944_100000742908 [0,2,0,0,0,0|2,0,0]=4 18581 B16R1.4614 CCOCCNC(=O)c1ccccc1C#N 1626a_102516460346_100000742908 [0,2,0,0,0,0|2,0,0]=4 18582 B16R1.4614 CCOCCNC(=O)c1ccccc1C#N 527a_100011200944_100000742908 [0,2,0,0,0,0|2,0,0]=4 18583 B16R1.4614 CCOCCNC(=O)c1ccccc1CC 11a_100011200944_100000689120 [0,2,0,0,0,0|2,0,0]=4 18584 B16R1.4614 CCOCCNC(=O)c1ccccc1CC 1626a_102516460346_100000689120 [0,2,0,0,0,0|2,0,0]=4 18585 B16R1.4614 CCOCCNC(=O)c1ccccc1CC 240690a_100011200944_100000689120 [0,2,0,0,0,0|2,0,0]=4 18586 B16R1.4614 CCOCCNC(=O)c1ccccc1CC 527a_100011200944_100000689120 [0,2,0,0,0,0|2,0,0]=4 18587 B16R1.4614 CCOCCNC(=O)c1ccccc1I=O 1626a_102516460346_100000032414 [0,2,0,0,0,0|1,0,1]=4 18588 B16R1.4614 CCOCCNC(=O)c1ccccc1I=O 240690a_100011200944_100000032414 [0,2,0,0,0,0|1,0,1]=4 18589 B16R1.4614 CCOCCNC(=O)c1ccccc1I=O 527a_100011200944_100000032414 [0,2,0,0,0,0|1,0,1]=4 18590 B16R1.4614 CCOCCNC(=O)c1ccccc1OC 11a_100011200944_100000185835 [0,2,0,0,0,0|1,0,0]=3 18591 B16R1.4614 CCOCCNC(=O)c1ccccc1OC 1626a_102516460346_100000185835 [0,2,0,0,0,0|1,0,0]=3 18592 B16R1.4614 CCOCCNC(=O)c1ccccc1OC 240690a_100011200944_100000185835 [0,2,0,0,0,0|1,0,0]=3 18593 B16R1.4614 CCOCCNC(=O)c1ccccc1OC 527a_100011200944_100000185835 [0,2,0,0,0,0|1,0,0]=3 18594 B16R1.4614 CCOCCNC(=O)c1ccccc1SC 11a_100011200944_100000183967 [0,2,0,0,0,0|1,1,0]=4 18595 B16R1.4614 CCOCCNC(=O)c1ccccc1SC 1626a_102516460346_100000183967 [0,2,0,0,0,0|1,1,0]=4 18596 B16R1.4614 CCOCCNC(=O)c1ccccc1SC 240690a_100011200944_100000183967 [0,2,0,0,0,0|1,1,0]=4 18597 B16R1.4614 CCOCCNC(=O)c1ccccc1SC 527a_100011200944_100000183967 [0,2,0,0,0,0|1,1,0]=4 18598 B16R1.4614 CCOCCOC(C)c1ccccc1OC 7a_100000742714_100011215890 [0,2,0,0,0,0|1,0,1]=4 18599 B16R1.4614 CCOCSCC(=O)c1ccccc1OC 62a_100000195505_100000739092 [0,2,0,0,0,0|1,1,0]=4 18600 B16R1.4614 CCSCCNC(=O)c1ccccc1C#N 11a_100000106463_100000742908 [0,2,0,0,0,0|2,0,0]=4 18601 B16R1.4614 CCSCCNC(=O)c1ccccc1C#N 1626a_100000106463_100000742908 [0,2,0,0,0,0|2,0,0]=4 18602 B16R1.4614 CCSCCNC(=O)c1ccccc1C#N 527a_100000106463_100000742908 [0,2,0,0,0,0|2,0,0]=4 18603 B16R1.4614 CCSCCNC(=O)c1ccccc1CC 11a_100000106463_100000689120 [0,2,0,0,0,0|2,0,0]=4 18604 B16R1.4614 CCSCCNC(=O)c1ccccc1CC 1626a_100000106463_100000689120 [0,2,0,0,0,0|2,0,0]=4 18605 B16R1.4614 CCSCCNC(=O)c1ccccc1CC 240690a_100000106463_100000689120 [0,2,0,0,0,0|2,0,0]=4 18606 B16R1.4614 CCSCCNC(=O)c1ccccc1CC 527a_100000106463_100000689120 [0,2,0,0,0,0|2,0,0]=4 18607 B16R1.4614 CCSCCNC(=O)c1ccccc1I=O 1626a_100000106463_100000032414 [0,2,0,0,0,0|1,0,1]=4 18608 B16R1.4614 CCSCCNC(=O)c1ccccc1I=O 240690a_100000106463_100000032414 [0,2,0,0,0,0|1,0,1]=4 18609 B16R1.4614 CCSCCNC(=O)c1ccccc1I=O 527a_100000106463_100000032414 [0,2,0,0,0,0|1,0,1]=4 18610 B16R1.4614 CCSCCNC(=O)c1ccccc1OC 11a_100000106463_100000185835 [0,2,0,0,0,0|1,0,0]=3 18611 B16R1.4614 CCSCCNC(=O)c1ccccc1OC 1626a_100000106463_100000185835 [0,2,0,0,0,0|1,0,0]=3 18612 B16R1.4614 CCSCCNC(=O)c1ccccc1OC 240690a_100000106463_100000185835 [0,2,0,0,0,0|1,0,0]=3 18613 B16R1.4614 CCSCCNC(=O)c1ccccc1OC 527a_100000106463_100000185835 [0,2,0,0,0,0|1,0,0]=3 18614 B16R1.4614 CCSCCNC(=O)c1ccccc1SC 11a_100000106463_100000183967 [0,2,0,0,0,0|1,1,0]=4 18615 B16R1.4614 CCSCCNC(=O)c1ccccc1SC 1626a_100000106463_100000183967 [0,2,0,0,0,0|1,1,0]=4 18616 B16R1.4614 CCSCCNC(=O)c1ccccc1SC 240690a_100000106463_100000183967 [0,2,0,0,0,0|1,1,0]=4 18617 B16R1.4614 CCSCCNC(=O)c1ccccc1SC 527a_100000106463_100000183967 [0,2,0,0,0,0|1,1,0]=4 18618 B16R1.4614 CCSCCOC(C)c1ccccc1OC 7a_100000742714_100000757381 [0,2,0,0,0,0|1,0,1]=4 18619 B16R1.4614 CCc1ccccc1C(=O)CCCCCF 1458a_100000689120_100000729378 [0,2,0,0,0,0|2,0,0]=4 18620 B16R1.4614 CCc1ccccc1C(=O)CCCCCO 1458a_100000689120_100000746330 [0,2,0,0,0,0|2,0,0]=4 18621 B16R1.4614 CCc1ccccc1C(=O)CCCCOC 1458a_100000689120_100000755781 [0,2,0,0,0,0|2,0,0]=4 18622 B16R1.4614 CCc1ccccc1C(=O)NCCCCO 240690a_100000750430_100000689120 [0,2,0,0,0,0|2,0,0]=4 18623 B16R1.4614 CCc1ccccc1C(=O)NCCCCO 527a_100000750430_100000689120 [0,2,0,0,0,0|2,0,0]=4 18624 B16R1.4614 CCc1ccccc1C(=O)NCCCOC 1626a_100150723488_100000689120 [0,2,0,0,0,0|2,0,0]=4 18625 B16R1.4614 CCc1ccccc1C(=O)NCCCOC 240690a_100150723488_100000689120 [0,2,0,0,0,0|2,0,0]=4 18626 B16R1.4614 CCc1ccccc1C(=O)NCCCOC 527a_100150723488_100000689120 [0,2,0,0,0,0|2,0,0]=4 18627 B16R1.4614 CCc1ccccc1C(=O)NCCCSC 11a_100000749238_100000689120 [0,2,0,0,0,0|2,0,0]=4 18628 B16R1.4614 CCc1ccccc1C(=O)NCCCSC 1626a_100000749238_100000689120 [0,2,0,0,0,0|2,0,0]=4 18629 B16R1.4614 CCc1ccccc1C(=O)NCCCSC 240690a_100000749238_100000689120 [0,2,0,0,0,0|2,0,0]=4 18630 B16R1.4614 CCc1ccccc1C(=O)NCCCSC 527a_100000749238_100000689120 [0,2,0,0,0,0|2,0,0]=4 18631 B16R1.4614 COCCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000755781 [0,2,0,0,0,0|2,0,0]=4 18632 B16R1.4614 COCCCCC(=O)c1ccccc1CO 1458a_100011301526_100000755781 [0,2,0,0,0,0|1,0,0]=3 18633 B16R1.4614 COCCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000755781 [0,2,0,0,0,0|1,0,1]=4 18634 B16R1.4614 COCCCCC(=O)c1ccccc1OC 1458a_100000185835_100000755781 [0,2,0,0,0,0|1,0,0]=3 18635 B16R1.4614 COCCCCC(=O)c1ccccc1SC 1458a_100000183967_100000755781 [0,2,0,0,0,0|1,1,0]=4 18636 B16R1.4614 COCCCNC(=O)c1ccccc1C#N 1626a_100150723488_100000742908 [0,2,0,0,0,0|2,0,0]=4 18637 B16R1.4614 COCCCNC(=O)c1ccccc1C#N 527a_100150723488_100000742908 [0,2,0,0,0,0|2,0,0]=4 18638 B16R1.4614 COCCCNC(=O)c1ccccc1I=O 1626a_100150723488_100000032414 [0,2,0,0,0,0|1,0,1]=4 18639 B16R1.4614 COCCCNC(=O)c1ccccc1I=O 240690a_100150723488_100000032414 [0,2,0,0,0,0|1,0,1]=4 18640 B16R1.4614 COCCCNC(=O)c1ccccc1I=O 527a_100150723488_100000032414 [0,2,0,0,0,0|1,0,1]=4 18641 B16R1.4614 COCCCNC(=O)c1ccccc1OC 1626a_100150723488_100000185835 [0,2,0,0,0,0|1,0,0]=3 18642 B16R1.4614 COCCCNC(=O)c1ccccc1OC 240690a_100150723488_100000185835 [0,2,0,0,0,0|1,0,0]=3 18643 B16R1.4614 COCCCNC(=O)c1ccccc1OC 527a_100150723488_100000185835 [0,2,0,0,0,0|1,0,0]=3 18644 B16R1.4614 COCCCNC(=O)c1ccccc1SC 1626a_100150723488_100000183967 [0,2,0,0,0,0|1,1,0]=4 18645 B16R1.4614 COCCCNC(=O)c1ccccc1SC 240690a_100150723488_100000183967 [0,2,0,0,0,0|1,1,0]=4 18646 B16R1.4614 COCCCNC(=O)c1ccccc1SC 527a_100150723488_100000183967 [0,2,0,0,0,0|1,1,0]=4 18647 B16R1.4614 COCCCOC(C)c1ccccc1OC 7a_100000742714_100000740836 [0,2,0,0,0,0|1,0,1]=4 18648 B16R1.4614 COCCNNC(=O)c1ccccc1OC 22a_100000741390_100000185835 [0,2,0,0,0,0|2,0,0]=4 18649 B16R1.4614 COCCOCC(=O)c1ccccc1OC 34a_100000210237_100000195505 [0,2,0,0,0,0|1,0,0]=3 18650 B16R1.4614 COCCSCC(=O)c1ccccc1OC 62a_100000195505_100000233755 [0,2,0,0,0,0|1,1,0]=4 18651 B16R1.4614 COc1ccccc1C(=O)CCCCC#N 1458a_100000185835_100000211819 [0,2,0,0,0,0|1,0,1]=4 18652 B16R1.4614 COc1ccccc1C(=O)CCCCCF 1458a_100000185835_100000729378 [0,2,0,0,0,0|1,0,0]=3 18653 B16R1.4614 COc1ccccc1C(=O)CCCCCO 1458a_100000185835_100000746330 [0,2,0,0,0,0|1,0,0]=3 18654 B16R1.4614 COc1ccccc1C(=O)CCOCCO 1458a_100000185835_100011215305 [0,2,0,0,0,0|2,0,0]=4 18655 B16R1.4614 COc1ccccc1C(=O)CNCCCF 34a_100015189416_100000195505 [0,2,0,0,0,0|2,0,0]=4 18656 B16R1.4614 COc1ccccc1C(=O)COCCCBr 34a_100011217188_100000195505 [0,2,0,0,0,0|1,0,0]=3 18657 B16R1.4614 COc1ccccc1C(=O)COCCCCl 34a_100000230001_100000195505 [0,2,0,0,0,0|1,0,0]=3 18658 B16R1.4614 COc1ccccc1C(=O)COCCCF 34a_100000759539_100000195505 [0,2,0,0,0,0|1,0,0]=3 18659 B16R1.4614 COc1ccccc1C(=O)COCCCN 34a_100000182051_100000195505 [0,2,0,0,0,0|1,0,0]=3 18660 B16R1.4614 COc1ccccc1C(=O)COCCON 34a_100000700252_100000195505 [0,2,0,0,0,0|2,0,0]=4 18661 B16R1.4614 COc1ccccc1C(=O)COCCSC 34a_100000230434_100000195505 [0,2,0,0,0,0|1,0,0]=3 18662 B16R1.4614 COc1ccccc1C(=O)COCCSC 7a_100000230434_100000195505 [0,2,0,0,0,0|1,0,0]=3 18663 B16R1.4614 COc1ccccc1C(=O)CSCCCF 62a_100000195505_100011934791 [0,2,0,0,0,0|1,1,0]=4 18664 B16R1.4614 COc1ccccc1C(=O)CSCCCO 62a_100000195505_100011215043 [0,2,0,0,0,0|1,1,0]=4 18665 B16R1.4614 COc1ccccc1C(=O)CSCCSC 62a_100000195505_100000751147 [0,2,0,0,0,0|1,1,0]=4 18666 B16R1.4614 COc1ccccc1C(=O)NCCCCO 240690a_100000750430_100000185835 [0,2,0,0,0,0|1,0,0]=3 18667 B16R1.4614 COc1ccccc1C(=O)NCCCCO 527a_100000750430_100000185835 [0,2,0,0,0,0|1,0,0]=3 18668 B16R1.4614 COc1ccccc1C(=O)NCCCSC 11a_100000749238_100000185835 [0,2,0,0,0,0|1,0,0]=3 18669 B16R1.4614 COc1ccccc1C(=O)NCCCSC 1626a_100000749238_100000185835 [0,2,0,0,0,0|1,0,0]=3 18670 B16R1.4614 COc1ccccc1C(=O)NCCCSC 240690a_100000749238_100000185835 [0,2,0,0,0,0|1,0,0]=3 18671 B16R1.4614 COc1ccccc1C(=O)NCCCSC 527a_100000749238_100000185835 [0,2,0,0,0,0|1,0,0]=3 18672 B16R1.4614 COc1ccccc1C(C)OCCCCF 7a_100000742714_100000729493 [0,2,0,0,0,0|1,0,1]=4 18673 B16R1.4614 COc1ccccc1C(C)OCCCCO 7a_100000742714_100000210776 [0,2,0,0,0,0|1,0,1]=4 18674 B16R1.4614 CSCCCNC(=O)c1ccccc1C#N 11a_100000749238_100000742908 [0,2,0,0,0,0|2,0,0]=4 18675 B16R1.4614 CSCCCNC(=O)c1ccccc1C#N 1626a_100000749238_100000742908 [0,2,0,0,0,0|2,0,0]=4 18676 B16R1.4614 CSCCCNC(=O)c1ccccc1C#N 527a_100000749238_100000742908 [0,2,0,0,0,0|2,0,0]=4 18677 B16R1.4614 CSCCCNC(=O)c1ccccc1I=O 1626a_100000749238_100000032414 [0,2,0,0,0,0|1,0,1]=4 18678 B16R1.4614 CSCCCNC(=O)c1ccccc1I=O 240690a_100000749238_100000032414 [0,2,0,0,0,0|1,0,1]=4 18679 B16R1.4614 CSCCCNC(=O)c1ccccc1I=O 527a_100000749238_100000032414 [0,2,0,0,0,0|1,0,1]=4 18680 B16R1.4614 CSCCCNC(=O)c1ccccc1SC 11a_100000749238_100000183967 [0,2,0,0,0,0|1,1,0]=4 18681 B16R1.4614 CSCCCNC(=O)c1ccccc1SC 1626a_100000749238_100000183967 [0,2,0,0,0,0|1,1,0]=4 18682 B16R1.4614 CSCCCNC(=O)c1ccccc1SC 240690a_100000749238_100000183967 [0,2,0,0,0,0|1,1,0]=4 18683 B16R1.4614 CSCCCNC(=O)c1ccccc1SC 527a_100000749238_100000183967 [0,2,0,0,0,0|1,1,0]=4 18684 B16R1.4614 CSc1ccccc1C(=O)CCCCCF 1458a_100000183967_100000729378 [0,2,0,0,0,0|1,1,0]=4 18685 B16R1.4614 CSc1ccccc1C(=O)CCCCCO 1458a_100000183967_100000746330 [0,2,0,0,0,0|1,1,0]=4 18686 B16R1.4614 CSc1ccccc1C(=O)NCCCCO 240690a_100000750430_100000183967 [0,2,0,0,0,0|1,1,0]=4 18687 B16R1.4614 CSc1ccccc1C(=O)NCCCCO 527a_100000750430_100000183967 [0,2,0,0,0,0|1,1,0]=4 18688 B16R1.4614 N#CCCCCC(=O)c1ccccc1CO 1458a_100011301526_100000211819 [0,2,0,0,0,0|1,0,1]=4 18689 B16R1.4614 N#Cc1ccccc1C(=O)CCCCCF 1458a_100000742908_100000729378 [0,2,0,0,0,0|2,0,0]=4 18690 B16R1.4614 N#Cc1ccccc1C(=O)CCCCCO 1458a_100000742908_100000746330 [0,2,0,0,0,0|2,0,0]=4 18691 B16R1.4614 N#Cc1ccccc1C(=O)NCCCCO 527a_100000750430_100000742908 [0,2,0,0,0,0|2,0,0]=4 18692 B16R1.4614 O=C(CCCCCF)c1ccccc1CO 1458a_100011301526_100000729378 [0,2,0,0,0,0|1,0,0]=3 18693 B16R1.4614 O=C(CCCCCO)c1ccccc1CO 1458a_100011301526_100000746330 [0,2,0,0,0,0|1,0,0]=3 18694 B16R1.4614 O=C(CCOCCO)c1ccccc1CO 1458a_100011301526_100011215305 [0,2,0,0,0,0|2,0,0]=4 18695 B16R1.4614 O=Ic1ccccc1C(=O)CCCCCF 1458a_100000032414_100000729378 [0,2,0,0,0,0|1,0,1]=4 18696 B16R1.4614 O=Ic1ccccc1C(=O)CCCCCO 1458a_100000032414_100000746330 [0,2,0,0,0,0|1,0,1]=4 18697 B16R1.4614 O=Ic1ccccc1C(=O)NCCCCO 240690a_100000750430_100000032414 [0,2,0,0,0,0|1,0,1]=4 18698 B16R1.4614 O=Ic1ccccc1C(=O)NCCCCO 527a_100000750430_100000032414 [0,2,0,0,0,0|1,0,1]=4 18699 B16R1.4811 CCCCNS(=O)(=O)c1ccccc1OC 270084a_100000102301_100000183792 [0,2,0,0,0,0|2,0,0]=4 18700 B16R1.4811 CCCCNS(=O)(=O)c1ccccc1OC 274078a_100000102301_100000183792 [0,2,0,0,0,0|2,0,0]=4 18701 B16R1.5567 C#Cc1ccccc1C(=O)NCC(C)CC 527a_100020588543_100011243808 [0,2,0,0,0,0|2,0,0]=4 18702 B16R1.5567 C#Cc1ccccc1C(=O)NCC(O)CC 527a_100011218483_100011243808 [0,2,0,0,0,0|2,0,0]=4 18703 B16R1.5567 C=Cc1ccccc1C(=O)NCC(C)CC 1626a_100020588543_100011830265 [0,2,0,0,0,0|2,0,0]=4 18704 B16R1.5567 CCC(=O)CNC(=O)c1ccccc1OC 1458a_100000183908_100000210202 [0,2,0,0,0,0|1,0,1]=4 18705 B16R1.5567 CCC(C)CNC(=O)c1ccccc1C#N 11a_100020588543_100000742908 [0,2,0,0,0,0|2,0,0]=4 18706 B16R1.5567 CCC(C)CNC(=O)c1ccccc1C#N 1626a_100020588543_100000742908 [0,2,0,0,0,0|2,0,0]=4 18707 B16R1.5567 CCC(C)CNC(=O)c1ccccc1C#N 527a_100020588543_100000742908 [0,2,0,0,0,0|2,0,0]=4 18708 B16R1.5567 CCC(C)CNC(=O)c1ccccc1I=O 1626a_100020588543_100000032414 [0,2,0,0,0,0|1,0,1]=4 18709 B16R1.5567 CCC(C)CNC(=O)c1ccccc1I=O 240690a_100020588543_100000032414 [0,2,0,0,0,0|1,0,1]=4 18710 B16R1.5567 CCC(C)CNC(=O)c1ccccc1I=O 527a_100020588543_100000032414 [0,2,0,0,0,0|1,0,1]=4 18711 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 11a_100020588543_100000185835 [0,2,0,0,0,0|1,0,0]=3 18712 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 1626a_100020588543_100000185835 [0,2,0,0,0,0|1,0,0]=3 18713 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 240690a_100020588543_100000185835 [0,2,0,0,0,0|1,0,0]=3 18714 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 527a_100020588543_100000185835 [0,2,0,0,0,0|1,0,0]=3 18715 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 11a_100020588543_100000183967 [0,2,0,0,0,0|1,1,0]=4 18716 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 1626a_100020588543_100000183967 [0,2,0,0,0,0|1,1,0]=4 18717 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 240690a_100020588543_100000183967 [0,2,0,0,0,0|1,1,0]=4 18718 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 527a_100020588543_100000183967 [0,2,0,0,0,0|1,1,0]=4 18719 B16R1.5567 CCC(C)COC(C)c1ccccc1OC 7a_100000742714_100000748023 [0,2,0,0,0,0|1,0,1]=4 18720 B16R1.5567 CCC(C)NNC(=O)c1ccccc1OC 22a_100000718999_100000185835 [0,2,0,0,0,0|2,0,0]=4 18721 B16R1.5567 CCC(C)OCC(=O)c1ccccc1OC 7a_100000210228_100000195505 [0,2,0,0,0,0|2,0,0]=4 18722 B16R1.5567 CCC(C)SCC(=O)c1ccccc1OC 62a_100000195505_100000758301 [0,2,0,0,0,0|2,0,0]=4 18723 B16R1.5567 CCC(O)CNC(=O)c1ccccc1C#N 11a_100011218483_100000742908 [0,2,0,0,0,0|2,0,0]=4 18724 B16R1.5567 CCC(O)CNC(=O)c1ccccc1C#N 527a_100011218483_100000742908 [0,2,0,0,0,0|2,0,0]=4 18725 B16R1.5567 CCC(O)CNC(=O)c1ccccc1I=O 240690a_100011218483_100000032414 [0,2,0,0,0,0|1,0,1]=4 18726 B16R1.5567 CCC(O)CNC(=O)c1ccccc1I=O 527a_100011218483_100000032414 [0,2,0,0,0,0|1,0,1]=4 18727 B16R1.5567 CCC(O)CNC(=O)c1ccccc1OC 11a_100011218483_100000185835 [0,2,0,0,0,0|1,0,0]=3 18728 B16R1.5567 CCC(O)CNC(=O)c1ccccc1OC 240690a_100011218483_100000185835 [0,2,0,0,0,0|1,0,0]=3 18729 B16R1.5567 CCC(O)CNC(=O)c1ccccc1OC 527a_100011218483_100000185835 [0,2,0,0,0,0|1,0,0]=3 18730 B16R1.5567 CCC(O)CNC(=O)c1ccccc1SC 11a_100011218483_100000183967 [0,2,0,0,0,0|1,1,0]=4 18731 B16R1.5567 CCC(O)CNC(=O)c1ccccc1SC 240690a_100011218483_100000183967 [0,2,0,0,0,0|1,1,0]=4 18732 B16R1.5567 CCC(O)CNC(=O)c1ccccc1SC 527a_100011218483_100000183967 [0,2,0,0,0,0|1,1,0]=4 18733 B16R1.5567 CCC(O)COC(C)c1ccccc1OC 7a_100000742714_100011218378 [0,2,0,0,0,0|1,0,1]=4 18734 B16R1.5567 CC[C@H](C)COC(C)c1ccccc1OC 7a_100000742714_100009816398 [0,2,0,0,0,0|1,0,1]=4 18735 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 11a_100020588543_100000689120 [0,2,0,0,0,0|2,0,0]=4 18736 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 1626a_100020588543_100000689120 [0,2,0,0,0,0|2,0,0]=4 18737 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 240690a_100020588543_100000689120 [0,2,0,0,0,0|2,0,0]=4 18738 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 527a_100020588543_100000689120 [0,2,0,0,0,0|2,0,0]=4 18739 B16R1.5567 CCc1ccccc1C(=O)NCC(O)CC 11a_100011218483_100000689120 [0,2,0,0,0,0|2,0,0]=4 18740 B16R1.5567 CCc1ccccc1C(=O)NCC(O)CC 240690a_100011218483_100000689120 [0,2,0,0,0,0|2,0,0]=4 18741 B16R1.5567 CCc1ccccc1C(=O)NCC(O)CC 527a_100011218483_100000689120 [0,2,0,0,0,0|2,0,0]=4 18742 B16R1.5567 COc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000185835 [0,2,0,0,0,0|2,0,0]=4 18743 B16R1.5567 COc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000185835 [0,2,0,0,0,0|2,0,0]=4 18744 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 11a_100020591295_100000185835 [0,2,0,0,0,0|2,0,0]=4 18745 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100000185835 [0,2,0,0,0,0|2,0,0]=4 18746 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 240690a_100020591295_100000185835 [0,2,0,0,0,0|2,0,0]=4 18747 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100000185835 [0,2,0,0,0,0|2,0,0]=4 18748 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000185835 [0,2,0,0,0,0|2,0,0]=4 18749 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000185835 [0,2,0,0,0,0|2,0,0]=4 18750 B16R1.5567 COc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000185835 [0,2,0,0,0,0|2,0,0]=4 18751 B16R1.5567 COc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000185835 [0,2,0,0,0,0|2,0,0]=4 18752 B16R1.7516 C#Cc1ccccc1C(=O)C(C)CCCC 1458a_100011243808_200011215066 [0,2,0,0,0,0|2,0,0]=4 18753 B16R1.7516 C#Cc1ccccc1C(=O)N(C)CCCC 527a_100000207549_100011243808 [0,2,0,0,0,0|2,0,0]=4 18754 B16R1.7516 C=Cc1ccccc1C(=O)C(C)CCCC 1458a_100011830265_200011215066 [0,2,0,0,0,0|2,0,0]=4 18755 B16R1.7516 C=Cc1ccccc1C(=O)N(C)CCCC 1626a_100000207549_100011830265 [0,2,0,0,0,0|2,0,0]=4 18756 B16R1.7516 CCCCC(C)C(=O)c1ccccc1C#N 1458a_100000742908_200011215066 [0,2,0,0,0,0|2,0,0]=4 18757 B16R1.7516 CCCCC(C)C(=O)c1ccccc1CC 1458a_100000689120_200011215066 [0,2,0,0,0,0|2,0,0]=4 18758 B16R1.7516 CCCCC(C)C(=O)c1ccccc1CO 1458a_100011301526_200011215066 [0,2,0,0,0,0|1,0,0]=3 18759 B16R1.7516 CCCCC(C)C(=O)c1ccccc1I=O 1458a_100000032414_200011215066 [0,2,0,0,0,0|1,0,1]=4 18760 B16R1.7516 CCCCC(C)C(=O)c1ccccc1OC 1458a_100000185835_200011215066 [0,2,0,0,0,0|1,0,0]=3 18761 B16R1.7516 CCCCC(C)C(=O)c1ccccc1SC 1458a_100000183967_200011215066 [0,2,0,0,0,0|1,1,0]=4 18762 B16R1.7516 CCCCN(C)C(=O)c1ccccc1C#N 11a_100000207549_100000742908 [0,2,0,0,0,0|2,0,0]=4 18763 B16R1.7516 CCCCN(C)C(=O)c1ccccc1C#N 1626a_100000207549_100000742908 [0,2,0,0,0,0|2,0,0]=4 18764 B16R1.7516 CCCCN(C)C(=O)c1ccccc1C#N 527a_100000207549_100000742908 [0,2,0,0,0,0|2,0,0]=4 18765 B16R1.7516 CCCCN(C)C(=O)c1ccccc1CC 11a_100000207549_100000689120 [0,2,0,0,0,0|2,0,0]=4 18766 B16R1.7516 CCCCN(C)C(=O)c1ccccc1CC 1626a_100000207549_100000689120 [0,2,0,0,0,0|2,0,0]=4 18767 B16R1.7516 CCCCN(C)C(=O)c1ccccc1CC 240690a_100000207549_100000689120 [0,2,0,0,0,0|2,0,0]=4 18768 B16R1.7516 CCCCN(C)C(=O)c1ccccc1CC 527a_100000207549_100000689120 [0,2,0,0,0,0|2,0,0]=4 18769 B16R1.7516 CCCCN(C)C(=O)c1ccccc1I=O 1626a_100000207549_100000032414 [0,2,0,0,0,0|1,0,1]=4 18770 B16R1.7516 CCCCN(C)C(=O)c1ccccc1I=O 240690a_100000207549_100000032414 [0,2,0,0,0,0|1,0,1]=4 18771 B16R1.7516 CCCCN(C)C(=O)c1ccccc1I=O 527a_100000207549_100000032414 [0,2,0,0,0,0|1,0,1]=4 18772 B16R1.7516 CCCCN(C)C(=O)c1ccccc1OC 11a_100000207549_100000185835 [0,2,0,0,0,0|1,0,0]=3 18773 B16R1.7516 CCCCN(C)C(=O)c1ccccc1OC 1626a_100000207549_100000185835 [0,2,0,0,0,0|1,0,0]=3 18774 B16R1.7516 CCCCN(C)C(=O)c1ccccc1OC 240690a_100000207549_100000185835 [0,2,0,0,0,0|1,0,0]=3 18775 B16R1.7516 CCCCN(C)C(=O)c1ccccc1OC 527a_100000207549_100000185835 [0,2,0,0,0,0|1,0,0]=3 18776 B16R1.7516 CCCCN(C)C(=O)c1ccccc1SC 11a_100000207549_100000183967 [0,2,0,0,0,0|1,1,0]=4 18777 B16R1.7516 CCCCN(C)C(=O)c1ccccc1SC 1626a_100000207549_100000183967 [0,2,0,0,0,0|1,1,0]=4 18778 B16R1.7516 CCCCN(C)C(=O)c1ccccc1SC 240690a_100000207549_100000183967 [0,2,0,0,0,0|1,1,0]=4 18779 B16R1.7516 CCCCN(C)C(=O)c1ccccc1SC 527a_100000207549_100000183967 [0,2,0,0,0,0|1,1,0]=4 18780 B16R1.7516 COCCN(C)C(=O)c1ccccc1OC 11a_100000743101_100000185835 [0,2,0,0,0,0|2,0,0]=4 18781 B16R1.7516 COCCN(C)C(=O)c1ccccc1OC 1626a_100000743101_100000185835 [0,2,0,0,0,0|2,0,0]=4 18782 B16R1.7516 COCCN(C)C(=O)c1ccccc1OC 240690a_100000743101_100000185835 [0,2,0,0,0,0|2,0,0]=4 18783 B16R1.7516 COCCN(C)C(=O)c1ccccc1OC 527a_100000743101_100000185835 [0,2,0,0,0,0|2,0,0]=4 18784 B16R1.7516 COc1ccccc1C(=O)N(C)CCCO 240690a_100000213112_100000185835 [0,2,0,0,0,0|2,0,0]=4 18785 B16R1.7516 COc1ccccc1C(=O)N(C)CCCO 527a_100000213112_100000185835 [0,2,0,0,0,0|2,0,0]=4 18786 B16R1.7516 COc1ccccc1C(=O)N(C)CCSC 11a_100000686725_100000185835 [0,2,0,0,0,0|2,0,0]=4 18787 B16R1.7516 COc1ccccc1C(=O)N(C)CCSC 1626a_100000686725_100000185835 [0,2,0,0,0,0|2,0,0]=4 18788 B16R1.7516 COc1ccccc1C(=O)N(C)CCSC 240690a_100000686725_100000185835 [0,2,0,0,0,0|2,0,0]=4 18789 B16R1.7516 COc1ccccc1C(=O)N(C)CCSC 527a_100000686725_100000185835 [0,2,0,0,0,0|2,0,0]=4 18790 B16R1.18704 C#Cc1ccccc1C(=O)CCCC(C)C 1458a_100011243808_100011214892 [0,2,0,0,0,0|2,0,0]=4 18791 B16R1.18704 C#Cc1ccccc1C(=O)CCCC(C)O 1458a_100011243808_200000718107 [0,2,0,0,0,0|2,0,0]=4 18792 B16R1.18704 C#Cc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100011243808 [0,2,0,0,0,0|2,0,0]=4 18793 B16R1.18704 C#Cc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100011243808 [0,2,0,0,0,0|2,0,0]=4 18794 B16R1.18704 C=Cc1ccccc1C(=O)CCCC(C)C 1458a_100011830265_100011214892 [0,2,0,0,0,0|2,0,0]=4 18795 B16R1.18704 C=Cc1ccccc1C(=O)CCCC(C)O 1458a_100011830265_200000718107 [0,2,0,0,0,0|2,0,0]=4 18796 B16R1.18704 C=Cc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100011830265 [0,2,0,0,0,0|2,0,0]=4 18797 B16R1.18704 CC(=O)CCCC(=O)c1ccccc1CO 1458a_100011301526_100011215641 [0,2,0,0,0,0|1,0,1]=4 18798 B16R1.18704 CC(C)CCCC(=O)c1ccccc1C#N 1458a_100000742908_100011214892 [0,2,0,0,0,0|2,0,0]=4 18799 B16R1.18704 CC(C)CCCC(=O)c1ccccc1CO 1458a_100011301526_100011214892 [0,2,0,0,0,0|1,0,0]=3 18800 B16R1.18704 CC(C)CCCC(=O)c1ccccc1I=O 1458a_100000032414_100011214892 [0,2,0,0,0,0|1,0,1]=4 18801 B16R1.18704 CC(C)CCNC(=O)c1ccccc1C#N 11a_100000210545_100000742908 [0,2,0,0,0,0|2,0,0]=4 18802 B16R1.18704 CC(C)CCNC(=O)c1ccccc1C#N 1626a_100000210545_100000742908 [0,2,0,0,0,0|2,0,0]=4 18803 B16R1.18704 CC(C)CCNC(=O)c1ccccc1C#N 527a_100000210545_100000742908 [0,2,0,0,0,0|2,0,0]=4 18804 B16R1.18704 CC(C)CCNC(=O)c1ccccc1I=O 1626a_100000210545_100000032414 [0,2,0,0,0,0|1,0,1]=4 18805 B16R1.18704 CC(C)CCNC(=O)c1ccccc1I=O 240690a_100000210545_100000032414 [0,2,0,0,0,0|1,0,1]=4 18806 B16R1.18704 CC(C)CCNC(=O)c1ccccc1I=O 527a_100000210545_100000032414 [0,2,0,0,0,0|1,0,1]=4 18807 B16R1.18704 CC(C)CCOC(=O)c1ccccc1O[13CH3] 7a_100000030269_200025704644 [0,2,0,0,0,0|0,0,0]=2 18808 B16R1.18704 CC(C)OCCC(=O)c1ccccc1CO 1458a_100011301526_100000211751 [0,2,0,0,0,0|2,0,0]=4 18809 B16R1.18704 CC(C)SCCC(=O)c1ccccc1CO 1458a_100011301526_100000730970 [0,2,0,0,0,0|2,0,0]=4 18810 B16R1.18704 CC(O)CCCC(=O)c1ccccc1C#N 1458a_100000742908_200000718107 [0,2,0,0,0,0|2,0,0]=4 18811 B16R1.18704 CC(O)CCCC(=O)c1ccccc1CO 1458a_100011301526_200000718107 [0,2,0,0,0,0|1,0,0]=3 18812 B16R1.18704 CC(O)CCCC(=O)c1ccccc1I=O 1458a_100000032414_200000718107 [0,2,0,0,0,0|1,0,1]=4 18813 B16R1.18704 CC(O)CCNC(=O)c1ccccc1C#N 527a_200000755665_100000742908 [0,2,0,0,0,0|2,0,0]=4 18814 B16R1.18704 CC(O)CCNC(=O)c1ccccc1I=O 240690a_200000755665_100000032414 [0,2,0,0,0,0|1,0,1]=4 18815 B16R1.18704 CC(O)CCNC(=O)c1ccccc1I=O 527a_200000755665_100000032414 [0,2,0,0,0,0|1,0,1]=4 18816 B16R1.18704 CCc1ccccc1C(=O)CCCC(C)C 1458a_100000689120_100011214892 [0,2,0,0,0,0|2,0,0]=4 18817 B16R1.18704 CCc1ccccc1C(=O)CCCC(C)O 1458a_100000689120_200000718107 [0,2,0,0,0,0|2,0,0]=4 18818 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000689120 [0,2,0,0,0,0|2,0,0]=4 18819 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000689120 [0,2,0,0,0,0|2,0,0]=4 18820 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000689120 [0,2,0,0,0,0|2,0,0]=4 18821 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000689120 [0,2,0,0,0,0|2,0,0]=4 18822 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000689120 [0,2,0,0,0,0|2,0,0]=4 18823 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000689120 [0,2,0,0,0,0|2,0,0]=4 18824 B16R1.18704 CN(C)CCCC(=O)c1ccccc1CO 1458a_100011301526_100000695564 [0,2,0,0,0,0|2,0,0]=4 18825 B16R1.18704 COc1ccccc1C(=O)CCCC(=O)C 1458a_100000185835_100011215641 [0,2,0,0,0,0|1,0,1]=4 18826 B16R1.18704 COc1ccccc1C(=O)CCCC(C)C 1458a_100000185835_100011214892 [0,2,0,0,0,0|1,0,0]=3 18827 B16R1.18704 COc1ccccc1C(=O)CCCC(C)O 1458a_100000185835_200000718107 [0,2,0,0,0,0|1,0,0]=3 18828 B16R1.18704 COc1ccccc1C(=O)CCCN(C)C 1458a_100000185835_100000695564 [0,2,0,0,0,0|2,0,0]=4 18829 B16R1.18704 COc1ccccc1C(=O)CCOC(C)C 1458a_100000185835_100000211751 [0,2,0,0,0,0|2,0,0]=4 18830 B16R1.18704 COc1ccccc1C(=O)CCSC(C)C 1458a_100000185835_100000730970 [0,2,0,0,0,0|2,0,0]=4 18831 B16R1.18704 COc1ccccc1C(=O)CNCC(C)C 34a_100000210953_100000195505 [0,2,0,0,0,0|2,0,0]=4 18832 B16R1.18704 COc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000195505 [0,2,0,0,0,0|2,0,0]=4 18833 B16R1.18704 COc1ccccc1C(=O)COCC(C)Br 34a_100012180447_100000195505 [0,2,0,0,0,0|2,0,0]=4 18834 B16R1.18704 COc1ccccc1C(=O)COCC(C)C 34a_100000210257_100000195505 [0,2,0,0,0,0|2,0,0]=4 18835 B16R1.18704 COc1ccccc1C(=O)COCC(C)F 34a_100015925927_100000195505 [0,2,0,0,0,0|2,0,0]=4 18836 B16R1.18704 COc1ccccc1C(=O)COC[C@@H](C)Cl 34a_100016084084_100000195505 [0,2,0,0,0,0|2,0,0]=4 18837 B16R1.18704 COc1ccccc1C(=O)COC[C@@H](C)N 34a_100000737577_100000195505 [0,2,0,0,0,0|2,0,0]=4 18838 B16R1.18704 COc1ccccc1C(=O)CSCC(C)C 62a_100000195505_100000210760 [0,2,0,0,0,0|2,0,0]=4 18839 B16R1.18704 COc1ccccc1C(=O)CSCC(C)O 62a_100000195505_100011218427 [0,2,0,0,0,0|2,0,0]=4 18840 B16R1.18704 COc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000195505_100009817552 [0,2,0,0,0,0|2,0,0]=4 18841 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)C 1458a_100000184143_200000210301 [0,2,0,0,0,0|1,0,1]=4 18842 B16R1.18704 COc1ccccc1C(=O)NCCC(=O)[13CH3] 1458a_100000184143_200025704644 [0,2,0,0,0,0|1,0,1]=4 18843 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000185835 [0,2,0,0,0,0|1,0,0]=3 18844 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000185835 [0,2,0,0,0,0|1,0,0]=3 18845 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000185835 [0,2,0,0,0,0|1,0,0]=3 18846 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000185835 [0,2,0,0,0,0|1,0,0]=3 18847 B16R1.18704 COc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000185835 [0,2,0,0,0,0|1,0,0]=3 18848 B16R1.18704 COc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000185835 [0,2,0,0,0,0|1,0,0]=3 18849 B16R1.18704 COc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000185835 [0,2,0,0,0,0|2,0,0]=4 18850 B16R1.18704 COc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000185835 [0,2,0,0,0,0|2,0,0]=4 18851 B16R1.18704 COc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000185835 [0,2,0,0,0,0|2,0,0]=4 18852 B16R1.18704 COc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000185835 [0,2,0,0,0,0|2,0,0]=4 18853 B16R1.18704 COc1ccccc1C(=O)OCCC(C)C 7a_100000030269_200000210301 [0,2,0,0,0,0|0,0,0]=2 18854 B16R1.18704 COc1ccccc1C(C)OCCC(C)C 7a_100000742714_100000210626 [0,2,0,0,0,0|1,0,1]=4 18855 B16R1.18704 COc1ccccc1C(C)OCCC(C)O 7a_100000742714_100012276601 [0,2,0,0,0,0|1,0,1]=4 18856 B16R1.18704 CSc1ccccc1C(=O)CCCC(C)C 1458a_100000183967_100011214892 [0,2,0,0,0,0|1,1,0]=4 18857 B16R1.18704 CSc1ccccc1C(=O)CCCC(C)O 1458a_100000183967_200000718107 [0,2,0,0,0,0|1,1,0]=4 18858 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000183967 [0,2,0,0,0,0|1,1,0]=4 18859 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000183967 [0,2,0,0,0,0|1,1,0]=4 18860 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000183967 [0,2,0,0,0,0|1,1,0]=4 18861 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000183967 [0,2,0,0,0,0|1,1,0]=4 18862 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000183967 [0,2,0,0,0,0|1,1,0]=4 18863 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000183967 [0,2,0,0,0,0|1,1,0]=4 18864 B16R1.3540 C#Cc1ccc(c(c1)Cl)C(=O)CCCCC 1458a_100103168756_100000210326 [0,2,0,0,0,0|2,0,0]=4 18865 B16R1.3540 C#Cc1ccc(c(c1)Cl)C(=O)NCCCC 11a_100000102301_100103168756 [0,2,0,0,0,0|2,0,0]=4 18866 B16R1.3540 C#Cc1ccc(c(c1)Cl)C(=O)NCCCC 1626a_100000102301_100103168756 [0,2,0,0,0,0|2,0,0]=4 18867 B16R1.3540 C#Cc1ccc(c(c1)Cl)C(=O)NCCCC 240690a_100000102301_100103168756 [0,2,0,0,0,0|2,0,0]=4 18868 B16R1.3540 C#Cc1ccc(c(c1)Cl)C(=O)NCCCC 527a_100000102301_100103168756 [0,2,0,0,0,0|2,0,0]=4 18869 B16R1.3540 CCCCCC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_100000210326 [0,2,0,0,0,0|2,0,0]=4 18870 B16R1.3540 CCCCCC(=O)c1ccc(cc1Br)OC 1458a_100000748873_100000210326 [0,2,0,0,0,0|2,0,0]=4 18871 B16R1.3540 CCCCCC(=O)c1ccc(cc1C)C#N 1458a_100000691869_100000210326 [0,2,0,0,0,0|2,0,0]=4 18872 B16R1.3540 CCCCCC(=O)c1ccc(cc1C)OC 1458a_100000763155_100000210326 [0,2,0,0,0,0|2,0,0]=4 18873 B16R1.3540 CCCCCC(=O)c1ccc(cc1C)SC 1458a_100012278374_100000210326 [0,2,0,0,0,0|2,0,0]=4 18874 B16R1.3540 CCCCCC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_100000210326 [0,2,0,0,0,0|2,0,0]=4 18875 B16R1.3540 CCCCCC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_100000210326 [0,2,0,0,0,0|2,0,0]=4 18876 B16R1.3540 CCCCCC(=O)c1ccc(cc1Cl)OC 1458a_100000753557_100000210326 [0,2,0,0,0,0|2,0,0]=4 18877 B16R1.3540 CCCCCC(=O)c1ccc(cc1F)C#N 1458a_100000238375_100000210326 [0,2,0,0,0,0|2,0,0]=4 18878 B16R1.3540 CCCCCC(=O)c1ccc(cc1F)CC 1458a_200009867912_100000210326 [0,2,0,0,0,0|2,0,0]=4 18879 B16R1.3540 CCCCCC(=O)c1ccc(cc1F)CO 1458a_100011934814_100000210326 [0,2,0,0,0,0|2,0,0]=4 18880 B16R1.3540 CCCCCC(=O)c1ccc(cc1F)OC 1458a_100000198494_100000210326 [0,2,0,0,0,0|2,0,0]=4 18881 B16R1.3540 CCCCCC(=O)c1ccc(cc1I)OC 1458a_100000688016_100000210326 [0,2,0,0,0,0|2,0,0]=4 18882 B16R1.3540 CCCCCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000210326 [0,2,0,0,0,0|1,0,0]=3 18883 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)C#N 11a_100000102301_100010244945 [0,2,0,0,0,0|2,0,0]=4 18884 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)C#N 1626a_100000102301_100010244945 [0,2,0,0,0,0|2,0,0]=4 18885 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)C#N 240690a_100000102301_100010244945 [0,2,0,0,0,0|2,0,0]=4 18886 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)C#N 527a_100000102301_100010244945 [0,2,0,0,0,0|2,0,0]=4 18887 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)OC 11a_100000102301_100000748873 [0,2,0,0,0,0|2,0,0]=4 18888 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)OC 1626a_100000102301_100000748873 [0,2,0,0,0,0|2,0,0]=4 18889 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)OC 240690a_100000102301_100000748873 [0,2,0,0,0,0|2,0,0]=4 18890 B16R1.3540 CCCCNC(=O)c1ccc(cc1Br)OC 527a_100000102301_100000748873 [0,2,0,0,0,0|2,0,0]=4 18891 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)C#N 11a_100000102301_100000691869 [0,2,0,0,0,0|2,0,0]=4 18892 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)C#N 1626a_100000102301_100000691869 [0,2,0,0,0,0|2,0,0]=4 18893 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)C#N 240690a_100000102301_100000691869 [0,2,0,0,0,0|2,0,0]=4 18894 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)C#N 527a_100000102301_100000691869 [0,2,0,0,0,0|2,0,0]=4 18895 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)OC 11a_100000102301_100000763155 [0,2,0,0,0,0|2,0,0]=4 18896 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)OC 1626a_100000102301_100000763155 [0,2,0,0,0,0|2,0,0]=4 18897 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)OC 240690a_100000102301_100000763155 [0,2,0,0,0,0|2,0,0]=4 18898 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)OC 527a_100000102301_100000763155 [0,2,0,0,0,0|2,0,0]=4 18899 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)SC 11a_100000102301_100012278374 [0,2,0,0,0,0|2,0,0]=4 18900 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)SC 1626a_100000102301_100012278374 [0,2,0,0,0,0|2,0,0]=4 18901 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)SC 240690a_100000102301_100012278374 [0,2,0,0,0,0|2,0,0]=4 18902 B16R1.3540 CCCCNC(=O)c1ccc(cc1C)SC 527a_100000102301_100012278374 [0,2,0,0,0,0|2,0,0]=4 18903 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)C#N 11a_100000102301_100000100588 [0,2,0,0,0,0|2,0,0]=4 18904 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)C#N 1626a_100000102301_100000100588 [0,2,0,0,0,0|2,0,0]=4 18905 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)C#N 240690a_100000102301_100000100588 [0,2,0,0,0,0|2,0,0]=4 18906 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)C#N 527a_100000102301_100000100588 [0,2,0,0,0,0|2,0,0]=4 18907 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)CO 240690a_100000102301_100015659073 [0,2,0,0,0,0|2,0,0]=4 18908 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)OC 11a_100000102301_100000753557 [0,2,0,0,0,0|2,0,0]=4 18909 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)OC 1626a_100000102301_100000753557 [0,2,0,0,0,0|2,0,0]=4 18910 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)OC 240690a_100000102301_100000753557 [0,2,0,0,0,0|2,0,0]=4 18911 B16R1.3540 CCCCNC(=O)c1ccc(cc1Cl)OC 527a_100000102301_100000753557 [0,2,0,0,0,0|2,0,0]=4 18912 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)C#N 11a_100000102301_100000238375 [0,2,0,0,0,0|2,0,0]=4 18913 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)C#N 1626a_100000102301_100000238375 [0,2,0,0,0,0|2,0,0]=4 18914 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)C#N 240690a_100000102301_100000238375 [0,2,0,0,0,0|2,0,0]=4 18915 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)C#N 527a_100000102301_100000238375 [0,2,0,0,0,0|2,0,0]=4 18916 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)CC 11a_100000102301_200009867912 [0,2,0,0,0,0|2,0,0]=4 18917 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)CC 1626a_100000102301_200009867912 [0,2,0,0,0,0|2,0,0]=4 18918 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)CC 240690a_100000102301_200009867912 [0,2,0,0,0,0|2,0,0]=4 18919 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)CC 527a_100000102301_200009867912 [0,2,0,0,0,0|2,0,0]=4 18920 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)CO 240690a_100000102301_100011934814 [0,2,0,0,0,0|2,0,0]=4 18921 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)OC 11a_100000102301_100000198494 [0,2,0,0,0,0|2,0,0]=4 18922 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)OC 1626a_100000102301_100000198494 [0,2,0,0,0,0|2,0,0]=4 18923 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)OC 240690a_100000102301_100000198494 [0,2,0,0,0,0|2,0,0]=4 18924 B16R1.3540 CCCCNC(=O)c1ccc(cc1F)OC 527a_100000102301_100000198494 [0,2,0,0,0,0|2,0,0]=4 18925 B16R1.3540 CCCCNC(=O)c1ccc(cc1I)OC 11a_100000102301_100000688016 [0,2,0,0,0,0|2,0,0]=4 18926 B16R1.3540 CCCCNC(=O)c1ccc(cc1I)OC 1626a_100000102301_100000688016 [0,2,0,0,0,0|2,0,0]=4 18927 B16R1.3540 CCCCNC(=O)c1ccc(cc1I)OC 240690a_100000102301_100000688016 [0,2,0,0,0,0|2,0,0]=4 18928 B16R1.3540 CCCCNC(=O)c1ccc(cc1I)OC 527a_100000102301_100000688016 [0,2,0,0,0,0|2,0,0]=4 18929 B16R1.3540 CCCCNC(=O)c1ccc(cc1O)OC 11a_100000102301_100000212123 [0,2,0,0,0,0|1,0,0]=3 18930 B16R1.3540 CCCCNC(=O)c1ccc(cc1O)OC 240690a_100000102301_100000212123 [0,2,0,0,0,0|1,0,0]=3 18931 B16R1.3540 CCCCNC(=O)c1ccc(cc1O)OC 527a_100000102301_100000212123 [0,2,0,0,0,0|1,0,0]=3 18932 B16R1.3540 CCCNNC(=O)c1ccc(cc1O)OC 22a_100000740057_100000212123 [0,2,0,0,0,0|2,0,0]=4 18933 B16R1.3540 CCOCCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100011215890 [0,2,0,0,0,0|2,0,0]=4 18934 B16R1.3540 CCSCCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000757381 [0,2,0,0,0,0|2,0,0]=4 18935 B16R1.3540 COCCCC(=O)c1ccc(cc1O)OC 1458a_100000212123_100000740836 [0,2,0,0,0,0|2,0,0]=4 18936 B16R1.3540 COCCNC(=O)c1ccc(cc1O)OC 240690a_100000209980_100000212123 [0,2,0,0,0,0|2,0,0]=4 18937 B16R1.3540 COCCNC(=O)c1ccc(cc1O)OC 527a_100000209980_100000212123 [0,2,0,0,0,0|2,0,0]=4 18938 B16R1.3540 COc1ccc(c(c1)O)C(=O)CCCCF 1458a_100000212123_100000729493 [0,2,0,0,0,0|2,0,0]=4 18939 B16R1.3540 COc1ccc(c(c1)O)C(=O)CCCCO 1458a_100000212123_100000210776 [0,2,0,0,0,0|2,0,0]=4 18940 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCCF 11a_100015189416_100000212123 [0,2,0,0,0,0|2,0,0]=4 18941 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCCF 240690a_100015189416_100000212123 [0,2,0,0,0,0|2,0,0]=4 18942 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCCF 527a_100015189416_100000212123 [0,2,0,0,0,0|2,0,0]=4 18943 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCCO 240690a_100000182051_100000212123 [0,2,0,0,0,0|2,0,0]=4 18944 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCCO 527a_100000182051_100000212123 [0,2,0,0,0,0|2,0,0]=4 18945 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCSC 11a_100020590264_100000212123 [0,2,0,0,0,0|2,0,0]=4 18946 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCSC 240690a_100020590264_100000212123 [0,2,0,0,0,0|2,0,0]=4 18947 B16R1.3540 COc1ccc(c(c1)O)C(=O)NCCSC 527a_100020590264_100000212123 [0,2,0,0,0,0|2,0,0]=4 18948 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215641 [0,2,0,0,0,0|1,0,1]=4 18949 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100011215641 [0,2,0,0,0,0|1,0,1]=4 18950 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215641 [0,2,0,0,0,0|1,0,1]=4 18951 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215641 [0,2,0,0,0,0|1,0,1]=4 18952 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215641 [0,2,0,0,0,0|1,0,1]=4 18953 B16R1.11442 CC(=O)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215641 [0,2,0,0,0,0|1,0,1]=4 18954 B16R1.11442 CC(Br)COCC(=O)c1ccc(cc1O)F 34a_100012180447_100009817053 [0,2,0,0,0,0|2,0,0]=4 18955 B16R1.11442 CC(Br)COCC(=O)c1ccc(cc1O)O 34a_100012180447_100009814262 [0,2,0,0,0,0|2,0,0]=4 18956 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011214892 [0,2,0,0,0,0|2,0,0]=4 18957 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011214892 [0,2,0,0,0,0|2,0,0]=4 18958 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011214892 [0,2,0,0,0,0|2,0,0]=4 18959 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011214892 [0,2,0,0,0,0|2,0,0]=4 18960 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011214892 [0,2,0,0,0,0|2,0,0]=4 18961 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011214892 [0,2,0,0,0,0|2,0,0]=4 18962 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011214892 [0,2,0,0,0,0|2,0,0]=4 18963 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011214892 [0,2,0,0,0,0|2,0,0]=4 18964 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011214892 [0,2,0,0,0,0|2,0,0]=4 18965 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011214892 [0,2,0,0,0,0|2,0,0]=4 18966 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011214892 [0,2,0,0,0,0|2,0,0]=4 18967 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011214892 [0,2,0,0,0,0|2,0,0]=4 18968 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100011214892 [0,2,0,0,0,0|2,0,0]=4 18969 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100011214892 [0,2,0,0,0,0|2,0,0]=4 18970 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100011214892 [0,2,0,0,0,0|2,0,0]=4 18971 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011214892 [0,2,0,0,0,0|2,0,0]=4 18972 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011214892 [0,2,0,0,0,0|2,0,0]=4 18973 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100011214892 [0,2,0,0,0,0|2,0,0]=4 18974 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011214892 [0,2,0,0,0,0|1,0,0]=3 18975 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011214892 [0,2,0,0,0,0|1,0,0]=3 18976 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011214892 [0,2,0,0,0,0|1,0,0]=3 18977 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011214892 [0,2,0,0,0,0|1,0,0]=3 18978 B16R1.11442 CC(C)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011214892 [0,2,0,0,0,0|1,0,0]=3 18979 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Br 11a_100000210545_100000762965 [0,2,0,0,0,0|2,0,0]=4 18980 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Br 1626a_100000210545_100000762965 [0,2,0,0,0,0|2,0,0]=4 18981 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Br 240690a_100000210545_100000762965 [0,2,0,0,0,0|2,0,0]=4 18982 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Br 527a_100000210545_100000762965 [0,2,0,0,0,0|2,0,0]=4 18983 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Cl 11a_100000210545_100000766353 [0,2,0,0,0,0|2,0,0]=4 18984 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Cl 1626a_100000210545_100000766353 [0,2,0,0,0,0|2,0,0]=4 18985 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Cl 240690a_100000210545_100000766353 [0,2,0,0,0,0|2,0,0]=4 18986 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)Cl 527a_100000210545_100000766353 [0,2,0,0,0,0|2,0,0]=4 18987 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)F 11a_100000210545_100000212304 [0,2,0,0,0,0|2,0,0]=4 18988 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)F 1626a_100000210545_100000212304 [0,2,0,0,0,0|2,0,0]=4 18989 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)F 240690a_100000210545_100000212304 [0,2,0,0,0,0|2,0,0]=4 18990 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)F 527a_100000210545_100000212304 [0,2,0,0,0,0|2,0,0]=4 18991 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)I 11a_100000210545_100012360512 [0,2,0,0,0,0|2,0,0]=4 18992 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)I 1626a_100000210545_100012360512 [0,2,0,0,0,0|2,0,0]=4 18993 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)I 240690a_100000210545_100012360512 [0,2,0,0,0,0|2,0,0]=4 18994 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)I 527a_100000210545_100012360512 [0,2,0,0,0,0|2,0,0]=4 18995 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)O 240690a_100000210545_100012344906 [0,2,0,0,0,0|2,0,0]=4 18996 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Br)O 527a_100000210545_100012344906 [0,2,0,0,0,0|2,0,0]=4 18997 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Br 11a_100000210545_100000741628 [0,2,0,0,0,0|2,0,0]=4 18998 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Br 1626a_100000210545_100000741628 [0,2,0,0,0,0|2,0,0]=4 18999 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Br 240690a_100000210545_100000741628 [0,2,0,0,0,0|2,0,0]=4 19000 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Br 527a_100000210545_100000741628 [0,2,0,0,0,0|2,0,0]=4 19001 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Cl 11a_100000210545_100000185840 [0,2,0,0,0,0|2,0,0]=4 19002 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000210545_100000185840 [0,2,0,0,0,0|2,0,0]=4 19003 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000210545_100000185840 [0,2,0,0,0,0|2,0,0]=4 19004 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)Cl 527a_100000210545_100000185840 [0,2,0,0,0,0|2,0,0]=4 19005 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)F 11a_100000210545_100000211397 [0,2,0,0,0,0|2,0,0]=4 19006 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)F 1626a_100000210545_100000211397 [0,2,0,0,0,0|2,0,0]=4 19007 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)F 240690a_100000210545_100000211397 [0,2,0,0,0,0|2,0,0]=4 19008 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)F 527a_100000210545_100000211397 [0,2,0,0,0,0|2,0,0]=4 19009 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)I 11a_100000210545_100000751301 [0,2,0,0,0,0|2,0,0]=4 19010 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)I 1626a_100000210545_100000751301 [0,2,0,0,0,0|2,0,0]=4 19011 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)I 240690a_100000210545_100000751301 [0,2,0,0,0,0|2,0,0]=4 19012 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)I 527a_100000210545_100000751301 [0,2,0,0,0,0|2,0,0]=4 19013 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)O 240690a_100000210545_100000702456 [0,2,0,0,0,0|2,0,0]=4 19014 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1Cl)O 527a_100000210545_100000702456 [0,2,0,0,0,0|2,0,0]=4 19015 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Br 11a_100000210545_100000214689 [0,2,0,0,0,0|2,0,0]=4 19016 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Br 1626a_100000210545_100000214689 [0,2,0,0,0,0|2,0,0]=4 19017 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Br 240690a_100000210545_100000214689 [0,2,0,0,0,0|2,0,0]=4 19018 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Br 527a_100000210545_100000214689 [0,2,0,0,0,0|2,0,0]=4 19019 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Cl 11a_100000210545_100000212326 [0,2,0,0,0,0|2,0,0]=4 19020 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Cl 1626a_100000210545_100000212326 [0,2,0,0,0,0|2,0,0]=4 19021 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Cl 240690a_100000210545_100000212326 [0,2,0,0,0,0|2,0,0]=4 19022 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)Cl 527a_100000210545_100000212326 [0,2,0,0,0,0|2,0,0]=4 19023 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)F 11a_100000210545_100000211022 [0,2,0,0,0,0|2,0,0]=4 19024 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)F 1626a_100000210545_100000211022 [0,2,0,0,0,0|2,0,0]=4 19025 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)F 240690a_100000210545_100000211022 [0,2,0,0,0,0|2,0,0]=4 19026 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)F 527a_100000210545_100000211022 [0,2,0,0,0,0|2,0,0]=4 19027 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)I 11a_100000210545_100000037189 [0,2,0,0,0,0|2,0,0]=4 19028 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)I 1626a_100000210545_100000037189 [0,2,0,0,0,0|2,0,0]=4 19029 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)I 240690a_100000210545_100000037189 [0,2,0,0,0,0|2,0,0]=4 19030 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)I 527a_100000210545_100000037189 [0,2,0,0,0,0|2,0,0]=4 19031 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)O 240690a_100000210545_100000689029 [0,2,0,0,0,0|2,0,0]=4 19032 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1F)O 527a_100000210545_100000689029 [0,2,0,0,0,0|2,0,0]=4 19033 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Br 11a_100000210545_100000751167 [0,2,0,0,0,0|2,0,0]=4 19034 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Br 1626a_100000210545_100000751167 [0,2,0,0,0,0|2,0,0]=4 19035 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Br 240690a_100000210545_100000751167 [0,2,0,0,0,0|2,0,0]=4 19036 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Br 527a_100000210545_100000751167 [0,2,0,0,0,0|2,0,0]=4 19037 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Cl 11a_100000210545_100000739380 [0,2,0,0,0,0|2,0,0]=4 19038 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Cl 1626a_100000210545_100000739380 [0,2,0,0,0,0|2,0,0]=4 19039 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Cl 240690a_100000210545_100000739380 [0,2,0,0,0,0|2,0,0]=4 19040 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)Cl 527a_100000210545_100000739380 [0,2,0,0,0,0|2,0,0]=4 19041 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)F 11a_100000210545_100000739341 [0,2,0,0,0,0|2,0,0]=4 19042 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)F 1626a_100000210545_100000739341 [0,2,0,0,0,0|2,0,0]=4 19043 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)F 240690a_100000210545_100000739341 [0,2,0,0,0,0|2,0,0]=4 19044 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1I)F 527a_100000210545_100000739341 [0,2,0,0,0,0|2,0,0]=4 19045 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)Br 240690a_100000210545_100000744433 [0,2,0,0,0,0|1,0,0]=3 19046 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)Br 527a_100000210545_100000744433 [0,2,0,0,0,0|1,0,0]=3 19047 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)Cl 11a_100000210545_100000188622 [0,2,0,0,0,0|1,0,0]=3 19048 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)Cl 240690a_100000210545_100000188622 [0,2,0,0,0,0|1,0,0]=3 19049 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)Cl 527a_100000210545_100000188622 [0,2,0,0,0,0|1,0,0]=3 19050 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)F 240690a_100000210545_100000746061 [0,2,0,0,0,0|1,0,0]=3 19051 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)F 527a_100000210545_100000746061 [0,2,0,0,0,0|1,0,0]=3 19052 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)I 240690a_100000210545_100000091984 [0,2,0,0,0,0|1,0,0]=3 19053 B16R1.11442 CC(C)CCNC(=O)c1ccc(cc1O)I 527a_100000210545_100000091984 [0,2,0,0,0,0|1,0,0]=3 19054 B16R1.11442 CC(C)CNCC(=O)c1ccc(cc1O)F 34a_100000210953_100009817053 [0,2,0,0,0,0|2,0,0]=4 19055 B16R1.11442 CC(C)CNCC(=O)c1ccc(cc1O)O 34a_100000210953_100009814262 [0,2,0,0,0,0|2,0,0]=4 19056 B16R1.11442 CC(C)CNNC(=O)c1ccc(cc1O)Br 22a_100000696102_100000744433 [0,2,0,0,0,0|2,0,0]=4 19057 B16R1.11442 CC(C)CNNC(=O)c1ccc(cc1O)Cl 22a_100000696102_100000188622 [0,2,0,0,0,0|2,0,0]=4 19058 B16R1.11442 CC(C)CNNC(=O)c1ccc(cc1O)F 22a_100000696102_100000746061 [0,2,0,0,0,0|2,0,0]=4 19059 B16R1.11442 CC(C)CNNC(=O)c1ccc(cc1O)I 22a_100000696102_100000091984 [0,2,0,0,0,0|2,0,0]=4 19060 B16R1.11442 CC(C)CNNC(=O)c1ccc(cc1O)O 22a_100000696102_100000212172 [0,2,0,0,0,0|2,0,0]=4 19061 B16R1.11442 CC(C)COCC(=O)c1ccc(cc1O)F 34a_100000210257_100009817053 [0,2,0,0,0,0|2,0,0]=4 19062 B16R1.11442 CC(C)COCC(=O)c1ccc(cc1O)O 34a_100000210257_100009814262 [0,2,0,0,0,0|2,0,0]=4 19063 B16R1.11442 CC(C)CSCC(=O)c1ccc(cc1O)F 62a_100000210624_100009817053 [0,2,0,0,0,0|2,0,0]=4 19064 B16R1.11442 CC(C)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000210760 [0,2,0,0,0,0|2,0,0]=4 19065 B16R1.11442 CC(C)CSCC(=O)c1ccc(cc1O)O 62a_100000210624_100009814262 [0,2,0,0,0,0|2,0,0]=4 19066 B16R1.11442 CC(C)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000210760 [0,2,0,0,0,0|2,0,0]=4 19067 B16R1.11442 CC(C)NCOC(=O)c1ccc(cc1Cl)Cl 2230a_100138425928_100010978946 [0,2,0,0,0,0|2,0,0]=4 19068 B16R1.11442 CC(C)OCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000211751 [0,2,0,0,0,0|2,0,0]=4 19069 B16R1.11442 CC(C)OCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000211751 [0,2,0,0,0,0|2,0,0]=4 19070 B16R1.11442 CC(C)OCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000211751 [0,2,0,0,0,0|2,0,0]=4 19071 B16R1.11442 CC(C)OCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000211751 [0,2,0,0,0,0|2,0,0]=4 19072 B16R1.11442 CC(C)OCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000211751 [0,2,0,0,0,0|2,0,0]=4 19073 B16R1.11442 CC(C)SCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000730970 [0,2,0,0,0,0|2,0,0]=4 19074 B16R1.11442 CC(C)SCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000730970 [0,2,0,0,0,0|2,0,0]=4 19075 B16R1.11442 CC(C)SCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000730970 [0,2,0,0,0,0|2,0,0]=4 19076 B16R1.11442 CC(C)SCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000730970 [0,2,0,0,0,0|2,0,0]=4 19077 B16R1.11442 CC(C)SCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000730970 [0,2,0,0,0,0|2,0,0]=4 19078 B16R1.11442 CC(C)SCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_100000210206 [0,2,0,0,0,0|2,0,0]=4 19079 B16R1.11442 CC(F)COCC(=O)c1ccc(cc1O)F 34a_100015925927_100009817053 [0,2,0,0,0,0|2,0,0]=4 19080 B16R1.11442 CC(F)COCC(=O)c1ccc(cc1O)O 34a_100015925927_100009814262 [0,2,0,0,0,0|2,0,0]=4 19081 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000718107 [0,2,0,0,0,0|2,0,0]=4 19082 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000718107 [0,2,0,0,0,0|2,0,0]=4 19083 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000718107 [0,2,0,0,0,0|2,0,0]=4 19084 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000718107 [0,2,0,0,0,0|2,0,0]=4 19085 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000718107 [0,2,0,0,0,0|2,0,0]=4 19086 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000718107 [0,2,0,0,0,0|2,0,0]=4 19087 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000718107 [0,2,0,0,0,0|2,0,0]=4 19088 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000718107 [0,2,0,0,0,0|2,0,0]=4 19089 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000718107 [0,2,0,0,0,0|2,0,0]=4 19090 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000718107 [0,2,0,0,0,0|2,0,0]=4 19091 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000718107 [0,2,0,0,0,0|2,0,0]=4 19092 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000718107 [0,2,0,0,0,0|2,0,0]=4 19093 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_200000718107 [0,2,0,0,0,0|2,0,0]=4 19094 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_200000718107 [0,2,0,0,0,0|2,0,0]=4 19095 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_200000718107 [0,2,0,0,0,0|2,0,0]=4 19096 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000718107 [0,2,0,0,0,0|2,0,0]=4 19097 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000718107 [0,2,0,0,0,0|2,0,0]=4 19098 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_200000718107 [0,2,0,0,0,0|2,0,0]=4 19099 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000718107 [0,2,0,0,0,0|1,0,0]=3 19100 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000718107 [0,2,0,0,0,0|1,0,0]=3 19101 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_200000718107 [0,2,0,0,0,0|1,0,0]=3 19102 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_200000718107 [0,2,0,0,0,0|1,0,0]=3 19103 B16R1.11442 CC(O)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_200000718107 [0,2,0,0,0,0|1,0,0]=3 19104 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)Br 240690a_200000755665_100000762965 [0,2,0,0,0,0|2,0,0]=4 19105 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)Br 527a_200000755665_100000762965 [0,2,0,0,0,0|2,0,0]=4 19106 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)Cl 240690a_200000755665_100000766353 [0,2,0,0,0,0|2,0,0]=4 19107 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)Cl 527a_200000755665_100000766353 [0,2,0,0,0,0|2,0,0]=4 19108 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)F 240690a_200000755665_100000212304 [0,2,0,0,0,0|2,0,0]=4 19109 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)F 527a_200000755665_100000212304 [0,2,0,0,0,0|2,0,0]=4 19110 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)I 240690a_200000755665_100012360512 [0,2,0,0,0,0|2,0,0]=4 19111 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)I 527a_200000755665_100012360512 [0,2,0,0,0,0|2,0,0]=4 19112 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)O 240690a_200000755665_100012344906 [0,2,0,0,0,0|2,0,0]=4 19113 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Br)O 527a_200000755665_100012344906 [0,2,0,0,0,0|2,0,0]=4 19114 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)Br 240690a_200000755665_100000741628 [0,2,0,0,0,0|2,0,0]=4 19115 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)Br 527a_200000755665_100000741628 [0,2,0,0,0,0|2,0,0]=4 19116 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)Cl 240690a_200000755665_100000185840 [0,2,0,0,0,0|2,0,0]=4 19117 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)Cl 527a_200000755665_100000185840 [0,2,0,0,0,0|2,0,0]=4 19118 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)F 240690a_200000755665_100000211397 [0,2,0,0,0,0|2,0,0]=4 19119 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)F 527a_200000755665_100000211397 [0,2,0,0,0,0|2,0,0]=4 19120 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)I 240690a_200000755665_100000751301 [0,2,0,0,0,0|2,0,0]=4 19121 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)I 527a_200000755665_100000751301 [0,2,0,0,0,0|2,0,0]=4 19122 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)O 240690a_200000755665_100000702456 [0,2,0,0,0,0|2,0,0]=4 19123 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1Cl)O 527a_200000755665_100000702456 [0,2,0,0,0,0|2,0,0]=4 19124 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)Br 240690a_200000755665_100000214689 [0,2,0,0,0,0|2,0,0]=4 19125 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)Br 527a_200000755665_100000214689 [0,2,0,0,0,0|2,0,0]=4 19126 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)Cl 240690a_200000755665_100000212326 [0,2,0,0,0,0|2,0,0]=4 19127 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)Cl 527a_200000755665_100000212326 [0,2,0,0,0,0|2,0,0]=4 19128 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)F 240690a_200000755665_100000211022 [0,2,0,0,0,0|2,0,0]=4 19129 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)F 527a_200000755665_100000211022 [0,2,0,0,0,0|2,0,0]=4 19130 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)I 240690a_200000755665_100000037189 [0,2,0,0,0,0|2,0,0]=4 19131 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)I 527a_200000755665_100000037189 [0,2,0,0,0,0|2,0,0]=4 19132 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)O 240690a_200000755665_100000689029 [0,2,0,0,0,0|2,0,0]=4 19133 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1F)O 527a_200000755665_100000689029 [0,2,0,0,0,0|2,0,0]=4 19134 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1I)Br 240690a_200000755665_100000751167 [0,2,0,0,0,0|2,0,0]=4 19135 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1I)Br 527a_200000755665_100000751167 [0,2,0,0,0,0|2,0,0]=4 19136 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1I)Cl 240690a_200000755665_100000739380 [0,2,0,0,0,0|2,0,0]=4 19137 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1I)Cl 527a_200000755665_100000739380 [0,2,0,0,0,0|2,0,0]=4 19138 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1I)F 240690a_200000755665_100000739341 [0,2,0,0,0,0|2,0,0]=4 19139 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1I)F 527a_200000755665_100000739341 [0,2,0,0,0,0|2,0,0]=4 19140 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Br 240690a_200000755665_100000744433 [0,2,0,0,0,0|1,0,0]=3 19141 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Br 527a_200000755665_100000744433 [0,2,0,0,0,0|1,0,0]=3 19142 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Cl 240690a_200000755665_100000188622 [0,2,0,0,0,0|1,0,0]=3 19143 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)Cl 527a_200000755665_100000188622 [0,2,0,0,0,0|1,0,0]=3 19144 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)F 240690a_200000755665_100000746061 [0,2,0,0,0,0|1,0,0]=3 19145 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)F 527a_200000755665_100000746061 [0,2,0,0,0,0|1,0,0]=3 19146 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)I 240690a_200000755665_100000091984 [0,2,0,0,0,0|1,0,0]=3 19147 B16R1.11442 CC(O)CCNC(=O)c1ccc(cc1O)I 527a_200000755665_100000091984 [0,2,0,0,0,0|1,0,0]=3 19148 B16R1.11442 CC(O)CNCC(=O)c1ccc(cc1O)F 34a_100000210904_100009817053 [0,2,0,0,0,0|2,0,0]=4 19149 B16R1.11442 CC(O)CNCC(=O)c1ccc(cc1O)O 34a_100000210904_100009814262 [0,2,0,0,0,0|2,0,0]=4 19150 B16R1.11442 CC(O)CNNC(=O)c1ccc(cc1O)Br 22a_200000730056_100000744433 [0,2,0,0,0,0|2,0,0]=4 19151 B16R1.11442 CC(O)CNNC(=O)c1ccc(cc1O)Cl 22a_200000730056_100000188622 [0,2,0,0,0,0|2,0,0]=4 19152 B16R1.11442 CC(O)CNNC(=O)c1ccc(cc1O)F 22a_200000730056_100000746061 [0,2,0,0,0,0|2,0,0]=4 19153 B16R1.11442 CC(O)CNNC(=O)c1ccc(cc1O)I 22a_200000730056_100000091984 [0,2,0,0,0,0|2,0,0]=4 19154 B16R1.11442 CC(O)CNNC(=O)c1ccc(cc1O)O 22a_200000730056_100000212172 [0,2,0,0,0,0|2,0,0]=4 19155 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100011218427 [0,2,0,0,0,0|2,0,0]=4 19156 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)F 62a_100011218427_100009817053 [0,2,0,0,0,0|2,0,0]=4 19157 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100011218427 [0,2,0,0,0,0|2,0,0]=4 19158 B16R1.11442 CC(O)CSCC(=O)c1ccc(cc1O)O 62a_100011218427_100009814262 [0,2,0,0,0,0|2,0,0]=4 19159 B16R1.11442 CN(C)CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000695564 [0,2,0,0,0,0|2,0,0]=4 19160 B16R1.11442 CN(C)CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000695564 [0,2,0,0,0,0|2,0,0]=4 19161 B16R1.11442 CN(C)CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000695564 [0,2,0,0,0,0|2,0,0]=4 19162 B16R1.11442 CN(C)CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000695564 [0,2,0,0,0,0|2,0,0]=4 19163 B16R1.11442 CN(C)CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000695564 [0,2,0,0,0,0|2,0,0]=4 19164 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)Br 240690a_100000210585_100000744433 [0,2,0,0,0,0|2,0,0]=4 19165 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)Br 527a_100000210585_100000744433 [0,2,0,0,0,0|2,0,0]=4 19166 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)Cl 240690a_100000210585_100000188622 [0,2,0,0,0,0|2,0,0]=4 19167 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)Cl 527a_100000210585_100000188622 [0,2,0,0,0,0|2,0,0]=4 19168 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)F 240690a_100000210585_100000746061 [0,2,0,0,0,0|2,0,0]=4 19169 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)F 527a_100000210585_100000746061 [0,2,0,0,0,0|2,0,0]=4 19170 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)I 240690a_100000210585_100000091984 [0,2,0,0,0,0|2,0,0]=4 19171 B16R1.11442 CN(C)CCNC(=O)c1ccc(cc1O)I 527a_100000210585_100000091984 [0,2,0,0,0,0|2,0,0]=4 19172 B16R1.11442 C[C@@H](Cl)COCC(=O)c1ccc(cc1O)F 34a_100016084084_100009817053 [0,2,0,0,0,0|2,0,0]=4 19173 B16R1.11442 C[C@@H](Cl)COCC(=O)c1ccc(cc1O)O 34a_100016084084_100009814262 [0,2,0,0,0,0|2,0,0]=4 19174 B16R1.11442 C[C@@H](N)COCC(=O)c1ccc(cc1O)F 34a_100000737577_100009817053 [0,2,0,0,0,0|2,0,0]=4 19175 B16R1.11442 C[C@@H](N)COCC(=O)c1ccc(cc1O)O 34a_100000737577_100009814262 [0,2,0,0,0,0|2,0,0]=4 19176 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)F 62a_100009817053_100009817552 [0,2,0,0,0,0|2,0,0]=4 19177 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)F 62a_100009817552_100009817053 [0,2,0,0,0,0|2,0,0]=4 19178 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)O 62a_100009814262_100009817552 [0,2,0,0,0,0|2,0,0]=4 19179 B16R1.11442 C[C@@H](O)CSCC(=O)c1ccc(cc1O)O 62a_100009817552_100009814262 [0,2,0,0,0,0|2,0,0]=4 19180 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)C)Br 1458a_100000741311_100011214892 [0,2,0,0,0,0|2,0,0]=4 19181 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)C)Cl 1458a_100000688705_100011214892 [0,2,0,0,0,0|2,0,0]=4 19182 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)C)F 1458a_100000686989_100011214892 [0,2,0,0,0,0|2,0,0]=4 19183 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)C)I 1458a_100010189873_100011214892 [0,2,0,0,0,0|2,0,0]=4 19184 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)C)O 1458a_100000692822_100011214892 [0,2,0,0,0,0|2,0,0]=4 19185 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)O)Br 1458a_100000741311_200000718107 [0,2,0,0,0,0|2,0,0]=4 19186 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)O)Cl 1458a_100000688705_200000718107 [0,2,0,0,0,0|2,0,0]=4 19187 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)O)F 1458a_100000686989_200000718107 [0,2,0,0,0,0|2,0,0]=4 19188 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)O)I 1458a_100010189873_200000718107 [0,2,0,0,0,0|2,0,0]=4 19189 B16R1.11442 Cc1cc(ccc1C(=O)CCCC(C)O)O 1458a_100000692822_200000718107 [0,2,0,0,0,0|2,0,0]=4 19190 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Br 11a_100000210545_100000741311 [0,2,0,0,0,0|2,0,0]=4 19191 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Br 1626a_100000210545_100000741311 [0,2,0,0,0,0|2,0,0]=4 19192 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Br 240690a_100000210545_100000741311 [0,2,0,0,0,0|2,0,0]=4 19193 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Br 527a_100000210545_100000741311 [0,2,0,0,0,0|2,0,0]=4 19194 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Cl 11a_100000210545_100000688705 [0,2,0,0,0,0|2,0,0]=4 19195 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000688705 [0,2,0,0,0,0|2,0,0]=4 19196 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000688705 [0,2,0,0,0,0|2,0,0]=4 19197 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)Cl 527a_100000210545_100000688705 [0,2,0,0,0,0|2,0,0]=4 19198 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)F 11a_100000210545_100000686989 [0,2,0,0,0,0|2,0,0]=4 19199 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)F 1626a_100000210545_100000686989 [0,2,0,0,0,0|2,0,0]=4 19200 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)F 240690a_100000210545_100000686989 [0,2,0,0,0,0|2,0,0]=4 19201 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)F 527a_100000210545_100000686989 [0,2,0,0,0,0|2,0,0]=4 19202 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)I 11a_100000210545_100010189873 [0,2,0,0,0,0|2,0,0]=4 19203 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)I 1626a_100000210545_100010189873 [0,2,0,0,0,0|2,0,0]=4 19204 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)I 240690a_100000210545_100010189873 [0,2,0,0,0,0|2,0,0]=4 19205 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)I 527a_100000210545_100010189873 [0,2,0,0,0,0|2,0,0]=4 19206 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)O 240690a_100000210545_100000692822 [0,2,0,0,0,0|2,0,0]=4 19207 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)C)O 527a_100000210545_100000692822 [0,2,0,0,0,0|2,0,0]=4 19208 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)Br 240690a_200000755665_100000741311 [0,2,0,0,0,0|2,0,0]=4 19209 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)Br 527a_200000755665_100000741311 [0,2,0,0,0,0|2,0,0]=4 19210 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)Cl 240690a_200000755665_100000688705 [0,2,0,0,0,0|2,0,0]=4 19211 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)Cl 527a_200000755665_100000688705 [0,2,0,0,0,0|2,0,0]=4 19212 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)F 240690a_200000755665_100000686989 [0,2,0,0,0,0|2,0,0]=4 19213 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)F 527a_200000755665_100000686989 [0,2,0,0,0,0|2,0,0]=4 19214 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)I 240690a_200000755665_100010189873 [0,2,0,0,0,0|2,0,0]=4 19215 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)I 527a_200000755665_100010189873 [0,2,0,0,0,0|2,0,0]=4 19216 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)O 240690a_200000755665_100000692822 [0,2,0,0,0,0|2,0,0]=4 19217 B16R1.11442 Cc1cc(ccc1C(=O)NCCC(C)O)O 527a_200000755665_100000692822 [0,2,0,0,0,0|2,0,0]=4 19218 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)CCCC(C)C 1458a_100000685072_100011214892 [0,2,0,0,0,0|2,0,0]=4 19219 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)CCCC(C)O 1458a_100000685072_200000718107 [0,2,0,0,0,0|2,0,0]=4 19220 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(C)C 11a_100000210545_100000685072 [0,2,0,0,0,0|2,0,0]=4 19221 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(C)C 1626a_100000210545_100000685072 [0,2,0,0,0,0|2,0,0]=4 19222 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(C)C 240690a_100000210545_100000685072 [0,2,0,0,0,0|2,0,0]=4 19223 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(C)C 527a_100000210545_100000685072 [0,2,0,0,0,0|2,0,0]=4 19224 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(C)O 240690a_200000755665_100000685072 [0,2,0,0,0,0|2,0,0]=4 19225 B16R1.11442 Cc1ccc(c(c1)Br)C(=O)NCCC(C)O 527a_200000755665_100000685072 [0,2,0,0,0,0|2,0,0]=4 19226 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CCCC(C)C 1458a_100000211164_100011214892 [0,2,0,0,0,0|2,0,0]=4 19227 B16R1.11442 Cc1ccc(c(c1)C)C(=O)CCCC(C)O 1458a_100000211164_200000718107 [0,2,0,0,0,0|2,0,0]=4 19228 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(C)C 11a_100000210545_100000211164 [0,2,0,0,0,0|2,0,0]=4 19229 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(C)C 1626a_100000210545_100000211164 [0,2,0,0,0,0|2,0,0]=4 19230 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(C)C 240690a_100000210545_100000211164 [0,2,0,0,0,0|2,0,0]=4 19231 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(C)C 527a_100000210545_100000211164 [0,2,0,0,0,0|2,0,0]=4 19232 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(C)O 240690a_200000755665_100000211164 [0,2,0,0,0,0|2,0,0]=4 19233 B16R1.11442 Cc1ccc(c(c1)C)C(=O)NCCC(C)O 527a_200000755665_100000211164 [0,2,0,0,0,0|2,0,0]=4 19234 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)CCCC(C)C 1458a_100000766932_100011214892 [0,2,0,0,0,0|2,0,0]=4 19235 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)CCCC(C)O 1458a_100000766932_200000718107 [0,2,0,0,0,0|2,0,0]=4 19236 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(C)C 11a_100000210545_100000766932 [0,2,0,0,0,0|2,0,0]=4 19237 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(C)C 1626a_100000210545_100000766932 [0,2,0,0,0,0|2,0,0]=4 19238 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(C)C 240690a_100000210545_100000766932 [0,2,0,0,0,0|2,0,0]=4 19239 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(C)C 527a_100000210545_100000766932 [0,2,0,0,0,0|2,0,0]=4 19240 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(C)O 240690a_200000755665_100000766932 [0,2,0,0,0,0|2,0,0]=4 19241 B16R1.11442 Cc1ccc(c(c1)Cl)C(=O)NCCC(C)O 527a_200000755665_100000766932 [0,2,0,0,0,0|2,0,0]=4 19242 B16R1.11442 Cc1ccc(c(c1)F)C(=O)CCCC(C)C 1458a_100000766033_100011214892 [0,2,0,0,0,0|2,0,0]=4 19243 B16R1.11442 Cc1ccc(c(c1)F)C(=O)CCCC(C)O 1458a_100000766033_200000718107 [0,2,0,0,0,0|2,0,0]=4 19244 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(C)C 11a_100000210545_100000766033 [0,2,0,0,0,0|2,0,0]=4 19245 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(C)C 1626a_100000210545_100000766033 [0,2,0,0,0,0|2,0,0]=4 19246 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(C)C 240690a_100000210545_100000766033 [0,2,0,0,0,0|2,0,0]=4 19247 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(C)C 527a_100000210545_100000766033 [0,2,0,0,0,0|2,0,0]=4 19248 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(C)O 240690a_200000755665_100000766033 [0,2,0,0,0,0|2,0,0]=4 19249 B16R1.11442 Cc1ccc(c(c1)F)C(=O)NCCC(C)O 527a_200000755665_100000766033 [0,2,0,0,0,0|2,0,0]=4 19250 B16R1.11442 Cc1ccc(c(c1)I)C(=O)CCCC(C)C 1458a_100009999607_100011214892 [0,2,0,0,0,0|2,0,0]=4 19251 B16R1.11442 Cc1ccc(c(c1)I)C(=O)CCCC(C)O 1458a_100009999607_200000718107 [0,2,0,0,0,0|2,0,0]=4 19252 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(C)C 11a_100000210545_100009999607 [0,2,0,0,0,0|2,0,0]=4 19253 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(C)C 1626a_100000210545_100009999607 [0,2,0,0,0,0|2,0,0]=4 19254 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(C)C 240690a_100000210545_100009999607 [0,2,0,0,0,0|2,0,0]=4 19255 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(C)C 527a_100000210545_100009999607 [0,2,0,0,0,0|2,0,0]=4 19256 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(C)O 240690a_200000755665_100009999607 [0,2,0,0,0,0|2,0,0]=4 19257 B16R1.11442 Cc1ccc(c(c1)I)C(=O)NCCC(C)O 527a_200000755665_100009999607 [0,2,0,0,0,0|2,0,0]=4 19258 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCCC(C)C 1458a_100000212137_100011214892 [0,2,0,0,0,0|1,0,0]=3 19259 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCCC(C)O 1458a_100000212137_200000718107 [0,2,0,0,0,0|1,0,0]=3 19260 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCCN(C)C 1458a_100000212137_100000695564 [0,2,0,0,0,0|2,0,0]=4 19261 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCOC(C)C 1458a_100000212137_100000211751 [0,2,0,0,0,0|2,0,0]=4 19262 B16R1.11442 Cc1ccc(c(c1)O)C(=O)CCSC(C)C 1458a_100000212137_100000730970 [0,2,0,0,0,0|2,0,0]=4 19263 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)C 1626a_100000210545_100000212137 [0,2,0,0,0,0|1,0,0]=3 19264 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)C 240690a_100000210545_100000212137 [0,2,0,0,0,0|1,0,0]=3 19265 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)C 527a_100000210545_100000212137 [0,2,0,0,0,0|1,0,0]=3 19266 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)O 240690a_200000755665_100000212137 [0,2,0,0,0,0|1,0,0]=3 19267 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCC(C)O 527a_200000755665_100000212137 [0,2,0,0,0,0|1,0,0]=3 19268 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCN(C)C 240690a_100000210585_100000212137 [0,2,0,0,0,0|2,0,0]=4 19269 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NCCN(C)C 527a_100000210585_100000212137 [0,2,0,0,0,0|2,0,0]=4 19270 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NNCC(C)C 22a_100000696102_100000212137 [0,2,0,0,0,0|2,0,0]=4 19271 B16R1.11442 Cc1ccc(c(c1)O)C(=O)NNCC(C)O 22a_200000730056_100000212137 [0,2,0,0,0,0|2,0,0]=4 19272 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_100000210326 [0,2,0,0,0,0|2,0,0]=4 19273 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_100000210326 [0,2,0,0,0,0|2,0,0]=4 19274 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)C)F 1458a_100010768510_100000210326 [0,2,0,0,0,0|2,0,0]=4 19275 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100000210326 [0,2,0,0,0,0|2,0,0]=4 19276 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_100000210326 [0,2,0,0,0,0|2,0,0]=4 19277 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)F)C 1458a_100010204434_100000210326 [0,2,0,0,0,0|2,0,0]=4 19278 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_100000210326 [0,2,0,0,0,0|2,0,0]=4 19279 B16R1.21625 CCCCCC(=O)c1c(cc(cc1C)Br)C 1458a_100000739581_100000210326 [0,2,0,0,0,0|2,0,0]=4 19280 B16R1.21625 CCCCCC(=O)c1c(cc(cc1C)C)C 1458a_100000211658_100000210326 [0,2,0,0,0,0|2,0,0]=4 19281 B16R1.21625 CCCCCC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_100000210326 [0,2,0,0,0,0|2,0,0]=4 19282 B16R1.21625 CCCCCC(=O)c1c(cc(cc1C)F)C 1458a_100012017201_100000210326 [0,2,0,0,0,0|2,0,0]=4 19283 B16R1.21625 CCCCCC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_100000210326 [0,2,0,0,0,0|2,0,0]=4 19284 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_100000210326 [0,2,0,0,0,0|2,0,0]=4 19285 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_100000210326 [0,2,0,0,0,0|2,0,0]=4 19286 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_100000210326 [0,2,0,0,0,0|2,0,0]=4 19287 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_100000210326 [0,2,0,0,0,0|2,0,0]=4 19288 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100000210326 [0,2,0,0,0,0|2,0,0]=4 19289 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100000210326 [0,2,0,0,0,0|2,0,0]=4 19290 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_100000210326 [0,2,0,0,0,0|2,0,0]=4 19291 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_100000210326 [0,2,0,0,0,0|2,0,0]=4 19292 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_100000210326 [0,2,0,0,0,0|2,0,0]=4 19293 B16R1.21625 CCCCCC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_100000210326 [0,2,0,0,0,0|2,0,0]=4 19294 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)Br)C 1458a_100000708665_100000210326 [0,2,0,0,0,0|2,0,0]=4 19295 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_100000210326 [0,2,0,0,0,0|2,0,0]=4 19296 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000210326 [0,2,0,0,0,0|1,0,0]=3 19297 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)C)F 1458a_100009878570_100000210326 [0,2,0,0,0,0|2,0,0]=4 19298 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_100000210326 [0,2,0,0,0,0|2,0,0]=4 19299 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_100000210326 [0,2,0,0,0,0|2,0,0]=4 19300 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)F)F 1458a_100000751013_100000210326 [0,2,0,0,0,0|2,0,0]=4 19301 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000210326 [0,2,0,0,0,0|1,0,0]=3 19302 B16R1.21625 CCCCCC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_100000210326 [0,2,0,0,0,0|2,0,0]=4 19303 B16R1.21625 CCCCCC(=O)c1c(cc(cc1I)C)I 1458a_200010371430_100000210326 [0,2,0,0,0,0|2,0,0]=4 19304 B16R1.21625 CCCCCC(=O)c1c(cc(cc1I)F)C 1458a_200010371433_100000210326 [0,2,0,0,0,0|2,0,0]=4 19305 B16R1.21625 CCCCCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000210326 [0,2,0,0,0,0|1,0,0]=3 19306 B16R1.21625 CCCCCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000210326 [0,2,0,0,0,0|1,0,0]=3 19307 B16R1.21625 CCCCCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000210326 [0,2,0,0,0,0|1,0,0]=3 19308 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)Br 11a_100000102301_100011217931 [0,2,0,0,0,0|2,0,0]=4 19309 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)Br 240690a_100000102301_100011217931 [0,2,0,0,0,0|2,0,0]=4 19310 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)Br 527a_100000102301_100011217931 [0,2,0,0,0,0|2,0,0]=4 19311 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)F 11a_100000102301_100009813784 [0,2,0,0,0,0|2,0,0]=4 19312 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)F 1626a_100000102301_100009813784 [0,2,0,0,0,0|2,0,0]=4 19313 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)F 240690a_100000102301_100009813784 [0,2,0,0,0,0|2,0,0]=4 19314 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Br)F 527a_100000102301_100009813784 [0,2,0,0,0,0|2,0,0]=4 19315 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)C)F 11a_100000102301_100010768510 [0,2,0,0,0,0|2,0,0]=4 19316 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)C)F 1626a_100000102301_100010768510 [0,2,0,0,0,0|2,0,0]=4 19317 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)C)F 240690a_100000102301_100010768510 [0,2,0,0,0,0|2,0,0]=4 19318 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)C)F 527a_100000102301_100010768510 [0,2,0,0,0,0|2,0,0]=4 19319 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Cl)F 11a_100000102301_100010244364 [0,2,0,0,0,0|2,0,0]=4 19320 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100000102301_100010244364 [0,2,0,0,0,0|2,0,0]=4 19321 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100000102301_100010244364 [0,2,0,0,0,0|2,0,0]=4 19322 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)Cl)F 527a_100000102301_100010244364 [0,2,0,0,0,0|2,0,0]=4 19323 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)Br 11a_100000102301_200015320377 [0,2,0,0,0,0|2,0,0]=4 19324 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)Br 1626a_100000102301_200015320377 [0,2,0,0,0,0|2,0,0]=4 19325 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)Br 240690a_100000102301_200015320377 [0,2,0,0,0,0|2,0,0]=4 19326 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)Br 527a_100000102301_200015320377 [0,2,0,0,0,0|2,0,0]=4 19327 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)C 11a_100000102301_100010204434 [0,2,0,0,0,0|2,0,0]=4 19328 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)C 1626a_100000102301_100010204434 [0,2,0,0,0,0|2,0,0]=4 19329 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)C 240690a_100000102301_100010204434 [0,2,0,0,0,0|2,0,0]=4 19330 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)C 527a_100000102301_100010204434 [0,2,0,0,0,0|2,0,0]=4 19331 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)F 11a_100000102301_100013316034 [0,2,0,0,0,0|2,0,0]=4 19332 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)F 1626a_100000102301_100013316034 [0,2,0,0,0,0|2,0,0]=4 19333 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)F 240690a_100000102301_100013316034 [0,2,0,0,0,0|2,0,0]=4 19334 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Br)F)F 527a_100000102301_100013316034 [0,2,0,0,0,0|2,0,0]=4 19335 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)Br)C 11a_100000102301_100000739581 [0,2,0,0,0,0|2,0,0]=4 19336 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)Br)C 1626a_100000102301_100000739581 [0,2,0,0,0,0|2,0,0]=4 19337 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)Br)C 240690a_100000102301_100000739581 [0,2,0,0,0,0|2,0,0]=4 19338 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)C)C 11a_100000102301_100000211658 [0,2,0,0,0,0|2,0,0]=4 19339 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)C)C 1626a_100000102301_100000211658 [0,2,0,0,0,0|2,0,0]=4 19340 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)C)C 240690a_100000102301_100000211658 [0,2,0,0,0,0|2,0,0]=4 19341 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)Cl)C 11a_100000102301_100000088873 [0,2,0,0,0,0|2,0,0]=4 19342 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)Cl)C 1626a_100000102301_100000088873 [0,2,0,0,0,0|2,0,0]=4 19343 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)Cl)C 240690a_100000102301_100000088873 [0,2,0,0,0,0|2,0,0]=4 19344 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)F)C 11a_100000102301_100012017201 [0,2,0,0,0,0|2,0,0]=4 19345 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)F)C 1626a_100000102301_100012017201 [0,2,0,0,0,0|2,0,0]=4 19346 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)F)C 240690a_100000102301_100012017201 [0,2,0,0,0,0|2,0,0]=4 19347 B16R1.21625 CCCCNC(=O)c1c(cc(cc1C)O)C 240690a_100000102301_100000066486 [0,2,0,0,0,0|2,0,0]=4 19348 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)C 11a_100000102301_100000698028 [0,2,0,0,0,0|2,0,0]=4 19349 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)C 1626a_100000102301_100000698028 [0,2,0,0,0,0|2,0,0]=4 19350 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)C 240690a_100000102301_100000698028 [0,2,0,0,0,0|2,0,0]=4 19351 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)Cl 11a_100000102301_100012360385 [0,2,0,0,0,0|2,0,0]=4 19352 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)Cl 1626a_100000102301_100012360385 [0,2,0,0,0,0|2,0,0]=4 19353 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)Cl 240690a_100000102301_100012360385 [0,2,0,0,0,0|2,0,0]=4 19354 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)F 11a_100000102301_100010078411 [0,2,0,0,0,0|2,0,0]=4 19355 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)F 1626a_100000102301_100010078411 [0,2,0,0,0,0|2,0,0]=4 19356 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)F 240690a_100000102301_100010078411 [0,2,0,0,0,0|2,0,0]=4 19357 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Br)F 527a_100000102301_100010078411 [0,2,0,0,0,0|2,0,0]=4 19358 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)C)Cl 11a_100000102301_100009989429 [0,2,0,0,0,0|2,0,0]=4 19359 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)C)Cl 1626a_100000102301_100009989429 [0,2,0,0,0,0|2,0,0]=4 19360 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)C)Cl 240690a_100000102301_100009989429 [0,2,0,0,0,0|2,0,0]=4 19361 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)C)Cl 527a_100000102301_100009989429 [0,2,0,0,0,0|2,0,0]=4 19362 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)Cl 11a_100000102301_100011215713 [0,2,0,0,0,0|2,0,0]=4 19363 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100000102301_100011215713 [0,2,0,0,0,0|2,0,0]=4 19364 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100000102301_100011215713 [0,2,0,0,0,0|2,0,0]=4 19365 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)F 11a_100000102301_100010068318 [0,2,0,0,0,0|2,0,0]=4 19366 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100000102301_100010068318 [0,2,0,0,0,0|2,0,0]=4 19367 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100000102301_100010068318 [0,2,0,0,0,0|2,0,0]=4 19368 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100000102301_100010068318 [0,2,0,0,0,0|2,0,0]=4 19369 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)Cl 11a_100000102301_100000703918 [0,2,0,0,0,0|2,0,0]=4 19370 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)Cl 1626a_100000102301_100000703918 [0,2,0,0,0,0|2,0,0]=4 19371 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)Cl 240690a_100000102301_100000703918 [0,2,0,0,0,0|2,0,0]=4 19372 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)F 11a_100000102301_100000119028 [0,2,0,0,0,0|2,0,0]=4 19373 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)F 1626a_100000102301_100000119028 [0,2,0,0,0,0|2,0,0]=4 19374 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)F 240690a_100000102301_100000119028 [0,2,0,0,0,0|2,0,0]=4 19375 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)F)F 527a_100000102301_100000119028 [0,2,0,0,0,0|2,0,0]=4 19376 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)I)Cl 11a_100000102301_100010740244 [0,2,0,0,0,0|2,0,0]=4 19377 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)I)Cl 1626a_100000102301_100010740244 [0,2,0,0,0,0|2,0,0]=4 19378 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)I)Cl 240690a_100000102301_100010740244 [0,2,0,0,0,0|2,0,0]=4 19379 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)I)Cl 527a_100000102301_100010740244 [0,2,0,0,0,0|2,0,0]=4 19380 B16R1.21625 CCCCNC(=O)c1c(cc(cc1Cl)O)Cl 240690a_100000102301_100010423397 [0,2,0,0,0,0|2,0,0]=4 19381 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)C 11a_100000102301_100000708665 [0,2,0,0,0,0|2,0,0]=4 19382 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)C 1626a_100000102301_100000708665 [0,2,0,0,0,0|2,0,0]=4 19383 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)C 240690a_100000102301_100000708665 [0,2,0,0,0,0|2,0,0]=4 19384 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)C 527a_100000102301_100000708665 [0,2,0,0,0,0|2,0,0]=4 19385 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)F 11a_100000102301_100000766946 [0,2,0,0,0,0|2,0,0]=4 19386 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)F 1626a_100000102301_100000766946 [0,2,0,0,0,0|2,0,0]=4 19387 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)F 240690a_100000102301_100000766946 [0,2,0,0,0,0|2,0,0]=4 19388 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)F 527a_100000102301_100000766946 [0,2,0,0,0,0|2,0,0]=4 19389 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Br)O 527a_100000102301_200015963038 [0,2,0,0,0,0|1,0,0]=3 19390 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)C)F 11a_100000102301_100009878570 [0,2,0,0,0,0|2,0,0]=4 19391 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)C)F 1626a_100000102301_100009878570 [0,2,0,0,0,0|2,0,0]=4 19392 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)C)F 240690a_100000102301_100009878570 [0,2,0,0,0,0|2,0,0]=4 19393 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)C)F 527a_100000102301_100009878570 [0,2,0,0,0,0|2,0,0]=4 19394 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)C 11a_100000102301_100010768517 [0,2,0,0,0,0|2,0,0]=4 19395 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)C 1626a_100000102301_100010768517 [0,2,0,0,0,0|2,0,0]=4 19396 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)C 240690a_100000102301_100010768517 [0,2,0,0,0,0|2,0,0]=4 19397 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)C 527a_100000102301_100010768517 [0,2,0,0,0,0|2,0,0]=4 19398 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)F 11a_100000102301_100000062413 [0,2,0,0,0,0|2,0,0]=4 19399 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)F 1626a_100000102301_100000062413 [0,2,0,0,0,0|2,0,0]=4 19400 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)F 240690a_100000102301_100000062413 [0,2,0,0,0,0|2,0,0]=4 19401 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)Cl)F 527a_100000102301_100000062413 [0,2,0,0,0,0|2,0,0]=4 19402 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)F)F 11a_100000102301_100000751013 [0,2,0,0,0,0|2,0,0]=4 19403 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)F)F 1626a_100000102301_100000751013 [0,2,0,0,0,0|2,0,0]=4 19404 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)F)F 240690a_100000102301_100000751013 [0,2,0,0,0,0|2,0,0]=4 19405 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)F)F 527a_100000102301_100000751013 [0,2,0,0,0,0|2,0,0]=4 19406 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)F)O 240690a_100000102301_100000746385 [0,2,0,0,0,0|1,0,0]=3 19407 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)F)O 527a_100000102301_100000746385 [0,2,0,0,0,0|1,0,0]=3 19408 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)O)F 240690a_100000102301_100000038755 [0,2,0,0,0,0|2,0,0]=4 19409 B16R1.21625 CCCCNC(=O)c1c(cc(cc1F)O)F 527a_100000102301_100000038755 [0,2,0,0,0,0|2,0,0]=4 19410 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)C)I 11a_100000102301_200010371430 [0,2,0,0,0,0|2,0,0]=4 19411 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)C)I 1626a_100000102301_200010371430 [0,2,0,0,0,0|2,0,0]=4 19412 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)C)I 240690a_100000102301_200010371430 [0,2,0,0,0,0|2,0,0]=4 19413 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)C)I 527a_100000102301_200010371430 [0,2,0,0,0,0|2,0,0]=4 19414 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)F)C 11a_100000102301_200010371433 [0,2,0,0,0,0|2,0,0]=4 19415 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)F)C 1626a_100000102301_200010371433 [0,2,0,0,0,0|2,0,0]=4 19416 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)F)C 240690a_100000102301_200010371433 [0,2,0,0,0,0|2,0,0]=4 19417 B16R1.21625 CCCCNC(=O)c1c(cc(cc1I)F)C 527a_100000102301_200010371433 [0,2,0,0,0,0|2,0,0]=4 19418 B16R1.21625 CCCCNC(=O)c1c(cc(cc1O)C)O 527a_100000102301_100000036929 [0,2,0,0,0,0|1,0,0]=3 19419 B16R1.21625 CCCCNC(=O)c1c(cc(cc1O)O)O 527a_100000102301_100000040092 [0,2,0,0,0,0|1,0,0]=3 19420 B16R1.21625 CCCNNC(=O)c1c(cc(cc1F)Br)O 22a_100000740057_200015963038 [0,2,0,0,0,0|2,0,0]=4 19421 B16R1.21625 CCCNNC(=O)c1c(cc(cc1O)C)C 22a_100000740057_100011255216 [0,2,0,0,0,0|2,0,0]=4 19422 B16R1.21625 CCOCCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100011215890 [0,2,0,0,0,0|2,0,0]=4 19423 B16R1.21625 CCOCCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100011215890 [0,2,0,0,0,0|2,0,0]=4 19424 B16R1.21625 CCOCCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100011215890 [0,2,0,0,0,0|2,0,0]=4 19425 B16R1.21625 CCOCCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100011215890 [0,2,0,0,0,0|2,0,0]=4 19426 B16R1.21625 CCOCCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100011215890 [0,2,0,0,0,0|2,0,0]=4 19427 B16R1.21625 CCSCCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000757381 [0,2,0,0,0,0|2,0,0]=4 19428 B16R1.21625 CCSCCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000757381 [0,2,0,0,0,0|2,0,0]=4 19429 B16R1.21625 CCSCCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000757381 [0,2,0,0,0,0|2,0,0]=4 19430 B16R1.21625 CCSCCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000757381 [0,2,0,0,0,0|2,0,0]=4 19431 B16R1.21625 CCSCCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000757381 [0,2,0,0,0,0|2,0,0]=4 19432 B16R1.21625 COCCCC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_100000740836 [0,2,0,0,0,0|2,0,0]=4 19433 B16R1.21625 COCCCC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_100000740836 [0,2,0,0,0,0|2,0,0]=4 19434 B16R1.21625 COCCCC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_100000740836 [0,2,0,0,0,0|2,0,0]=4 19435 B16R1.21625 COCCCC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_100000740836 [0,2,0,0,0,0|2,0,0]=4 19436 B16R1.21625 COCCCC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_100000740836 [0,2,0,0,0,0|2,0,0]=4 19437 B16R1.21625 COCCNC(=O)c1c(cc(cc1F)Br)O 527a_100000209980_200015963038 [0,2,0,0,0,0|2,0,0]=4 19438 B16R1.21625 COCCNC(=O)c1c(cc(cc1F)F)O 240690a_100000209980_100000746385 [0,2,0,0,0,0|2,0,0]=4 19439 B16R1.21625 COCCNC(=O)c1c(cc(cc1F)F)O 527a_100000209980_100000746385 [0,2,0,0,0,0|2,0,0]=4 19440 B16R1.21625 COCCNC(=O)c1c(cc(cc1O)C)O 527a_100000209980_100000036929 [0,2,0,0,0,0|2,0,0]=4 19441 B16R1.21625 COCCNC(=O)c1c(cc(cc1O)O)O 527a_100000209980_100000040092 [0,2,0,0,0,0|2,0,0]=4 19442 B16R1.21625 CSCCNC(=O)c1c(cc(cc1F)Br)O 527a_100020590264_200015963038 [0,2,0,0,0,0|2,0,0]=4 19443 B16R1.21625 CSCCNC(=O)c1c(cc(cc1F)F)O 240690a_100020590264_100000746385 [0,2,0,0,0,0|2,0,0]=4 19444 B16R1.21625 CSCCNC(=O)c1c(cc(cc1F)F)O 527a_100020590264_100000746385 [0,2,0,0,0,0|2,0,0]=4 19445 B16R1.21625 CSCCNC(=O)c1c(cc(cc1O)C)O 527a_100020590264_100000036929 [0,2,0,0,0,0|2,0,0]=4 19446 B16R1.21625 CSCCNC(=O)c1c(cc(cc1O)O)O 527a_100020590264_100000040092 [0,2,0,0,0,0|2,0,0]=4 19447 B16R1.21625 Cc1cc(c(c(c1)O)C(=O)CCCCF)C 1458a_100011255216_100000729493 [0,2,0,0,0,0|2,0,0]=4 19448 B16R1.21625 Cc1cc(c(c(c1)O)C(=O)CCCCF)O 1458a_100000036929_100000729493 [0,2,0,0,0,0|2,0,0]=4 19449 B16R1.21625 Cc1cc(c(c(c1)O)C(=O)CCCCO)C 1458a_100011255216_100000210776 [0,2,0,0,0,0|2,0,0]=4 19450 B16R1.21625 Cc1cc(c(c(c1)O)C(=O)CCCCO)O 1458a_100000036929_100000210776 [0,2,0,0,0,0|2,0,0]=4 19451 B16R1.21625 Cc1cc(c(c(c1)O)C(=O)NCCCF)O 527a_100015189416_100000036929 [0,2,0,0,0,0|2,0,0]=4 19452 B16R1.21625 Cc1cc(c(c(c1)O)C(=O)NCCCO)O 527a_100000182051_100000036929 [0,2,0,0,0,0|2,0,0]=4 19453 B16R1.21625 Cc1cc(cc(c1C(=O)CCCCF)O)O 1458a_200000061528_100000729493 [0,2,0,0,0,0|2,0,0]=4 19454 B16R1.21625 Cc1cc(cc(c1C(=O)CCCCO)O)O 1458a_200000061528_100000210776 [0,2,0,0,0,0|2,0,0]=4 19455 B16R1.21625 O=C(CCCCF)c1c(cc(cc1F)Br)O 1458a_200015963038_100000729493 [0,2,0,0,0,0|2,0,0]=4 19456 B16R1.21625 O=C(CCCCF)c1c(cc(cc1F)F)O 1458a_100000746385_100000729493 [0,2,0,0,0,0|2,0,0]=4 19457 B16R1.21625 O=C(CCCCO)c1c(cc(cc1F)Br)O 1458a_200015963038_100000210776 [0,2,0,0,0,0|2,0,0]=4 19458 B16R1.21625 O=C(CCCCO)c1c(cc(cc1F)F)O 1458a_100000746385_100000210776 [0,2,0,0,0,0|2,0,0]=4 19459 B16R1.21625 O=C(NCCCF)c1c(cc(cc1F)Br)O 527a_100015189416_200015963038 [0,2,0,0,0,0|2,0,0]=4 19460 B16R1.21625 O=C(NCCCF)c1c(cc(cc1F)F)O 240690a_100015189416_100000746385 [0,2,0,0,0,0|2,0,0]=4 19461 B16R1.21625 O=C(NCCCF)c1c(cc(cc1F)F)O 527a_100015189416_100000746385 [0,2,0,0,0,0|2,0,0]=4 19462 B16R1.21625 O=C(NCCCF)c1c(cc(cc1O)O)O 527a_100015189416_100000040092 [0,2,0,0,0,0|2,0,0]=4 19463 B16R1.21625 O=C(NCCCO)c1c(cc(cc1F)Br)O 527a_100000182051_200015963038 [0,2,0,0,0,0|2,0,0]=4 19464 B16R1.21625 O=C(NCCCO)c1c(cc(cc1F)F)O 240690a_100000182051_100000746385 [0,2,0,0,0,0|2,0,0]=4 19465 B16R1.21625 O=C(NCCCO)c1c(cc(cc1F)F)O 527a_100000182051_100000746385 [0,2,0,0,0,0|2,0,0]=4 19466 B16R1.21625 O=C(NCCCO)c1c(cc(cc1O)O)O 527a_100000182051_100000040092 [0,2,0,0,0,0|2,0,0]=4 19467 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000747444 [0,2,0,0,0,0|1,0,1]=4 19468 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)C 1458a_100000212137_100000747444 [0,2,0,0,0,0|1,0,1]=4 19469 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000747444 [0,2,0,0,0,0|1,0,1]=4 19470 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)F 1458a_100000211992_100009817053 [0,2,0,0,0,0|1,0,1]=4 19471 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000747444 [0,2,0,0,0,0|1,0,1]=4 19472 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000747444 [0,2,0,0,0,0|1,0,1]=4 19473 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000211992_100009814262 [0,2,0,0,0,0|1,0,1]=4 19474 B16R1.24755 CCCC(=O)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000747444 [0,2,0,0,0,0|1,0,1]=4 19475 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011216630 [0,2,0,0,0,0|2,0,0]=4 19476 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)C 1458a_100000685072_100011216630 [0,2,0,0,0,0|2,0,0]=4 19477 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011216630 [0,2,0,0,0,0|2,0,0]=4 19478 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011216630 [0,2,0,0,0,0|2,0,0]=4 19479 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011216630 [0,2,0,0,0,0|2,0,0]=4 19480 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011216630 [0,2,0,0,0,0|2,0,0]=4 19481 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1C)Br 1458a_100000741311_100011216630 [0,2,0,0,0,0|2,0,0]=4 19482 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1C)C 1458a_100000211164_100011216630 [0,2,0,0,0,0|2,0,0]=4 19483 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011216630 [0,2,0,0,0,0|2,0,0]=4 19484 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1C)F 1458a_100000686989_100011216630 [0,2,0,0,0,0|2,0,0]=4 19485 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1C)I 1458a_100010189873_100011216630 [0,2,0,0,0,0|2,0,0]=4 19486 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1C)O 1458a_100000692822_100011216630 [0,2,0,0,0,0|2,0,0]=4 19487 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011216630 [0,2,0,0,0,0|2,0,0]=4 19488 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100011216630 [0,2,0,0,0,0|2,0,0]=4 19489 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011216630 [0,2,0,0,0,0|2,0,0]=4 19490 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011216630 [0,2,0,0,0,0|2,0,0]=4 19491 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011216630 [0,2,0,0,0,0|2,0,0]=4 19492 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011216630 [0,2,0,0,0,0|2,0,0]=4 19493 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011216630 [0,2,0,0,0,0|2,0,0]=4 19494 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1F)C 1458a_100000766033_100011216630 [0,2,0,0,0,0|2,0,0]=4 19495 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011216630 [0,2,0,0,0,0|2,0,0]=4 19496 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1F)F 1458a_100000211022_100011216630 [0,2,0,0,0,0|2,0,0]=4 19497 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1F)I 1458a_100000037189_100011216630 [0,2,0,0,0,0|2,0,0]=4 19498 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1F)O 1458a_100000689029_100011216630 [0,2,0,0,0,0|2,0,0]=4 19499 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011216630 [0,2,0,0,0,0|2,0,0]=4 19500 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1I)C 1458a_100009999607_100011216630 [0,2,0,0,0,0|2,0,0]=4 19501 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011216630 [0,2,0,0,0,0|2,0,0]=4 19502 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1I)F 1458a_100000739341_100011216630 [0,2,0,0,0,0|2,0,0]=4 19503 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011216630 [0,2,0,0,0,0|1,0,0]=3 19504 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1O)C 1458a_100000212137_100011216630 [0,2,0,0,0,0|1,0,0]=3 19505 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011216630 [0,2,0,0,0,0|1,0,0]=3 19506 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100011216630 [0,2,0,0,0,0|1,0,0]=3 19507 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100011216630 [0,2,0,0,0,0|1,0,0]=3 19508 B16R1.24755 CCCC(C)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100011216630 [0,2,0,0,0,0|1,0,0]=3 19509 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Br 11a_100000741246_100000762965 [0,2,0,0,0,0|2,0,0]=4 19510 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Br 1626a_100000741246_100000762965 [0,2,0,0,0,0|2,0,0]=4 19511 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Br 240690a_100000741246_100000762965 [0,2,0,0,0,0|2,0,0]=4 19512 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Br 527a_100000741246_100000762965 [0,2,0,0,0,0|2,0,0]=4 19513 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)C 11a_100000741246_100000685072 [0,2,0,0,0,0|2,0,0]=4 19514 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)C 1626a_100000741246_100000685072 [0,2,0,0,0,0|2,0,0]=4 19515 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)C 240690a_100000741246_100000685072 [0,2,0,0,0,0|2,0,0]=4 19516 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)C 527a_100000741246_100000685072 [0,2,0,0,0,0|2,0,0]=4 19517 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Cl 11a_100000741246_100000766353 [0,2,0,0,0,0|2,0,0]=4 19518 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Cl 1626a_100000741246_100000766353 [0,2,0,0,0,0|2,0,0]=4 19519 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Cl 240690a_100000741246_100000766353 [0,2,0,0,0,0|2,0,0]=4 19520 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)Cl 527a_100000741246_100000766353 [0,2,0,0,0,0|2,0,0]=4 19521 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)F 11a_100000741246_100000212304 [0,2,0,0,0,0|2,0,0]=4 19522 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)F 1626a_100000741246_100000212304 [0,2,0,0,0,0|2,0,0]=4 19523 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)F 240690a_100000741246_100000212304 [0,2,0,0,0,0|2,0,0]=4 19524 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)F 527a_100000741246_100000212304 [0,2,0,0,0,0|2,0,0]=4 19525 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)I 11a_100000741246_100012360512 [0,2,0,0,0,0|2,0,0]=4 19526 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)I 1626a_100000741246_100012360512 [0,2,0,0,0,0|2,0,0]=4 19527 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)I 240690a_100000741246_100012360512 [0,2,0,0,0,0|2,0,0]=4 19528 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)I 527a_100000741246_100012360512 [0,2,0,0,0,0|2,0,0]=4 19529 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)O 240690a_100000741246_100012344906 [0,2,0,0,0,0|2,0,0]=4 19530 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Br)O 527a_100000741246_100012344906 [0,2,0,0,0,0|2,0,0]=4 19531 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Br 11a_100000741246_100000741311 [0,2,0,0,0,0|2,0,0]=4 19532 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Br 1626a_100000741246_100000741311 [0,2,0,0,0,0|2,0,0]=4 19533 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Br 240690a_100000741246_100000741311 [0,2,0,0,0,0|2,0,0]=4 19534 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Br 527a_100000741246_100000741311 [0,2,0,0,0,0|2,0,0]=4 19535 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)C 11a_100000741246_100000211164 [0,2,0,0,0,0|2,0,0]=4 19536 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)C 1626a_100000741246_100000211164 [0,2,0,0,0,0|2,0,0]=4 19537 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)C 240690a_100000741246_100000211164 [0,2,0,0,0,0|2,0,0]=4 19538 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)C 527a_100000741246_100000211164 [0,2,0,0,0,0|2,0,0]=4 19539 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Cl 11a_100000741246_100000688705 [0,2,0,0,0,0|2,0,0]=4 19540 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Cl 1626a_100000741246_100000688705 [0,2,0,0,0,0|2,0,0]=4 19541 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Cl 240690a_100000741246_100000688705 [0,2,0,0,0,0|2,0,0]=4 19542 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)Cl 527a_100000741246_100000688705 [0,2,0,0,0,0|2,0,0]=4 19543 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)F 11a_100000741246_100000686989 [0,2,0,0,0,0|2,0,0]=4 19544 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)F 1626a_100000741246_100000686989 [0,2,0,0,0,0|2,0,0]=4 19545 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)F 240690a_100000741246_100000686989 [0,2,0,0,0,0|2,0,0]=4 19546 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)F 527a_100000741246_100000686989 [0,2,0,0,0,0|2,0,0]=4 19547 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)I 11a_100000741246_100010189873 [0,2,0,0,0,0|2,0,0]=4 19548 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)I 1626a_100000741246_100010189873 [0,2,0,0,0,0|2,0,0]=4 19549 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)I 240690a_100000741246_100010189873 [0,2,0,0,0,0|2,0,0]=4 19550 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)I 527a_100000741246_100010189873 [0,2,0,0,0,0|2,0,0]=4 19551 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)O 240690a_100000741246_100000692822 [0,2,0,0,0,0|2,0,0]=4 19552 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1C)O 527a_100000741246_100000692822 [0,2,0,0,0,0|2,0,0]=4 19553 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Br 11a_100000741246_100000741628 [0,2,0,0,0,0|2,0,0]=4 19554 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Br 1626a_100000741246_100000741628 [0,2,0,0,0,0|2,0,0]=4 19555 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Br 240690a_100000741246_100000741628 [0,2,0,0,0,0|2,0,0]=4 19556 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Br 527a_100000741246_100000741628 [0,2,0,0,0,0|2,0,0]=4 19557 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)C 11a_100000741246_100000766932 [0,2,0,0,0,0|2,0,0]=4 19558 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)C 1626a_100000741246_100000766932 [0,2,0,0,0,0|2,0,0]=4 19559 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)C 240690a_100000741246_100000766932 [0,2,0,0,0,0|2,0,0]=4 19560 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)C 527a_100000741246_100000766932 [0,2,0,0,0,0|2,0,0]=4 19561 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Cl 11a_100000741246_100000185840 [0,2,0,0,0,0|2,0,0]=4 19562 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Cl 1626a_100000741246_100000185840 [0,2,0,0,0,0|2,0,0]=4 19563 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Cl 240690a_100000741246_100000185840 [0,2,0,0,0,0|2,0,0]=4 19564 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)Cl 527a_100000741246_100000185840 [0,2,0,0,0,0|2,0,0]=4 19565 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)F 11a_100000741246_100000211397 [0,2,0,0,0,0|2,0,0]=4 19566 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)F 1626a_100000741246_100000211397 [0,2,0,0,0,0|2,0,0]=4 19567 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)F 240690a_100000741246_100000211397 [0,2,0,0,0,0|2,0,0]=4 19568 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)F 527a_100000741246_100000211397 [0,2,0,0,0,0|2,0,0]=4 19569 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)I 11a_100000741246_100000751301 [0,2,0,0,0,0|2,0,0]=4 19570 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)I 1626a_100000741246_100000751301 [0,2,0,0,0,0|2,0,0]=4 19571 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)I 240690a_100000741246_100000751301 [0,2,0,0,0,0|2,0,0]=4 19572 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)I 527a_100000741246_100000751301 [0,2,0,0,0,0|2,0,0]=4 19573 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)O 240690a_100000741246_100000702456 [0,2,0,0,0,0|2,0,0]=4 19574 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1Cl)O 527a_100000741246_100000702456 [0,2,0,0,0,0|2,0,0]=4 19575 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Br 11a_100000741246_100000214689 [0,2,0,0,0,0|2,0,0]=4 19576 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Br 1626a_100000741246_100000214689 [0,2,0,0,0,0|2,0,0]=4 19577 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Br 240690a_100000741246_100000214689 [0,2,0,0,0,0|2,0,0]=4 19578 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Br 527a_100000741246_100000214689 [0,2,0,0,0,0|2,0,0]=4 19579 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)C 11a_100000741246_100000766033 [0,2,0,0,0,0|2,0,0]=4 19580 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)C 1626a_100000741246_100000766033 [0,2,0,0,0,0|2,0,0]=4 19581 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)C 240690a_100000741246_100000766033 [0,2,0,0,0,0|2,0,0]=4 19582 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)C 527a_100000741246_100000766033 [0,2,0,0,0,0|2,0,0]=4 19583 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Cl 11a_100000741246_100000212326 [0,2,0,0,0,0|2,0,0]=4 19584 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Cl 1626a_100000741246_100000212326 [0,2,0,0,0,0|2,0,0]=4 19585 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Cl 240690a_100000741246_100000212326 [0,2,0,0,0,0|2,0,0]=4 19586 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)Cl 527a_100000741246_100000212326 [0,2,0,0,0,0|2,0,0]=4 19587 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)F 11a_100000741246_100000211022 [0,2,0,0,0,0|2,0,0]=4 19588 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)F 1626a_100000741246_100000211022 [0,2,0,0,0,0|2,0,0]=4 19589 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)F 240690a_100000741246_100000211022 [0,2,0,0,0,0|2,0,0]=4 19590 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)F 527a_100000741246_100000211022 [0,2,0,0,0,0|2,0,0]=4 19591 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)I 11a_100000741246_100000037189 [0,2,0,0,0,0|2,0,0]=4 19592 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)I 1626a_100000741246_100000037189 [0,2,0,0,0,0|2,0,0]=4 19593 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)I 240690a_100000741246_100000037189 [0,2,0,0,0,0|2,0,0]=4 19594 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)I 527a_100000741246_100000037189 [0,2,0,0,0,0|2,0,0]=4 19595 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)O 240690a_100000741246_100000689029 [0,2,0,0,0,0|2,0,0]=4 19596 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1F)O 527a_100000741246_100000689029 [0,2,0,0,0,0|2,0,0]=4 19597 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Br 11a_100000741246_100000751167 [0,2,0,0,0,0|2,0,0]=4 19598 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Br 1626a_100000741246_100000751167 [0,2,0,0,0,0|2,0,0]=4 19599 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Br 240690a_100000741246_100000751167 [0,2,0,0,0,0|2,0,0]=4 19600 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Br 527a_100000741246_100000751167 [0,2,0,0,0,0|2,0,0]=4 19601 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)C 11a_100000741246_100009999607 [0,2,0,0,0,0|2,0,0]=4 19602 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)C 1626a_100000741246_100009999607 [0,2,0,0,0,0|2,0,0]=4 19603 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)C 240690a_100000741246_100009999607 [0,2,0,0,0,0|2,0,0]=4 19604 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)C 527a_100000741246_100009999607 [0,2,0,0,0,0|2,0,0]=4 19605 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Cl 11a_100000741246_100000739380 [0,2,0,0,0,0|2,0,0]=4 19606 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Cl 1626a_100000741246_100000739380 [0,2,0,0,0,0|2,0,0]=4 19607 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Cl 240690a_100000741246_100000739380 [0,2,0,0,0,0|2,0,0]=4 19608 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)Cl 527a_100000741246_100000739380 [0,2,0,0,0,0|2,0,0]=4 19609 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)F 11a_100000741246_100000739341 [0,2,0,0,0,0|2,0,0]=4 19610 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)F 1626a_100000741246_100000739341 [0,2,0,0,0,0|2,0,0]=4 19611 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)F 240690a_100000741246_100000739341 [0,2,0,0,0,0|2,0,0]=4 19612 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1I)F 527a_100000741246_100000739341 [0,2,0,0,0,0|2,0,0]=4 19613 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)Br 240690a_100000741246_100000744433 [0,2,0,0,0,0|1,0,0]=3 19614 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)Br 527a_100000741246_100000744433 [0,2,0,0,0,0|1,0,0]=3 19615 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)C 1626a_100000741246_100000212137 [0,2,0,0,0,0|1,0,0]=3 19616 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)C 240690a_100000741246_100000212137 [0,2,0,0,0,0|1,0,0]=3 19617 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)C 527a_100000741246_100000212137 [0,2,0,0,0,0|1,0,0]=3 19618 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)Cl 11a_100000741246_100000188622 [0,2,0,0,0,0|1,0,0]=3 19619 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)Cl 240690a_100000741246_100000188622 [0,2,0,0,0,0|1,0,0]=3 19620 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)Cl 527a_100000741246_100000188622 [0,2,0,0,0,0|1,0,0]=3 19621 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)F 240690a_100000741246_100000746061 [0,2,0,0,0,0|1,0,0]=3 19622 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)F 527a_100000741246_100000746061 [0,2,0,0,0,0|1,0,0]=3 19623 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)I 240690a_100000741246_100000091984 [0,2,0,0,0,0|1,0,0]=3 19624 B16R1.24755 CCCC(C)NC(=O)c1ccc(cc1O)I 527a_100000741246_100000091984 [0,2,0,0,0,0|1,0,0]=3 19625 B16R1.24755 CCCN(C)CC(=O)c1ccc(cc1O)F 269982a_100000747261_100009817053 [0,2,0,0,0,0|2,0,0]=4 19626 B16R1.24755 CCCN(C)CC(=O)c1ccc(cc1O)O 269982a_100000747261_100009814262 [0,2,0,0,0,0|2,0,0]=4 19627 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)Br 240690a_100000764878_100000744433 [0,2,0,0,0,0|2,0,0]=4 19628 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)Br 527a_100000764878_100000744433 [0,2,0,0,0,0|2,0,0]=4 19629 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)C 1626a_100000764878_100000212137 [0,2,0,0,0,0|2,0,0]=4 19630 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)C 240690a_100000764878_100000212137 [0,2,0,0,0,0|2,0,0]=4 19631 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)C 527a_100000764878_100000212137 [0,2,0,0,0,0|2,0,0]=4 19632 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)Cl 11a_100000764878_100000188622 [0,2,0,0,0,0|2,0,0]=4 19633 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)Cl 240690a_100000764878_100000188622 [0,2,0,0,0,0|2,0,0]=4 19634 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)Cl 527a_100000764878_100000188622 [0,2,0,0,0,0|2,0,0]=4 19635 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)F 240690a_100000764878_100000746061 [0,2,0,0,0,0|2,0,0]=4 19636 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)F 527a_100000764878_100000746061 [0,2,0,0,0,0|2,0,0]=4 19637 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)I 240690a_100000764878_100000091984 [0,2,0,0,0,0|2,0,0]=4 19638 B16R1.24755 COC[C@@H](C)NC(=O)c1ccc(cc1O)I 527a_100000764878_100000091984 [0,2,0,0,0,0|2,0,0]=4 19639 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)Br 240690a_100000706166_100000744433 [0,2,0,0,0,0|2,0,0]=4 19640 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)Br 527a_100000706166_100000744433 [0,2,0,0,0,0|2,0,0]=4 19641 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)Cl 240690a_100000706166_100000188622 [0,2,0,0,0,0|2,0,0]=4 19642 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)Cl 527a_100000706166_100000188622 [0,2,0,0,0,0|2,0,0]=4 19643 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)F 240690a_100000706166_100000746061 [0,2,0,0,0,0|2,0,0]=4 19644 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)F 527a_100000706166_100000746061 [0,2,0,0,0,0|2,0,0]=4 19645 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)I 240690a_100000706166_100000091984 [0,2,0,0,0,0|2,0,0]=4 19646 B16R1.24755 C[C@H](CCO)NC(=O)c1ccc(cc1O)I 527a_100000706166_100000091984 [0,2,0,0,0,0|2,0,0]=4 19647 B16R1.24755 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CCO 240690a_100000706166_100000212137 [0,2,0,0,0,0|2,0,0]=4 19648 B16R1.24755 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CCO 527a_100000706166_100000212137 [0,2,0,0,0,0|2,0,0]=4 19649 B16R1.26593 C#CCCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100010269958 [0,2,0,0,0,0|1,0,1]=4 19650 B16R1.26593 C#CCCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100010269958 [0,2,0,0,0,0|1,0,1]=4 19651 B16R1.26593 C#CCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100010269958 [0,2,0,0,0,0|1,0,1]=4 19652 B16R1.26593 C#CCCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100010269958 [0,2,0,0,0,0|1,0,1]=4 19653 B16R1.26593 C#CCCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100010269958 [0,2,0,0,0,0|1,0,1]=4 19654 B16R1.26593 C#CCCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100010269958 [0,2,0,0,0,0|1,0,1]=4 19655 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)Br 240690a_100000718082_100000744433 [0,2,0,0,0,0|1,0,1]=4 19656 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)Br 527a_100000718082_100000744433 [0,2,0,0,0,0|1,0,1]=4 19657 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)C 1626a_100000718082_100000212137 [0,2,0,0,0,0|1,0,1]=4 19658 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)C 240690a_100000718082_100000212137 [0,2,0,0,0,0|1,0,1]=4 19659 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)C 527a_100000718082_100000212137 [0,2,0,0,0,0|1,0,1]=4 19660 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)Cl 11a_100000718082_100000188622 [0,2,0,0,0,0|1,0,1]=4 19661 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)Cl 240690a_100000718082_100000188622 [0,2,0,0,0,0|1,0,1]=4 19662 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)Cl 527a_100000718082_100000188622 [0,2,0,0,0,0|1,0,1]=4 19663 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)F 240690a_100000718082_100000746061 [0,2,0,0,0,0|1,0,1]=4 19664 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)F 527a_100000718082_100000746061 [0,2,0,0,0,0|1,0,1]=4 19665 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)I 240690a_100000718082_100000091984 [0,2,0,0,0,0|1,0,1]=4 19666 B16R1.26593 C#CCCCNC(=O)c1ccc(cc1O)I 527a_100000718082_100000091984 [0,2,0,0,0,0|1,0,1]=4 19667 B16R1.26593 C#CCCOCC(=O)c1ccc(cc1O)F 34a_100011215631_100009817053 [0,2,0,0,0,0|0,0,2]=4 19668 B16R1.26593 C#CCCOCC(=O)c1ccc(cc1O)O 34a_100011215631_100009814262 [0,2,0,0,0,0|0,0,2]=4 19669 B16R1.26593 C/C=C/COCC(=O)c1ccc(cc1O)F 34a_100016270725_100009817053 [0,2,0,0,0,0|0,0,2]=4 19670 B16R1.26593 C/C=C/COCC(=O)c1ccc(cc1O)O 34a_100016270725_100009814262 [0,2,0,0,0,0|0,0,2]=4 19671 B16R1.26593 C=CCCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215482 [0,2,0,0,0,0|1,0,1]=4 19672 B16R1.26593 C=CCCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100011215482 [0,2,0,0,0,0|1,0,1]=4 19673 B16R1.26593 C=CCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215482 [0,2,0,0,0,0|1,0,1]=4 19674 B16R1.26593 C=CCCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215482 [0,2,0,0,0,0|1,0,1]=4 19675 B16R1.26593 C=CCCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215482 [0,2,0,0,0,0|1,0,1]=4 19676 B16R1.26593 C=CCCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215482 [0,2,0,0,0,0|1,0,1]=4 19677 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)Br 240690a_100000700776_100000744433 [0,2,0,0,0,0|1,0,1]=4 19678 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)Br 527a_100000700776_100000744433 [0,2,0,0,0,0|1,0,1]=4 19679 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)C 1626a_100000700776_100000212137 [0,2,0,0,0,0|1,0,1]=4 19680 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)C 240690a_100000700776_100000212137 [0,2,0,0,0,0|1,0,1]=4 19681 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)C 527a_100000700776_100000212137 [0,2,0,0,0,0|1,0,1]=4 19682 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)Cl 11a_100000700776_100000188622 [0,2,0,0,0,0|1,0,1]=4 19683 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)Cl 240690a_100000700776_100000188622 [0,2,0,0,0,0|1,0,1]=4 19684 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)Cl 527a_100000700776_100000188622 [0,2,0,0,0,0|1,0,1]=4 19685 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)F 240690a_100000700776_100000746061 [0,2,0,0,0,0|1,0,1]=4 19686 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)F 527a_100000700776_100000746061 [0,2,0,0,0,0|1,0,1]=4 19687 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)I 240690a_100000700776_100000091984 [0,2,0,0,0,0|1,0,1]=4 19688 B16R1.26593 C=CCCCNC(=O)c1ccc(cc1O)I 527a_100000700776_100000091984 [0,2,0,0,0,0|1,0,1]=4 19689 B16R1.26593 C=CCCOCC(=O)c1ccc(cc1O)F 34a_100011205117_100009817053 [0,2,0,0,0,0|0,0,2]=4 19690 B16R1.26593 C=CCCOCC(=O)c1ccc(cc1O)O 34a_100011205117_100009814262 [0,2,0,0,0,0|0,0,2]=4 19691 B16R1.26593 CC#CCOCC(=O)c1ccc(cc1O)F 34a_100000761923_100009817053 [0,2,0,0,0,0|0,0,2]=4 19692 B16R1.26593 CC#CCOCC(=O)c1ccc(cc1O)O 34a_100000761923_100009814262 [0,2,0,0,0,0|0,0,2]=4 19693 B16R1.26593 CC/C=C\CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100015370543 [0,2,0,0,0,0|1,0,1]=4 19694 B16R1.26593 CC/C=C\CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100015370543 [0,2,0,0,0,0|1,0,1]=4 19695 B16R1.26593 CC/C=C\CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100015370543 [0,2,0,0,0,0|1,0,1]=4 19696 B16R1.26593 CC/C=C\CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100015370543 [0,2,0,0,0,0|1,0,1]=4 19697 B16R1.26593 CC/C=C\CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100015370543 [0,2,0,0,0,0|1,0,1]=4 19698 B16R1.26593 CC/C=C\CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100015370543 [0,2,0,0,0,0|1,0,1]=4 19699 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210757 [0,2,0,0,0,0|2,0,0]=4 19700 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210757 [0,2,0,0,0,0|2,0,0]=4 19701 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210757 [0,2,0,0,0,0|2,0,0]=4 19702 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210757 [0,2,0,0,0,0|2,0,0]=4 19703 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210757 [0,2,0,0,0,0|2,0,0]=4 19704 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210757 [0,2,0,0,0,0|2,0,0]=4 19705 B16R1.26593 CCCCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210757 [0,2,0,0,0,0|2,0,0]=4 19706 B16R1.26593 CCCCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210757 [0,2,0,0,0,0|2,0,0]=4 19707 B16R1.26593 CCCCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210757 [0,2,0,0,0,0|2,0,0]=4 19708 B16R1.26593 CCCCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210757 [0,2,0,0,0,0|2,0,0]=4 19709 B16R1.26593 CCCCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210757 [0,2,0,0,0,0|2,0,0]=4 19710 B16R1.26593 CCCCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210757 [0,2,0,0,0,0|2,0,0]=4 19711 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210757 [0,2,0,0,0,0|2,0,0]=4 19712 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210757 [0,2,0,0,0,0|2,0,0]=4 19713 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210757 [0,2,0,0,0,0|2,0,0]=4 19714 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210757 [0,2,0,0,0,0|2,0,0]=4 19715 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210757 [0,2,0,0,0,0|2,0,0]=4 19716 B16R1.26593 CCCCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210757 [0,2,0,0,0,0|2,0,0]=4 19717 B16R1.26593 CCCCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210757 [0,2,0,0,0,0|2,0,0]=4 19718 B16R1.26593 CCCCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210757 [0,2,0,0,0,0|2,0,0]=4 19719 B16R1.26593 CCCCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210757 [0,2,0,0,0,0|2,0,0]=4 19720 B16R1.26593 CCCCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210757 [0,2,0,0,0,0|2,0,0]=4 19721 B16R1.26593 CCCCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210757 [0,2,0,0,0,0|2,0,0]=4 19722 B16R1.26593 CCCCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210757 [0,2,0,0,0,0|2,0,0]=4 19723 B16R1.26593 CCCCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210757 [0,2,0,0,0,0|2,0,0]=4 19724 B16R1.26593 CCCCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210757 [0,2,0,0,0,0|2,0,0]=4 19725 B16R1.26593 CCCCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210757 [0,2,0,0,0,0|2,0,0]=4 19726 B16R1.26593 CCCCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210757 [0,2,0,0,0,0|2,0,0]=4 19727 B16R1.26593 CCCCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210757 [0,2,0,0,0,0|1,0,0]=3 19728 B16R1.26593 CCCCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210757 [0,2,0,0,0,0|1,0,0]=3 19729 B16R1.26593 CCCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210757 [0,2,0,0,0,0|1,0,0]=3 19730 B16R1.26593 CCCCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210757 [0,2,0,0,0,0|1,0,0]=3 19731 B16R1.26593 CCCCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210757 [0,2,0,0,0,0|1,0,0]=3 19732 B16R1.26593 CCCCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210757 [0,2,0,0,0,0|1,0,0]=3 19733 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Br 11a_100000209983_100000762965 [0,2,0,0,0,0|2,0,0]=4 19734 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Br 1626a_100000209983_100000762965 [0,2,0,0,0,0|2,0,0]=4 19735 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Br 240690a_100000209983_100000762965 [0,2,0,0,0,0|2,0,0]=4 19736 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Br 527a_100000209983_100000762965 [0,2,0,0,0,0|2,0,0]=4 19737 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)C 11a_100000209983_100000685072 [0,2,0,0,0,0|2,0,0]=4 19738 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)C 1626a_100000209983_100000685072 [0,2,0,0,0,0|2,0,0]=4 19739 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)C 240690a_100000209983_100000685072 [0,2,0,0,0,0|2,0,0]=4 19740 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)C 527a_100000209983_100000685072 [0,2,0,0,0,0|2,0,0]=4 19741 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Cl 11a_100000209983_100000766353 [0,2,0,0,0,0|2,0,0]=4 19742 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000209983_100000766353 [0,2,0,0,0,0|2,0,0]=4 19743 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000209983_100000766353 [0,2,0,0,0,0|2,0,0]=4 19744 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)Cl 527a_100000209983_100000766353 [0,2,0,0,0,0|2,0,0]=4 19745 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)F 11a_100000209983_100000212304 [0,2,0,0,0,0|2,0,0]=4 19746 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)F 1626a_100000209983_100000212304 [0,2,0,0,0,0|2,0,0]=4 19747 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)F 240690a_100000209983_100000212304 [0,2,0,0,0,0|2,0,0]=4 19748 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)F 527a_100000209983_100000212304 [0,2,0,0,0,0|2,0,0]=4 19749 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)I 11a_100000209983_100012360512 [0,2,0,0,0,0|2,0,0]=4 19750 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)I 1626a_100000209983_100012360512 [0,2,0,0,0,0|2,0,0]=4 19751 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)I 240690a_100000209983_100012360512 [0,2,0,0,0,0|2,0,0]=4 19752 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)I 527a_100000209983_100012360512 [0,2,0,0,0,0|2,0,0]=4 19753 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)O 240690a_100000209983_100012344906 [0,2,0,0,0,0|2,0,0]=4 19754 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Br)O 527a_100000209983_100012344906 [0,2,0,0,0,0|2,0,0]=4 19755 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Br 11a_100000209983_100000741311 [0,2,0,0,0,0|2,0,0]=4 19756 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Br 1626a_100000209983_100000741311 [0,2,0,0,0,0|2,0,0]=4 19757 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Br 240690a_100000209983_100000741311 [0,2,0,0,0,0|2,0,0]=4 19758 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Br 527a_100000209983_100000741311 [0,2,0,0,0,0|2,0,0]=4 19759 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)C 11a_100000209983_100000211164 [0,2,0,0,0,0|2,0,0]=4 19760 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)C 1626a_100000209983_100000211164 [0,2,0,0,0,0|2,0,0]=4 19761 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)C 240690a_100000209983_100000211164 [0,2,0,0,0,0|2,0,0]=4 19762 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)C 527a_100000209983_100000211164 [0,2,0,0,0,0|2,0,0]=4 19763 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Cl 11a_100000209983_100000688705 [0,2,0,0,0,0|2,0,0]=4 19764 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Cl 1626a_100000209983_100000688705 [0,2,0,0,0,0|2,0,0]=4 19765 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Cl 240690a_100000209983_100000688705 [0,2,0,0,0,0|2,0,0]=4 19766 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)Cl 527a_100000209983_100000688705 [0,2,0,0,0,0|2,0,0]=4 19767 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)F 11a_100000209983_100000686989 [0,2,0,0,0,0|2,0,0]=4 19768 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)F 1626a_100000209983_100000686989 [0,2,0,0,0,0|2,0,0]=4 19769 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)F 240690a_100000209983_100000686989 [0,2,0,0,0,0|2,0,0]=4 19770 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)F 527a_100000209983_100000686989 [0,2,0,0,0,0|2,0,0]=4 19771 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)I 11a_100000209983_100010189873 [0,2,0,0,0,0|2,0,0]=4 19772 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)I 1626a_100000209983_100010189873 [0,2,0,0,0,0|2,0,0]=4 19773 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)I 240690a_100000209983_100010189873 [0,2,0,0,0,0|2,0,0]=4 19774 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)I 527a_100000209983_100010189873 [0,2,0,0,0,0|2,0,0]=4 19775 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)O 240690a_100000209983_100000692822 [0,2,0,0,0,0|2,0,0]=4 19776 B16R1.26593 CCCCCNC(=O)c1ccc(cc1C)O 527a_100000209983_100000692822 [0,2,0,0,0,0|2,0,0]=4 19777 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Br 11a_100000209983_100000741628 [0,2,0,0,0,0|2,0,0]=4 19778 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000209983_100000741628 [0,2,0,0,0,0|2,0,0]=4 19779 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000209983_100000741628 [0,2,0,0,0,0|2,0,0]=4 19780 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Br 527a_100000209983_100000741628 [0,2,0,0,0,0|2,0,0]=4 19781 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)C 11a_100000209983_100000766932 [0,2,0,0,0,0|2,0,0]=4 19782 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)C 1626a_100000209983_100000766932 [0,2,0,0,0,0|2,0,0]=4 19783 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)C 240690a_100000209983_100000766932 [0,2,0,0,0,0|2,0,0]=4 19784 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)C 527a_100000209983_100000766932 [0,2,0,0,0,0|2,0,0]=4 19785 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000209983_100000185840 [0,2,0,0,0,0|2,0,0]=4 19786 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000209983_100000185840 [0,2,0,0,0,0|2,0,0]=4 19787 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000209983_100000185840 [0,2,0,0,0,0|2,0,0]=4 19788 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000209983_100000185840 [0,2,0,0,0,0|2,0,0]=4 19789 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)F 11a_100000209983_100000211397 [0,2,0,0,0,0|2,0,0]=4 19790 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)F 1626a_100000209983_100000211397 [0,2,0,0,0,0|2,0,0]=4 19791 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)F 240690a_100000209983_100000211397 [0,2,0,0,0,0|2,0,0]=4 19792 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)F 527a_100000209983_100000211397 [0,2,0,0,0,0|2,0,0]=4 19793 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)I 11a_100000209983_100000751301 [0,2,0,0,0,0|2,0,0]=4 19794 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)I 1626a_100000209983_100000751301 [0,2,0,0,0,0|2,0,0]=4 19795 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)I 240690a_100000209983_100000751301 [0,2,0,0,0,0|2,0,0]=4 19796 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)I 527a_100000209983_100000751301 [0,2,0,0,0,0|2,0,0]=4 19797 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)O 240690a_100000209983_100000702456 [0,2,0,0,0,0|2,0,0]=4 19798 B16R1.26593 CCCCCNC(=O)c1ccc(cc1Cl)O 527a_100000209983_100000702456 [0,2,0,0,0,0|2,0,0]=4 19799 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Br 11a_100000209983_100000214689 [0,2,0,0,0,0|2,0,0]=4 19800 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Br 1626a_100000209983_100000214689 [0,2,0,0,0,0|2,0,0]=4 19801 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Br 240690a_100000209983_100000214689 [0,2,0,0,0,0|2,0,0]=4 19802 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Br 527a_100000209983_100000214689 [0,2,0,0,0,0|2,0,0]=4 19803 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)C 11a_100000209983_100000766033 [0,2,0,0,0,0|2,0,0]=4 19804 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)C 1626a_100000209983_100000766033 [0,2,0,0,0,0|2,0,0]=4 19805 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)C 240690a_100000209983_100000766033 [0,2,0,0,0,0|2,0,0]=4 19806 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)C 527a_100000209983_100000766033 [0,2,0,0,0,0|2,0,0]=4 19807 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Cl 11a_100000209983_100000212326 [0,2,0,0,0,0|2,0,0]=4 19808 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Cl 1626a_100000209983_100000212326 [0,2,0,0,0,0|2,0,0]=4 19809 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Cl 240690a_100000209983_100000212326 [0,2,0,0,0,0|2,0,0]=4 19810 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)Cl 527a_100000209983_100000212326 [0,2,0,0,0,0|2,0,0]=4 19811 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)F 11a_100000209983_100000211022 [0,2,0,0,0,0|2,0,0]=4 19812 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)F 1626a_100000209983_100000211022 [0,2,0,0,0,0|2,0,0]=4 19813 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)F 240690a_100000209983_100000211022 [0,2,0,0,0,0|2,0,0]=4 19814 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)F 527a_100000209983_100000211022 [0,2,0,0,0,0|2,0,0]=4 19815 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)I 11a_100000209983_100000037189 [0,2,0,0,0,0|2,0,0]=4 19816 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)I 1626a_100000209983_100000037189 [0,2,0,0,0,0|2,0,0]=4 19817 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)I 240690a_100000209983_100000037189 [0,2,0,0,0,0|2,0,0]=4 19818 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)I 527a_100000209983_100000037189 [0,2,0,0,0,0|2,0,0]=4 19819 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)O 240690a_100000209983_100000689029 [0,2,0,0,0,0|2,0,0]=4 19820 B16R1.26593 CCCCCNC(=O)c1ccc(cc1F)O 527a_100000209983_100000689029 [0,2,0,0,0,0|2,0,0]=4 19821 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Br 11a_100000209983_100000751167 [0,2,0,0,0,0|2,0,0]=4 19822 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Br 1626a_100000209983_100000751167 [0,2,0,0,0,0|2,0,0]=4 19823 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Br 240690a_100000209983_100000751167 [0,2,0,0,0,0|2,0,0]=4 19824 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Br 527a_100000209983_100000751167 [0,2,0,0,0,0|2,0,0]=4 19825 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)C 11a_100000209983_100009999607 [0,2,0,0,0,0|2,0,0]=4 19826 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)C 1626a_100000209983_100009999607 [0,2,0,0,0,0|2,0,0]=4 19827 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)C 240690a_100000209983_100009999607 [0,2,0,0,0,0|2,0,0]=4 19828 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)C 527a_100000209983_100009999607 [0,2,0,0,0,0|2,0,0]=4 19829 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Cl 11a_100000209983_100000739380 [0,2,0,0,0,0|2,0,0]=4 19830 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Cl 1626a_100000209983_100000739380 [0,2,0,0,0,0|2,0,0]=4 19831 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Cl 240690a_100000209983_100000739380 [0,2,0,0,0,0|2,0,0]=4 19832 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)Cl 527a_100000209983_100000739380 [0,2,0,0,0,0|2,0,0]=4 19833 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)F 11a_100000209983_100000739341 [0,2,0,0,0,0|2,0,0]=4 19834 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)F 1626a_100000209983_100000739341 [0,2,0,0,0,0|2,0,0]=4 19835 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)F 240690a_100000209983_100000739341 [0,2,0,0,0,0|2,0,0]=4 19836 B16R1.26593 CCCCCNC(=O)c1ccc(cc1I)F 527a_100000209983_100000739341 [0,2,0,0,0,0|2,0,0]=4 19837 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)Br 240690a_100000209983_100000744433 [0,2,0,0,0,0|1,0,0]=3 19838 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)Br 527a_100000209983_100000744433 [0,2,0,0,0,0|1,0,0]=3 19839 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)C 1626a_100000209983_100000212137 [0,2,0,0,0,0|1,0,0]=3 19840 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)C 240690a_100000209983_100000212137 [0,2,0,0,0,0|1,0,0]=3 19841 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)C 527a_100000209983_100000212137 [0,2,0,0,0,0|1,0,0]=3 19842 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)Cl 11a_100000209983_100000188622 [0,2,0,0,0,0|1,0,0]=3 19843 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)Cl 240690a_100000209983_100000188622 [0,2,0,0,0,0|1,0,0]=3 19844 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)Cl 527a_100000209983_100000188622 [0,2,0,0,0,0|1,0,0]=3 19845 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)F 240690a_100000209983_100000746061 [0,2,0,0,0,0|1,0,0]=3 19846 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)F 527a_100000209983_100000746061 [0,2,0,0,0,0|1,0,0]=3 19847 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)I 240690a_100000209983_100000091984 [0,2,0,0,0,0|1,0,0]=3 19848 B16R1.26593 CCCCCNC(=O)c1ccc(cc1O)I 527a_100000209983_100000091984 [0,2,0,0,0,0|1,0,0]=3 19849 B16R1.26593 CCCCNCC(=O)c1ccc(cc1Br)F 7a_106832991798_100012361341 [0,2,0,0,0,0|2,0,0]=4 19850 B16R1.26593 CCCCNCC(=O)c1ccc(cc1C)C 2230a_100000102301_100000229959 [0,2,0,0,0,0|2,0,0]=4 19851 B16R1.26593 CCCCNCC(=O)c1ccc(cc1C)C 7a_106832991798_100000229959 [0,2,0,0,0,0|2,0,0]=4 19852 B16R1.26593 CCCCNCC(=O)c1ccc(cc1Cl)Cl 2230a_100000102301_100011218845 [0,2,0,0,0,0|2,0,0]=4 19853 B16R1.26593 CCCCNCC(=O)c1ccc(cc1Cl)F 2230a_100000102301_100012056422 [0,2,0,0,0,0|2,0,0]=4 19854 B16R1.26593 CCCCNCC(=O)c1ccc(cc1F)Br 7a_106832991798_200012361339 [0,2,0,0,0,0|2,0,0]=4 19855 B16R1.26593 CCCCNCC(=O)c1ccc(cc1F)Cl 7a_106832991798_100012351891 [0,2,0,0,0,0|2,0,0]=4 19856 B16R1.26593 CCCCNCC(=O)c1ccc(cc1F)F 7a_106832991798_100000229962 [0,2,0,0,0,0|2,0,0]=4 19857 B16R1.26593 CCCCNCC(=O)c1ccc(cc1O)O 7a_106832991798_100009814262 [0,2,0,0,0,0|1,0,0]=3 19858 B16R1.26593 CCCCNN=C(C)c1ccc(cc1O)Br 4a_100025702795_100000188348 [0,2,0,0,0,0|2,0,0]=4 19859 B16R1.26593 CCCCNN=C(C)c1ccc(cc1O)C 4a_100025702795_100000234885 [0,2,0,0,0,0|2,0,0]=4 19860 B16R1.26593 CCCCNN=C(C)c1ccc(cc1O)Cl 4a_100025702795_100000061402 [0,2,0,0,0,0|2,0,0]=4 19861 B16R1.26593 CCCCNN=C(C)c1ccc(cc1O)F 4a_100025702795_100011215782 [0,2,0,0,0,0|2,0,0]=4 19862 B16R1.26593 CCCCNN=C(C)c1ccc(cc1O)O 4a_100025702795_100000189368 [0,2,0,0,0,0|2,0,0]=4 19863 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Br)Br 22a_100025702795_100000762965 [0,2,0,0,0,0|2,0,0]=4 19864 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Br)C 22a_100025702795_100000685072 [0,2,0,0,0,0|2,0,0]=4 19865 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Br)Cl 22a_100025702795_100000766353 [0,2,0,0,0,0|2,0,0]=4 19866 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Br)F 22a_100025702795_100000212304 [0,2,0,0,0,0|2,0,0]=4 19867 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Br)I 22a_100025702795_100012360512 [0,2,0,0,0,0|2,0,0]=4 19868 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Br)O 22a_100025702795_100012344906 [0,2,0,0,0,0|2,0,0]=4 19869 B16R1.26593 CCCCNNC(=O)c1ccc(cc1C)Br 22a_100025702795_100000741311 [0,2,0,0,0,0|2,0,0]=4 19870 B16R1.26593 CCCCNNC(=O)c1ccc(cc1C)C 22a_100025702795_100000211164 [0,2,0,0,0,0|2,0,0]=4 19871 B16R1.26593 CCCCNNC(=O)c1ccc(cc1C)Cl 22a_100025702795_100000688705 [0,2,0,0,0,0|2,0,0]=4 19872 B16R1.26593 CCCCNNC(=O)c1ccc(cc1C)F 22a_100025702795_100000686989 [0,2,0,0,0,0|2,0,0]=4 19873 B16R1.26593 CCCCNNC(=O)c1ccc(cc1C)I 22a_100025702795_100010189873 [0,2,0,0,0,0|2,0,0]=4 19874 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Cl)Br 22a_100025702795_100000741628 [0,2,0,0,0,0|2,0,0]=4 19875 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Cl)C 22a_100025702795_100000766932 [0,2,0,0,0,0|2,0,0]=4 19876 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Cl)Cl 22a_100025702795_100000185840 [0,2,0,0,0,0|2,0,0]=4 19877 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Cl)F 22a_100025702795_100000211397 [0,2,0,0,0,0|2,0,0]=4 19878 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Cl)I 22a_100025702795_100000751301 [0,2,0,0,0,0|2,0,0]=4 19879 B16R1.26593 CCCCNNC(=O)c1ccc(cc1Cl)O 22a_100025702795_100000702456 [0,2,0,0,0,0|2,0,0]=4 19880 B16R1.26593 CCCCNNC(=O)c1ccc(cc1F)Br 22a_100025702795_100000214689 [0,2,0,0,0,0|2,0,0]=4 19881 B16R1.26593 CCCCNNC(=O)c1ccc(cc1F)C 22a_100025702795_100000766033 [0,2,0,0,0,0|2,0,0]=4 19882 B16R1.26593 CCCCNNC(=O)c1ccc(cc1F)Cl 22a_100025702795_100000212326 [0,2,0,0,0,0|2,0,0]=4 19883 B16R1.26593 CCCCNNC(=O)c1ccc(cc1F)F 22a_100025702795_100000211022 [0,2,0,0,0,0|2,0,0]=4 19884 B16R1.26593 CCCCNNC(=O)c1ccc(cc1F)I 22a_100025702795_100000037189 [0,2,0,0,0,0|2,0,0]=4 19885 B16R1.26593 CCCCNNC(=O)c1ccc(cc1F)O 22a_100025702795_100000689029 [0,2,0,0,0,0|2,0,0]=4 19886 B16R1.26593 CCCCNNC(=O)c1ccc(cc1I)Br 22a_100025702795_100000751167 [0,2,0,0,0,0|2,0,0]=4 19887 B16R1.26593 CCCCNNC(=O)c1ccc(cc1I)C 22a_100025702795_100009999607 [0,2,0,0,0,0|2,0,0]=4 19888 B16R1.26593 CCCCNNC(=O)c1ccc(cc1I)Cl 22a_100025702795_100000739380 [0,2,0,0,0,0|2,0,0]=4 19889 B16R1.26593 CCCCNNC(=O)c1ccc(cc1I)F 22a_100025702795_100000739341 [0,2,0,0,0,0|2,0,0]=4 19890 B16R1.26593 CCCCNNC(=O)c1ccc(cc1O)Br 22a_100025702795_100000744433 [0,2,0,0,0,0|1,0,0]=3 19891 B16R1.26593 CCCCNNC(=O)c1ccc(cc1O)C 22a_100025702795_100000212137 [0,2,0,0,0,0|1,0,0]=3 19892 B16R1.26593 CCCCNNC(=O)c1ccc(cc1O)Cl 22a_100025702795_100000188622 [0,2,0,0,0,0|1,0,0]=3 19893 B16R1.26593 CCCCNNC(=O)c1ccc(cc1O)F 22a_100025702795_100000746061 [0,2,0,0,0,0|1,0,0]=3 19894 B16R1.26593 CCCCNNC(=O)c1ccc(cc1O)I 22a_100025702795_100000091984 [0,2,0,0,0,0|1,0,0]=3 19895 B16R1.26593 CCCCNNC(=O)c1ccc(cc1O)O 22a_100025702795_100000212172 [0,2,0,0,0,0|1,0,0]=3 19896 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011995733 [0,2,0,0,0,0|1,0,0]=3 19897 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100011995733 [0,2,0,0,0,0|1,0,0]=3 19898 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011995733 [0,2,0,0,0,0|1,0,0]=3 19899 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011995733 [0,2,0,0,0,0|1,0,0]=3 19900 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)F 34a_100000210227_100012361341 [0,2,0,0,0,0|1,0,0]=3 19901 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)F 7a_100000210227_100012361341 [0,2,0,0,0,0|1,0,0]=3 19902 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011995733 [0,2,0,0,0,0|1,0,0]=3 19903 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011995733 [0,2,0,0,0,0|1,0,0]=3 19904 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100011995733 [0,2,0,0,0,0|1,0,0]=3 19905 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)C 1458a_100000211164_100011995733 [0,2,0,0,0,0|1,0,0]=3 19906 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)C 34a_100000210227_100000229959 [0,2,0,0,0,0|1,0,0]=3 19907 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)C 7a_100000210227_100000229959 [0,2,0,0,0,0|1,0,0]=3 19908 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011995733 [0,2,0,0,0,0|1,0,0]=3 19909 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)F 1458a_100000686989_100011995733 [0,2,0,0,0,0|1,0,0]=3 19910 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)I 1458a_100010189873_100011995733 [0,2,0,0,0,0|1,0,0]=3 19911 B16R1.26593 CCCCOCC(=O)c1ccc(cc1C)O 1458a_100000692822_100011995733 [0,2,0,0,0,0|1,0,0]=3 19912 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011995733 [0,2,0,0,0,0|1,0,0]=3 19913 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100011995733 [0,2,0,0,0,0|1,0,0]=3 19914 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011995733 [0,2,0,0,0,0|1,0,0]=3 19915 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011995733 [0,2,0,0,0,0|1,0,0]=3 19916 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)F 34a_100000210227_100012056422 [0,2,0,0,0,0|1,0,0]=3 19917 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011995733 [0,2,0,0,0,0|1,0,0]=3 19918 B16R1.26593 CCCCOCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011995733 [0,2,0,0,0,0|1,0,0]=3 19919 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011995733 [0,2,0,0,0,0|1,0,0]=3 19920 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)Br 34a_100000210227_200012361339 [0,2,0,0,0,0|1,0,0]=3 19921 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)Br 7a_100000210227_200012361339 [0,2,0,0,0,0|1,0,0]=3 19922 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)C 1458a_100000766033_100011995733 [0,2,0,0,0,0|1,0,0]=3 19923 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011995733 [0,2,0,0,0,0|1,0,0]=3 19924 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)Cl 34a_100000210227_100012351891 [0,2,0,0,0,0|1,0,0]=3 19925 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)Cl 7a_100000210227_100012351891 [0,2,0,0,0,0|1,0,0]=3 19926 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)F 1458a_100000211022_100011995733 [0,2,0,0,0,0|1,0,0]=3 19927 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)F 34a_100000210227_100000229962 [0,2,0,0,0,0|1,0,0]=3 19928 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)F 7a_100000210227_100000229962 [0,2,0,0,0,0|1,0,0]=3 19929 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)I 1458a_100000037189_100011995733 [0,2,0,0,0,0|1,0,0]=3 19930 B16R1.26593 CCCCOCC(=O)c1ccc(cc1F)O 1458a_100000689029_100011995733 [0,2,0,0,0,0|1,0,0]=3 19931 B16R1.26593 CCCCOCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011995733 [0,2,0,0,0,0|1,0,0]=3 19932 B16R1.26593 CCCCOCC(=O)c1ccc(cc1I)C 1458a_100009999607_100011995733 [0,2,0,0,0,0|1,0,0]=3 19933 B16R1.26593 CCCCOCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011995733 [0,2,0,0,0,0|1,0,0]=3 19934 B16R1.26593 CCCCOCC(=O)c1ccc(cc1I)F 1458a_100000739341_100011995733 [0,2,0,0,0,0|1,0,0]=3 19935 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011995733 [0,2,0,0,0,0|0,0,0]=2 19936 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)C 1458a_100000212137_100011995733 [0,2,0,0,0,0|0,0,0]=2 19937 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011995733 [0,2,0,0,0,0|0,0,0]=2 19938 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011995733 [0,2,0,0,0,0|0,0,0]=2 19939 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)F 34a_100000210227_100009817053 [0,2,0,0,0,0|0,0,0]=2 19940 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011995733 [0,2,0,0,0,0|0,0,0]=2 19941 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011995733 [0,2,0,0,0,0|0,0,0]=2 19942 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)O 34a_100000210227_100009814262 [0,2,0,0,0,0|0,0,0]=2 19943 B16R1.26593 CCCCOCC(=O)c1ccc(cc1O)O 7a_100000210227_100009814262 [0,2,0,0,0,0|0,0,0]=2 19944 B16R1.26593 CCCCSCC(=O)c1ccc(cc1Br)F 62a_100012361341_100000210210 [0,2,0,0,0,0|1,1,0]=4 19945 B16R1.26593 CCCCSCC(=O)c1ccc(cc1C)C 62a_100000210211_100000229959 [0,2,0,0,0,0|1,1,0]=4 19946 B16R1.26593 CCCCSCC(=O)c1ccc(cc1C)C 62a_100000229959_100000210210 [0,2,0,0,0,0|1,1,0]=4 19947 B16R1.26593 CCCCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210210 [0,2,0,0,0,0|1,1,0]=4 19948 B16R1.26593 CCCCSCC(=O)c1ccc(cc1Cl)F 62a_100000210211_100012056422 [0,2,0,0,0,0|1,1,0]=4 19949 B16R1.26593 CCCCSCC(=O)c1ccc(cc1Cl)F 62a_100012056422_100000210210 [0,2,0,0,0,0|1,1,0]=4 19950 B16R1.26593 CCCCSCC(=O)c1ccc(cc1F)Br 62a_200012361339_100000210210 [0,2,0,0,0,0|1,1,0]=4 19951 B16R1.26593 CCCCSCC(=O)c1ccc(cc1F)Cl 62a_100000210211_100012351891 [0,2,0,0,0,0|1,1,0]=4 19952 B16R1.26593 CCCCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210210 [0,2,0,0,0,0|1,1,0]=4 19953 B16R1.26593 CCCCSCC(=O)c1ccc(cc1F)F 62a_100000210211_100000229962 [0,2,0,0,0,0|1,1,0]=4 19954 B16R1.26593 CCCCSCC(=O)c1ccc(cc1F)F 62a_100000229962_100000210210 [0,2,0,0,0,0|1,1,0]=4 19955 B16R1.26593 CCCCSCC(=O)c1ccc(cc1O)F 62a_100000210211_100009817053 [0,2,0,0,0,0|0,1,0]=3 19956 B16R1.26593 CCCCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000210210 [0,2,0,0,0,0|0,1,0]=3 19957 B16R1.26593 CCCCSCC(=O)c1ccc(cc1O)O 62a_100000210211_100009814262 [0,2,0,0,0,0|0,1,0]=3 19958 B16R1.26593 CCCCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000210210 [0,2,0,0,0,0|0,1,0]=3 19959 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100011215938 [0,2,0,0,0,0|2,0,0]=4 19960 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100011215938 [0,2,0,0,0,0|2,0,0]=4 19961 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011215938 [0,2,0,0,0,0|2,0,0]=4 19962 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100011215938 [0,2,0,0,0,0|2,0,0]=4 19963 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100011215938 [0,2,0,0,0,0|2,0,0]=4 19964 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100011215938 [0,2,0,0,0,0|2,0,0]=4 19965 B16R1.26593 CCCOCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100011215938 [0,2,0,0,0,0|2,0,0]=4 19966 B16R1.26593 CCCOCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100011215938 [0,2,0,0,0,0|2,0,0]=4 19967 B16R1.26593 CCCOCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011215938 [0,2,0,0,0,0|2,0,0]=4 19968 B16R1.26593 CCCOCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100011215938 [0,2,0,0,0,0|2,0,0]=4 19969 B16R1.26593 CCCOCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100011215938 [0,2,0,0,0,0|2,0,0]=4 19970 B16R1.26593 CCCOCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100011215938 [0,2,0,0,0,0|2,0,0]=4 19971 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100011215938 [0,2,0,0,0,0|2,0,0]=4 19972 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100011215938 [0,2,0,0,0,0|2,0,0]=4 19973 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215938 [0,2,0,0,0,0|2,0,0]=4 19974 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100011215938 [0,2,0,0,0,0|2,0,0]=4 19975 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100011215938 [0,2,0,0,0,0|2,0,0]=4 19976 B16R1.26593 CCCOCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100011215938 [0,2,0,0,0,0|2,0,0]=4 19977 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100011215938 [0,2,0,0,0,0|2,0,0]=4 19978 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)Br 34a_100000210258_100010339771 [0,2,0,0,0,0|2,0,0]=4 19979 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100011215938 [0,2,0,0,0,0|2,0,0]=4 19980 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011215938 [0,2,0,0,0,0|2,0,0]=4 19981 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100011215938 [0,2,0,0,0,0|2,0,0]=4 19982 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100011215938 [0,2,0,0,0,0|2,0,0]=4 19983 B16R1.26593 CCCOCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100011215938 [0,2,0,0,0,0|2,0,0]=4 19984 B16R1.26593 CCCOCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100011215938 [0,2,0,0,0,0|2,0,0]=4 19985 B16R1.26593 CCCOCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100011215938 [0,2,0,0,0,0|2,0,0]=4 19986 B16R1.26593 CCCOCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011215938 [0,2,0,0,0,0|2,0,0]=4 19987 B16R1.26593 CCCOCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100011215938 [0,2,0,0,0,0|2,0,0]=4 19988 B16R1.26593 CCCOCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100011215938 [0,2,0,0,0,0|1,0,0]=3 19989 B16R1.26593 CCCOCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100011215938 [0,2,0,0,0,0|1,0,0]=3 19990 B16R1.26593 CCCOCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215938 [0,2,0,0,0,0|1,0,0]=3 19991 B16R1.26593 CCCOCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100011215938 [0,2,0,0,0,0|1,0,0]=3 19992 B16R1.26593 CCCOCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100011215938 [0,2,0,0,0,0|1,0,0]=3 19993 B16R1.26593 CCCOCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100011215938 [0,2,0,0,0,0|1,0,0]=3 19994 B16R1.26593 CCCSCCC(=O)c1ccc(cc1F)Br 62a_100000210303_100010339771 [0,2,0,0,0,0|2,0,0]=4 19995 B16R1.26593 CCCSCCC(=O)c1ccc(cc1F)Br 62a_100010339771_100000210303 [0,2,0,0,0,0|2,0,0]=4 19996 B16R1.26593 CCCSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_100000210303 [0,2,0,0,0,0|1,0,0]=3 19997 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100012232248 [0,2,0,0,0,0|2,0,0]=4 19998 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100012232248 [0,2,0,0,0,0|2,0,0]=4 19999 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100012232248 [0,2,0,0,0,0|2,0,0]=4 20000 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100012232248 [0,2,0,0,0,0|2,0,0]=4 20001 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100012232248 [0,2,0,0,0,0|2,0,0]=4 20002 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100012232248 [0,2,0,0,0,0|2,0,0]=4 20003 B16R1.26593 CCOCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100012232248 [0,2,0,0,0,0|2,0,0]=4 20004 B16R1.26593 CCOCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100012232248 [0,2,0,0,0,0|2,0,0]=4 20005 B16R1.26593 CCOCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100012232248 [0,2,0,0,0,0|2,0,0]=4 20006 B16R1.26593 CCOCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100012232248 [0,2,0,0,0,0|2,0,0]=4 20007 B16R1.26593 CCOCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100012232248 [0,2,0,0,0,0|2,0,0]=4 20008 B16R1.26593 CCOCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100012232248 [0,2,0,0,0,0|2,0,0]=4 20009 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100012232248 [0,2,0,0,0,0|2,0,0]=4 20010 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100012232248 [0,2,0,0,0,0|2,0,0]=4 20011 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100012232248 [0,2,0,0,0,0|2,0,0]=4 20012 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100012232248 [0,2,0,0,0,0|2,0,0]=4 20013 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100012232248 [0,2,0,0,0,0|2,0,0]=4 20014 B16R1.26593 CCOCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100012232248 [0,2,0,0,0,0|2,0,0]=4 20015 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100012232248 [0,2,0,0,0,0|2,0,0]=4 20016 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100012232248 [0,2,0,0,0,0|2,0,0]=4 20017 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100012232248 [0,2,0,0,0,0|2,0,0]=4 20018 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100012232248 [0,2,0,0,0,0|2,0,0]=4 20019 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)F 34a_100121572206_100012405562 [0,2,0,0,0,0|2,0,0]=4 20020 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100012232248 [0,2,0,0,0,0|2,0,0]=4 20021 B16R1.26593 CCOCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100012232248 [0,2,0,0,0,0|2,0,0]=4 20022 B16R1.26593 CCOCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100012232248 [0,2,0,0,0,0|2,0,0]=4 20023 B16R1.26593 CCOCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100012232248 [0,2,0,0,0,0|2,0,0]=4 20024 B16R1.26593 CCOCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100012232248 [0,2,0,0,0,0|2,0,0]=4 20025 B16R1.26593 CCOCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100012232248 [0,2,0,0,0,0|2,0,0]=4 20026 B16R1.26593 CCOCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100012232248 [0,2,0,0,0,0|1,0,0]=3 20027 B16R1.26593 CCOCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100012232248 [0,2,0,0,0,0|1,0,0]=3 20028 B16R1.26593 CCOCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100012232248 [0,2,0,0,0,0|1,0,0]=3 20029 B16R1.26593 CCOCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100012232248 [0,2,0,0,0,0|1,0,0]=3 20030 B16R1.26593 CCOCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100012232248 [0,2,0,0,0,0|1,0,0]=3 20031 B16R1.26593 CCOCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100012232248 [0,2,0,0,0,0|1,0,0]=3 20032 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Br 11a_100011200944_100000762965 [0,2,0,0,0,0|2,0,0]=4 20033 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Br 1626a_102516460346_100000762965 [0,2,0,0,0,0|2,0,0]=4 20034 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Br 240690a_100011200944_100000762965 [0,2,0,0,0,0|2,0,0]=4 20035 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Br 527a_100011200944_100000762965 [0,2,0,0,0,0|2,0,0]=4 20036 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)C 11a_100011200944_100000685072 [0,2,0,0,0,0|2,0,0]=4 20037 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)C 1626a_102516460346_100000685072 [0,2,0,0,0,0|2,0,0]=4 20038 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)C 240690a_100011200944_100000685072 [0,2,0,0,0,0|2,0,0]=4 20039 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)C 527a_100011200944_100000685072 [0,2,0,0,0,0|2,0,0]=4 20040 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Cl 11a_100011200944_100000766353 [0,2,0,0,0,0|2,0,0]=4 20041 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Cl 1626a_102516460346_100000766353 [0,2,0,0,0,0|2,0,0]=4 20042 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Cl 240690a_100011200944_100000766353 [0,2,0,0,0,0|2,0,0]=4 20043 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)Cl 527a_100011200944_100000766353 [0,2,0,0,0,0|2,0,0]=4 20044 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)F 11a_100011200944_100000212304 [0,2,0,0,0,0|2,0,0]=4 20045 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)F 1626a_102516460346_100000212304 [0,2,0,0,0,0|2,0,0]=4 20046 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)F 240690a_100011200944_100000212304 [0,2,0,0,0,0|2,0,0]=4 20047 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)F 527a_100011200944_100000212304 [0,2,0,0,0,0|2,0,0]=4 20048 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)I 11a_100011200944_100012360512 [0,2,0,0,0,0|2,0,0]=4 20049 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)I 1626a_102516460346_100012360512 [0,2,0,0,0,0|2,0,0]=4 20050 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)I 240690a_100011200944_100012360512 [0,2,0,0,0,0|2,0,0]=4 20051 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)I 527a_100011200944_100012360512 [0,2,0,0,0,0|2,0,0]=4 20052 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)O 240690a_100011200944_100012344906 [0,2,0,0,0,0|2,0,0]=4 20053 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Br)O 527a_100011200944_100012344906 [0,2,0,0,0,0|2,0,0]=4 20054 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Br 11a_100011200944_100000741311 [0,2,0,0,0,0|2,0,0]=4 20055 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Br 1626a_102516460346_100000741311 [0,2,0,0,0,0|2,0,0]=4 20056 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Br 240690a_100011200944_100000741311 [0,2,0,0,0,0|2,0,0]=4 20057 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Br 527a_100011200944_100000741311 [0,2,0,0,0,0|2,0,0]=4 20058 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)C 11a_100011200944_100000211164 [0,2,0,0,0,0|2,0,0]=4 20059 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)C 1626a_102516460346_100000211164 [0,2,0,0,0,0|2,0,0]=4 20060 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)C 240690a_100011200944_100000211164 [0,2,0,0,0,0|2,0,0]=4 20061 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)C 527a_100011200944_100000211164 [0,2,0,0,0,0|2,0,0]=4 20062 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Cl 11a_100011200944_100000688705 [0,2,0,0,0,0|2,0,0]=4 20063 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Cl 1626a_102516460346_100000688705 [0,2,0,0,0,0|2,0,0]=4 20064 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Cl 240690a_100011200944_100000688705 [0,2,0,0,0,0|2,0,0]=4 20065 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)Cl 527a_100011200944_100000688705 [0,2,0,0,0,0|2,0,0]=4 20066 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)F 11a_100011200944_100000686989 [0,2,0,0,0,0|2,0,0]=4 20067 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)F 1626a_102516460346_100000686989 [0,2,0,0,0,0|2,0,0]=4 20068 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)F 240690a_100011200944_100000686989 [0,2,0,0,0,0|2,0,0]=4 20069 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)F 527a_100011200944_100000686989 [0,2,0,0,0,0|2,0,0]=4 20070 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)I 11a_100011200944_100010189873 [0,2,0,0,0,0|2,0,0]=4 20071 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)I 1626a_102516460346_100010189873 [0,2,0,0,0,0|2,0,0]=4 20072 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)I 240690a_100011200944_100010189873 [0,2,0,0,0,0|2,0,0]=4 20073 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)I 527a_100011200944_100010189873 [0,2,0,0,0,0|2,0,0]=4 20074 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)O 240690a_100011200944_100000692822 [0,2,0,0,0,0|2,0,0]=4 20075 B16R1.26593 CCOCCNC(=O)c1ccc(cc1C)O 527a_100011200944_100000692822 [0,2,0,0,0,0|2,0,0]=4 20076 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Br 11a_100011200944_100000741628 [0,2,0,0,0,0|2,0,0]=4 20077 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Br 1626a_102516460346_100000741628 [0,2,0,0,0,0|2,0,0]=4 20078 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Br 240690a_100011200944_100000741628 [0,2,0,0,0,0|2,0,0]=4 20079 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Br 527a_100011200944_100000741628 [0,2,0,0,0,0|2,0,0]=4 20080 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)C 11a_100011200944_100000766932 [0,2,0,0,0,0|2,0,0]=4 20081 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)C 1626a_102516460346_100000766932 [0,2,0,0,0,0|2,0,0]=4 20082 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)C 240690a_100011200944_100000766932 [0,2,0,0,0,0|2,0,0]=4 20083 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)C 527a_100011200944_100000766932 [0,2,0,0,0,0|2,0,0]=4 20084 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Cl 11a_100011200944_100000185840 [0,2,0,0,0,0|2,0,0]=4 20085 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Cl 1626a_102516460346_100000185840 [0,2,0,0,0,0|2,0,0]=4 20086 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100011200944_100000185840 [0,2,0,0,0,0|2,0,0]=4 20087 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)Cl 527a_100011200944_100000185840 [0,2,0,0,0,0|2,0,0]=4 20088 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)F 11a_100011200944_100000211397 [0,2,0,0,0,0|2,0,0]=4 20089 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)F 1626a_102516460346_100000211397 [0,2,0,0,0,0|2,0,0]=4 20090 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)F 240690a_100011200944_100000211397 [0,2,0,0,0,0|2,0,0]=4 20091 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)F 527a_100011200944_100000211397 [0,2,0,0,0,0|2,0,0]=4 20092 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)I 11a_100011200944_100000751301 [0,2,0,0,0,0|2,0,0]=4 20093 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)I 1626a_102516460346_100000751301 [0,2,0,0,0,0|2,0,0]=4 20094 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)I 240690a_100011200944_100000751301 [0,2,0,0,0,0|2,0,0]=4 20095 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)I 527a_100011200944_100000751301 [0,2,0,0,0,0|2,0,0]=4 20096 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)N 34a_100000725507_100000210202 [0,2,0,0,0,0|2,0,0]=4 20097 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)O 240690a_100011200944_100000702456 [0,2,0,0,0,0|2,0,0]=4 20098 B16R1.26593 CCOCCNC(=O)c1ccc(cc1Cl)O 527a_100011200944_100000702456 [0,2,0,0,0,0|2,0,0]=4 20099 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Br 11a_100011200944_100000214689 [0,2,0,0,0,0|2,0,0]=4 20100 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Br 1626a_102516460346_100000214689 [0,2,0,0,0,0|2,0,0]=4 20101 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Br 240690a_100011200944_100000214689 [0,2,0,0,0,0|2,0,0]=4 20102 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Br 527a_100011200944_100000214689 [0,2,0,0,0,0|2,0,0]=4 20103 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)C 11a_100011200944_100000766033 [0,2,0,0,0,0|2,0,0]=4 20104 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)C 1626a_102516460346_100000766033 [0,2,0,0,0,0|2,0,0]=4 20105 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)C 240690a_100011200944_100000766033 [0,2,0,0,0,0|2,0,0]=4 20106 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)C 527a_100011200944_100000766033 [0,2,0,0,0,0|2,0,0]=4 20107 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Cl 11a_100011200944_100000212326 [0,2,0,0,0,0|2,0,0]=4 20108 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Cl 1626a_102516460346_100000212326 [0,2,0,0,0,0|2,0,0]=4 20109 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Cl 240690a_100011200944_100000212326 [0,2,0,0,0,0|2,0,0]=4 20110 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)Cl 527a_100011200944_100000212326 [0,2,0,0,0,0|2,0,0]=4 20111 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)F 11a_100011200944_100000211022 [0,2,0,0,0,0|2,0,0]=4 20112 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)F 1626a_102516460346_100000211022 [0,2,0,0,0,0|2,0,0]=4 20113 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)F 240690a_100011200944_100000211022 [0,2,0,0,0,0|2,0,0]=4 20114 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)F 527a_100011200944_100000211022 [0,2,0,0,0,0|2,0,0]=4 20115 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)I 11a_100011200944_100000037189 [0,2,0,0,0,0|2,0,0]=4 20116 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)I 1626a_102516460346_100000037189 [0,2,0,0,0,0|2,0,0]=4 20117 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)I 240690a_100011200944_100000037189 [0,2,0,0,0,0|2,0,0]=4 20118 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)I 527a_100011200944_100000037189 [0,2,0,0,0,0|2,0,0]=4 20119 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)O 240690a_100011200944_100000689029 [0,2,0,0,0,0|2,0,0]=4 20120 B16R1.26593 CCOCCNC(=O)c1ccc(cc1F)O 527a_100011200944_100000689029 [0,2,0,0,0,0|2,0,0]=4 20121 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Br 11a_100011200944_100000751167 [0,2,0,0,0,0|2,0,0]=4 20122 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Br 1626a_102516460346_100000751167 [0,2,0,0,0,0|2,0,0]=4 20123 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Br 240690a_100011200944_100000751167 [0,2,0,0,0,0|2,0,0]=4 20124 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Br 527a_100011200944_100000751167 [0,2,0,0,0,0|2,0,0]=4 20125 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)C 11a_100011200944_100009999607 [0,2,0,0,0,0|2,0,0]=4 20126 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)C 1626a_102516460346_100009999607 [0,2,0,0,0,0|2,0,0]=4 20127 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)C 240690a_100011200944_100009999607 [0,2,0,0,0,0|2,0,0]=4 20128 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)C 527a_100011200944_100009999607 [0,2,0,0,0,0|2,0,0]=4 20129 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Cl 11a_100011200944_100000739380 [0,2,0,0,0,0|2,0,0]=4 20130 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Cl 1626a_102516460346_100000739380 [0,2,0,0,0,0|2,0,0]=4 20131 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Cl 240690a_100011200944_100000739380 [0,2,0,0,0,0|2,0,0]=4 20132 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)Cl 527a_100011200944_100000739380 [0,2,0,0,0,0|2,0,0]=4 20133 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)F 11a_100011200944_100000739341 [0,2,0,0,0,0|2,0,0]=4 20134 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)F 1626a_102516460346_100000739341 [0,2,0,0,0,0|2,0,0]=4 20135 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)F 240690a_100011200944_100000739341 [0,2,0,0,0,0|2,0,0]=4 20136 B16R1.26593 CCOCCNC(=O)c1ccc(cc1I)F 527a_100011200944_100000739341 [0,2,0,0,0,0|2,0,0]=4 20137 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)Br 240690a_100011200944_100000744433 [0,2,0,0,0,0|1,0,0]=3 20138 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)Br 527a_100011200944_100000744433 [0,2,0,0,0,0|1,0,0]=3 20139 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)C 1626a_102516460346_100000212137 [0,2,0,0,0,0|1,0,0]=3 20140 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)C 240690a_100011200944_100000212137 [0,2,0,0,0,0|1,0,0]=3 20141 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)C 527a_100011200944_100000212137 [0,2,0,0,0,0|1,0,0]=3 20142 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)Cl 11a_100011200944_100000188622 [0,2,0,0,0,0|1,0,0]=3 20143 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)Cl 240690a_100011200944_100000188622 [0,2,0,0,0,0|1,0,0]=3 20144 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)Cl 527a_100011200944_100000188622 [0,2,0,0,0,0|1,0,0]=3 20145 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)F 240690a_100011200944_100000746061 [0,2,0,0,0,0|1,0,0]=3 20146 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)F 527a_100011200944_100000746061 [0,2,0,0,0,0|1,0,0]=3 20147 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)I 240690a_100011200944_100000091984 [0,2,0,0,0,0|1,0,0]=3 20148 B16R1.26593 CCOCCNC(=O)c1ccc(cc1O)I 527a_100011200944_100000091984 [0,2,0,0,0,0|1,0,0]=3 20149 B16R1.26593 CCOCSCC(=O)c1ccc(cc1O)F 62a_100000739092_100009817053 [0,2,0,0,0,0|1,1,0]=4 20150 B16R1.26593 CCOCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000739092 [0,2,0,0,0,0|1,1,0]=4 20151 B16R1.26593 CCOCSCC(=O)c1ccc(cc1O)O 62a_100000739092_100009814262 [0,2,0,0,0,0|1,1,0]=4 20152 B16R1.26593 CCOCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000739092 [0,2,0,0,0,0|1,1,0]=4 20153 B16R1.26593 CCSCCCC(=O)c1ccc(cc1F)F 62a_100000210202_100012405562 [0,2,0,0,0,0|2,0,0]=4 20154 B16R1.26593 CCSCCCC(=O)c1ccc(cc1F)F 62a_100012405562_100000210202 [0,2,0,0,0,0|2,0,0]=4 20155 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Br 11a_100000106463_100000762965 [0,2,0,0,0,0|2,0,0]=4 20156 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Br 1626a_100000106463_100000762965 [0,2,0,0,0,0|2,0,0]=4 20157 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Br 240690a_100000106463_100000762965 [0,2,0,0,0,0|2,0,0]=4 20158 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Br 527a_100000106463_100000762965 [0,2,0,0,0,0|2,0,0]=4 20159 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)C 11a_100000106463_100000685072 [0,2,0,0,0,0|2,0,0]=4 20160 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)C 1626a_100000106463_100000685072 [0,2,0,0,0,0|2,0,0]=4 20161 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)C 240690a_100000106463_100000685072 [0,2,0,0,0,0|2,0,0]=4 20162 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)C 527a_100000106463_100000685072 [0,2,0,0,0,0|2,0,0]=4 20163 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Cl 11a_100000106463_100000766353 [0,2,0,0,0,0|2,0,0]=4 20164 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000106463_100000766353 [0,2,0,0,0,0|2,0,0]=4 20165 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000106463_100000766353 [0,2,0,0,0,0|2,0,0]=4 20166 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)Cl 527a_100000106463_100000766353 [0,2,0,0,0,0|2,0,0]=4 20167 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)F 11a_100000106463_100000212304 [0,2,0,0,0,0|2,0,0]=4 20168 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)F 1626a_100000106463_100000212304 [0,2,0,0,0,0|2,0,0]=4 20169 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)F 240690a_100000106463_100000212304 [0,2,0,0,0,0|2,0,0]=4 20170 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)F 527a_100000106463_100000212304 [0,2,0,0,0,0|2,0,0]=4 20171 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)I 11a_100000106463_100012360512 [0,2,0,0,0,0|2,0,0]=4 20172 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)I 1626a_100000106463_100012360512 [0,2,0,0,0,0|2,0,0]=4 20173 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)I 240690a_100000106463_100012360512 [0,2,0,0,0,0|2,0,0]=4 20174 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)I 527a_100000106463_100012360512 [0,2,0,0,0,0|2,0,0]=4 20175 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)O 240690a_100000106463_100012344906 [0,2,0,0,0,0|2,0,0]=4 20176 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Br)O 527a_100000106463_100012344906 [0,2,0,0,0,0|2,0,0]=4 20177 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Br 11a_100000106463_100000741311 [0,2,0,0,0,0|2,0,0]=4 20178 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Br 1626a_100000106463_100000741311 [0,2,0,0,0,0|2,0,0]=4 20179 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Br 240690a_100000106463_100000741311 [0,2,0,0,0,0|2,0,0]=4 20180 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Br 527a_100000106463_100000741311 [0,2,0,0,0,0|2,0,0]=4 20181 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)C 11a_100000106463_100000211164 [0,2,0,0,0,0|2,0,0]=4 20182 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)C 1626a_100000106463_100000211164 [0,2,0,0,0,0|2,0,0]=4 20183 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)C 240690a_100000106463_100000211164 [0,2,0,0,0,0|2,0,0]=4 20184 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)C 527a_100000106463_100000211164 [0,2,0,0,0,0|2,0,0]=4 20185 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Cl 11a_100000106463_100000688705 [0,2,0,0,0,0|2,0,0]=4 20186 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Cl 1626a_100000106463_100000688705 [0,2,0,0,0,0|2,0,0]=4 20187 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Cl 240690a_100000106463_100000688705 [0,2,0,0,0,0|2,0,0]=4 20188 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)Cl 527a_100000106463_100000688705 [0,2,0,0,0,0|2,0,0]=4 20189 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)F 11a_100000106463_100000686989 [0,2,0,0,0,0|2,0,0]=4 20190 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)F 1626a_100000106463_100000686989 [0,2,0,0,0,0|2,0,0]=4 20191 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)F 240690a_100000106463_100000686989 [0,2,0,0,0,0|2,0,0]=4 20192 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)F 527a_100000106463_100000686989 [0,2,0,0,0,0|2,0,0]=4 20193 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)I 11a_100000106463_100010189873 [0,2,0,0,0,0|2,0,0]=4 20194 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)I 1626a_100000106463_100010189873 [0,2,0,0,0,0|2,0,0]=4 20195 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)I 240690a_100000106463_100010189873 [0,2,0,0,0,0|2,0,0]=4 20196 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)I 527a_100000106463_100010189873 [0,2,0,0,0,0|2,0,0]=4 20197 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)O 240690a_100000106463_100000692822 [0,2,0,0,0,0|2,0,0]=4 20198 B16R1.26593 CCSCCNC(=O)c1ccc(cc1C)O 527a_100000106463_100000692822 [0,2,0,0,0,0|2,0,0]=4 20199 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Br 11a_100000106463_100000741628 [0,2,0,0,0,0|2,0,0]=4 20200 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000106463_100000741628 [0,2,0,0,0,0|2,0,0]=4 20201 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000106463_100000741628 [0,2,0,0,0,0|2,0,0]=4 20202 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Br 527a_100000106463_100000741628 [0,2,0,0,0,0|2,0,0]=4 20203 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)C 11a_100000106463_100000766932 [0,2,0,0,0,0|2,0,0]=4 20204 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)C 1626a_100000106463_100000766932 [0,2,0,0,0,0|2,0,0]=4 20205 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)C 240690a_100000106463_100000766932 [0,2,0,0,0,0|2,0,0]=4 20206 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)C 527a_100000106463_100000766932 [0,2,0,0,0,0|2,0,0]=4 20207 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000106463_100000185840 [0,2,0,0,0,0|2,0,0]=4 20208 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000106463_100000185840 [0,2,0,0,0,0|2,0,0]=4 20209 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000106463_100000185840 [0,2,0,0,0,0|2,0,0]=4 20210 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000106463_100000185840 [0,2,0,0,0,0|2,0,0]=4 20211 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)F 11a_100000106463_100000211397 [0,2,0,0,0,0|2,0,0]=4 20212 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)F 1626a_100000106463_100000211397 [0,2,0,0,0,0|2,0,0]=4 20213 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)F 240690a_100000106463_100000211397 [0,2,0,0,0,0|2,0,0]=4 20214 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)F 527a_100000106463_100000211397 [0,2,0,0,0,0|2,0,0]=4 20215 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)I 11a_100000106463_100000751301 [0,2,0,0,0,0|2,0,0]=4 20216 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)I 1626a_100000106463_100000751301 [0,2,0,0,0,0|2,0,0]=4 20217 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)I 240690a_100000106463_100000751301 [0,2,0,0,0,0|2,0,0]=4 20218 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)I 527a_100000106463_100000751301 [0,2,0,0,0,0|2,0,0]=4 20219 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)O 240690a_100000106463_100000702456 [0,2,0,0,0,0|2,0,0]=4 20220 B16R1.26593 CCSCCNC(=O)c1ccc(cc1Cl)O 527a_100000106463_100000702456 [0,2,0,0,0,0|2,0,0]=4 20221 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Br 11a_100000106463_100000214689 [0,2,0,0,0,0|2,0,0]=4 20222 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Br 1626a_100000106463_100000214689 [0,2,0,0,0,0|2,0,0]=4 20223 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Br 240690a_100000106463_100000214689 [0,2,0,0,0,0|2,0,0]=4 20224 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Br 527a_100000106463_100000214689 [0,2,0,0,0,0|2,0,0]=4 20225 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)C 11a_100000106463_100000766033 [0,2,0,0,0,0|2,0,0]=4 20226 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)C 1626a_100000106463_100000766033 [0,2,0,0,0,0|2,0,0]=4 20227 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)C 240690a_100000106463_100000766033 [0,2,0,0,0,0|2,0,0]=4 20228 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)C 527a_100000106463_100000766033 [0,2,0,0,0,0|2,0,0]=4 20229 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Cl 11a_100000106463_100000212326 [0,2,0,0,0,0|2,0,0]=4 20230 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Cl 1626a_100000106463_100000212326 [0,2,0,0,0,0|2,0,0]=4 20231 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Cl 240690a_100000106463_100000212326 [0,2,0,0,0,0|2,0,0]=4 20232 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)Cl 527a_100000106463_100000212326 [0,2,0,0,0,0|2,0,0]=4 20233 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)F 11a_100000106463_100000211022 [0,2,0,0,0,0|2,0,0]=4 20234 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)F 1626a_100000106463_100000211022 [0,2,0,0,0,0|2,0,0]=4 20235 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)F 240690a_100000106463_100000211022 [0,2,0,0,0,0|2,0,0]=4 20236 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)F 527a_100000106463_100000211022 [0,2,0,0,0,0|2,0,0]=4 20237 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)I 11a_100000106463_100000037189 [0,2,0,0,0,0|2,0,0]=4 20238 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)I 1626a_100000106463_100000037189 [0,2,0,0,0,0|2,0,0]=4 20239 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)I 240690a_100000106463_100000037189 [0,2,0,0,0,0|2,0,0]=4 20240 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)I 527a_100000106463_100000037189 [0,2,0,0,0,0|2,0,0]=4 20241 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)O 240690a_100000106463_100000689029 [0,2,0,0,0,0|2,0,0]=4 20242 B16R1.26593 CCSCCNC(=O)c1ccc(cc1F)O 527a_100000106463_100000689029 [0,2,0,0,0,0|2,0,0]=4 20243 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Br 11a_100000106463_100000751167 [0,2,0,0,0,0|2,0,0]=4 20244 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Br 1626a_100000106463_100000751167 [0,2,0,0,0,0|2,0,0]=4 20245 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Br 240690a_100000106463_100000751167 [0,2,0,0,0,0|2,0,0]=4 20246 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Br 527a_100000106463_100000751167 [0,2,0,0,0,0|2,0,0]=4 20247 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)C 11a_100000106463_100009999607 [0,2,0,0,0,0|2,0,0]=4 20248 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)C 1626a_100000106463_100009999607 [0,2,0,0,0,0|2,0,0]=4 20249 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)C 240690a_100000106463_100009999607 [0,2,0,0,0,0|2,0,0]=4 20250 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)C 527a_100000106463_100009999607 [0,2,0,0,0,0|2,0,0]=4 20251 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Cl 11a_100000106463_100000739380 [0,2,0,0,0,0|2,0,0]=4 20252 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Cl 1626a_100000106463_100000739380 [0,2,0,0,0,0|2,0,0]=4 20253 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Cl 240690a_100000106463_100000739380 [0,2,0,0,0,0|2,0,0]=4 20254 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)Cl 527a_100000106463_100000739380 [0,2,0,0,0,0|2,0,0]=4 20255 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)F 11a_100000106463_100000739341 [0,2,0,0,0,0|2,0,0]=4 20256 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)F 1626a_100000106463_100000739341 [0,2,0,0,0,0|2,0,0]=4 20257 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)F 240690a_100000106463_100000739341 [0,2,0,0,0,0|2,0,0]=4 20258 B16R1.26593 CCSCCNC(=O)c1ccc(cc1I)F 527a_100000106463_100000739341 [0,2,0,0,0,0|2,0,0]=4 20259 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)Br 240690a_100000106463_100000744433 [0,2,0,0,0,0|1,0,0]=3 20260 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)Br 527a_100000106463_100000744433 [0,2,0,0,0,0|1,0,0]=3 20261 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)C 1626a_100000106463_100000212137 [0,2,0,0,0,0|1,0,0]=3 20262 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)C 240690a_100000106463_100000212137 [0,2,0,0,0,0|1,0,0]=3 20263 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)C 527a_100000106463_100000212137 [0,2,0,0,0,0|1,0,0]=3 20264 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)Cl 11a_100000106463_100000188622 [0,2,0,0,0,0|1,0,0]=3 20265 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)Cl 240690a_100000106463_100000188622 [0,2,0,0,0,0|1,0,0]=3 20266 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)Cl 527a_100000106463_100000188622 [0,2,0,0,0,0|1,0,0]=3 20267 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)F 240690a_100000106463_100000746061 [0,2,0,0,0,0|1,0,0]=3 20268 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)F 527a_100000106463_100000746061 [0,2,0,0,0,0|1,0,0]=3 20269 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)I 240690a_100000106463_100000091984 [0,2,0,0,0,0|1,0,0]=3 20270 B16R1.26593 CCSCCNC(=O)c1ccc(cc1O)I 527a_100000106463_100000091984 [0,2,0,0,0,0|1,0,0]=3 20271 B16R1.26593 COCCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000755781 [0,2,0,0,0,0|2,0,0]=4 20272 B16R1.26593 COCCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000755781 [0,2,0,0,0,0|2,0,0]=4 20273 B16R1.26593 COCCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000755781 [0,2,0,0,0,0|2,0,0]=4 20274 B16R1.26593 COCCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000755781 [0,2,0,0,0,0|2,0,0]=4 20275 B16R1.26593 COCCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000755781 [0,2,0,0,0,0|2,0,0]=4 20276 B16R1.26593 COCCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000755781 [0,2,0,0,0,0|2,0,0]=4 20277 B16R1.26593 COCCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000755781 [0,2,0,0,0,0|2,0,0]=4 20278 B16R1.26593 COCCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000755781 [0,2,0,0,0,0|2,0,0]=4 20279 B16R1.26593 COCCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000755781 [0,2,0,0,0,0|2,0,0]=4 20280 B16R1.26593 COCCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000755781 [0,2,0,0,0,0|2,0,0]=4 20281 B16R1.26593 COCCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000755781 [0,2,0,0,0,0|2,0,0]=4 20282 B16R1.26593 COCCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000755781 [0,2,0,0,0,0|2,0,0]=4 20283 B16R1.26593 COCCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000755781 [0,2,0,0,0,0|2,0,0]=4 20284 B16R1.26593 COCCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000755781 [0,2,0,0,0,0|2,0,0]=4 20285 B16R1.26593 COCCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000755781 [0,2,0,0,0,0|2,0,0]=4 20286 B16R1.26593 COCCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000755781 [0,2,0,0,0,0|2,0,0]=4 20287 B16R1.26593 COCCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000755781 [0,2,0,0,0,0|2,0,0]=4 20288 B16R1.26593 COCCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000755781 [0,2,0,0,0,0|2,0,0]=4 20289 B16R1.26593 COCCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000755781 [0,2,0,0,0,0|2,0,0]=4 20290 B16R1.26593 COCCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000755781 [0,2,0,0,0,0|2,0,0]=4 20291 B16R1.26593 COCCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000755781 [0,2,0,0,0,0|2,0,0]=4 20292 B16R1.26593 COCCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000755781 [0,2,0,0,0,0|2,0,0]=4 20293 B16R1.26593 COCCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000755781 [0,2,0,0,0,0|2,0,0]=4 20294 B16R1.26593 COCCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000755781 [0,2,0,0,0,0|2,0,0]=4 20295 B16R1.26593 COCCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000755781 [0,2,0,0,0,0|2,0,0]=4 20296 B16R1.26593 COCCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000755781 [0,2,0,0,0,0|2,0,0]=4 20297 B16R1.26593 COCCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000755781 [0,2,0,0,0,0|2,0,0]=4 20298 B16R1.26593 COCCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000755781 [0,2,0,0,0,0|2,0,0]=4 20299 B16R1.26593 COCCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000755781 [0,2,0,0,0,0|1,0,0]=3 20300 B16R1.26593 COCCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000755781 [0,2,0,0,0,0|1,0,0]=3 20301 B16R1.26593 COCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000755781 [0,2,0,0,0,0|1,0,0]=3 20302 B16R1.26593 COCCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000755781 [0,2,0,0,0,0|1,0,0]=3 20303 B16R1.26593 COCCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000755781 [0,2,0,0,0,0|1,0,0]=3 20304 B16R1.26593 COCCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000755781 [0,2,0,0,0,0|1,0,0]=3 20305 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)Br 1626a_100150723488_100000762965 [0,2,0,0,0,0|2,0,0]=4 20306 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)Br 240690a_100150723488_100000762965 [0,2,0,0,0,0|2,0,0]=4 20307 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)Br 527a_100150723488_100000762965 [0,2,0,0,0,0|2,0,0]=4 20308 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)C 1626a_100150723488_100000685072 [0,2,0,0,0,0|2,0,0]=4 20309 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)C 240690a_100150723488_100000685072 [0,2,0,0,0,0|2,0,0]=4 20310 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)C 527a_100150723488_100000685072 [0,2,0,0,0,0|2,0,0]=4 20311 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)Cl 1626a_100150723488_100000766353 [0,2,0,0,0,0|2,0,0]=4 20312 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)Cl 240690a_100150723488_100000766353 [0,2,0,0,0,0|2,0,0]=4 20313 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)Cl 527a_100150723488_100000766353 [0,2,0,0,0,0|2,0,0]=4 20314 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)F 1626a_100150723488_100000212304 [0,2,0,0,0,0|2,0,0]=4 20315 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)F 240690a_100150723488_100000212304 [0,2,0,0,0,0|2,0,0]=4 20316 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)F 527a_100150723488_100000212304 [0,2,0,0,0,0|2,0,0]=4 20317 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)I 1626a_100150723488_100012360512 [0,2,0,0,0,0|2,0,0]=4 20318 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)I 240690a_100150723488_100012360512 [0,2,0,0,0,0|2,0,0]=4 20319 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)I 527a_100150723488_100012360512 [0,2,0,0,0,0|2,0,0]=4 20320 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)O 240690a_100150723488_100012344906 [0,2,0,0,0,0|2,0,0]=4 20321 B16R1.26593 COCCCNC(=O)c1ccc(cc1Br)O 527a_100150723488_100012344906 [0,2,0,0,0,0|2,0,0]=4 20322 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)Br 1626a_100150723488_100000741311 [0,2,0,0,0,0|2,0,0]=4 20323 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)Br 240690a_100150723488_100000741311 [0,2,0,0,0,0|2,0,0]=4 20324 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)Br 527a_100150723488_100000741311 [0,2,0,0,0,0|2,0,0]=4 20325 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)C 1626a_100150723488_100000211164 [0,2,0,0,0,0|2,0,0]=4 20326 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)C 240690a_100150723488_100000211164 [0,2,0,0,0,0|2,0,0]=4 20327 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)C 527a_100150723488_100000211164 [0,2,0,0,0,0|2,0,0]=4 20328 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)Cl 1626a_100150723488_100000688705 [0,2,0,0,0,0|2,0,0]=4 20329 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)Cl 240690a_100150723488_100000688705 [0,2,0,0,0,0|2,0,0]=4 20330 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)Cl 527a_100150723488_100000688705 [0,2,0,0,0,0|2,0,0]=4 20331 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)F 1626a_100150723488_100000686989 [0,2,0,0,0,0|2,0,0]=4 20332 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)F 240690a_100150723488_100000686989 [0,2,0,0,0,0|2,0,0]=4 20333 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)F 527a_100150723488_100000686989 [0,2,0,0,0,0|2,0,0]=4 20334 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)I 1626a_100150723488_100010189873 [0,2,0,0,0,0|2,0,0]=4 20335 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)I 240690a_100150723488_100010189873 [0,2,0,0,0,0|2,0,0]=4 20336 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)I 527a_100150723488_100010189873 [0,2,0,0,0,0|2,0,0]=4 20337 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)O 240690a_100150723488_100000692822 [0,2,0,0,0,0|2,0,0]=4 20338 B16R1.26593 COCCCNC(=O)c1ccc(cc1C)O 527a_100150723488_100000692822 [0,2,0,0,0,0|2,0,0]=4 20339 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)Br 1626a_100150723488_100000741628 [0,2,0,0,0,0|2,0,0]=4 20340 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)Br 240690a_100150723488_100000741628 [0,2,0,0,0,0|2,0,0]=4 20341 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)Br 527a_100150723488_100000741628 [0,2,0,0,0,0|2,0,0]=4 20342 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)C 1626a_100150723488_100000766932 [0,2,0,0,0,0|2,0,0]=4 20343 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)C 240690a_100150723488_100000766932 [0,2,0,0,0,0|2,0,0]=4 20344 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)C 527a_100150723488_100000766932 [0,2,0,0,0,0|2,0,0]=4 20345 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100150723488_100000185840 [0,2,0,0,0,0|2,0,0]=4 20346 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100150723488_100000185840 [0,2,0,0,0,0|2,0,0]=4 20347 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)Cl 527a_100150723488_100000185840 [0,2,0,0,0,0|2,0,0]=4 20348 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)F 1626a_100150723488_100000211397 [0,2,0,0,0,0|2,0,0]=4 20349 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)F 240690a_100150723488_100000211397 [0,2,0,0,0,0|2,0,0]=4 20350 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)F 527a_100150723488_100000211397 [0,2,0,0,0,0|2,0,0]=4 20351 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)I 1626a_100150723488_100000751301 [0,2,0,0,0,0|2,0,0]=4 20352 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)I 240690a_100150723488_100000751301 [0,2,0,0,0,0|2,0,0]=4 20353 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)I 527a_100150723488_100000751301 [0,2,0,0,0,0|2,0,0]=4 20354 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)O 240690a_100150723488_100000702456 [0,2,0,0,0,0|2,0,0]=4 20355 B16R1.26593 COCCCNC(=O)c1ccc(cc1Cl)O 527a_100150723488_100000702456 [0,2,0,0,0,0|2,0,0]=4 20356 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)Br 1626a_100150723488_100000214689 [0,2,0,0,0,0|2,0,0]=4 20357 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)Br 240690a_100150723488_100000214689 [0,2,0,0,0,0|2,0,0]=4 20358 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)Br 527a_100150723488_100000214689 [0,2,0,0,0,0|2,0,0]=4 20359 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)C 1626a_100150723488_100000766033 [0,2,0,0,0,0|2,0,0]=4 20360 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)C 240690a_100150723488_100000766033 [0,2,0,0,0,0|2,0,0]=4 20361 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)C 527a_100150723488_100000766033 [0,2,0,0,0,0|2,0,0]=4 20362 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)Cl 1626a_100150723488_100000212326 [0,2,0,0,0,0|2,0,0]=4 20363 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)Cl 240690a_100150723488_100000212326 [0,2,0,0,0,0|2,0,0]=4 20364 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)Cl 527a_100150723488_100000212326 [0,2,0,0,0,0|2,0,0]=4 20365 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)F 1626a_100150723488_100000211022 [0,2,0,0,0,0|2,0,0]=4 20366 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)F 240690a_100150723488_100000211022 [0,2,0,0,0,0|2,0,0]=4 20367 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)F 527a_100150723488_100000211022 [0,2,0,0,0,0|2,0,0]=4 20368 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)I 1626a_100150723488_100000037189 [0,2,0,0,0,0|2,0,0]=4 20369 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)I 240690a_100150723488_100000037189 [0,2,0,0,0,0|2,0,0]=4 20370 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)I 527a_100150723488_100000037189 [0,2,0,0,0,0|2,0,0]=4 20371 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)O 240690a_100150723488_100000689029 [0,2,0,0,0,0|2,0,0]=4 20372 B16R1.26593 COCCCNC(=O)c1ccc(cc1F)O 527a_100150723488_100000689029 [0,2,0,0,0,0|2,0,0]=4 20373 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)Br 1626a_100150723488_100000751167 [0,2,0,0,0,0|2,0,0]=4 20374 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)Br 240690a_100150723488_100000751167 [0,2,0,0,0,0|2,0,0]=4 20375 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)Br 527a_100150723488_100000751167 [0,2,0,0,0,0|2,0,0]=4 20376 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)C 1626a_100150723488_100009999607 [0,2,0,0,0,0|2,0,0]=4 20377 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)C 240690a_100150723488_100009999607 [0,2,0,0,0,0|2,0,0]=4 20378 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)C 527a_100150723488_100009999607 [0,2,0,0,0,0|2,0,0]=4 20379 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)Cl 1626a_100150723488_100000739380 [0,2,0,0,0,0|2,0,0]=4 20380 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)Cl 240690a_100150723488_100000739380 [0,2,0,0,0,0|2,0,0]=4 20381 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)Cl 527a_100150723488_100000739380 [0,2,0,0,0,0|2,0,0]=4 20382 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)F 1626a_100150723488_100000739341 [0,2,0,0,0,0|2,0,0]=4 20383 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)F 240690a_100150723488_100000739341 [0,2,0,0,0,0|2,0,0]=4 20384 B16R1.26593 COCCCNC(=O)c1ccc(cc1I)F 527a_100150723488_100000739341 [0,2,0,0,0,0|2,0,0]=4 20385 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)Br 240690a_100150723488_100000744433 [0,2,0,0,0,0|1,0,0]=3 20386 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)Br 527a_100150723488_100000744433 [0,2,0,0,0,0|1,0,0]=3 20387 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)C 1626a_100150723488_100000212137 [0,2,0,0,0,0|1,0,0]=3 20388 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)C 240690a_100150723488_100000212137 [0,2,0,0,0,0|1,0,0]=3 20389 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)C 527a_100150723488_100000212137 [0,2,0,0,0,0|1,0,0]=3 20390 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)Cl 240690a_100150723488_100000188622 [0,2,0,0,0,0|1,0,0]=3 20391 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)Cl 527a_100150723488_100000188622 [0,2,0,0,0,0|1,0,0]=3 20392 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)F 240690a_100150723488_100000746061 [0,2,0,0,0,0|1,0,0]=3 20393 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)F 527a_100150723488_100000746061 [0,2,0,0,0,0|1,0,0]=3 20394 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)I 240690a_100150723488_100000091984 [0,2,0,0,0,0|1,0,0]=3 20395 B16R1.26593 COCCCNC(=O)c1ccc(cc1O)I 527a_100150723488_100000091984 [0,2,0,0,0,0|1,0,0]=3 20396 B16R1.26593 COCCNNC(=O)c1ccc(cc1O)Br 22a_100000741390_100000744433 [0,2,0,0,0,0|2,0,0]=4 20397 B16R1.26593 COCCNNC(=O)c1ccc(cc1O)C 22a_100000741390_100000212137 [0,2,0,0,0,0|2,0,0]=4 20398 B16R1.26593 COCCNNC(=O)c1ccc(cc1O)Cl 22a_100000741390_100000188622 [0,2,0,0,0,0|2,0,0]=4 20399 B16R1.26593 COCCNNC(=O)c1ccc(cc1O)F 22a_100000741390_100000746061 [0,2,0,0,0,0|2,0,0]=4 20400 B16R1.26593 COCCNNC(=O)c1ccc(cc1O)I 22a_100000741390_100000091984 [0,2,0,0,0,0|2,0,0]=4 20401 B16R1.26593 COCCNNC(=O)c1ccc(cc1O)O 22a_100000741390_100000212172 [0,2,0,0,0,0|2,0,0]=4 20402 B16R1.26593 COCCOCC(=O)c1ccc(cc1Br)F 34a_100000210237_100012361341 [0,2,0,0,0,0|2,0,0]=4 20403 B16R1.26593 COCCOCC(=O)c1ccc(cc1C)C 34a_100000210237_100000229959 [0,2,0,0,0,0|2,0,0]=4 20404 B16R1.26593 COCCOCC(=O)c1ccc(cc1Cl)F 34a_100000210237_100012056422 [0,2,0,0,0,0|2,0,0]=4 20405 B16R1.26593 COCCOCC(=O)c1ccc(cc1F)Br 34a_100000210237_200012361339 [0,2,0,0,0,0|2,0,0]=4 20406 B16R1.26593 COCCOCC(=O)c1ccc(cc1F)Cl 34a_100000210237_100012351891 [0,2,0,0,0,0|2,0,0]=4 20407 B16R1.26593 COCCOCC(=O)c1ccc(cc1F)F 34a_100000210237_100000229962 [0,2,0,0,0,0|2,0,0]=4 20408 B16R1.26593 COCCOCC(=O)c1ccc(cc1O)F 34a_100000210237_100009817053 [0,2,0,0,0,0|1,0,0]=3 20409 B16R1.26593 COCCOCC(=O)c1ccc(cc1O)O 34a_100000210237_100009814262 [0,2,0,0,0,0|1,0,0]=3 20410 B16R1.26593 COCCSCC(=O)c1ccc(cc1O)F 62a_100000233755_100009817053 [0,2,0,0,0,0|1,1,0]=4 20411 B16R1.26593 COCCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000233755 [0,2,0,0,0,0|1,1,0]=4 20412 B16R1.26593 COCCSCC(=O)c1ccc(cc1O)O 62a_100000233755_100009814262 [0,2,0,0,0,0|1,1,0]=4 20413 B16R1.26593 COCCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000233755 [0,2,0,0,0,0|1,1,0]=4 20414 B16R1.26593 COCSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_100000766300 [0,2,0,0,0,0|2,0,0]=4 20415 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Br 11a_100000749238_100000762965 [0,2,0,0,0,0|2,0,0]=4 20416 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Br 1626a_100000749238_100000762965 [0,2,0,0,0,0|2,0,0]=4 20417 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Br 240690a_100000749238_100000762965 [0,2,0,0,0,0|2,0,0]=4 20418 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Br 527a_100000749238_100000762965 [0,2,0,0,0,0|2,0,0]=4 20419 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)C 11a_100000749238_100000685072 [0,2,0,0,0,0|2,0,0]=4 20420 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)C 1626a_100000749238_100000685072 [0,2,0,0,0,0|2,0,0]=4 20421 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)C 240690a_100000749238_100000685072 [0,2,0,0,0,0|2,0,0]=4 20422 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)C 527a_100000749238_100000685072 [0,2,0,0,0,0|2,0,0]=4 20423 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Cl 11a_100000749238_100000766353 [0,2,0,0,0,0|2,0,0]=4 20424 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000749238_100000766353 [0,2,0,0,0,0|2,0,0]=4 20425 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000749238_100000766353 [0,2,0,0,0,0|2,0,0]=4 20426 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)Cl 527a_100000749238_100000766353 [0,2,0,0,0,0|2,0,0]=4 20427 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)F 11a_100000749238_100000212304 [0,2,0,0,0,0|2,0,0]=4 20428 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)F 1626a_100000749238_100000212304 [0,2,0,0,0,0|2,0,0]=4 20429 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)F 240690a_100000749238_100000212304 [0,2,0,0,0,0|2,0,0]=4 20430 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)F 527a_100000749238_100000212304 [0,2,0,0,0,0|2,0,0]=4 20431 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)I 11a_100000749238_100012360512 [0,2,0,0,0,0|2,0,0]=4 20432 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)I 1626a_100000749238_100012360512 [0,2,0,0,0,0|2,0,0]=4 20433 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)I 240690a_100000749238_100012360512 [0,2,0,0,0,0|2,0,0]=4 20434 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)I 527a_100000749238_100012360512 [0,2,0,0,0,0|2,0,0]=4 20435 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)O 240690a_100000749238_100012344906 [0,2,0,0,0,0|2,0,0]=4 20436 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Br)O 527a_100000749238_100012344906 [0,2,0,0,0,0|2,0,0]=4 20437 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Br 11a_100000749238_100000741311 [0,2,0,0,0,0|2,0,0]=4 20438 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Br 1626a_100000749238_100000741311 [0,2,0,0,0,0|2,0,0]=4 20439 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Br 240690a_100000749238_100000741311 [0,2,0,0,0,0|2,0,0]=4 20440 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Br 527a_100000749238_100000741311 [0,2,0,0,0,0|2,0,0]=4 20441 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)C 11a_100000749238_100000211164 [0,2,0,0,0,0|2,0,0]=4 20442 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)C 1626a_100000749238_100000211164 [0,2,0,0,0,0|2,0,0]=4 20443 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)C 240690a_100000749238_100000211164 [0,2,0,0,0,0|2,0,0]=4 20444 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)C 527a_100000749238_100000211164 [0,2,0,0,0,0|2,0,0]=4 20445 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Cl 11a_100000749238_100000688705 [0,2,0,0,0,0|2,0,0]=4 20446 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Cl 1626a_100000749238_100000688705 [0,2,0,0,0,0|2,0,0]=4 20447 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Cl 240690a_100000749238_100000688705 [0,2,0,0,0,0|2,0,0]=4 20448 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)Cl 527a_100000749238_100000688705 [0,2,0,0,0,0|2,0,0]=4 20449 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)F 11a_100000749238_100000686989 [0,2,0,0,0,0|2,0,0]=4 20450 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)F 1626a_100000749238_100000686989 [0,2,0,0,0,0|2,0,0]=4 20451 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)F 240690a_100000749238_100000686989 [0,2,0,0,0,0|2,0,0]=4 20452 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)F 527a_100000749238_100000686989 [0,2,0,0,0,0|2,0,0]=4 20453 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)I 11a_100000749238_100010189873 [0,2,0,0,0,0|2,0,0]=4 20454 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)I 1626a_100000749238_100010189873 [0,2,0,0,0,0|2,0,0]=4 20455 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)I 240690a_100000749238_100010189873 [0,2,0,0,0,0|2,0,0]=4 20456 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)I 527a_100000749238_100010189873 [0,2,0,0,0,0|2,0,0]=4 20457 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)O 240690a_100000749238_100000692822 [0,2,0,0,0,0|2,0,0]=4 20458 B16R1.26593 CSCCCNC(=O)c1ccc(cc1C)O 527a_100000749238_100000692822 [0,2,0,0,0,0|2,0,0]=4 20459 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Br 11a_100000749238_100000741628 [0,2,0,0,0,0|2,0,0]=4 20460 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000749238_100000741628 [0,2,0,0,0,0|2,0,0]=4 20461 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000749238_100000741628 [0,2,0,0,0,0|2,0,0]=4 20462 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Br 527a_100000749238_100000741628 [0,2,0,0,0,0|2,0,0]=4 20463 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)C 11a_100000749238_100000766932 [0,2,0,0,0,0|2,0,0]=4 20464 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)C 1626a_100000749238_100000766932 [0,2,0,0,0,0|2,0,0]=4 20465 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)C 240690a_100000749238_100000766932 [0,2,0,0,0,0|2,0,0]=4 20466 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)C 527a_100000749238_100000766932 [0,2,0,0,0,0|2,0,0]=4 20467 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000749238_100000185840 [0,2,0,0,0,0|2,0,0]=4 20468 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000749238_100000185840 [0,2,0,0,0,0|2,0,0]=4 20469 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000749238_100000185840 [0,2,0,0,0,0|2,0,0]=4 20470 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000749238_100000185840 [0,2,0,0,0,0|2,0,0]=4 20471 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)F 11a_100000749238_100000211397 [0,2,0,0,0,0|2,0,0]=4 20472 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)F 1626a_100000749238_100000211397 [0,2,0,0,0,0|2,0,0]=4 20473 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)F 240690a_100000749238_100000211397 [0,2,0,0,0,0|2,0,0]=4 20474 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)F 527a_100000749238_100000211397 [0,2,0,0,0,0|2,0,0]=4 20475 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)I 11a_100000749238_100000751301 [0,2,0,0,0,0|2,0,0]=4 20476 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)I 1626a_100000749238_100000751301 [0,2,0,0,0,0|2,0,0]=4 20477 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)I 240690a_100000749238_100000751301 [0,2,0,0,0,0|2,0,0]=4 20478 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)I 527a_100000749238_100000751301 [0,2,0,0,0,0|2,0,0]=4 20479 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)O 240690a_100000749238_100000702456 [0,2,0,0,0,0|2,0,0]=4 20480 B16R1.26593 CSCCCNC(=O)c1ccc(cc1Cl)O 527a_100000749238_100000702456 [0,2,0,0,0,0|2,0,0]=4 20481 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Br 11a_100000749238_100000214689 [0,2,0,0,0,0|2,0,0]=4 20482 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Br 1626a_100000749238_100000214689 [0,2,0,0,0,0|2,0,0]=4 20483 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Br 240690a_100000749238_100000214689 [0,2,0,0,0,0|2,0,0]=4 20484 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Br 527a_100000749238_100000214689 [0,2,0,0,0,0|2,0,0]=4 20485 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)C 11a_100000749238_100000766033 [0,2,0,0,0,0|2,0,0]=4 20486 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)C 1626a_100000749238_100000766033 [0,2,0,0,0,0|2,0,0]=4 20487 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)C 240690a_100000749238_100000766033 [0,2,0,0,0,0|2,0,0]=4 20488 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)C 527a_100000749238_100000766033 [0,2,0,0,0,0|2,0,0]=4 20489 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Cl 11a_100000749238_100000212326 [0,2,0,0,0,0|2,0,0]=4 20490 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Cl 1626a_100000749238_100000212326 [0,2,0,0,0,0|2,0,0]=4 20491 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Cl 240690a_100000749238_100000212326 [0,2,0,0,0,0|2,0,0]=4 20492 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)Cl 527a_100000749238_100000212326 [0,2,0,0,0,0|2,0,0]=4 20493 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)F 11a_100000749238_100000211022 [0,2,0,0,0,0|2,0,0]=4 20494 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)F 1626a_100000749238_100000211022 [0,2,0,0,0,0|2,0,0]=4 20495 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)F 240690a_100000749238_100000211022 [0,2,0,0,0,0|2,0,0]=4 20496 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)F 527a_100000749238_100000211022 [0,2,0,0,0,0|2,0,0]=4 20497 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)I 11a_100000749238_100000037189 [0,2,0,0,0,0|2,0,0]=4 20498 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)I 1626a_100000749238_100000037189 [0,2,0,0,0,0|2,0,0]=4 20499 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)I 240690a_100000749238_100000037189 [0,2,0,0,0,0|2,0,0]=4 20500 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)I 527a_100000749238_100000037189 [0,2,0,0,0,0|2,0,0]=4 20501 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)O 240690a_100000749238_100000689029 [0,2,0,0,0,0|2,0,0]=4 20502 B16R1.26593 CSCCCNC(=O)c1ccc(cc1F)O 527a_100000749238_100000689029 [0,2,0,0,0,0|2,0,0]=4 20503 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Br 11a_100000749238_100000751167 [0,2,0,0,0,0|2,0,0]=4 20504 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Br 1626a_100000749238_100000751167 [0,2,0,0,0,0|2,0,0]=4 20505 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Br 240690a_100000749238_100000751167 [0,2,0,0,0,0|2,0,0]=4 20506 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Br 527a_100000749238_100000751167 [0,2,0,0,0,0|2,0,0]=4 20507 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)C 11a_100000749238_100009999607 [0,2,0,0,0,0|2,0,0]=4 20508 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)C 1626a_100000749238_100009999607 [0,2,0,0,0,0|2,0,0]=4 20509 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)C 240690a_100000749238_100009999607 [0,2,0,0,0,0|2,0,0]=4 20510 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)C 527a_100000749238_100009999607 [0,2,0,0,0,0|2,0,0]=4 20511 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Cl 11a_100000749238_100000739380 [0,2,0,0,0,0|2,0,0]=4 20512 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Cl 1626a_100000749238_100000739380 [0,2,0,0,0,0|2,0,0]=4 20513 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Cl 240690a_100000749238_100000739380 [0,2,0,0,0,0|2,0,0]=4 20514 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)Cl 527a_100000749238_100000739380 [0,2,0,0,0,0|2,0,0]=4 20515 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)F 11a_100000749238_100000739341 [0,2,0,0,0,0|2,0,0]=4 20516 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)F 1626a_100000749238_100000739341 [0,2,0,0,0,0|2,0,0]=4 20517 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)F 240690a_100000749238_100000739341 [0,2,0,0,0,0|2,0,0]=4 20518 B16R1.26593 CSCCCNC(=O)c1ccc(cc1I)F 527a_100000749238_100000739341 [0,2,0,0,0,0|2,0,0]=4 20519 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)Br 240690a_100000749238_100000744433 [0,2,0,0,0,0|1,0,0]=3 20520 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)Br 527a_100000749238_100000744433 [0,2,0,0,0,0|1,0,0]=3 20521 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)C 1626a_100000749238_100000212137 [0,2,0,0,0,0|1,0,0]=3 20522 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)C 240690a_100000749238_100000212137 [0,2,0,0,0,0|1,0,0]=3 20523 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)C 527a_100000749238_100000212137 [0,2,0,0,0,0|1,0,0]=3 20524 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)Cl 11a_100000749238_100000188622 [0,2,0,0,0,0|1,0,0]=3 20525 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)Cl 240690a_100000749238_100000188622 [0,2,0,0,0,0|1,0,0]=3 20526 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)Cl 527a_100000749238_100000188622 [0,2,0,0,0,0|1,0,0]=3 20527 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)F 240690a_100000749238_100000746061 [0,2,0,0,0,0|1,0,0]=3 20528 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)F 527a_100000749238_100000746061 [0,2,0,0,0,0|1,0,0]=3 20529 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)I 240690a_100000749238_100000091984 [0,2,0,0,0,0|1,0,0]=3 20530 B16R1.26593 CSCCCNC(=O)c1ccc(cc1O)I 527a_100000749238_100000091984 [0,2,0,0,0,0|1,0,0]=3 20531 B16R1.26593 CSCCOCC(=O)c1ccc(cc1Br)F 34a_100000230434_100012361341 [0,2,0,0,0,0|2,0,0]=4 20532 B16R1.26593 CSCCOCC(=O)c1ccc(cc1Br)F 7a_100000230434_100012361341 [0,2,0,0,0,0|2,0,0]=4 20533 B16R1.26593 CSCCOCC(=O)c1ccc(cc1C)C 34a_100000230434_100000229959 [0,2,0,0,0,0|2,0,0]=4 20534 B16R1.26593 CSCCOCC(=O)c1ccc(cc1C)C 7a_100000230434_100000229959 [0,2,0,0,0,0|2,0,0]=4 20535 B16R1.26593 CSCCOCC(=O)c1ccc(cc1Cl)F 34a_100000230434_100012056422 [0,2,0,0,0,0|2,0,0]=4 20536 B16R1.26593 CSCCOCC(=O)c1ccc(cc1F)Br 34a_100000230434_200012361339 [0,2,0,0,0,0|2,0,0]=4 20537 B16R1.26593 CSCCOCC(=O)c1ccc(cc1F)Br 7a_100000230434_200012361339 [0,2,0,0,0,0|2,0,0]=4 20538 B16R1.26593 CSCCOCC(=O)c1ccc(cc1F)Cl 34a_100000230434_100012351891 [0,2,0,0,0,0|2,0,0]=4 20539 B16R1.26593 CSCCOCC(=O)c1ccc(cc1F)Cl 7a_100000230434_100012351891 [0,2,0,0,0,0|2,0,0]=4 20540 B16R1.26593 CSCCOCC(=O)c1ccc(cc1F)F 34a_100000230434_100000229962 [0,2,0,0,0,0|2,0,0]=4 20541 B16R1.26593 CSCCOCC(=O)c1ccc(cc1F)F 7a_100000230434_100000229962 [0,2,0,0,0,0|2,0,0]=4 20542 B16R1.26593 CSCCOCC(=O)c1ccc(cc1O)F 34a_100000230434_100009817053 [0,2,0,0,0,0|1,0,0]=3 20543 B16R1.26593 CSCCOCC(=O)c1ccc(cc1O)O 34a_100000230434_100009814262 [0,2,0,0,0,0|1,0,0]=3 20544 B16R1.26593 CSCCOCC(=O)c1ccc(cc1O)O 7a_100000230434_100009814262 [0,2,0,0,0,0|1,0,0]=3 20545 B16R1.26593 CSCCSCC(=O)c1ccc(cc1O)F 62a_100000212216_100009817053 [0,2,0,0,0,0|1,1,0]=4 20546 B16R1.26593 CSCCSCC(=O)c1ccc(cc1O)F 62a_100009817053_100000751147 [0,2,0,0,0,0|1,1,0]=4 20547 B16R1.26593 CSCCSCC(=O)c1ccc(cc1O)O 62a_100000212216_100009814262 [0,2,0,0,0,0|1,1,0]=4 20548 B16R1.26593 CSCCSCC(=O)c1ccc(cc1O)O 62a_100009814262_100000751147 [0,2,0,0,0,0|1,1,0]=4 20549 B16R1.26593 CSCSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_100011218213 [0,2,0,0,0,0|2,0,0]=4 20550 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCF)Br 1458a_100000741311_100000729378 [0,2,0,0,0,0|2,0,0]=4 20551 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCF)Cl 1458a_100000688705_100000729378 [0,2,0,0,0,0|2,0,0]=4 20552 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCF)F 1458a_100000686989_100000729378 [0,2,0,0,0,0|2,0,0]=4 20553 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCF)I 1458a_100010189873_100000729378 [0,2,0,0,0,0|2,0,0]=4 20554 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCF)O 1458a_100000692822_100000729378 [0,2,0,0,0,0|2,0,0]=4 20555 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCO)Br 1458a_100000741311_100000746330 [0,2,0,0,0,0|2,0,0]=4 20556 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCO)Cl 1458a_100000688705_100000746330 [0,2,0,0,0,0|2,0,0]=4 20557 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCO)F 1458a_100000686989_100000746330 [0,2,0,0,0,0|2,0,0]=4 20558 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCO)I 1458a_100010189873_100000746330 [0,2,0,0,0,0|2,0,0]=4 20559 B16R1.26593 Cc1cc(ccc1C(=O)CCCCCO)O 1458a_100000692822_100000746330 [0,2,0,0,0,0|2,0,0]=4 20560 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)Br 240690a_100000750430_100000741311 [0,2,0,0,0,0|2,0,0]=4 20561 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)Br 527a_100000750430_100000741311 [0,2,0,0,0,0|2,0,0]=4 20562 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)Cl 240690a_100000750430_100000688705 [0,2,0,0,0,0|2,0,0]=4 20563 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)Cl 527a_100000750430_100000688705 [0,2,0,0,0,0|2,0,0]=4 20564 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)F 240690a_100000750430_100000686989 [0,2,0,0,0,0|2,0,0]=4 20565 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)F 527a_100000750430_100000686989 [0,2,0,0,0,0|2,0,0]=4 20566 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)I 240690a_100000750430_100010189873 [0,2,0,0,0,0|2,0,0]=4 20567 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)I 527a_100000750430_100010189873 [0,2,0,0,0,0|2,0,0]=4 20568 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)O 240690a_100000750430_100000692822 [0,2,0,0,0,0|2,0,0]=4 20569 B16R1.26593 Cc1cc(ccc1C(=O)NCCCCO)O 527a_100000750430_100000692822 [0,2,0,0,0,0|2,0,0]=4 20570 B16R1.26593 Cc1ccc(c(c1)Br)C(=O)CCCCCF 1458a_100000685072_100000729378 [0,2,0,0,0,0|2,0,0]=4 20571 B16R1.26593 Cc1ccc(c(c1)Br)C(=O)CCCCCO 1458a_100000685072_100000746330 [0,2,0,0,0,0|2,0,0]=4 20572 B16R1.26593 Cc1ccc(c(c1)Br)C(=O)NCCCCO 240690a_100000750430_100000685072 [0,2,0,0,0,0|2,0,0]=4 20573 B16R1.26593 Cc1ccc(c(c1)Br)C(=O)NCCCCO 527a_100000750430_100000685072 [0,2,0,0,0,0|2,0,0]=4 20574 B16R1.26593 Cc1ccc(c(c1)C)C(=O)CCCCCF 1458a_100000211164_100000729378 [0,2,0,0,0,0|2,0,0]=4 20575 B16R1.26593 Cc1ccc(c(c1)C)C(=O)CCCCCO 1458a_100000211164_100000746330 [0,2,0,0,0,0|2,0,0]=4 20576 B16R1.26593 Cc1ccc(c(c1)C)C(=O)COCCCBr 34a_100011217188_100000229959 [0,2,0,0,0,0|2,0,0]=4 20577 B16R1.26593 Cc1ccc(c(c1)C)C(=O)COCCCCl 34a_100000230001_100000229959 [0,2,0,0,0,0|2,0,0]=4 20578 B16R1.26593 Cc1ccc(c(c1)C)C(=O)COCCCF 34a_100000759539_100000229959 [0,2,0,0,0,0|2,0,0]=4 20579 B16R1.26593 Cc1ccc(c(c1)C)C(=O)COCCCN 34a_100000182051_100000229959 [0,2,0,0,0,0|2,0,0]=4 20580 B16R1.26593 Cc1ccc(c(c1)C)C(=O)NCCCCO 240690a_100000750430_100000211164 [0,2,0,0,0,0|2,0,0]=4 20581 B16R1.26593 Cc1ccc(c(c1)C)C(=O)NCCCCO 527a_100000750430_100000211164 [0,2,0,0,0,0|2,0,0]=4 20582 B16R1.26593 Cc1ccc(c(c1)Cl)C(=O)CCCCCF 1458a_100000766932_100000729378 [0,2,0,0,0,0|2,0,0]=4 20583 B16R1.26593 Cc1ccc(c(c1)Cl)C(=O)CCCCCO 1458a_100000766932_100000746330 [0,2,0,0,0,0|2,0,0]=4 20584 B16R1.26593 Cc1ccc(c(c1)Cl)C(=O)NCCCCO 240690a_100000750430_100000766932 [0,2,0,0,0,0|2,0,0]=4 20585 B16R1.26593 Cc1ccc(c(c1)Cl)C(=O)NCCCCO 527a_100000750430_100000766932 [0,2,0,0,0,0|2,0,0]=4 20586 B16R1.26593 Cc1ccc(c(c1)F)C(=O)CCCCCF 1458a_100000766033_100000729378 [0,2,0,0,0,0|2,0,0]=4 20587 B16R1.26593 Cc1ccc(c(c1)F)C(=O)CCCCCO 1458a_100000766033_100000746330 [0,2,0,0,0,0|2,0,0]=4 20588 B16R1.26593 Cc1ccc(c(c1)F)C(=O)NCCCCO 240690a_100000750430_100000766033 [0,2,0,0,0,0|2,0,0]=4 20589 B16R1.26593 Cc1ccc(c(c1)F)C(=O)NCCCCO 527a_100000750430_100000766033 [0,2,0,0,0,0|2,0,0]=4 20590 B16R1.26593 Cc1ccc(c(c1)I)C(=O)CCCCCF 1458a_100009999607_100000729378 [0,2,0,0,0,0|2,0,0]=4 20591 B16R1.26593 Cc1ccc(c(c1)I)C(=O)CCCCCO 1458a_100009999607_100000746330 [0,2,0,0,0,0|2,0,0]=4 20592 B16R1.26593 Cc1ccc(c(c1)I)C(=O)NCCCCO 240690a_100000750430_100009999607 [0,2,0,0,0,0|2,0,0]=4 20593 B16R1.26593 Cc1ccc(c(c1)I)C(=O)NCCCCO 527a_100000750430_100009999607 [0,2,0,0,0,0|2,0,0]=4 20594 B16R1.26593 Cc1ccc(c(c1)O)C(=O)CCCCC#N 1458a_100000212137_100000211819 [0,2,0,0,0,0|1,0,1]=4 20595 B16R1.26593 Cc1ccc(c(c1)O)C(=O)CCCCCF 1458a_100000212137_100000729378 [0,2,0,0,0,0|1,0,0]=3 20596 B16R1.26593 Cc1ccc(c(c1)O)C(=O)CCCCCO 1458a_100000212137_100000746330 [0,2,0,0,0,0|1,0,0]=3 20597 B16R1.26593 Cc1ccc(c(c1)O)C(=O)CCOCCO 1458a_100000212137_100011215305 [0,2,0,0,0,0|2,0,0]=4 20598 B16R1.26593 Cc1ccc(c(c1)O)C(=O)NCCCCO 240690a_100000750430_100000212137 [0,2,0,0,0,0|1,0,0]=3 20599 B16R1.26593 Cc1ccc(c(c1)O)C(=O)NCCCCO 527a_100000750430_100000212137 [0,2,0,0,0,0|1,0,0]=3 20600 B16R1.26593 N#CCCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000211819 [0,2,0,0,0,0|1,0,1]=4 20601 B16R1.26593 N#CCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000211819 [0,2,0,0,0,0|1,0,1]=4 20602 B16R1.26593 N#CCCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000211819 [0,2,0,0,0,0|1,0,1]=4 20603 B16R1.26593 N#CCCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000211819 [0,2,0,0,0,0|1,0,1]=4 20604 B16R1.26593 N#CCCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000211819 [0,2,0,0,0,0|1,0,1]=4 20605 B16R1.26593 NCCCOCC(=O)c1ccc(cc1Br)F 34a_100000182051_100012361341 [0,2,0,0,0,0|2,0,0]=4 20606 B16R1.26593 NCCCOCC(=O)c1ccc(cc1Cl)F 34a_100000182051_100012056422 [0,2,0,0,0,0|2,0,0]=4 20607 B16R1.26593 NCCCOCC(=O)c1ccc(cc1F)Br 34a_100000182051_200012361339 [0,2,0,0,0,0|2,0,0]=4 20608 B16R1.26593 NCCCOCC(=O)c1ccc(cc1F)Cl 34a_100000182051_100012351891 [0,2,0,0,0,0|2,0,0]=4 20609 B16R1.26593 NCCCOCC(=O)c1ccc(cc1F)F 34a_100000182051_100000229962 [0,2,0,0,0,0|2,0,0]=4 20610 B16R1.26593 NCCCOCC(=O)c1ccc(cc1O)F 34a_100000182051_100009817053 [0,2,0,0,0,0|1,0,0]=3 20611 B16R1.26593 NCCCOCC(=O)c1ccc(cc1O)O 34a_100000182051_100009814262 [0,2,0,0,0,0|1,0,0]=3 20612 B16R1.26593 NOCCOCC(=O)c1ccc(cc1O)F 34a_100000700252_100009817053 [0,2,0,0,0,0|2,0,0]=4 20613 B16R1.26593 NOCCOCC(=O)c1ccc(cc1O)O 34a_100000700252_100009814262 [0,2,0,0,0,0|2,0,0]=4 20614 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Br)Br 1458a_100000762965_100000729378 [0,2,0,0,0,0|2,0,0]=4 20615 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Br)Cl 1458a_100000766353_100000729378 [0,2,0,0,0,0|2,0,0]=4 20616 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Br)F 1458a_100000212304_100000729378 [0,2,0,0,0,0|2,0,0]=4 20617 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Br)I 1458a_100012360512_100000729378 [0,2,0,0,0,0|2,0,0]=4 20618 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Br)O 1458a_100012344906_100000729378 [0,2,0,0,0,0|2,0,0]=4 20619 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Cl)Br 1458a_100000741628_100000729378 [0,2,0,0,0,0|2,0,0]=4 20620 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100000729378 [0,2,0,0,0,0|2,0,0]=4 20621 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Cl)F 1458a_100000211397_100000729378 [0,2,0,0,0,0|2,0,0]=4 20622 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Cl)I 1458a_100000751301_100000729378 [0,2,0,0,0,0|2,0,0]=4 20623 B16R1.26593 O=C(CCCCCF)c1ccc(cc1Cl)O 1458a_100000702456_100000729378 [0,2,0,0,0,0|2,0,0]=4 20624 B16R1.26593 O=C(CCCCCF)c1ccc(cc1F)Br 1458a_100000214689_100000729378 [0,2,0,0,0,0|2,0,0]=4 20625 B16R1.26593 O=C(CCCCCF)c1ccc(cc1F)Cl 1458a_100000212326_100000729378 [0,2,0,0,0,0|2,0,0]=4 20626 B16R1.26593 O=C(CCCCCF)c1ccc(cc1F)F 1458a_100000211022_100000729378 [0,2,0,0,0,0|2,0,0]=4 20627 B16R1.26593 O=C(CCCCCF)c1ccc(cc1F)I 1458a_100000037189_100000729378 [0,2,0,0,0,0|2,0,0]=4 20628 B16R1.26593 O=C(CCCCCF)c1ccc(cc1F)O 1458a_100000689029_100000729378 [0,2,0,0,0,0|2,0,0]=4 20629 B16R1.26593 O=C(CCCCCF)c1ccc(cc1I)Br 1458a_100000751167_100000729378 [0,2,0,0,0,0|2,0,0]=4 20630 B16R1.26593 O=C(CCCCCF)c1ccc(cc1I)Cl 1458a_100000739380_100000729378 [0,2,0,0,0,0|2,0,0]=4 20631 B16R1.26593 O=C(CCCCCF)c1ccc(cc1I)F 1458a_100000739341_100000729378 [0,2,0,0,0,0|2,0,0]=4 20632 B16R1.26593 O=C(CCCCCF)c1ccc(cc1O)Br 1458a_100000744433_100000729378 [0,2,0,0,0,0|1,0,0]=3 20633 B16R1.26593 O=C(CCCCCF)c1ccc(cc1O)Cl 1458a_100000188622_100000729378 [0,2,0,0,0,0|1,0,0]=3 20634 B16R1.26593 O=C(CCCCCF)c1ccc(cc1O)F 1458a_100000746061_100000729378 [0,2,0,0,0,0|1,0,0]=3 20635 B16R1.26593 O=C(CCCCCF)c1ccc(cc1O)I 1458a_100000091984_100000729378 [0,2,0,0,0,0|1,0,0]=3 20636 B16R1.26593 O=C(CCCCCF)c1ccc(cc1O)O 1458a_100000212172_100000729378 [0,2,0,0,0,0|1,0,0]=3 20637 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Br)Br 1458a_100000762965_100000746330 [0,2,0,0,0,0|2,0,0]=4 20638 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000746330 [0,2,0,0,0,0|2,0,0]=4 20639 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Br)F 1458a_100000212304_100000746330 [0,2,0,0,0,0|2,0,0]=4 20640 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Br)I 1458a_100012360512_100000746330 [0,2,0,0,0,0|2,0,0]=4 20641 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Br)O 1458a_100012344906_100000746330 [0,2,0,0,0,0|2,0,0]=4 20642 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000746330 [0,2,0,0,0,0|2,0,0]=4 20643 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000746330 [0,2,0,0,0,0|2,0,0]=4 20644 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Cl)F 1458a_100000211397_100000746330 [0,2,0,0,0,0|2,0,0]=4 20645 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Cl)I 1458a_100000751301_100000746330 [0,2,0,0,0,0|2,0,0]=4 20646 B16R1.26593 O=C(CCCCCO)c1ccc(cc1Cl)O 1458a_100000702456_100000746330 [0,2,0,0,0,0|2,0,0]=4 20647 B16R1.26593 O=C(CCCCCO)c1ccc(cc1F)Br 1458a_100000214689_100000746330 [0,2,0,0,0,0|2,0,0]=4 20648 B16R1.26593 O=C(CCCCCO)c1ccc(cc1F)Cl 1458a_100000212326_100000746330 [0,2,0,0,0,0|2,0,0]=4 20649 B16R1.26593 O=C(CCCCCO)c1ccc(cc1F)F 1458a_100000211022_100000746330 [0,2,0,0,0,0|2,0,0]=4 20650 B16R1.26593 O=C(CCCCCO)c1ccc(cc1F)I 1458a_100000037189_100000746330 [0,2,0,0,0,0|2,0,0]=4 20651 B16R1.26593 O=C(CCCCCO)c1ccc(cc1F)O 1458a_100000689029_100000746330 [0,2,0,0,0,0|2,0,0]=4 20652 B16R1.26593 O=C(CCCCCO)c1ccc(cc1I)Br 1458a_100000751167_100000746330 [0,2,0,0,0,0|2,0,0]=4 20653 B16R1.26593 O=C(CCCCCO)c1ccc(cc1I)Cl 1458a_100000739380_100000746330 [0,2,0,0,0,0|2,0,0]=4 20654 B16R1.26593 O=C(CCCCCO)c1ccc(cc1I)F 1458a_100000739341_100000746330 [0,2,0,0,0,0|2,0,0]=4 20655 B16R1.26593 O=C(CCCCCO)c1ccc(cc1O)Br 1458a_100000744433_100000746330 [0,2,0,0,0,0|1,0,0]=3 20656 B16R1.26593 O=C(CCCCCO)c1ccc(cc1O)Cl 1458a_100000188622_100000746330 [0,2,0,0,0,0|1,0,0]=3 20657 B16R1.26593 O=C(CCCCCO)c1ccc(cc1O)F 1458a_100000746061_100000746330 [0,2,0,0,0,0|1,0,0]=3 20658 B16R1.26593 O=C(CCCCCO)c1ccc(cc1O)I 1458a_100000091984_100000746330 [0,2,0,0,0,0|1,0,0]=3 20659 B16R1.26593 O=C(CCCCCO)c1ccc(cc1O)O 1458a_100000212172_100000746330 [0,2,0,0,0,0|1,0,0]=3 20660 B16R1.26593 O=C(CCOCCO)c1ccc(cc1O)Br 1458a_100000744433_100011215305 [0,2,0,0,0,0|2,0,0]=4 20661 B16R1.26593 O=C(CCOCCO)c1ccc(cc1O)Cl 1458a_100000188622_100011215305 [0,2,0,0,0,0|2,0,0]=4 20662 B16R1.26593 O=C(CCOCCO)c1ccc(cc1O)F 1458a_100000746061_100011215305 [0,2,0,0,0,0|2,0,0]=4 20663 B16R1.26593 O=C(CCOCCO)c1ccc(cc1O)I 1458a_100000091984_100011215305 [0,2,0,0,0,0|2,0,0]=4 20664 B16R1.26593 O=C(CCOCCO)c1ccc(cc1O)O 1458a_100000212172_100011215305 [0,2,0,0,0,0|2,0,0]=4 20665 B16R1.26593 O=C(CNCCCF)c1ccc(cc1O)F 34a_100015189416_100009817053 [0,2,0,0,0,0|2,0,0]=4 20666 B16R1.26593 O=C(CNCCCF)c1ccc(cc1O)O 34a_100015189416_100009814262 [0,2,0,0,0,0|2,0,0]=4 20667 B16R1.26593 O=C(COCCCBr)c1ccc(cc1Br)F 34a_100011217188_100012361341 [0,2,0,0,0,0|2,0,0]=4 20668 B16R1.26593 O=C(COCCCBr)c1ccc(cc1Cl)F 34a_100011217188_100012056422 [0,2,0,0,0,0|2,0,0]=4 20669 B16R1.26593 O=C(COCCCBr)c1ccc(cc1F)Br 34a_100011217188_200012361339 [0,2,0,0,0,0|2,0,0]=4 20670 B16R1.26593 O=C(COCCCBr)c1ccc(cc1F)Cl 34a_100011217188_100012351891 [0,2,0,0,0,0|2,0,0]=4 20671 B16R1.26593 O=C(COCCCBr)c1ccc(cc1F)F 34a_100011217188_100000229962 [0,2,0,0,0,0|2,0,0]=4 20672 B16R1.26593 O=C(COCCCBr)c1ccc(cc1O)F 34a_100011217188_100009817053 [0,2,0,0,0,0|1,0,0]=3 20673 B16R1.26593 O=C(COCCCBr)c1ccc(cc1O)O 34a_100011217188_100009814262 [0,2,0,0,0,0|1,0,0]=3 20674 B16R1.26593 O=C(COCCCCl)c1ccc(cc1Br)F 34a_100000230001_100012361341 [0,2,0,0,0,0|2,0,0]=4 20675 B16R1.26593 O=C(COCCCCl)c1ccc(cc1Cl)F 34a_100000230001_100012056422 [0,2,0,0,0,0|2,0,0]=4 20676 B16R1.26593 O=C(COCCCCl)c1ccc(cc1F)Br 34a_100000230001_200012361339 [0,2,0,0,0,0|2,0,0]=4 20677 B16R1.26593 O=C(COCCCCl)c1ccc(cc1F)Cl 34a_100000230001_100012351891 [0,2,0,0,0,0|2,0,0]=4 20678 B16R1.26593 O=C(COCCCCl)c1ccc(cc1F)F 34a_100000230001_100000229962 [0,2,0,0,0,0|2,0,0]=4 20679 B16R1.26593 O=C(COCCCCl)c1ccc(cc1O)F 34a_100000230001_100009817053 [0,2,0,0,0,0|1,0,0]=3 20680 B16R1.26593 O=C(COCCCCl)c1ccc(cc1O)O 34a_100000230001_100009814262 [0,2,0,0,0,0|1,0,0]=3 20681 B16R1.26593 O=C(COCCCF)c1ccc(cc1Br)F 34a_100000759539_100012361341 [0,2,0,0,0,0|2,0,0]=4 20682 B16R1.26593 O=C(COCCCF)c1ccc(cc1Cl)F 34a_100000759539_100012056422 [0,2,0,0,0,0|2,0,0]=4 20683 B16R1.26593 O=C(COCCCF)c1ccc(cc1F)Br 34a_100000759539_200012361339 [0,2,0,0,0,0|2,0,0]=4 20684 B16R1.26593 O=C(COCCCF)c1ccc(cc1F)Cl 34a_100000759539_100012351891 [0,2,0,0,0,0|2,0,0]=4 20685 B16R1.26593 O=C(COCCCF)c1ccc(cc1F)F 34a_100000759539_100000229962 [0,2,0,0,0,0|2,0,0]=4 20686 B16R1.26593 O=C(COCCCF)c1ccc(cc1O)F 34a_100000759539_100009817053 [0,2,0,0,0,0|1,0,0]=3 20687 B16R1.26593 O=C(COCCCF)c1ccc(cc1O)O 34a_100000759539_100009814262 [0,2,0,0,0,0|1,0,0]=3 20688 B16R1.26593 O=C(CSCCCF)c1ccc(cc1O)F 62a_100009817053_100011934791 [0,2,0,0,0,0|1,1,0]=4 20689 B16R1.26593 O=C(CSCCCF)c1ccc(cc1O)F 62a_100011934791_100009817053 [0,2,0,0,0,0|1,1,0]=4 20690 B16R1.26593 O=C(CSCCCF)c1ccc(cc1O)O 62a_100009814262_100011934791 [0,2,0,0,0,0|1,1,0]=4 20691 B16R1.26593 O=C(CSCCCF)c1ccc(cc1O)O 62a_100011934791_100009814262 [0,2,0,0,0,0|1,1,0]=4 20692 B16R1.26593 O=C(CSCCCO)c1ccc(cc1O)F 62a_100009817053_100011215043 [0,2,0,0,0,0|1,1,0]=4 20693 B16R1.26593 O=C(CSCCCO)c1ccc(cc1O)F 62a_100011215043_100009817053 [0,2,0,0,0,0|1,1,0]=4 20694 B16R1.26593 O=C(CSCCCO)c1ccc(cc1O)O 62a_100009814262_100011215043 [0,2,0,0,0,0|1,1,0]=4 20695 B16R1.26593 O=C(CSCCCO)c1ccc(cc1O)O 62a_100011215043_100009814262 [0,2,0,0,0,0|1,1,0]=4 20696 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)Br 240690a_100000750430_100000762965 [0,2,0,0,0,0|2,0,0]=4 20697 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)Br 527a_100000750430_100000762965 [0,2,0,0,0,0|2,0,0]=4 20698 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)Cl 240690a_100000750430_100000766353 [0,2,0,0,0,0|2,0,0]=4 20699 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)Cl 527a_100000750430_100000766353 [0,2,0,0,0,0|2,0,0]=4 20700 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)F 240690a_100000750430_100000212304 [0,2,0,0,0,0|2,0,0]=4 20701 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)F 527a_100000750430_100000212304 [0,2,0,0,0,0|2,0,0]=4 20702 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)I 240690a_100000750430_100012360512 [0,2,0,0,0,0|2,0,0]=4 20703 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)I 527a_100000750430_100012360512 [0,2,0,0,0,0|2,0,0]=4 20704 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)O 240690a_100000750430_100012344906 [0,2,0,0,0,0|2,0,0]=4 20705 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Br)O 527a_100000750430_100012344906 [0,2,0,0,0,0|2,0,0]=4 20706 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)Br 240690a_100000750430_100000741628 [0,2,0,0,0,0|2,0,0]=4 20707 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)Br 527a_100000750430_100000741628 [0,2,0,0,0,0|2,0,0]=4 20708 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)Cl 240690a_100000750430_100000185840 [0,2,0,0,0,0|2,0,0]=4 20709 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)Cl 527a_100000750430_100000185840 [0,2,0,0,0,0|2,0,0]=4 20710 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)F 240690a_100000750430_100000211397 [0,2,0,0,0,0|2,0,0]=4 20711 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)F 527a_100000750430_100000211397 [0,2,0,0,0,0|2,0,0]=4 20712 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)I 240690a_100000750430_100000751301 [0,2,0,0,0,0|2,0,0]=4 20713 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)I 527a_100000750430_100000751301 [0,2,0,0,0,0|2,0,0]=4 20714 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)O 240690a_100000750430_100000702456 [0,2,0,0,0,0|2,0,0]=4 20715 B16R1.26593 O=C(NCCCCO)c1ccc(cc1Cl)O 527a_100000750430_100000702456 [0,2,0,0,0,0|2,0,0]=4 20716 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)Br 240690a_100000750430_100000214689 [0,2,0,0,0,0|2,0,0]=4 20717 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)Br 527a_100000750430_100000214689 [0,2,0,0,0,0|2,0,0]=4 20718 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)Cl 240690a_100000750430_100000212326 [0,2,0,0,0,0|2,0,0]=4 20719 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)Cl 527a_100000750430_100000212326 [0,2,0,0,0,0|2,0,0]=4 20720 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)F 240690a_100000750430_100000211022 [0,2,0,0,0,0|2,0,0]=4 20721 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)F 527a_100000750430_100000211022 [0,2,0,0,0,0|2,0,0]=4 20722 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)I 240690a_100000750430_100000037189 [0,2,0,0,0,0|2,0,0]=4 20723 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)I 527a_100000750430_100000037189 [0,2,0,0,0,0|2,0,0]=4 20724 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)O 240690a_100000750430_100000689029 [0,2,0,0,0,0|2,0,0]=4 20725 B16R1.26593 O=C(NCCCCO)c1ccc(cc1F)O 527a_100000750430_100000689029 [0,2,0,0,0,0|2,0,0]=4 20726 B16R1.26593 O=C(NCCCCO)c1ccc(cc1I)Br 240690a_100000750430_100000751167 [0,2,0,0,0,0|2,0,0]=4 20727 B16R1.26593 O=C(NCCCCO)c1ccc(cc1I)Br 527a_100000750430_100000751167 [0,2,0,0,0,0|2,0,0]=4 20728 B16R1.26593 O=C(NCCCCO)c1ccc(cc1I)Cl 240690a_100000750430_100000739380 [0,2,0,0,0,0|2,0,0]=4 20729 B16R1.26593 O=C(NCCCCO)c1ccc(cc1I)Cl 527a_100000750430_100000739380 [0,2,0,0,0,0|2,0,0]=4 20730 B16R1.26593 O=C(NCCCCO)c1ccc(cc1I)F 240690a_100000750430_100000739341 [0,2,0,0,0,0|2,0,0]=4 20731 B16R1.26593 O=C(NCCCCO)c1ccc(cc1I)F 527a_100000750430_100000739341 [0,2,0,0,0,0|2,0,0]=4 20732 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)Br 240690a_100000750430_100000744433 [0,2,0,0,0,0|1,0,0]=3 20733 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)Br 527a_100000750430_100000744433 [0,2,0,0,0,0|1,0,0]=3 20734 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)Cl 240690a_100000750430_100000188622 [0,2,0,0,0,0|1,0,0]=3 20735 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)Cl 527a_100000750430_100000188622 [0,2,0,0,0,0|1,0,0]=3 20736 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)F 240690a_100000750430_100000746061 [0,2,0,0,0,0|1,0,0]=3 20737 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)F 527a_100000750430_100000746061 [0,2,0,0,0,0|1,0,0]=3 20738 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)I 240690a_100000750430_100000091984 [0,2,0,0,0,0|1,0,0]=3 20739 B16R1.26593 O=C(NCCCCO)c1ccc(cc1O)I 527a_100000750430_100000091984 [0,2,0,0,0,0|1,0,0]=3 20740 B16R1.26593 O=C(OCNCCO)c1ccc(cc1Cl)Cl 2230a_100016997473_100010978946 [0,2,0,0,0,0|2,0,0]=4 20741 B16R1.26593 O=C(OCSCCF)c1ccc(cc1Cl)Cl 62a_100010978946_100011217306 [0,2,0,0,0,0|2,0,0]=4 20742 B16R1.26593 O=C(OCSCCO)c1ccc(cc1Cl)Cl 62a_100010978946_100000211926 [0,2,0,0,0,0|2,0,0]=4 20743 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)Br 240690a_100000744482_100000744433 [0,2,0,0,0,0|2,0,0]=4 20744 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)Br 527a_100000744482_100000744433 [0,2,0,0,0,0|2,0,0]=4 20745 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)Cl 240690a_100000744482_100000188622 [0,2,0,0,0,0|2,0,0]=4 20746 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)Cl 527a_100000744482_100000188622 [0,2,0,0,0,0|2,0,0]=4 20747 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)F 240690a_100000744482_100000746061 [0,2,0,0,0,0|2,0,0]=4 20748 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)F 527a_100000744482_100000746061 [0,2,0,0,0,0|2,0,0]=4 20749 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)I 240690a_100000744482_100000091984 [0,2,0,0,0,0|2,0,0]=4 20750 B16R1.40160 CC(CO)CNC(=O)c1ccc(cc1O)I 527a_100000744482_100000091984 [0,2,0,0,0,0|2,0,0]=4 20751 B16R1.40160 CCC(=O)COC(=O)c1ccc(cc1Cl)Cl 1458a_100000210414_100010978946 [0,2,0,0,0,0|1,0,1]=4 20752 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Br 11a_100020588543_100000762965 [0,2,0,0,0,0|2,0,0]=4 20753 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Br 1626a_100020588543_100000762965 [0,2,0,0,0,0|2,0,0]=4 20754 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Br 240690a_100020588543_100000762965 [0,2,0,0,0,0|2,0,0]=4 20755 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Br 527a_100020588543_100000762965 [0,2,0,0,0,0|2,0,0]=4 20756 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)C 11a_100020588543_100000685072 [0,2,0,0,0,0|2,0,0]=4 20757 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)C 1626a_100020588543_100000685072 [0,2,0,0,0,0|2,0,0]=4 20758 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)C 240690a_100020588543_100000685072 [0,2,0,0,0,0|2,0,0]=4 20759 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)C 527a_100020588543_100000685072 [0,2,0,0,0,0|2,0,0]=4 20760 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Cl 11a_100020588543_100000766353 [0,2,0,0,0,0|2,0,0]=4 20761 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Cl 1626a_100020588543_100000766353 [0,2,0,0,0,0|2,0,0]=4 20762 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Cl 240690a_100020588543_100000766353 [0,2,0,0,0,0|2,0,0]=4 20763 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)Cl 527a_100020588543_100000766353 [0,2,0,0,0,0|2,0,0]=4 20764 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)F 11a_100020588543_100000212304 [0,2,0,0,0,0|2,0,0]=4 20765 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)F 1626a_100020588543_100000212304 [0,2,0,0,0,0|2,0,0]=4 20766 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)F 240690a_100020588543_100000212304 [0,2,0,0,0,0|2,0,0]=4 20767 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)F 527a_100020588543_100000212304 [0,2,0,0,0,0|2,0,0]=4 20768 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)I 11a_100020588543_100012360512 [0,2,0,0,0,0|2,0,0]=4 20769 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)I 1626a_100020588543_100012360512 [0,2,0,0,0,0|2,0,0]=4 20770 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)I 240690a_100020588543_100012360512 [0,2,0,0,0,0|2,0,0]=4 20771 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)I 527a_100020588543_100012360512 [0,2,0,0,0,0|2,0,0]=4 20772 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)O 240690a_100020588543_100012344906 [0,2,0,0,0,0|2,0,0]=4 20773 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Br)O 527a_100020588543_100012344906 [0,2,0,0,0,0|2,0,0]=4 20774 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Br 11a_100020588543_100000741311 [0,2,0,0,0,0|2,0,0]=4 20775 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Br 1626a_100020588543_100000741311 [0,2,0,0,0,0|2,0,0]=4 20776 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Br 240690a_100020588543_100000741311 [0,2,0,0,0,0|2,0,0]=4 20777 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Br 527a_100020588543_100000741311 [0,2,0,0,0,0|2,0,0]=4 20778 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)C 11a_100020588543_100000211164 [0,2,0,0,0,0|2,0,0]=4 20779 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)C 1626a_100020588543_100000211164 [0,2,0,0,0,0|2,0,0]=4 20780 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)C 240690a_100020588543_100000211164 [0,2,0,0,0,0|2,0,0]=4 20781 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)C 527a_100020588543_100000211164 [0,2,0,0,0,0|2,0,0]=4 20782 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Cl 11a_100020588543_100000688705 [0,2,0,0,0,0|2,0,0]=4 20783 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Cl 1626a_100020588543_100000688705 [0,2,0,0,0,0|2,0,0]=4 20784 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Cl 240690a_100020588543_100000688705 [0,2,0,0,0,0|2,0,0]=4 20785 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)Cl 527a_100020588543_100000688705 [0,2,0,0,0,0|2,0,0]=4 20786 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)F 11a_100020588543_100000686989 [0,2,0,0,0,0|2,0,0]=4 20787 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)F 1626a_100020588543_100000686989 [0,2,0,0,0,0|2,0,0]=4 20788 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)F 240690a_100020588543_100000686989 [0,2,0,0,0,0|2,0,0]=4 20789 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)F 527a_100020588543_100000686989 [0,2,0,0,0,0|2,0,0]=4 20790 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)I 11a_100020588543_100010189873 [0,2,0,0,0,0|2,0,0]=4 20791 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)I 1626a_100020588543_100010189873 [0,2,0,0,0,0|2,0,0]=4 20792 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)I 240690a_100020588543_100010189873 [0,2,0,0,0,0|2,0,0]=4 20793 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)I 527a_100020588543_100010189873 [0,2,0,0,0,0|2,0,0]=4 20794 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)O 240690a_100020588543_100000692822 [0,2,0,0,0,0|2,0,0]=4 20795 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1C)O 527a_100020588543_100000692822 [0,2,0,0,0,0|2,0,0]=4 20796 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Br 11a_100020588543_100000741628 [0,2,0,0,0,0|2,0,0]=4 20797 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Br 1626a_100020588543_100000741628 [0,2,0,0,0,0|2,0,0]=4 20798 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Br 240690a_100020588543_100000741628 [0,2,0,0,0,0|2,0,0]=4 20799 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Br 527a_100020588543_100000741628 [0,2,0,0,0,0|2,0,0]=4 20800 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)C 11a_100020588543_100000766932 [0,2,0,0,0,0|2,0,0]=4 20801 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)C 1626a_100020588543_100000766932 [0,2,0,0,0,0|2,0,0]=4 20802 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)C 240690a_100020588543_100000766932 [0,2,0,0,0,0|2,0,0]=4 20803 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)C 527a_100020588543_100000766932 [0,2,0,0,0,0|2,0,0]=4 20804 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Cl 11a_100020588543_100000185840 [0,2,0,0,0,0|2,0,0]=4 20805 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Cl 1626a_100020588543_100000185840 [0,2,0,0,0,0|2,0,0]=4 20806 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100020588543_100000185840 [0,2,0,0,0,0|2,0,0]=4 20807 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)Cl 527a_100020588543_100000185840 [0,2,0,0,0,0|2,0,0]=4 20808 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)F 11a_100020588543_100000211397 [0,2,0,0,0,0|2,0,0]=4 20809 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)F 1626a_100020588543_100000211397 [0,2,0,0,0,0|2,0,0]=4 20810 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)F 240690a_100020588543_100000211397 [0,2,0,0,0,0|2,0,0]=4 20811 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)F 527a_100020588543_100000211397 [0,2,0,0,0,0|2,0,0]=4 20812 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)I 11a_100020588543_100000751301 [0,2,0,0,0,0|2,0,0]=4 20813 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)I 1626a_100020588543_100000751301 [0,2,0,0,0,0|2,0,0]=4 20814 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)I 240690a_100020588543_100000751301 [0,2,0,0,0,0|2,0,0]=4 20815 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)I 527a_100020588543_100000751301 [0,2,0,0,0,0|2,0,0]=4 20816 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)O 240690a_100020588543_100000702456 [0,2,0,0,0,0|2,0,0]=4 20817 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1Cl)O 527a_100020588543_100000702456 [0,2,0,0,0,0|2,0,0]=4 20818 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Br 11a_100020588543_100000214689 [0,2,0,0,0,0|2,0,0]=4 20819 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Br 1626a_100020588543_100000214689 [0,2,0,0,0,0|2,0,0]=4 20820 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Br 240690a_100020588543_100000214689 [0,2,0,0,0,0|2,0,0]=4 20821 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Br 527a_100020588543_100000214689 [0,2,0,0,0,0|2,0,0]=4 20822 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)C 11a_100020588543_100000766033 [0,2,0,0,0,0|2,0,0]=4 20823 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)C 1626a_100020588543_100000766033 [0,2,0,0,0,0|2,0,0]=4 20824 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)C 240690a_100020588543_100000766033 [0,2,0,0,0,0|2,0,0]=4 20825 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)C 527a_100020588543_100000766033 [0,2,0,0,0,0|2,0,0]=4 20826 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Cl 11a_100020588543_100000212326 [0,2,0,0,0,0|2,0,0]=4 20827 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Cl 1626a_100020588543_100000212326 [0,2,0,0,0,0|2,0,0]=4 20828 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Cl 240690a_100020588543_100000212326 [0,2,0,0,0,0|2,0,0]=4 20829 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)Cl 527a_100020588543_100000212326 [0,2,0,0,0,0|2,0,0]=4 20830 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)F 11a_100020588543_100000211022 [0,2,0,0,0,0|2,0,0]=4 20831 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)F 1626a_100020588543_100000211022 [0,2,0,0,0,0|2,0,0]=4 20832 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)F 240690a_100020588543_100000211022 [0,2,0,0,0,0|2,0,0]=4 20833 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)F 527a_100020588543_100000211022 [0,2,0,0,0,0|2,0,0]=4 20834 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)I 11a_100020588543_100000037189 [0,2,0,0,0,0|2,0,0]=4 20835 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)I 1626a_100020588543_100000037189 [0,2,0,0,0,0|2,0,0]=4 20836 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)I 240690a_100020588543_100000037189 [0,2,0,0,0,0|2,0,0]=4 20837 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)I 527a_100020588543_100000037189 [0,2,0,0,0,0|2,0,0]=4 20838 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)O 240690a_100020588543_100000689029 [0,2,0,0,0,0|2,0,0]=4 20839 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1F)O 527a_100020588543_100000689029 [0,2,0,0,0,0|2,0,0]=4 20840 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Br 11a_100020588543_100000751167 [0,2,0,0,0,0|2,0,0]=4 20841 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Br 1626a_100020588543_100000751167 [0,2,0,0,0,0|2,0,0]=4 20842 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Br 240690a_100020588543_100000751167 [0,2,0,0,0,0|2,0,0]=4 20843 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Br 527a_100020588543_100000751167 [0,2,0,0,0,0|2,0,0]=4 20844 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)C 11a_100020588543_100009999607 [0,2,0,0,0,0|2,0,0]=4 20845 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)C 1626a_100020588543_100009999607 [0,2,0,0,0,0|2,0,0]=4 20846 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)C 240690a_100020588543_100009999607 [0,2,0,0,0,0|2,0,0]=4 20847 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)C 527a_100020588543_100009999607 [0,2,0,0,0,0|2,0,0]=4 20848 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Cl 11a_100020588543_100000739380 [0,2,0,0,0,0|2,0,0]=4 20849 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Cl 1626a_100020588543_100000739380 [0,2,0,0,0,0|2,0,0]=4 20850 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Cl 240690a_100020588543_100000739380 [0,2,0,0,0,0|2,0,0]=4 20851 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)Cl 527a_100020588543_100000739380 [0,2,0,0,0,0|2,0,0]=4 20852 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)F 11a_100020588543_100000739341 [0,2,0,0,0,0|2,0,0]=4 20853 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)F 1626a_100020588543_100000739341 [0,2,0,0,0,0|2,0,0]=4 20854 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)F 240690a_100020588543_100000739341 [0,2,0,0,0,0|2,0,0]=4 20855 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1I)F 527a_100020588543_100000739341 [0,2,0,0,0,0|2,0,0]=4 20856 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)Br 240690a_100020588543_100000744433 [0,2,0,0,0,0|1,0,0]=3 20857 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)Br 527a_100020588543_100000744433 [0,2,0,0,0,0|1,0,0]=3 20858 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)C 1626a_100020588543_100000212137 [0,2,0,0,0,0|1,0,0]=3 20859 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)C 240690a_100020588543_100000212137 [0,2,0,0,0,0|1,0,0]=3 20860 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)C 527a_100020588543_100000212137 [0,2,0,0,0,0|1,0,0]=3 20861 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)Cl 11a_100020588543_100000188622 [0,2,0,0,0,0|1,0,0]=3 20862 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)Cl 240690a_100020588543_100000188622 [0,2,0,0,0,0|1,0,0]=3 20863 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)Cl 527a_100020588543_100000188622 [0,2,0,0,0,0|1,0,0]=3 20864 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)F 240690a_100020588543_100000746061 [0,2,0,0,0,0|1,0,0]=3 20865 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)F 527a_100020588543_100000746061 [0,2,0,0,0,0|1,0,0]=3 20866 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)I 240690a_100020588543_100000091984 [0,2,0,0,0,0|1,0,0]=3 20867 B16R1.40160 CCC(C)CNC(=O)c1ccc(cc1O)I 527a_100020588543_100000091984 [0,2,0,0,0,0|1,0,0]=3 20868 B16R1.40160 CCC(C)NNC(=O)c1ccc(cc1O)Br 22a_100000718999_100000744433 [0,2,0,0,0,0|2,0,0]=4 20869 B16R1.40160 CCC(C)NNC(=O)c1ccc(cc1O)C 22a_100000718999_100000212137 [0,2,0,0,0,0|2,0,0]=4 20870 B16R1.40160 CCC(C)NNC(=O)c1ccc(cc1O)Cl 22a_100000718999_100000188622 [0,2,0,0,0,0|2,0,0]=4 20871 B16R1.40160 CCC(C)NNC(=O)c1ccc(cc1O)F 22a_100000718999_100000746061 [0,2,0,0,0,0|2,0,0]=4 20872 B16R1.40160 CCC(C)NNC(=O)c1ccc(cc1O)I 22a_100000718999_100000091984 [0,2,0,0,0,0|2,0,0]=4 20873 B16R1.40160 CCC(C)NNC(=O)c1ccc(cc1O)O 22a_100000718999_100000212172 [0,2,0,0,0,0|2,0,0]=4 20874 B16R1.40160 CCC(C)OCC(=O)c1ccc(cc1O)O 7a_100000210228_100009814262 [0,2,0,0,0,0|2,0,0]=4 20875 B16R1.40160 CCC(C)SCC(=O)c1ccc(cc1O)F 62a_100000758301_100009817053 [0,2,0,0,0,0|2,0,0]=4 20876 B16R1.40160 CCC(C)SCC(=O)c1ccc(cc1O)F 62a_100009817053_100000758301 [0,2,0,0,0,0|2,0,0]=4 20877 B16R1.40160 CCC(C)SCC(=O)c1ccc(cc1O)O 62a_100000758301_100009814262 [0,2,0,0,0,0|2,0,0]=4 20878 B16R1.40160 CCC(C)SCC(=O)c1ccc(cc1O)O 62a_100009814262_100000758301 [0,2,0,0,0,0|2,0,0]=4 20879 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)Br 11a_100011218483_100000762965 [0,2,0,0,0,0|2,0,0]=4 20880 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)Br 240690a_100011218483_100000762965 [0,2,0,0,0,0|2,0,0]=4 20881 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)Br 527a_100011218483_100000762965 [0,2,0,0,0,0|2,0,0]=4 20882 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)C 11a_100011218483_100000685072 [0,2,0,0,0,0|2,0,0]=4 20883 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)C 240690a_100011218483_100000685072 [0,2,0,0,0,0|2,0,0]=4 20884 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)C 527a_100011218483_100000685072 [0,2,0,0,0,0|2,0,0]=4 20885 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)Cl 11a_100011218483_100000766353 [0,2,0,0,0,0|2,0,0]=4 20886 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)Cl 240690a_100011218483_100000766353 [0,2,0,0,0,0|2,0,0]=4 20887 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)Cl 527a_100011218483_100000766353 [0,2,0,0,0,0|2,0,0]=4 20888 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)F 11a_100011218483_100000212304 [0,2,0,0,0,0|2,0,0]=4 20889 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)F 240690a_100011218483_100000212304 [0,2,0,0,0,0|2,0,0]=4 20890 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)F 527a_100011218483_100000212304 [0,2,0,0,0,0|2,0,0]=4 20891 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)I 11a_100011218483_100012360512 [0,2,0,0,0,0|2,0,0]=4 20892 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)I 240690a_100011218483_100012360512 [0,2,0,0,0,0|2,0,0]=4 20893 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)I 527a_100011218483_100012360512 [0,2,0,0,0,0|2,0,0]=4 20894 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)O 240690a_100011218483_100012344906 [0,2,0,0,0,0|2,0,0]=4 20895 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Br)O 527a_100011218483_100012344906 [0,2,0,0,0,0|2,0,0]=4 20896 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)Br 11a_100011218483_100000741311 [0,2,0,0,0,0|2,0,0]=4 20897 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)Br 240690a_100011218483_100000741311 [0,2,0,0,0,0|2,0,0]=4 20898 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)Br 527a_100011218483_100000741311 [0,2,0,0,0,0|2,0,0]=4 20899 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)C 11a_100011218483_100000211164 [0,2,0,0,0,0|2,0,0]=4 20900 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)C 240690a_100011218483_100000211164 [0,2,0,0,0,0|2,0,0]=4 20901 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)C 527a_100011218483_100000211164 [0,2,0,0,0,0|2,0,0]=4 20902 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)Cl 11a_100011218483_100000688705 [0,2,0,0,0,0|2,0,0]=4 20903 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)Cl 240690a_100011218483_100000688705 [0,2,0,0,0,0|2,0,0]=4 20904 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)Cl 527a_100011218483_100000688705 [0,2,0,0,0,0|2,0,0]=4 20905 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)F 11a_100011218483_100000686989 [0,2,0,0,0,0|2,0,0]=4 20906 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)F 240690a_100011218483_100000686989 [0,2,0,0,0,0|2,0,0]=4 20907 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)F 527a_100011218483_100000686989 [0,2,0,0,0,0|2,0,0]=4 20908 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)I 11a_100011218483_100010189873 [0,2,0,0,0,0|2,0,0]=4 20909 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)I 240690a_100011218483_100010189873 [0,2,0,0,0,0|2,0,0]=4 20910 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)I 527a_100011218483_100010189873 [0,2,0,0,0,0|2,0,0]=4 20911 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)O 240690a_100011218483_100000692822 [0,2,0,0,0,0|2,0,0]=4 20912 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1C)O 527a_100011218483_100000692822 [0,2,0,0,0,0|2,0,0]=4 20913 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)Br 11a_100011218483_100000741628 [0,2,0,0,0,0|2,0,0]=4 20914 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)Br 240690a_100011218483_100000741628 [0,2,0,0,0,0|2,0,0]=4 20915 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)Br 527a_100011218483_100000741628 [0,2,0,0,0,0|2,0,0]=4 20916 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)C 11a_100011218483_100000766932 [0,2,0,0,0,0|2,0,0]=4 20917 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)C 240690a_100011218483_100000766932 [0,2,0,0,0,0|2,0,0]=4 20918 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)C 527a_100011218483_100000766932 [0,2,0,0,0,0|2,0,0]=4 20919 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)Cl 11a_100011218483_100000185840 [0,2,0,0,0,0|2,0,0]=4 20920 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100011218483_100000185840 [0,2,0,0,0,0|2,0,0]=4 20921 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)Cl 527a_100011218483_100000185840 [0,2,0,0,0,0|2,0,0]=4 20922 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)F 11a_100011218483_100000211397 [0,2,0,0,0,0|2,0,0]=4 20923 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)F 240690a_100011218483_100000211397 [0,2,0,0,0,0|2,0,0]=4 20924 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)F 527a_100011218483_100000211397 [0,2,0,0,0,0|2,0,0]=4 20925 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)I 11a_100011218483_100000751301 [0,2,0,0,0,0|2,0,0]=4 20926 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)I 240690a_100011218483_100000751301 [0,2,0,0,0,0|2,0,0]=4 20927 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)I 527a_100011218483_100000751301 [0,2,0,0,0,0|2,0,0]=4 20928 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)O 240690a_100011218483_100000702456 [0,2,0,0,0,0|2,0,0]=4 20929 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1Cl)O 527a_100011218483_100000702456 [0,2,0,0,0,0|2,0,0]=4 20930 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)Br 11a_100011218483_100000214689 [0,2,0,0,0,0|2,0,0]=4 20931 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)Br 240690a_100011218483_100000214689 [0,2,0,0,0,0|2,0,0]=4 20932 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)Br 527a_100011218483_100000214689 [0,2,0,0,0,0|2,0,0]=4 20933 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)C 11a_100011218483_100000766033 [0,2,0,0,0,0|2,0,0]=4 20934 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)C 240690a_100011218483_100000766033 [0,2,0,0,0,0|2,0,0]=4 20935 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)C 527a_100011218483_100000766033 [0,2,0,0,0,0|2,0,0]=4 20936 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)Cl 11a_100011218483_100000212326 [0,2,0,0,0,0|2,0,0]=4 20937 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)Cl 240690a_100011218483_100000212326 [0,2,0,0,0,0|2,0,0]=4 20938 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)Cl 527a_100011218483_100000212326 [0,2,0,0,0,0|2,0,0]=4 20939 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)F 11a_100011218483_100000211022 [0,2,0,0,0,0|2,0,0]=4 20940 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)F 240690a_100011218483_100000211022 [0,2,0,0,0,0|2,0,0]=4 20941 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)F 527a_100011218483_100000211022 [0,2,0,0,0,0|2,0,0]=4 20942 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)I 11a_100011218483_100000037189 [0,2,0,0,0,0|2,0,0]=4 20943 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)I 240690a_100011218483_100000037189 [0,2,0,0,0,0|2,0,0]=4 20944 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)I 527a_100011218483_100000037189 [0,2,0,0,0,0|2,0,0]=4 20945 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)O 240690a_100011218483_100000689029 [0,2,0,0,0,0|2,0,0]=4 20946 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1F)O 527a_100011218483_100000689029 [0,2,0,0,0,0|2,0,0]=4 20947 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)Br 11a_100011218483_100000751167 [0,2,0,0,0,0|2,0,0]=4 20948 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)Br 240690a_100011218483_100000751167 [0,2,0,0,0,0|2,0,0]=4 20949 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)Br 527a_100011218483_100000751167 [0,2,0,0,0,0|2,0,0]=4 20950 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)C 11a_100011218483_100009999607 [0,2,0,0,0,0|2,0,0]=4 20951 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)C 240690a_100011218483_100009999607 [0,2,0,0,0,0|2,0,0]=4 20952 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)C 527a_100011218483_100009999607 [0,2,0,0,0,0|2,0,0]=4 20953 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)Cl 11a_100011218483_100000739380 [0,2,0,0,0,0|2,0,0]=4 20954 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)Cl 240690a_100011218483_100000739380 [0,2,0,0,0,0|2,0,0]=4 20955 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)Cl 527a_100011218483_100000739380 [0,2,0,0,0,0|2,0,0]=4 20956 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)F 11a_100011218483_100000739341 [0,2,0,0,0,0|2,0,0]=4 20957 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)F 240690a_100011218483_100000739341 [0,2,0,0,0,0|2,0,0]=4 20958 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1I)F 527a_100011218483_100000739341 [0,2,0,0,0,0|2,0,0]=4 20959 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)Br 240690a_100011218483_100000744433 [0,2,0,0,0,0|1,0,0]=3 20960 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)Br 527a_100011218483_100000744433 [0,2,0,0,0,0|1,0,0]=3 20961 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)C 240690a_100011218483_100000212137 [0,2,0,0,0,0|1,0,0]=3 20962 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)C 527a_100011218483_100000212137 [0,2,0,0,0,0|1,0,0]=3 20963 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)Cl 11a_100011218483_100000188622 [0,2,0,0,0,0|1,0,0]=3 20964 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)Cl 240690a_100011218483_100000188622 [0,2,0,0,0,0|1,0,0]=3 20965 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)Cl 527a_100011218483_100000188622 [0,2,0,0,0,0|1,0,0]=3 20966 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)F 240690a_100011218483_100000746061 [0,2,0,0,0,0|1,0,0]=3 20967 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)F 527a_100011218483_100000746061 [0,2,0,0,0,0|1,0,0]=3 20968 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)I 240690a_100011218483_100000091984 [0,2,0,0,0,0|1,0,0]=3 20969 B16R1.40160 CCC(O)CNC(=O)c1ccc(cc1O)I 527a_100011218483_100000091984 [0,2,0,0,0,0|1,0,0]=3 20970 B16R1.40160 CCN(C)COC(=O)c1ccc(cc1Cl)Cl 2230a_100000225621_100010978946 [0,2,0,0,0,0|2,0,0]=4 20971 B16R1.40160 CCN(C)COC(=O)c1ccc(cc1Cl)Cl 269982a_100000225621_100010978946 [0,2,0,0,0,0|2,0,0]=4 20972 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)Br 240690a_100020591295_100000744433 [0,2,0,0,0,0|2,0,0]=4 20973 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)Br 527a_100020591295_100000744433 [0,2,0,0,0,0|2,0,0]=4 20974 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)C 1626a_100020591295_100000212137 [0,2,0,0,0,0|2,0,0]=4 20975 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)C 240690a_100020591295_100000212137 [0,2,0,0,0,0|2,0,0]=4 20976 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)C 527a_100020591295_100000212137 [0,2,0,0,0,0|2,0,0]=4 20977 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)Cl 11a_100020591295_100000188622 [0,2,0,0,0,0|2,0,0]=4 20978 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)Cl 240690a_100020591295_100000188622 [0,2,0,0,0,0|2,0,0]=4 20979 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)Cl 527a_100020591295_100000188622 [0,2,0,0,0,0|2,0,0]=4 20980 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)F 240690a_100020591295_100000746061 [0,2,0,0,0,0|2,0,0]=4 20981 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)F 527a_100020591295_100000746061 [0,2,0,0,0,0|2,0,0]=4 20982 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)I 240690a_100020591295_100000091984 [0,2,0,0,0,0|2,0,0]=4 20983 B16R1.40160 CO[C@H](C)CNC(=O)c1ccc(cc1O)I 527a_100020591295_100000091984 [0,2,0,0,0,0|2,0,0]=4 20984 B16R1.40160 Cc1ccc(c(c1)O)C(=O)NCC(C)CO 240690a_100000744482_100000212137 [0,2,0,0,0,0|2,0,0]=4 20985 B16R1.40160 Cc1ccc(c(c1)O)C(=O)NCC(C)CO 527a_100000744482_100000212137 [0,2,0,0,0,0|2,0,0]=4 20986 B16R1.40160 Cc1ccc(c(c1)O)C(=O)NC[C@@H](F)CO 240690a_100015665980_100000212137 [0,2,0,0,0,0|2,0,0]=4 20987 B16R1.40160 Cc1ccc(c(c1)O)C(=O)NC[C@@H](F)CO 527a_100015665980_100000212137 [0,2,0,0,0,0|2,0,0]=4 20988 B16R1.40160 Cc1ccc(c(c1)O)C(=O)NC[C@H](O)CO 240690a_100020644852_100000212137 [0,2,0,0,0,0|2,0,0]=4 20989 B16R1.40160 Cc1ccc(c(c1)O)C(=O)NC[C@H](O)CO 527a_100020644852_100000212137 [0,2,0,0,0,0|2,0,0]=4 20990 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)Br 240690a_100015665980_100000744433 [0,2,0,0,0,0|2,0,0]=4 20991 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)Br 527a_100015665980_100000744433 [0,2,0,0,0,0|2,0,0]=4 20992 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)Cl 240690a_100015665980_100000188622 [0,2,0,0,0,0|2,0,0]=4 20993 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)Cl 527a_100015665980_100000188622 [0,2,0,0,0,0|2,0,0]=4 20994 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)F 240690a_100015665980_100000746061 [0,2,0,0,0,0|2,0,0]=4 20995 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)F 527a_100015665980_100000746061 [0,2,0,0,0,0|2,0,0]=4 20996 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)I 240690a_100015665980_100000091984 [0,2,0,0,0,0|2,0,0]=4 20997 B16R1.40160 O=C(NC[C@@H](F)CO)c1ccc(cc1O)I 527a_100015665980_100000091984 [0,2,0,0,0,0|2,0,0]=4 20998 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)Br 240690a_100020644852_100000744433 [0,2,0,0,0,0|2,0,0]=4 20999 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)Br 527a_100020644852_100000744433 [0,2,0,0,0,0|2,0,0]=4 21000 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)Cl 240690a_100020644852_100000188622 [0,2,0,0,0,0|2,0,0]=4 21001 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)Cl 527a_100020644852_100000188622 [0,2,0,0,0,0|2,0,0]=4 21002 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)F 240690a_100020644852_100000746061 [0,2,0,0,0,0|2,0,0]=4 21003 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)F 527a_100020644852_100000746061 [0,2,0,0,0,0|2,0,0]=4 21004 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)I 240690a_100020644852_100000091984 [0,2,0,0,0,0|2,0,0]=4 21005 B16R1.40160 O=C(NC[C@H](O)CO)c1ccc(cc1O)I 527a_100020644852_100000091984 [0,2,0,0,0,0|2,0,0]=4 21006 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200011215066 [0,2,0,0,0,0|2,0,0]=4 21007 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)C 1458a_100000685072_200011215066 [0,2,0,0,0,0|2,0,0]=4 21008 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200011215066 [0,2,0,0,0,0|2,0,0]=4 21009 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)F 1458a_100000212304_200011215066 [0,2,0,0,0,0|2,0,0]=4 21010 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)I 1458a_100012360512_200011215066 [0,2,0,0,0,0|2,0,0]=4 21011 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Br)O 1458a_100012344906_200011215066 [0,2,0,0,0,0|2,0,0]=4 21012 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1C)Br 1458a_100000741311_200011215066 [0,2,0,0,0,0|2,0,0]=4 21013 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1C)C 1458a_100000211164_200011215066 [0,2,0,0,0,0|2,0,0]=4 21014 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1C)Cl 1458a_100000688705_200011215066 [0,2,0,0,0,0|2,0,0]=4 21015 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1C)F 1458a_100000686989_200011215066 [0,2,0,0,0,0|2,0,0]=4 21016 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1C)I 1458a_100010189873_200011215066 [0,2,0,0,0,0|2,0,0]=4 21017 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1C)O 1458a_100000692822_200011215066 [0,2,0,0,0,0|2,0,0]=4 21018 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200011215066 [0,2,0,0,0,0|2,0,0]=4 21019 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)C 1458a_100000766932_200011215066 [0,2,0,0,0,0|2,0,0]=4 21020 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200011215066 [0,2,0,0,0,0|2,0,0]=4 21021 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200011215066 [0,2,0,0,0,0|2,0,0]=4 21022 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200011215066 [0,2,0,0,0,0|2,0,0]=4 21023 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200011215066 [0,2,0,0,0,0|2,0,0]=4 21024 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1F)Br 1458a_100000214689_200011215066 [0,2,0,0,0,0|2,0,0]=4 21025 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1F)C 1458a_100000766033_200011215066 [0,2,0,0,0,0|2,0,0]=4 21026 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200011215066 [0,2,0,0,0,0|2,0,0]=4 21027 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1F)F 1458a_100000211022_200011215066 [0,2,0,0,0,0|2,0,0]=4 21028 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1F)I 1458a_100000037189_200011215066 [0,2,0,0,0,0|2,0,0]=4 21029 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1F)O 1458a_100000689029_200011215066 [0,2,0,0,0,0|2,0,0]=4 21030 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1I)Br 1458a_100000751167_200011215066 [0,2,0,0,0,0|2,0,0]=4 21031 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1I)C 1458a_100009999607_200011215066 [0,2,0,0,0,0|2,0,0]=4 21032 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200011215066 [0,2,0,0,0,0|2,0,0]=4 21033 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1I)F 1458a_100000739341_200011215066 [0,2,0,0,0,0|2,0,0]=4 21034 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1O)Br 1458a_100000744433_200011215066 [0,2,0,0,0,0|1,0,0]=3 21035 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1O)C 1458a_100000212137_200011215066 [0,2,0,0,0,0|1,0,0]=3 21036 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200011215066 [0,2,0,0,0,0|1,0,0]=3 21037 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1O)F 1458a_100000746061_200011215066 [0,2,0,0,0,0|1,0,0]=3 21038 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1O)I 1458a_100000091984_200011215066 [0,2,0,0,0,0|1,0,0]=3 21039 B16R1.40312 CCCCC(C)C(=O)c1ccc(cc1O)O 1458a_100000212172_200011215066 [0,2,0,0,0,0|1,0,0]=3 21040 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Br 11a_100000207549_100000762965 [0,2,0,0,0,0|2,0,0]=4 21041 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Br 1626a_100000207549_100000762965 [0,2,0,0,0,0|2,0,0]=4 21042 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Br 240690a_100000207549_100000762965 [0,2,0,0,0,0|2,0,0]=4 21043 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Br 527a_100000207549_100000762965 [0,2,0,0,0,0|2,0,0]=4 21044 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)C 11a_100000207549_100000685072 [0,2,0,0,0,0|2,0,0]=4 21045 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)C 1626a_100000207549_100000685072 [0,2,0,0,0,0|2,0,0]=4 21046 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)C 240690a_100000207549_100000685072 [0,2,0,0,0,0|2,0,0]=4 21047 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)C 527a_100000207549_100000685072 [0,2,0,0,0,0|2,0,0]=4 21048 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Cl 11a_100000207549_100000766353 [0,2,0,0,0,0|2,0,0]=4 21049 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100000207549_100000766353 [0,2,0,0,0,0|2,0,0]=4 21050 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Cl 240690a_100000207549_100000766353 [0,2,0,0,0,0|2,0,0]=4 21051 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)Cl 527a_100000207549_100000766353 [0,2,0,0,0,0|2,0,0]=4 21052 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)F 11a_100000207549_100000212304 [0,2,0,0,0,0|2,0,0]=4 21053 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)F 1626a_100000207549_100000212304 [0,2,0,0,0,0|2,0,0]=4 21054 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)F 240690a_100000207549_100000212304 [0,2,0,0,0,0|2,0,0]=4 21055 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)F 527a_100000207549_100000212304 [0,2,0,0,0,0|2,0,0]=4 21056 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)I 11a_100000207549_100012360512 [0,2,0,0,0,0|2,0,0]=4 21057 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)I 1626a_100000207549_100012360512 [0,2,0,0,0,0|2,0,0]=4 21058 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)I 240690a_100000207549_100012360512 [0,2,0,0,0,0|2,0,0]=4 21059 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)I 527a_100000207549_100012360512 [0,2,0,0,0,0|2,0,0]=4 21060 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)O 240690a_100000207549_100012344906 [0,2,0,0,0,0|2,0,0]=4 21061 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Br)O 527a_100000207549_100012344906 [0,2,0,0,0,0|2,0,0]=4 21062 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Br 11a_100000207549_100000741311 [0,2,0,0,0,0|2,0,0]=4 21063 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Br 1626a_100000207549_100000741311 [0,2,0,0,0,0|2,0,0]=4 21064 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Br 240690a_100000207549_100000741311 [0,2,0,0,0,0|2,0,0]=4 21065 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Br 527a_100000207549_100000741311 [0,2,0,0,0,0|2,0,0]=4 21066 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)C 11a_100000207549_100000211164 [0,2,0,0,0,0|2,0,0]=4 21067 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)C 1626a_100000207549_100000211164 [0,2,0,0,0,0|2,0,0]=4 21068 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)C 240690a_100000207549_100000211164 [0,2,0,0,0,0|2,0,0]=4 21069 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)C 527a_100000207549_100000211164 [0,2,0,0,0,0|2,0,0]=4 21070 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Cl 11a_100000207549_100000688705 [0,2,0,0,0,0|2,0,0]=4 21071 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Cl 1626a_100000207549_100000688705 [0,2,0,0,0,0|2,0,0]=4 21072 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Cl 240690a_100000207549_100000688705 [0,2,0,0,0,0|2,0,0]=4 21073 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)Cl 527a_100000207549_100000688705 [0,2,0,0,0,0|2,0,0]=4 21074 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)F 11a_100000207549_100000686989 [0,2,0,0,0,0|2,0,0]=4 21075 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)F 1626a_100000207549_100000686989 [0,2,0,0,0,0|2,0,0]=4 21076 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)F 240690a_100000207549_100000686989 [0,2,0,0,0,0|2,0,0]=4 21077 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)F 527a_100000207549_100000686989 [0,2,0,0,0,0|2,0,0]=4 21078 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)I 11a_100000207549_100010189873 [0,2,0,0,0,0|2,0,0]=4 21079 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)I 1626a_100000207549_100010189873 [0,2,0,0,0,0|2,0,0]=4 21080 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)I 240690a_100000207549_100010189873 [0,2,0,0,0,0|2,0,0]=4 21081 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)I 527a_100000207549_100010189873 [0,2,0,0,0,0|2,0,0]=4 21082 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)O 240690a_100000207549_100000692822 [0,2,0,0,0,0|2,0,0]=4 21083 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1C)O 527a_100000207549_100000692822 [0,2,0,0,0,0|2,0,0]=4 21084 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Br 11a_100000207549_100000741628 [0,2,0,0,0,0|2,0,0]=4 21085 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Br 1626a_100000207549_100000741628 [0,2,0,0,0,0|2,0,0]=4 21086 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Br 240690a_100000207549_100000741628 [0,2,0,0,0,0|2,0,0]=4 21087 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Br 527a_100000207549_100000741628 [0,2,0,0,0,0|2,0,0]=4 21088 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)C 11a_100000207549_100000766932 [0,2,0,0,0,0|2,0,0]=4 21089 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)C 1626a_100000207549_100000766932 [0,2,0,0,0,0|2,0,0]=4 21090 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)C 240690a_100000207549_100000766932 [0,2,0,0,0,0|2,0,0]=4 21091 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)C 527a_100000207549_100000766932 [0,2,0,0,0,0|2,0,0]=4 21092 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100000207549_100000185840 [0,2,0,0,0,0|2,0,0]=4 21093 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100000207549_100000185840 [0,2,0,0,0,0|2,0,0]=4 21094 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Cl 240690a_100000207549_100000185840 [0,2,0,0,0,0|2,0,0]=4 21095 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100000207549_100000185840 [0,2,0,0,0,0|2,0,0]=4 21096 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)F 11a_100000207549_100000211397 [0,2,0,0,0,0|2,0,0]=4 21097 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)F 1626a_100000207549_100000211397 [0,2,0,0,0,0|2,0,0]=4 21098 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)F 240690a_100000207549_100000211397 [0,2,0,0,0,0|2,0,0]=4 21099 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)F 527a_100000207549_100000211397 [0,2,0,0,0,0|2,0,0]=4 21100 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)I 11a_100000207549_100000751301 [0,2,0,0,0,0|2,0,0]=4 21101 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)I 1626a_100000207549_100000751301 [0,2,0,0,0,0|2,0,0]=4 21102 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)I 240690a_100000207549_100000751301 [0,2,0,0,0,0|2,0,0]=4 21103 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)I 527a_100000207549_100000751301 [0,2,0,0,0,0|2,0,0]=4 21104 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)O 240690a_100000207549_100000702456 [0,2,0,0,0,0|2,0,0]=4 21105 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1Cl)O 527a_100000207549_100000702456 [0,2,0,0,0,0|2,0,0]=4 21106 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Br 11a_100000207549_100000214689 [0,2,0,0,0,0|2,0,0]=4 21107 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Br 1626a_100000207549_100000214689 [0,2,0,0,0,0|2,0,0]=4 21108 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Br 240690a_100000207549_100000214689 [0,2,0,0,0,0|2,0,0]=4 21109 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Br 527a_100000207549_100000214689 [0,2,0,0,0,0|2,0,0]=4 21110 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)C 11a_100000207549_100000766033 [0,2,0,0,0,0|2,0,0]=4 21111 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)C 1626a_100000207549_100000766033 [0,2,0,0,0,0|2,0,0]=4 21112 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)C 240690a_100000207549_100000766033 [0,2,0,0,0,0|2,0,0]=4 21113 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)C 527a_100000207549_100000766033 [0,2,0,0,0,0|2,0,0]=4 21114 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Cl 11a_100000207549_100000212326 [0,2,0,0,0,0|2,0,0]=4 21115 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Cl 1626a_100000207549_100000212326 [0,2,0,0,0,0|2,0,0]=4 21116 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Cl 240690a_100000207549_100000212326 [0,2,0,0,0,0|2,0,0]=4 21117 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)Cl 527a_100000207549_100000212326 [0,2,0,0,0,0|2,0,0]=4 21118 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)F 11a_100000207549_100000211022 [0,2,0,0,0,0|2,0,0]=4 21119 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)F 1626a_100000207549_100000211022 [0,2,0,0,0,0|2,0,0]=4 21120 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)F 240690a_100000207549_100000211022 [0,2,0,0,0,0|2,0,0]=4 21121 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)F 527a_100000207549_100000211022 [0,2,0,0,0,0|2,0,0]=4 21122 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)I 11a_100000207549_100000037189 [0,2,0,0,0,0|2,0,0]=4 21123 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)I 1626a_100000207549_100000037189 [0,2,0,0,0,0|2,0,0]=4 21124 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)I 240690a_100000207549_100000037189 [0,2,0,0,0,0|2,0,0]=4 21125 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)I 527a_100000207549_100000037189 [0,2,0,0,0,0|2,0,0]=4 21126 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)O 240690a_100000207549_100000689029 [0,2,0,0,0,0|2,0,0]=4 21127 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1F)O 527a_100000207549_100000689029 [0,2,0,0,0,0|2,0,0]=4 21128 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Br 11a_100000207549_100000751167 [0,2,0,0,0,0|2,0,0]=4 21129 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Br 1626a_100000207549_100000751167 [0,2,0,0,0,0|2,0,0]=4 21130 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Br 240690a_100000207549_100000751167 [0,2,0,0,0,0|2,0,0]=4 21131 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Br 527a_100000207549_100000751167 [0,2,0,0,0,0|2,0,0]=4 21132 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)C 11a_100000207549_100009999607 [0,2,0,0,0,0|2,0,0]=4 21133 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)C 1626a_100000207549_100009999607 [0,2,0,0,0,0|2,0,0]=4 21134 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)C 240690a_100000207549_100009999607 [0,2,0,0,0,0|2,0,0]=4 21135 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)C 527a_100000207549_100009999607 [0,2,0,0,0,0|2,0,0]=4 21136 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Cl 11a_100000207549_100000739380 [0,2,0,0,0,0|2,0,0]=4 21137 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Cl 1626a_100000207549_100000739380 [0,2,0,0,0,0|2,0,0]=4 21138 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Cl 240690a_100000207549_100000739380 [0,2,0,0,0,0|2,0,0]=4 21139 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)Cl 527a_100000207549_100000739380 [0,2,0,0,0,0|2,0,0]=4 21140 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)F 11a_100000207549_100000739341 [0,2,0,0,0,0|2,0,0]=4 21141 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)F 1626a_100000207549_100000739341 [0,2,0,0,0,0|2,0,0]=4 21142 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)F 240690a_100000207549_100000739341 [0,2,0,0,0,0|2,0,0]=4 21143 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1I)F 527a_100000207549_100000739341 [0,2,0,0,0,0|2,0,0]=4 21144 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)Br 240690a_100000207549_100000744433 [0,2,0,0,0,0|1,0,0]=3 21145 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)Br 527a_100000207549_100000744433 [0,2,0,0,0,0|1,0,0]=3 21146 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)C 1626a_100000207549_100000212137 [0,2,0,0,0,0|1,0,0]=3 21147 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)C 240690a_100000207549_100000212137 [0,2,0,0,0,0|1,0,0]=3 21148 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)C 527a_100000207549_100000212137 [0,2,0,0,0,0|1,0,0]=3 21149 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000207549_100000188622 [0,2,0,0,0,0|1,0,0]=3 21150 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)Cl 240690a_100000207549_100000188622 [0,2,0,0,0,0|1,0,0]=3 21151 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000207549_100000188622 [0,2,0,0,0,0|1,0,0]=3 21152 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)F 240690a_100000207549_100000746061 [0,2,0,0,0,0|1,0,0]=3 21153 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)F 527a_100000207549_100000746061 [0,2,0,0,0,0|1,0,0]=3 21154 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)I 240690a_100000207549_100000091984 [0,2,0,0,0,0|1,0,0]=3 21155 B16R1.40312 CCCCN(C)C(=O)c1ccc(cc1O)I 527a_100000207549_100000091984 [0,2,0,0,0,0|1,0,0]=3 21156 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)Br 240690a_100000213112_100000744433 [0,2,0,0,0,0|2,0,0]=4 21157 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)Br 527a_100000213112_100000744433 [0,2,0,0,0,0|2,0,0]=4 21158 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)Cl 240690a_100000213112_100000188622 [0,2,0,0,0,0|2,0,0]=4 21159 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)Cl 527a_100000213112_100000188622 [0,2,0,0,0,0|2,0,0]=4 21160 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)F 240690a_100000213112_100000746061 [0,2,0,0,0,0|2,0,0]=4 21161 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)F 527a_100000213112_100000746061 [0,2,0,0,0,0|2,0,0]=4 21162 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)I 240690a_100000213112_100000091984 [0,2,0,0,0,0|2,0,0]=4 21163 B16R1.40312 CN(CCCO)C(=O)c1ccc(cc1O)I 527a_100000213112_100000091984 [0,2,0,0,0,0|2,0,0]=4 21164 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)Br 240690a_100000743101_100000744433 [0,2,0,0,0,0|2,0,0]=4 21165 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)Br 527a_100000743101_100000744433 [0,2,0,0,0,0|2,0,0]=4 21166 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)C 1626a_100000743101_100000212137 [0,2,0,0,0,0|2,0,0]=4 21167 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)C 240690a_100000743101_100000212137 [0,2,0,0,0,0|2,0,0]=4 21168 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)C 527a_100000743101_100000212137 [0,2,0,0,0,0|2,0,0]=4 21169 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000743101_100000188622 [0,2,0,0,0,0|2,0,0]=4 21170 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)Cl 240690a_100000743101_100000188622 [0,2,0,0,0,0|2,0,0]=4 21171 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000743101_100000188622 [0,2,0,0,0,0|2,0,0]=4 21172 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)F 240690a_100000743101_100000746061 [0,2,0,0,0,0|2,0,0]=4 21173 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)F 527a_100000743101_100000746061 [0,2,0,0,0,0|2,0,0]=4 21174 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)I 240690a_100000743101_100000091984 [0,2,0,0,0,0|2,0,0]=4 21175 B16R1.40312 COCCN(C)C(=O)c1ccc(cc1O)I 527a_100000743101_100000091984 [0,2,0,0,0,0|2,0,0]=4 21176 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)Br 240690a_100000686725_100000744433 [0,2,0,0,0,0|2,0,0]=4 21177 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)Br 527a_100000686725_100000744433 [0,2,0,0,0,0|2,0,0]=4 21178 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)C 1626a_100000686725_100000212137 [0,2,0,0,0,0|2,0,0]=4 21179 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)C 240690a_100000686725_100000212137 [0,2,0,0,0,0|2,0,0]=4 21180 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)C 527a_100000686725_100000212137 [0,2,0,0,0,0|2,0,0]=4 21181 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000686725_100000188622 [0,2,0,0,0,0|2,0,0]=4 21182 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)Cl 240690a_100000686725_100000188622 [0,2,0,0,0,0|2,0,0]=4 21183 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000686725_100000188622 [0,2,0,0,0,0|2,0,0]=4 21184 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)F 240690a_100000686725_100000746061 [0,2,0,0,0,0|2,0,0]=4 21185 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)F 527a_100000686725_100000746061 [0,2,0,0,0,0|2,0,0]=4 21186 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)I 240690a_100000686725_100000091984 [0,2,0,0,0,0|2,0,0]=4 21187 B16R1.40312 CSCCN(C)C(=O)c1ccc(cc1O)I 527a_100000686725_100000091984 [0,2,0,0,0,0|2,0,0]=4 21188 B16R1.40312 Cc1ccc(c(c1)O)C(=O)N(C)CCCO 240690a_100000213112_100000212137 [0,2,0,0,0,0|2,0,0]=4 21189 B16R1.40312 Cc1ccc(c(c1)O)C(=O)N(C)CCCO 527a_100000213112_100000212137 [0,2,0,0,0,0|2,0,0]=4 21190 B16R1.4679 CCCCNN=C(CC)c1ccccc1O 4a_100025702795_100000184720 [0,2,0,0,0,0|2,0,0]=4 21191 B16R1.4679 CCCCOCN(CC)c1ccccc1O 269982a_103624766699_100011995733 [0,2,0,0,0,0|2,0,0]=4 21192 B16R1.7010 CCCCC(=O)CC(=O)c1ccccc1Br 1458a_100000210183_100000199116 [0,2,0,0,0,0|2,0,0]=4 21193 B16R1.7010 CCCCC(=O)CC(=O)c1ccccc1C 1458a_100000210183_100000741374 [0,2,0,0,0,0|2,0,0]=4 21194 B16R1.7010 CCCCC(=O)CC(=O)c1ccccc1Cl 1458a_100000210183_100000211432 [0,2,0,0,0,0|2,0,0]=4 21195 B16R1.7010 CCCCC(=O)CC(=O)c1ccccc1F 1458a_100000210183_100000204681 [0,2,0,0,0,0|2,0,0]=4 21196 B16R1.7010 CCCCC(=O)CC(=O)c1ccccc1O 1458a_100000210183_100000188908 [0,2,0,0,0,0|1,0,0]=3 21197 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Br 11a_100000126638_100000188424 [0,2,0,0,0,0|2,0,0]=4 21198 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Br 1626a_100000126638_100000188424 [0,2,0,0,0,0|2,0,0]=4 21199 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Br 240690a_100000126638_100000188424 [0,2,0,0,0,0|2,0,0]=4 21200 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Br 527a_100000126638_100000188424 [0,2,0,0,0,0|2,0,0]=4 21201 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1C 11a_100000126638_100000212026 [0,2,0,0,0,0|2,0,0]=4 21202 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1C 1626a_100000126638_100000212026 [0,2,0,0,0,0|2,0,0]=4 21203 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1C 240690a_100000126638_100000212026 [0,2,0,0,0,0|2,0,0]=4 21204 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1C 527a_100000126638_100000212026 [0,2,0,0,0,0|2,0,0]=4 21205 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Cl 11a_100000126638_100000185844 [0,2,0,0,0,0|2,0,0]=4 21206 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Cl 1626a_100000126638_100000185844 [0,2,0,0,0,0|2,0,0]=4 21207 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Cl 240690a_100000126638_100000185844 [0,2,0,0,0,0|2,0,0]=4 21208 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1Cl 527a_100000126638_100000185844 [0,2,0,0,0,0|2,0,0]=4 21209 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1F 11a_100000126638_100000188656 [0,2,0,0,0,0|2,0,0]=4 21210 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1F 1626a_100000126638_100000188656 [0,2,0,0,0,0|2,0,0]=4 21211 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1F 240690a_100000126638_100000188656 [0,2,0,0,0,0|2,0,0]=4 21212 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1F 527a_100000126638_100000188656 [0,2,0,0,0,0|2,0,0]=4 21213 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1I 11a_100000126638_100000187884 [0,2,0,0,0,0|2,0,0]=4 21214 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1I 1626a_100000126638_100000187884 [0,2,0,0,0,0|2,0,0]=4 21215 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1I 240690a_100000126638_100000187884 [0,2,0,0,0,0|2,0,0]=4 21216 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1I 527a_100000126638_100000187884 [0,2,0,0,0,0|2,0,0]=4 21217 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1O 240690a_100000126638_100015234032 [0,2,0,0,0,0|1,0,0]=3 21218 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1[O-] 1626a_100000126638_100009911694 [0,2,0,0,0,0|1,0,1]=4 21219 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1[O-] 240690a_100000126638_100009911694 [0,2,0,0,0,0|1,0,1]=4 21220 B16R1.7010 CCCCC(C)NC(=O)c1ccccc1[O-] 527a_100000126638_100009911694 [0,2,0,0,0,0|1,0,1]=4 21221 B16R1.7010 CCCCN(C)CC(=O)c1ccccc1Br 269982a_100000207549_100000199116 [0,2,0,0,0,0|2,0,0]=4 21222 B16R1.7010 CCCCN(C)CC(=O)c1ccccc1C 2230a_100000207549_100000741374 [0,2,0,0,0,0|2,0,0]=4 21223 B16R1.7010 CCCCN(C)CC(=O)c1ccccc1C 269982a_100000207549_100000741374 [0,2,0,0,0,0|2,0,0]=4 21224 B16R1.7010 CCCCN(C)CC(=O)c1ccccc1Cl 269982a_100000207549_100000211432 [0,2,0,0,0,0|2,0,0]=4 21225 B16R1.7010 CCCCN(C)CC(=O)c1ccccc1F 269982a_100000207549_100000204681 [0,2,0,0,0,0|2,0,0]=4 21226 B16R1.7010 CCCCN(C)CC(=O)c1ccccc1O 269982a_100000207549_100000188908 [0,2,0,0,0,0|1,0,0]=3 21227 B16R1.7010 CCCNC(=O)CC(=O)c1ccccc1O 1458a_100015234032_100000183358 [0,2,0,0,0,0|1,0,1]=4 21228 B16R1.7010 CCCOC(=O)CC(=O)c1ccccc1O 1458a_100015234032_200011215008 [0,2,0,0,0,0|1,0,1]=4 21229 B16R1.7010 CCOCC(=O)CC(=O)c1ccccc1O 1458a_100000211967_100000188908 [0,2,0,0,0,0|1,0,1]=4 21230 B16R1.7010 CCSCC(=O)CC(=O)c1ccccc1O 1458a_100000230394_100000188908 [0,2,0,0,0,0|1,0,1]=4 21231 B16R1.7010 CN(CCCO)CC(=O)c1ccccc1O 269982a_100000213112_100000188908 [0,2,0,0,0,0|2,0,0]=4 21232 B16R1.7010 COCCC(=O)CC(=O)c1ccccc1O 1458a_100000749529_100000188908 [0,2,0,0,0,0|1,0,1]=4 21233 B16R1.7010 COCCN(C)CC(=O)c1ccccc1O 269982a_100000743101_100000188908 [0,2,0,0,0,0|2,0,0]=4 21234 B16R1.7010 CSCCC(=O)CC(=O)c1ccccc1O 1458a_100000174002_100000188908 [0,2,0,0,0,0|1,0,1]=4 21235 B16R1.7010 CSCCN(C)CC(=O)c1ccccc1O 269982a_100000686725_100000188908 [0,2,0,0,0,0|2,0,0]=4 21236 B16R1.7437 CC(C)CC(=O)CC(=O)c1ccccc1O 1458a_100000210554_100000188908 [0,2,0,0,0,0|1,0,1]=4 21237 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Br 11a_100000692259_100000188424 [0,2,0,0,0,0|2,0,0]=4 21238 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Br 1626a_100000692259_100000188424 [0,2,0,0,0,0|2,0,0]=4 21239 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Br 240690a_100000692259_100000188424 [0,2,0,0,0,0|2,0,0]=4 21240 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Br 527a_100000692259_100000188424 [0,2,0,0,0,0|2,0,0]=4 21241 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Cl 11a_100000692259_100000185844 [0,2,0,0,0,0|2,0,0]=4 21242 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Cl 1626a_100000692259_100000185844 [0,2,0,0,0,0|2,0,0]=4 21243 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Cl 240690a_100000692259_100000185844 [0,2,0,0,0,0|2,0,0]=4 21244 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1Cl 527a_100000692259_100000185844 [0,2,0,0,0,0|2,0,0]=4 21245 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1F 11a_100000692259_100000188656 [0,2,0,0,0,0|2,0,0]=4 21246 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1F 1626a_100000692259_100000188656 [0,2,0,0,0,0|2,0,0]=4 21247 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1F 240690a_100000692259_100000188656 [0,2,0,0,0,0|2,0,0]=4 21248 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1F 527a_100000692259_100000188656 [0,2,0,0,0,0|2,0,0]=4 21249 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1I 11a_100000692259_100000187884 [0,2,0,0,0,0|2,0,0]=4 21250 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1I 1626a_100000692259_100000187884 [0,2,0,0,0,0|2,0,0]=4 21251 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1I 240690a_100000692259_100000187884 [0,2,0,0,0,0|2,0,0]=4 21252 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1I 527a_100000692259_100000187884 [0,2,0,0,0,0|2,0,0]=4 21253 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1O 240690a_100000692259_100015234032 [0,2,0,0,0,0|1,0,0]=3 21254 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1[O-] 1626a_100000692259_100009911694 [0,2,0,0,0,0|1,0,1]=4 21255 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1[O-] 240690a_100000692259_100009911694 [0,2,0,0,0,0|1,0,1]=4 21256 B16R1.7437 CC(C)CC(C)NC(=O)c1ccccc1[O-] 527a_100000692259_100009911694 [0,2,0,0,0,0|1,0,1]=4 21257 B16R1.7437 CC(C)CN(C)CC(=O)c1ccccc1O 269982a_100000747067_100000188908 [0,2,0,0,0,0|2,0,0]=4 21258 B16R1.7437 CC(CN(C)C)NC(=O)c1ccccc1O 240690a_100016992788_100015234032 [0,2,0,0,0,0|2,0,0]=4 21259 B16R1.7437 CC(O)CN(C)CC(=O)c1ccccc1O 269982a_100000227577_100000188908 [0,2,0,0,0,0|2,0,0]=4 21260 B16R1.7437 C[C@@H](O)CC(=O)CC(=O)c1ccccc1O 1458a_100011933948_100000188908 [0,2,0,0,0,0|1,0,1]=4 21261 B16R1.7437 Cc1ccccc1C(=O)NC(C)CC(C)C 11a_100000692259_100000212026 [0,2,0,0,0,0|2,0,0]=4 21262 B16R1.7437 Cc1ccccc1C(=O)NC(C)CC(C)C 1626a_100000692259_100000212026 [0,2,0,0,0,0|2,0,0]=4 21263 B16R1.7437 Cc1ccccc1C(=O)NC(C)CC(C)C 240690a_100000692259_100000212026 [0,2,0,0,0,0|2,0,0]=4 21264 B16R1.7437 Cc1ccccc1C(=O)NC(C)CC(C)C 527a_100000692259_100000212026 [0,2,0,0,0,0|2,0,0]=4 21265 B16R1.12839 CCC(COC)NC(=O)c1ccccc1O 240690a_100000757820_100015234032 [0,2,0,0,0,0|2,0,0]=4 21266 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Br 11a_100000747048_100000188424 [0,2,0,0,0,0|2,0,0]=4 21267 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Br 1626a_100000747048_100000188424 [0,2,0,0,0,0|2,0,0]=4 21268 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Br 240690a_100000747048_100000188424 [0,2,0,0,0,0|2,0,0]=4 21269 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Br 527a_100000747048_100000188424 [0,2,0,0,0,0|2,0,0]=4 21270 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1C 11a_100000747048_100000212026 [0,2,0,0,0,0|2,0,0]=4 21271 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1C 1626a_100000747048_100000212026 [0,2,0,0,0,0|2,0,0]=4 21272 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1C 240690a_100000747048_100000212026 [0,2,0,0,0,0|2,0,0]=4 21273 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1C 527a_100000747048_100000212026 [0,2,0,0,0,0|2,0,0]=4 21274 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Cl 11a_100000747048_100000185844 [0,2,0,0,0,0|2,0,0]=4 21275 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Cl 1626a_100000747048_100000185844 [0,2,0,0,0,0|2,0,0]=4 21276 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Cl 240690a_100000747048_100000185844 [0,2,0,0,0,0|2,0,0]=4 21277 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1Cl 527a_100000747048_100000185844 [0,2,0,0,0,0|2,0,0]=4 21278 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1F 11a_100000747048_100000188656 [0,2,0,0,0,0|2,0,0]=4 21279 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1F 1626a_100000747048_100000188656 [0,2,0,0,0,0|2,0,0]=4 21280 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1F 240690a_100000747048_100000188656 [0,2,0,0,0,0|2,0,0]=4 21281 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1F 527a_100000747048_100000188656 [0,2,0,0,0,0|2,0,0]=4 21282 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1I 11a_100000747048_100000187884 [0,2,0,0,0,0|2,0,0]=4 21283 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1I 1626a_100000747048_100000187884 [0,2,0,0,0,0|2,0,0]=4 21284 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1I 240690a_100000747048_100000187884 [0,2,0,0,0,0|2,0,0]=4 21285 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1I 527a_100000747048_100000187884 [0,2,0,0,0,0|2,0,0]=4 21286 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1O 240690a_100000747048_100015234032 [0,2,0,0,0,0|1,0,0]=3 21287 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1[O-] 1626a_100000747048_100009911694 [0,2,0,0,0,0|1,0,1]=4 21288 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1[O-] 240690a_100000747048_100009911694 [0,2,0,0,0,0|1,0,1]=4 21289 B16R1.12839 CCCC(CC)NC(=O)c1ccccc1[O-] 527a_100000747048_100009911694 [0,2,0,0,0,0|1,0,1]=4 21290 B16R1.12839 CCCN(CC)CC(=O)c1ccccc1O 269982a_100000226822_100000188908 [0,2,0,0,0,0|2,0,0]=4 21291 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1Br 240690a_100000732646_100000188424 [0,2,0,0,0,0|2,0,0]=4 21292 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1Br 527a_100000732646_100000188424 [0,2,0,0,0,0|2,0,0]=4 21293 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1C 240690a_100000732646_100000212026 [0,2,0,0,0,0|2,0,0]=4 21294 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1C 527a_100000732646_100000212026 [0,2,0,0,0,0|2,0,0]=4 21295 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1Cl 240690a_100000732646_100000185844 [0,2,0,0,0,0|2,0,0]=4 21296 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1Cl 527a_100000732646_100000185844 [0,2,0,0,0,0|2,0,0]=4 21297 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1F 240690a_100000732646_100000188656 [0,2,0,0,0,0|2,0,0]=4 21298 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1F 527a_100000732646_100000188656 [0,2,0,0,0,0|2,0,0]=4 21299 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1I 240690a_100000732646_100000187884 [0,2,0,0,0,0|2,0,0]=4 21300 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1I 527a_100000732646_100000187884 [0,2,0,0,0,0|2,0,0]=4 21301 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1O 240690a_100000732646_100015234032 [0,2,0,0,0,0|1,0,0]=3 21302 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1[O-] 240690a_100000732646_100009911694 [0,2,0,0,0,0|1,0,1]=4 21303 B16R1.12839 CCC[C@@H](CO)NC(=O)c1ccccc1[O-] 527a_100000732646_100009911694 [0,2,0,0,0,0|1,0,1]=4 21304 B16R1.12839 COCC(CO)NC(=O)c1ccccc1O 240690a_100000724102_100015234032 [0,2,0,0,0,0|2,0,0]=4 21305 B16R1.13247 CC(CCO)N(C)C(=O)c1ccccc1O 240690a_100000731037_100015234032 [0,2,0,0,0,0|2,0,0]=4 21306 B16R1.16904 CCC(C)C(=O)CC(=O)c1ccccc1O 1458a_100011192722_100000188908 [0,2,0,0,0,0|1,0,1]=4 21307 B16R1.16904 CCC(C)N(C)CC(=O)c1ccccc1O 269982a_100000741768_100000188908 [0,2,0,0,0,0|2,0,0]=4 21308 B16R1.16904 CCC(O)C(=O)CC(=O)c1ccccc1O 1458a_100011196387_100000188908 [0,2,0,0,0,0|1,0,1]=4 21309 B16R1.64548 CC(C)(CCO)NC(=O)c1ccccc1O 240690a_100000763138_100015234032 [0,2,0,0,0,0|2,0,0]=4 21310 B16R1.64548 CCCS(=O)(=O)NC(=O)c1ccccc1O 2740a_100000171175_100015234032 [0,2,0,0,0,0|2,0,0]=4 21311 B16R1.64548 COCC(C)(C)NC(=O)c1ccccc1O 240690a_100000752728_100015234032 [0,2,0,0,0,0|2,0,0]=4 21312 B16R1.64548 CSCC(C)(C)NC(=O)c1ccccc1O 240690a_100000759623_100015234032 [0,2,0,0,0,0|2,0,0]=4 21313 B16R1.104268 CCCC(=O)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100000747444 [0,2,0,0,0,0|1,0,1]=4 21314 B16R1.104268 CCCC(=O)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000747444 [0,2,0,0,0,0|1,0,1]=4 21315 B16R1.104268 CCCC(=O)CC(=O)c1c(cccc1F)O 1458a_100000763259_100000747444 [0,2,0,0,0,0|1,0,1]=4 21316 B16R1.104268 CCCC(=O)CC(=O)c1c(cccc1O)C 1458a_100011934116_100000747444 [0,2,0,0,0,0|1,0,1]=4 21317 B16R1.104268 CCCC(=O)CC(=O)c1c(cccc1O)O 1458a_100000755285_100000747444 [0,2,0,0,0,0|1,0,1]=4 21318 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011216630 [0,2,0,0,0,0|2,0,0]=4 21319 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Br)C 1458a_100000701904_100011216630 [0,2,0,0,0,0|2,0,0]=4 21320 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011216630 [0,2,0,0,0,0|2,0,0]=4 21321 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Br)F 1458a_100000752694_100011216630 [0,2,0,0,0,0|2,0,0]=4 21322 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Br)O 1458a_100011935254_100011216630 [0,2,0,0,0,0|1,0,0]=3 21323 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1C)C 1458a_100000758298_100011216630 [0,2,0,0,0,0|2,0,0]=4 21324 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Cl)C 1458a_100000692601_100011216630 [0,2,0,0,0,0|2,0,0]=4 21325 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011216630 [0,2,0,0,0,0|2,0,0]=4 21326 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011216630 [0,2,0,0,0,0|2,0,0]=4 21327 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011216630 [0,2,0,0,0,0|1,0,0]=3 21328 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1F)C 1458a_100000762013_100011216630 [0,2,0,0,0,0|2,0,0]=4 21329 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1F)F 1458a_100000210804_100011216630 [0,2,0,0,0,0|2,0,0]=4 21330 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1F)O 1458a_100000763259_100011216630 [0,2,0,0,0,0|1,0,0]=3 21331 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1I)Br 1458a_100010232521_100011216630 [0,2,0,0,0,0|2,0,0]=4 21332 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1I)C 1458a_100000688020_100011216630 [0,2,0,0,0,0|2,0,0]=4 21333 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011216630 [0,2,0,0,0,0|2,0,0]=4 21334 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1I)F 1458a_100000023732_100011216630 [0,2,0,0,0,0|2,0,0]=4 21335 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1O)C 1458a_100011934116_100011216630 [0,2,0,0,0,0|1,0,0]=3 21336 B16R1.104268 CCCC(C)CC(=O)c1c(cccc1O)O 1458a_100000755285_100011216630 [0,2,0,0,0,0|1,0,0]=3 21337 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Br 11a_100000741246_100000690891 [0,2,0,0,0,0|2,0,0]=4 21338 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Br 1626a_100000741246_100000690891 [0,2,0,0,0,0|2,0,0]=4 21339 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Br 240690a_100000741246_100000690891 [0,2,0,0,0,0|2,0,0]=4 21340 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Br 527a_100000741246_100000690891 [0,2,0,0,0,0|2,0,0]=4 21341 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)C 11a_100000741246_100000701904 [0,2,0,0,0,0|2,0,0]=4 21342 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)C 1626a_100000741246_100000701904 [0,2,0,0,0,0|2,0,0]=4 21343 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)C 240690a_100000741246_100000701904 [0,2,0,0,0,0|2,0,0]=4 21344 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)C 527a_100000741246_100000701904 [0,2,0,0,0,0|2,0,0]=4 21345 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Cl 11a_100000741246_100011253703 [0,2,0,0,0,0|2,0,0]=4 21346 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Cl 1626a_100000741246_100011253703 [0,2,0,0,0,0|2,0,0]=4 21347 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Cl 240690a_100000741246_100011253703 [0,2,0,0,0,0|2,0,0]=4 21348 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)Cl 527a_100000741246_100011253703 [0,2,0,0,0,0|2,0,0]=4 21349 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)F 11a_100000741246_100000752694 [0,2,0,0,0,0|2,0,0]=4 21350 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)F 1626a_100000741246_100000752694 [0,2,0,0,0,0|2,0,0]=4 21351 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)F 240690a_100000741246_100000752694 [0,2,0,0,0,0|2,0,0]=4 21352 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)F 527a_100000741246_100000752694 [0,2,0,0,0,0|2,0,0]=4 21353 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)O 240690a_100000741246_100011935254 [0,2,0,0,0,0|1,0,0]=3 21354 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Br)O 527a_100000741246_100011935254 [0,2,0,0,0,0|1,0,0]=3 21355 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1C)C 11a_100000741246_100000758298 [0,2,0,0,0,0|2,0,0]=4 21356 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1C)C 1626a_100000741246_100000758298 [0,2,0,0,0,0|2,0,0]=4 21357 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1C)C 240690a_100000741246_100000758298 [0,2,0,0,0,0|2,0,0]=4 21358 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)C 11a_100000741246_100000692601 [0,2,0,0,0,0|2,0,0]=4 21359 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)C 1626a_100000741246_100000692601 [0,2,0,0,0,0|2,0,0]=4 21360 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)C 240690a_100000741246_100000692601 [0,2,0,0,0,0|2,0,0]=4 21361 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)Cl 11a_100000741246_100000210656 [0,2,0,0,0,0|2,0,0]=4 21362 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)Cl 1626a_100000741246_100000210656 [0,2,0,0,0,0|2,0,0]=4 21363 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)Cl 240690a_100000741246_100000210656 [0,2,0,0,0,0|2,0,0]=4 21364 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)F 11a_100000741246_100000210369 [0,2,0,0,0,0|2,0,0]=4 21365 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)F 1626a_100000741246_100000210369 [0,2,0,0,0,0|2,0,0]=4 21366 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)F 240690a_100000741246_100000210369 [0,2,0,0,0,0|2,0,0]=4 21367 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)F 527a_100000741246_100000210369 [0,2,0,0,0,0|2,0,0]=4 21368 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)O 240690a_100000741246_100000745519 [0,2,0,0,0,0|1,0,0]=3 21369 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1Cl)O 527a_100000741246_100000745519 [0,2,0,0,0,0|1,0,0]=3 21370 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)C 11a_100000741246_100000762013 [0,2,0,0,0,0|2,0,0]=4 21371 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)C 1626a_100000741246_100000762013 [0,2,0,0,0,0|2,0,0]=4 21372 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)C 240690a_100000741246_100000762013 [0,2,0,0,0,0|2,0,0]=4 21373 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)C 527a_100000741246_100000762013 [0,2,0,0,0,0|2,0,0]=4 21374 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)F 11a_100000741246_100000210804 [0,2,0,0,0,0|2,0,0]=4 21375 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)F 1626a_100000741246_100000210804 [0,2,0,0,0,0|2,0,0]=4 21376 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)F 240690a_100000741246_100000210804 [0,2,0,0,0,0|2,0,0]=4 21377 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)F 527a_100000741246_100000210804 [0,2,0,0,0,0|2,0,0]=4 21378 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1F)O 527a_100000741246_100000763259 [0,2,0,0,0,0|1,0,0]=3 21379 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Br 11a_100000741246_100010232521 [0,2,0,0,0,0|2,0,0]=4 21380 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Br 1626a_100000741246_100010232521 [0,2,0,0,0,0|2,0,0]=4 21381 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Br 240690a_100000741246_100010232521 [0,2,0,0,0,0|2,0,0]=4 21382 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Br 527a_100000741246_100010232521 [0,2,0,0,0,0|2,0,0]=4 21383 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)C 11a_100000741246_100000688020 [0,2,0,0,0,0|2,0,0]=4 21384 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)C 1626a_100000741246_100000688020 [0,2,0,0,0,0|2,0,0]=4 21385 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)C 240690a_100000741246_100000688020 [0,2,0,0,0,0|2,0,0]=4 21386 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Cl 11a_100000741246_100000702859 [0,2,0,0,0,0|2,0,0]=4 21387 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Cl 1626a_100000741246_100000702859 [0,2,0,0,0,0|2,0,0]=4 21388 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Cl 240690a_100000741246_100000702859 [0,2,0,0,0,0|2,0,0]=4 21389 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)Cl 527a_100000741246_100000702859 [0,2,0,0,0,0|2,0,0]=4 21390 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)F 11a_100000741246_100000023732 [0,2,0,0,0,0|2,0,0]=4 21391 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)F 1626a_100000741246_100000023732 [0,2,0,0,0,0|2,0,0]=4 21392 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1I)F 240690a_100000741246_100000023732 [0,2,0,0,0,0|2,0,0]=4 21393 B16R1.104268 CCCC(C)NC(=O)c1c(cccc1O)O 527a_100000741246_100000755285 [0,2,0,0,0,0|1,0,0]=3 21394 B16R1.104268 COC[C@@H](C)NC(=O)c1c(cccc1Br)O 240690a_100000764878_100011935254 [0,2,0,0,0,0|2,0,0]=4 21395 B16R1.104268 COC[C@@H](C)NC(=O)c1c(cccc1Br)O 527a_100000764878_100011935254 [0,2,0,0,0,0|2,0,0]=4 21396 B16R1.104268 COC[C@@H](C)NC(=O)c1c(cccc1Cl)O 240690a_100000764878_100000745519 [0,2,0,0,0,0|2,0,0]=4 21397 B16R1.104268 COC[C@@H](C)NC(=O)c1c(cccc1Cl)O 527a_100000764878_100000745519 [0,2,0,0,0,0|2,0,0]=4 21398 B16R1.104268 COC[C@@H](C)NC(=O)c1c(cccc1F)O 527a_100000764878_100000763259 [0,2,0,0,0,0|2,0,0]=4 21399 B16R1.104268 COC[C@@H](C)NC(=O)c1c(cccc1O)O 527a_100000764878_100000755285 [0,2,0,0,0,0|2,0,0]=4 21400 B16R1.104268 C[C@H](CCO)NC(=O)c1c(cccc1Br)O 240690a_100000706166_100011935254 [0,2,0,0,0,0|2,0,0]=4 21401 B16R1.104268 C[C@H](CCO)NC(=O)c1c(cccc1Br)O 527a_100000706166_100011935254 [0,2,0,0,0,0|2,0,0]=4 21402 B16R1.104268 C[C@H](CCO)NC(=O)c1c(cccc1Cl)O 240690a_100000706166_100000745519 [0,2,0,0,0,0|2,0,0]=4 21403 B16R1.104268 C[C@H](CCO)NC(=O)c1c(cccc1Cl)O 527a_100000706166_100000745519 [0,2,0,0,0,0|2,0,0]=4 21404 B16R1.104268 C[C@H](CCO)NC(=O)c1c(cccc1F)O 527a_100000706166_100000763259 [0,2,0,0,0,0|2,0,0]=4 21405 B16R1.104268 C[C@H](CCO)NC(=O)c1c(cccc1O)O 527a_100000706166_100000755285 [0,2,0,0,0,0|2,0,0]=4 21406 B16R1.5624 C#CCC(C)OCC(=O)c1ccccc1O 7a_100000685586_100000188908 [0,2,0,0,0,0|0,0,2]=4 21407 B16R1.5624 C=CC[C@@H](C)OCC(=O)c1ccccc1O 7a_100000731007_100000188908 [0,2,0,0,0,0|0,0,2]=4 21408 B16R1.5624 CC(CCBr)OCC(=O)c1ccccc1Br 34a_100012276601_100000199116 [0,2,0,0,0,0|2,0,0]=4 21409 B16R1.5624 CC(CCBr)OCC(=O)c1ccccc1Cl 34a_100012276601_100000211432 [0,2,0,0,0,0|2,0,0]=4 21410 B16R1.5624 CC(CCBr)OCC(=O)c1ccccc1F 34a_100012276601_100000204681 [0,2,0,0,0,0|2,0,0]=4 21411 B16R1.5624 CC(CCO)SCC(=O)c1ccccc1O 62a_100000188908_100009893172 [0,2,0,0,0,0|1,1,0]=4 21412 B16R1.5624 CC(CCO)SCC(=O)c1ccccc1O 62a_100009893172_100000188908 [0,2,0,0,0,0|1,1,0]=4 21413 B16R1.5624 CCCC(=O)CCC(=O)c1ccccc1F 1458a_100000211992_100000086012 [0,2,0,0,0,0|2,0,0]=4 21414 B16R1.5624 CCCC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_100000210303 [0,2,0,0,0,0|2,0,0]=4 21415 B16R1.5624 CCCC(=O)CNC(=O)c1ccccc1Cl 1458a_100000182550_100000210303 [0,2,0,0,0,0|2,0,0]=4 21416 B16R1.5624 CCCC(=O)CNC(=O)c1ccccc1F 1458a_100000182453_100000210303 [0,2,0,0,0,0|2,0,0]=4 21417 B16R1.5624 CCCC(=O)CNC(=O)c1ccccc1I 1458a_100000194700_100000210303 [0,2,0,0,0,0|2,0,0]=4 21418 B16R1.5624 CCCC(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000210303 [0,2,0,0,0,0|1,0,0]=3 21419 B16R1.5624 CCCC(=O)NNC(=O)c1ccccc1O 22a_100000189770_100015234032 [0,2,0,0,0,0|1,0,1]=4 21420 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1Br 1458a_100000188424_100000034017 [0,2,0,0,0,0|1,0,1]=4 21421 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1C 1458a_100000212026_100000034017 [0,2,0,0,0,0|1,0,1]=4 21422 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1Cl 1458a_100000185844_100000034017 [0,2,0,0,0,0|1,0,1]=4 21423 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1F 1458a_100000188656_100000034017 [0,2,0,0,0,0|1,0,1]=4 21424 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1I 1458a_100000187884_100000034017 [0,2,0,0,0,0|1,0,1]=4 21425 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1O 1458a_100015234032_100000034017 [0,2,0,0,0,0|0,0,1]=3 21426 B16R1.5624 CCCC(=O)OCC(=O)c1ccccc1[O-] 1458a_100009911694_100000034017 [0,2,0,0,0,0|0,0,2]=4 21427 B16R1.5624 CCCC(C)NCC(=O)c1ccccc1C 2230a_100000741246_100000741374 [0,2,0,0,0,0|2,0,0]=4 21428 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1Br 34a_100000764384_100000199116 [0,2,0,0,0,0|1,0,0]=3 21429 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1C 34a_100000764384_100000741374 [0,2,0,0,0,0|1,0,0]=3 21430 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1C 7a_100000764384_100000741374 [0,2,0,0,0,0|1,0,0]=3 21431 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1Cl 34a_100000764384_100000211432 [0,2,0,0,0,0|1,0,0]=3 21432 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1F 34a_100000764384_100000204681 [0,2,0,0,0,0|1,0,0]=3 21433 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1F 7a_100000764384_100000204681 [0,2,0,0,0,0|1,0,0]=3 21434 B16R1.5624 CCCC(C)OCC(=O)c1ccccc1O 7a_100000764384_100000188908 [0,2,0,0,0,0|0,0,0]=2 21435 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000766640 [0,2,0,0,0,0|1,1,0]=4 21436 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1C 62a_100000741374_100000766640 [0,2,0,0,0,0|1,1,0]=4 21437 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1C 62a_100000766640_100000741374 [0,2,0,0,0,0|1,1,0]=4 21438 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000766640 [0,2,0,0,0,0|1,1,0]=4 21439 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1Cl 62a_100000766640_100000211432 [0,2,0,0,0,0|1,1,0]=4 21440 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000766640 [0,2,0,0,0,0|1,1,0]=4 21441 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1F 62a_100000766640_100000204681 [0,2,0,0,0,0|1,1,0]=4 21442 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000766640 [0,2,0,0,0,0|0,1,0]=3 21443 B16R1.5624 CCCC(C)SCC(=O)c1ccccc1O 62a_100000766640_100000188908 [0,2,0,0,0,0|0,1,0]=3 21444 B16R1.5624 CCCN(C)CCC(=O)c1ccccc1F 2230a_100000747261_100000086012 [0,2,0,0,0,0|2,0,0]=4 21445 B16R1.5624 CCCN(C)CCC(=O)c1ccccc1F 269982a_100000747261_100000086012 [0,2,0,0,0,0|2,0,0]=4 21446 B16R1.5624 CCCN(C)CCC(=O)c1ccccc1O 269982a_100000747261_100009873196 [0,2,0,0,0,0|1,0,0]=3 21447 B16R1.5624 CCNC(=O)CNC(=O)c1ccccc1O 240690a_100015525214_100011193979 [0,2,0,0,0,0|1,0,1]=4 21448 B16R1.5624 CCNC(=O)CNC(=O)c1ccccc1O 240690a_100016988866_100015234032 [0,2,0,0,0,0|1,0,1]=4 21449 B16R1.5624 CCNC(=O)CNC(=O)c1ccccc1O 527a_100015525214_100011193979 [0,2,0,0,0,0|1,0,1]=4 21450 B16R1.5624 CCNC(C)COC(=O)c1ccccc1Br 270004a_100015525214_201991511838 [0,2,0,0,0,0|1,0,0]=3 21451 B16R1.5624 CCOC(=O)CNC(=O)c1ccccc1O 188690a_100000741813_100015234032 [0,2,0,0,0,0|1,0,1]=4 21452 B16R1.5624 CN(CCO)CCC(=O)c1ccccc1O 269982a_100000210263_100009873196 [0,2,0,0,0,0|2,0,0]=4 21453 B16R1.5624 COCC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000765312 [0,2,0,0,0,0|1,1,0]=4 21454 B16R1.5624 COCC(C)SCC(=O)c1ccccc1O 62a_100000765312_100000188908 [0,2,0,0,0,0|1,1,0]=4 21455 B16R1.5624 COCC(O)CNC(=O)c1ccccc1Br 240690a_100000756049_100000188424 [0,2,0,0,0,0|2,0,0]=4 21456 B16R1.5624 COCC(O)CNC(=O)c1ccccc1Br 527a_100000756049_100000188424 [0,2,0,0,0,0|2,0,0]=4 21457 B16R1.5624 COCC(O)CNC(=O)c1ccccc1C 240690a_100000756049_100000212026 [0,2,0,0,0,0|2,0,0]=4 21458 B16R1.5624 COCC(O)CNC(=O)c1ccccc1C 527a_100000756049_100000212026 [0,2,0,0,0,0|2,0,0]=4 21459 B16R1.5624 COCC(O)CNC(=O)c1ccccc1Cl 240690a_100000756049_100000185844 [0,2,0,0,0,0|2,0,0]=4 21460 B16R1.5624 COCC(O)CNC(=O)c1ccccc1Cl 527a_100000756049_100000185844 [0,2,0,0,0,0|2,0,0]=4 21461 B16R1.5624 COCC(O)CNC(=O)c1ccccc1F 240690a_100000756049_100000188656 [0,2,0,0,0,0|2,0,0]=4 21462 B16R1.5624 COCC(O)CNC(=O)c1ccccc1F 527a_100000756049_100000188656 [0,2,0,0,0,0|2,0,0]=4 21463 B16R1.5624 COCC(O)CNC(=O)c1ccccc1I 240690a_100000756049_100000187884 [0,2,0,0,0,0|2,0,0]=4 21464 B16R1.5624 COCC(O)CNC(=O)c1ccccc1I 527a_100000756049_100000187884 [0,2,0,0,0,0|2,0,0]=4 21465 B16R1.5624 COCC(O)CNC(=O)c1ccccc1O 240690a_100000756049_100015234032 [0,2,0,0,0,0|1,0,0]=3 21466 B16R1.5624 COCC(O)CNC(=O)c1ccccc1[O-] 240690a_100000756049_100009911694 [0,2,0,0,0,0|1,0,1]=4 21467 B16R1.5624 COCC(O)CNC(=O)c1ccccc1[O-] 527a_100000756049_100009911694 [0,2,0,0,0,0|1,0,1]=4 21468 B16R1.5624 COC[C@@H](C)OCC(=O)c1ccccc1Br 34a_100011934205_100000199116 [0,2,0,0,0,0|2,0,0]=4 21469 B16R1.5624 COC[C@@H](C)OCC(=O)c1ccccc1C 34a_100011934205_100000741374 [0,2,0,0,0,0|2,0,0]=4 21470 B16R1.5624 COC[C@@H](C)OCC(=O)c1ccccc1Cl 34a_100011934205_100000211432 [0,2,0,0,0,0|2,0,0]=4 21471 B16R1.5624 COC[C@@H](C)OCC(=O)c1ccccc1F 34a_100011934205_100000204681 [0,2,0,0,0,0|2,0,0]=4 21472 B16R1.5624 Cc1ccccc1C(=O)COC(C)CCBr 34a_100012276601_100000741374 [0,2,0,0,0,0|2,0,0]=4 21473 B16R1.5624 O=C(CCF)CNC(=O)c1ccccc1O 1458a_100011193979_100011217306 [0,2,0,0,0,0|1,0,1]=4 21474 B16R1.5624 O=C(CCO)CNC(=O)c1ccccc1O 1458a_100011193979_100000211926 [0,2,0,0,0,0|1,0,1]=4 21475 B16R1.7596 C#CCCCCCC(=O)c1ccccc1Br 1458a_100000188424_100012094781 [0,2,0,0,0,0|2,0,0]=4 21476 B16R1.7596 C#CCCCCCC(=O)c1ccccc1C 1458a_100000212026_100012094781 [0,2,0,0,0,0|2,0,0]=4 21477 B16R1.7596 C#CCCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100012094781 [0,2,0,0,0,0|2,0,0]=4 21478 B16R1.7596 C#CCCCCCC(=O)c1ccccc1F 1458a_100000188656_100012094781 [0,2,0,0,0,0|2,0,0]=4 21479 B16R1.7596 C#CCCCCCC(=O)c1ccccc1I 1458a_100000187884_100012094781 [0,2,0,0,0,0|2,0,0]=4 21480 B16R1.7596 C#CCCCCCC(=O)c1ccccc1O 1458a_100015234032_100012094781 [0,2,0,0,0,0|1,0,0]=3 21481 B16R1.7596 C#CCCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100012094781 [0,2,0,0,0,0|1,0,1]=4 21482 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Br 11a_100000706060_100000188424 [0,2,0,0,0,0|2,0,0]=4 21483 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Br 1626a_100000706060_100000188424 [0,2,0,0,0,0|2,0,0]=4 21484 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Br 240690a_100000706060_100000188424 [0,2,0,0,0,0|2,0,0]=4 21485 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Br 527a_100000706060_100000188424 [0,2,0,0,0,0|2,0,0]=4 21486 B16R1.7596 C#CCCCCNC(=O)c1ccccc1C 11a_100000706060_100000212026 [0,2,0,0,0,0|2,0,0]=4 21487 B16R1.7596 C#CCCCCNC(=O)c1ccccc1C 1626a_100000706060_100000212026 [0,2,0,0,0,0|2,0,0]=4 21488 B16R1.7596 C#CCCCCNC(=O)c1ccccc1C 240690a_100000706060_100000212026 [0,2,0,0,0,0|2,0,0]=4 21489 B16R1.7596 C#CCCCCNC(=O)c1ccccc1C 527a_100000706060_100000212026 [0,2,0,0,0,0|2,0,0]=4 21490 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Cl 11a_100000706060_100000185844 [0,2,0,0,0,0|2,0,0]=4 21491 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Cl 1626a_100000706060_100000185844 [0,2,0,0,0,0|2,0,0]=4 21492 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Cl 240690a_100000706060_100000185844 [0,2,0,0,0,0|2,0,0]=4 21493 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Cl 527a_100000706060_100000185844 [0,2,0,0,0,0|2,0,0]=4 21494 B16R1.7596 C#CCCCCNC(=O)c1ccccc1F 11a_100000706060_100000188656 [0,2,0,0,0,0|2,0,0]=4 21495 B16R1.7596 C#CCCCCNC(=O)c1ccccc1F 1626a_100000706060_100000188656 [0,2,0,0,0,0|2,0,0]=4 21496 B16R1.7596 C#CCCCCNC(=O)c1ccccc1F 240690a_100000706060_100000188656 [0,2,0,0,0,0|2,0,0]=4 21497 B16R1.7596 C#CCCCCNC(=O)c1ccccc1F 527a_100000706060_100000188656 [0,2,0,0,0,0|2,0,0]=4 21498 B16R1.7596 C#CCCCCNC(=O)c1ccccc1I 11a_100000706060_100000187884 [0,2,0,0,0,0|2,0,0]=4 21499 B16R1.7596 C#CCCCCNC(=O)c1ccccc1I 1626a_100000706060_100000187884 [0,2,0,0,0,0|2,0,0]=4 21500 B16R1.7596 C#CCCCCNC(=O)c1ccccc1I 240690a_100000706060_100000187884 [0,2,0,0,0,0|2,0,0]=4 21501 B16R1.7596 C#CCCCCNC(=O)c1ccccc1I 527a_100000706060_100000187884 [0,2,0,0,0,0|2,0,0]=4 21502 B16R1.7596 C#CCCCCNC(=O)c1ccccc1O 240690a_100000706060_100015234032 [0,2,0,0,0,0|1,0,0]=3 21503 B16R1.7596 C#CCCCCNC(=O)c1ccccc1[O-] 1626a_100000706060_100009911694 [0,2,0,0,0,0|1,0,1]=4 21504 B16R1.7596 C#CCCCCNC(=O)c1ccccc1[O-] 240690a_100000706060_100009911694 [0,2,0,0,0,0|1,0,1]=4 21505 B16R1.7596 C#CCCCCNC(=O)c1ccccc1[O-] 527a_100000706060_100009911694 [0,2,0,0,0,0|1,0,1]=4 21506 B16R1.7596 C#CCCCOCC(=O)c1ccccc1Br 34a_100000215630_100000199116 [0,2,0,0,0,0|1,0,1]=4 21507 B16R1.7596 C#CCCCOCC(=O)c1ccccc1C 34a_100000215630_100000741374 [0,2,0,0,0,0|1,0,1]=4 21508 B16R1.7596 C#CCCCOCC(=O)c1ccccc1C 7a_100000215630_100000741374 [0,2,0,0,0,0|1,0,1]=4 21509 B16R1.7596 C#CCCCOCC(=O)c1ccccc1Cl 34a_100000215630_100000211432 [0,2,0,0,0,0|1,0,1]=4 21510 B16R1.7596 C#CCCCOCC(=O)c1ccccc1F 34a_100000215630_100000204681 [0,2,0,0,0,0|1,0,1]=4 21511 B16R1.7596 C#CCCCOCC(=O)c1ccccc1F 7a_100000215630_100000204681 [0,2,0,0,0,0|1,0,1]=4 21512 B16R1.7596 C#CCCCOCC(=O)c1ccccc1O 7a_100000215630_100000188908 [0,2,0,0,0,0|0,0,1]=3 21513 B16R1.7596 C#CCCCSCC(=O)c1ccccc1O 62a_100000188908_100011215417 [0,2,0,0,0,0|0,1,1]=4 21514 B16R1.7596 C#CCCCSCC(=O)c1ccccc1O 62a_100011215417_100000188908 [0,2,0,0,0,0|0,1,1]=4 21515 B16R1.7596 C#CCCSCCC(=O)c1ccccc1O 62a_100000688953_100009873196 [0,2,0,0,0,0|1,0,1]=4 21516 B16R1.7596 C#CCOCCNC(=O)c1ccccc1O 240690a_100000700922_100015234032 [0,2,0,0,0,0|1,0,1]=4 21517 B16R1.7596 C/C=C/CCOCC(=O)c1ccccc1Br 34a_100016278192_100000199116 [0,2,0,0,0,0|1,0,1]=4 21518 B16R1.7596 C/C=C/CCOCC(=O)c1ccccc1C 34a_100016278192_100000741374 [0,2,0,0,0,0|1,0,1]=4 21519 B16R1.7596 C/C=C/CCOCC(=O)c1ccccc1Cl 34a_100016278192_100000211432 [0,2,0,0,0,0|1,0,1]=4 21520 B16R1.7596 C/C=C/CCOCC(=O)c1ccccc1F 34a_100016278192_100000204681 [0,2,0,0,0,0|1,0,1]=4 21521 B16R1.7596 C/C=C/CSCCC(=O)c1ccccc1O 62a_100102629194_100009873196 [0,2,0,0,0,0|1,0,1]=4 21522 B16R1.7596 C=CCCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000700193 [0,2,0,0,0,0|2,0,0]=4 21523 B16R1.7596 C=CCCCCCC(=O)c1ccccc1C 1458a_100000212026_100000700193 [0,2,0,0,0,0|2,0,0]=4 21524 B16R1.7596 C=CCCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000700193 [0,2,0,0,0,0|2,0,0]=4 21525 B16R1.7596 C=CCCCCCC(=O)c1ccccc1F 1458a_100000188656_100000700193 [0,2,0,0,0,0|2,0,0]=4 21526 B16R1.7596 C=CCCCCCC(=O)c1ccccc1I 1458a_100000187884_100000700193 [0,2,0,0,0,0|2,0,0]=4 21527 B16R1.7596 C=CCCCCCC(=O)c1ccccc1O 1458a_100015234032_100000700193 [0,2,0,0,0,0|1,0,0]=3 21528 B16R1.7596 C=CCCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000700193 [0,2,0,0,0,0|1,0,1]=4 21529 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Br 11a_100000703577_100000188424 [0,2,0,0,0,0|2,0,0]=4 21530 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Br 1626a_100000703577_100000188424 [0,2,0,0,0,0|2,0,0]=4 21531 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Br 240690a_100000703577_100000188424 [0,2,0,0,0,0|2,0,0]=4 21532 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Br 527a_100000703577_100000188424 [0,2,0,0,0,0|2,0,0]=4 21533 B16R1.7596 C=CCCCCNC(=O)c1ccccc1C 11a_100000703577_100000212026 [0,2,0,0,0,0|2,0,0]=4 21534 B16R1.7596 C=CCCCCNC(=O)c1ccccc1C 1626a_100000703577_100000212026 [0,2,0,0,0,0|2,0,0]=4 21535 B16R1.7596 C=CCCCCNC(=O)c1ccccc1C 240690a_100000703577_100000212026 [0,2,0,0,0,0|2,0,0]=4 21536 B16R1.7596 C=CCCCCNC(=O)c1ccccc1C 527a_100000703577_100000212026 [0,2,0,0,0,0|2,0,0]=4 21537 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Cl 11a_100000703577_100000185844 [0,2,0,0,0,0|2,0,0]=4 21538 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Cl 1626a_100000703577_100000185844 [0,2,0,0,0,0|2,0,0]=4 21539 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Cl 240690a_100000703577_100000185844 [0,2,0,0,0,0|2,0,0]=4 21540 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Cl 527a_100000703577_100000185844 [0,2,0,0,0,0|2,0,0]=4 21541 B16R1.7596 C=CCCCCNC(=O)c1ccccc1F 11a_100000703577_100000188656 [0,2,0,0,0,0|2,0,0]=4 21542 B16R1.7596 C=CCCCCNC(=O)c1ccccc1F 1626a_100000703577_100000188656 [0,2,0,0,0,0|2,0,0]=4 21543 B16R1.7596 C=CCCCCNC(=O)c1ccccc1F 240690a_100000703577_100000188656 [0,2,0,0,0,0|2,0,0]=4 21544 B16R1.7596 C=CCCCCNC(=O)c1ccccc1F 527a_100000703577_100000188656 [0,2,0,0,0,0|2,0,0]=4 21545 B16R1.7596 C=CCCCCNC(=O)c1ccccc1I 11a_100000703577_100000187884 [0,2,0,0,0,0|2,0,0]=4 21546 B16R1.7596 C=CCCCCNC(=O)c1ccccc1I 1626a_100000703577_100000187884 [0,2,0,0,0,0|2,0,0]=4 21547 B16R1.7596 C=CCCCCNC(=O)c1ccccc1I 240690a_100000703577_100000187884 [0,2,0,0,0,0|2,0,0]=4 21548 B16R1.7596 C=CCCCCNC(=O)c1ccccc1I 527a_100000703577_100000187884 [0,2,0,0,0,0|2,0,0]=4 21549 B16R1.7596 C=CCCCCNC(=O)c1ccccc1O 240690a_100000703577_100015234032 [0,2,0,0,0,0|1,0,0]=3 21550 B16R1.7596 C=CCCCCNC(=O)c1ccccc1[O-] 1626a_100000703577_100009911694 [0,2,0,0,0,0|1,0,1]=4 21551 B16R1.7596 C=CCCCCNC(=O)c1ccccc1[O-] 240690a_100000703577_100009911694 [0,2,0,0,0,0|1,0,1]=4 21552 B16R1.7596 C=CCCCCNC(=O)c1ccccc1[O-] 527a_100000703577_100009911694 [0,2,0,0,0,0|1,0,1]=4 21553 B16R1.7596 C=CCCCOCC(=O)c1ccccc1Br 34a_100000758997_100000199116 [0,2,0,0,0,0|1,0,1]=4 21554 B16R1.7596 C=CCCCOCC(=O)c1ccccc1C 34a_100000758997_100000741374 [0,2,0,0,0,0|1,0,1]=4 21555 B16R1.7596 C=CCCCOCC(=O)c1ccccc1C 7a_100000758997_100000741374 [0,2,0,0,0,0|1,0,1]=4 21556 B16R1.7596 C=CCCCOCC(=O)c1ccccc1Cl 34a_100000758997_100000211432 [0,2,0,0,0,0|1,0,1]=4 21557 B16R1.7596 C=CCCCOCC(=O)c1ccccc1F 34a_100000758997_100000204681 [0,2,0,0,0,0|1,0,1]=4 21558 B16R1.7596 C=CCCCOCC(=O)c1ccccc1F 7a_100000758997_100000204681 [0,2,0,0,0,0|1,0,1]=4 21559 B16R1.7596 C=CCCCOCC(=O)c1ccccc1O 7a_100000758997_100000188908 [0,2,0,0,0,0|0,0,1]=3 21560 B16R1.7596 C=CCCCSCC(=O)c1ccccc1O 62a_100000188908_100000757094 [0,2,0,0,0,0|0,1,1]=4 21561 B16R1.7596 C=CCCCSCC(=O)c1ccccc1O 62a_100011713584_100000188908 [0,2,0,0,0,0|0,1,1]=4 21562 B16R1.7596 C=CCCSCCC(=O)c1ccccc1O 62a_100000754431_100009873196 [0,2,0,0,0,0|1,0,1]=4 21563 B16R1.7596 C=COCCCNC(=O)c1ccccc1O 240690a_100000210767_100015234032 [0,2,0,0,0,0|1,0,1]=4 21564 B16R1.7596 CC#CCCOCC(=O)c1ccccc1Br 34a_100000750427_100000199116 [0,2,0,0,0,0|1,0,1]=4 21565 B16R1.7596 CC#CCCOCC(=O)c1ccccc1C 34a_100000750427_100000741374 [0,2,0,0,0,0|1,0,1]=4 21566 B16R1.7596 CC#CCCOCC(=O)c1ccccc1Cl 34a_100000750427_100000211432 [0,2,0,0,0,0|1,0,1]=4 21567 B16R1.7596 CC#CCCOCC(=O)c1ccccc1F 34a_100000750427_100000204681 [0,2,0,0,0,0|1,0,1]=4 21568 B16R1.7596 CC#CCSCCC(=O)c1ccccc1O 62a_100000748600_100009873196 [0,2,0,0,0,0|1,0,1]=4 21569 B16R1.7596 CC/C=C\COCC(=O)c1ccccc1Br 34a_100016268518_100000199116 [0,2,0,0,0,0|1,0,1]=4 21570 B16R1.7596 CC/C=C\COCC(=O)c1ccccc1C 34a_100016268518_100000741374 [0,2,0,0,0,0|1,0,1]=4 21571 B16R1.7596 CC/C=C\COCC(=O)c1ccccc1Cl 34a_100016268518_100000211432 [0,2,0,0,0,0|1,0,1]=4 21572 B16R1.7596 CC/C=C\COCC(=O)c1ccccc1F 34a_100016268518_100000204681 [0,2,0,0,0,0|1,0,1]=4 21573 B16R1.7596 CC/C=C\CSCC(=O)c1ccccc1O 62a_100000188908_100103147603 [0,2,0,0,0,0|0,1,1]=4 21574 B16R1.7596 CC/C=C\CSCC(=O)c1ccccc1O 62a_100103147603_100000188908 [0,2,0,0,0,0|0,1,1]=4 21575 B16R1.7596 CC=CCSCCC(=O)c1ccccc1O 62a_100000070051_100009873196 [0,2,0,0,0,0|1,0,1]=4 21576 B16R1.7596 CCC#CCOCC(=O)c1ccccc1Br 34a_100000032950_100000199116 [0,2,0,0,0,0|1,0,1]=4 21577 B16R1.7596 CCC#CCOCC(=O)c1ccccc1C 34a_100000032950_100000741374 [0,2,0,0,0,0|1,0,1]=4 21578 B16R1.7596 CCC#CCOCC(=O)c1ccccc1Cl 34a_100000032950_100000211432 [0,2,0,0,0,0|1,0,1]=4 21579 B16R1.7596 CCC#CCOCC(=O)c1ccccc1F 34a_100000032950_100000204681 [0,2,0,0,0,0|1,0,1]=4 21580 B16R1.7596 CCC#CCSCC(=O)c1ccccc1O 62a_100000188908_100009813939 [0,2,0,0,0,0|0,1,1]=4 21581 B16R1.7596 CCC#CCSCC(=O)c1ccccc1O 62a_100009813939_100000188908 [0,2,0,0,0,0|0,1,1]=4 21582 B16R1.7596 CCCCC=NNC(=O)c1ccccc1Br 4a_100000183644_100000210104 [0,2,0,0,0,0|2,0,0]=4 21583 B16R1.7596 CCCCC=NNC(=O)c1ccccc1C 4a_100000181371_100000210104 [0,2,0,0,0,0|2,0,0]=4 21584 B16R1.7596 CCCCC=NNC(=O)c1ccccc1Cl 4a_100000186534_100000210104 [0,2,0,0,0,0|2,0,0]=4 21585 B16R1.7596 CCCCC=NNC(=O)c1ccccc1F 4a_100000183521_100000210104 [0,2,0,0,0,0|2,0,0]=4 21586 B16R1.7596 CCCCC=NNC(=O)c1ccccc1I 4a_100000190081_100000210104 [0,2,0,0,0,0|2,0,0]=4 21587 B16R1.7596 CCCCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210614 [0,2,0,0,0,0|2,0,0]=4 21588 B16R1.7596 CCCCCCCC(=O)c1ccccc1C 1458a_100000212026_100000210614 [0,2,0,0,0,0|2,0,0]=4 21589 B16R1.7596 CCCCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210614 [0,2,0,0,0,0|2,0,0]=4 21590 B16R1.7596 CCCCCCCC(=O)c1ccccc1F 1458a_100000188656_100000210614 [0,2,0,0,0,0|2,0,0]=4 21591 B16R1.7596 CCCCCCCC(=O)c1ccccc1I 1458a_100000187884_100000210614 [0,2,0,0,0,0|2,0,0]=4 21592 B16R1.7596 CCCCCCCC(=O)c1ccccc1O 1458a_100015234032_100000210614 [0,2,0,0,0,0|1,0,0]=3 21593 B16R1.7596 CCCCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210614 [0,2,0,0,0,0|1,0,1]=4 21594 B16R1.7596 CCCCCCNC(=O)c1ccccc1Br 11a_100000210581_100000188424 [0,2,0,0,0,0|2,0,0]=4 21595 B16R1.7596 CCCCCCNC(=O)c1ccccc1Br 1626a_100000210581_100000188424 [0,2,0,0,0,0|2,0,0]=4 21596 B16R1.7596 CCCCCCNC(=O)c1ccccc1Br 240690a_100000210581_100000188424 [0,2,0,0,0,0|2,0,0]=4 21597 B16R1.7596 CCCCCCNC(=O)c1ccccc1Br 527a_100000210581_100000188424 [0,2,0,0,0,0|2,0,0]=4 21598 B16R1.7596 CCCCCCNC(=O)c1ccccc1C 11a_100000210581_100000212026 [0,2,0,0,0,0|2,0,0]=4 21599 B16R1.7596 CCCCCCNC(=O)c1ccccc1C 1626a_100000210581_100000212026 [0,2,0,0,0,0|2,0,0]=4 21600 B16R1.7596 CCCCCCNC(=O)c1ccccc1C 240690a_100000210581_100000212026 [0,2,0,0,0,0|2,0,0]=4 21601 B16R1.7596 CCCCCCNC(=O)c1ccccc1C 527a_100000210581_100000212026 [0,2,0,0,0,0|2,0,0]=4 21602 B16R1.7596 CCCCCCNC(=O)c1ccccc1Cl 11a_100000210581_100000185844 [0,2,0,0,0,0|2,0,0]=4 21603 B16R1.7596 CCCCCCNC(=O)c1ccccc1Cl 1626a_100000210581_100000185844 [0,2,0,0,0,0|2,0,0]=4 21604 B16R1.7596 CCCCCCNC(=O)c1ccccc1Cl 240690a_100000210581_100000185844 [0,2,0,0,0,0|2,0,0]=4 21605 B16R1.7596 CCCCCCNC(=O)c1ccccc1Cl 527a_100000210581_100000185844 [0,2,0,0,0,0|2,0,0]=4 21606 B16R1.7596 CCCCCCNC(=O)c1ccccc1F 11a_100000210581_100000188656 [0,2,0,0,0,0|2,0,0]=4 21607 B16R1.7596 CCCCCCNC(=O)c1ccccc1F 1626a_100000210581_100000188656 [0,2,0,0,0,0|2,0,0]=4 21608 B16R1.7596 CCCCCCNC(=O)c1ccccc1F 240690a_100000210581_100000188656 [0,2,0,0,0,0|2,0,0]=4 21609 B16R1.7596 CCCCCCNC(=O)c1ccccc1F 527a_100000210581_100000188656 [0,2,0,0,0,0|2,0,0]=4 21610 B16R1.7596 CCCCCCNC(=O)c1ccccc1I 11a_100000210581_100000187884 [0,2,0,0,0,0|2,0,0]=4 21611 B16R1.7596 CCCCCCNC(=O)c1ccccc1I 1626a_100000210581_100000187884 [0,2,0,0,0,0|2,0,0]=4 21612 B16R1.7596 CCCCCCNC(=O)c1ccccc1I 240690a_100000210581_100000187884 [0,2,0,0,0,0|2,0,0]=4 21613 B16R1.7596 CCCCCCNC(=O)c1ccccc1I 527a_100000210581_100000187884 [0,2,0,0,0,0|2,0,0]=4 21614 B16R1.7596 CCCCCCNC(=O)c1ccccc1O 240690a_100000210581_100015234032 [0,2,0,0,0,0|1,0,0]=3 21615 B16R1.7596 CCCCCCNC(=O)c1ccccc1[O-] 1626a_100000210581_100009911694 [0,2,0,0,0,0|1,0,1]=4 21616 B16R1.7596 CCCCCCNC(=O)c1ccccc1[O-] 240690a_100000210581_100009911694 [0,2,0,0,0,0|1,0,1]=4 21617 B16R1.7596 CCCCCCNC(=O)c1ccccc1[O-] 527a_100000210581_100009911694 [0,2,0,0,0,0|1,0,1]=4 21618 B16R1.7596 CCCCCNCC(=O)c1ccccc1C 2230a_100000209983_100000741374 [0,2,0,0,0,0|2,0,0]=4 21619 B16R1.7596 CCCCCNN=C(C)c1ccccc1O 4a_100000694160_100000188907 [0,2,0,0,0,0|2,0,0]=4 21620 B16R1.7596 CCCCCNNC(=O)c1ccccc1Br 22a_100000694160_100000188424 [0,2,0,0,0,0|2,0,0]=4 21621 B16R1.7596 CCCCCNNC(=O)c1ccccc1C 22a_100000694160_100000212026 [0,2,0,0,0,0|2,0,0]=4 21622 B16R1.7596 CCCCCNNC(=O)c1ccccc1Cl 22a_100000694160_100000185844 [0,2,0,0,0,0|2,0,0]=4 21623 B16R1.7596 CCCCCNNC(=O)c1ccccc1F 22a_100000694160_100000188656 [0,2,0,0,0,0|2,0,0]=4 21624 B16R1.7596 CCCCCNNC(=O)c1ccccc1I 22a_100000694160_100000187884 [0,2,0,0,0,0|2,0,0]=4 21625 B16R1.7596 CCCCCNNC(=O)c1ccccc1O 22a_100000694160_100015234032 [0,2,0,0,0,0|1,0,0]=3 21626 B16R1.7596 CCCCCNNC(=O)c1ccccc1[O-] 22a_100000694160_100009911694 [0,2,0,0,0,0|1,0,1]=4 21627 B16R1.7596 CCCCCOCC(=O)c1ccccc1Br 34a_100000210253_100000199116 [0,2,0,0,0,0|1,0,0]=3 21628 B16R1.7596 CCCCCOCC(=O)c1ccccc1C 34a_100000210253_100000741374 [0,2,0,0,0,0|1,0,0]=3 21629 B16R1.7596 CCCCCOCC(=O)c1ccccc1C 7a_100000210253_100000741374 [0,2,0,0,0,0|1,0,0]=3 21630 B16R1.7596 CCCCCOCC(=O)c1ccccc1Cl 34a_100000210253_100000211432 [0,2,0,0,0,0|1,0,0]=3 21631 B16R1.7596 CCCCCOCC(=O)c1ccccc1F 34a_100000210253_100000204681 [0,2,0,0,0,0|1,0,0]=3 21632 B16R1.7596 CCCCCOCC(=O)c1ccccc1F 7a_100000210253_100000204681 [0,2,0,0,0,0|1,0,0]=3 21633 B16R1.7596 CCCCCOCC(=O)c1ccccc1O 7a_100000210253_100000188908 [0,2,0,0,0,0|0,0,0]=2 21634 B16R1.7596 CCCCCSCC(=O)c1ccccc1Br 62a_100000199116_100000210326 [0,2,0,0,0,0|1,1,0]=4 21635 B16R1.7596 CCCCCSCC(=O)c1ccccc1C 62a_100000210326_100000741374 [0,2,0,0,0,0|1,1,0]=4 21636 B16R1.7596 CCCCCSCC(=O)c1ccccc1C 62a_100000741374_100000210326 [0,2,0,0,0,0|1,1,0]=4 21637 B16R1.7596 CCCCCSCC(=O)c1ccccc1Cl 62a_100000210326_100000211432 [0,2,0,0,0,0|1,1,0]=4 21638 B16R1.7596 CCCCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210326 [0,2,0,0,0,0|1,1,0]=4 21639 B16R1.7596 CCCCCSCC(=O)c1ccccc1F 62a_100000204681_100000210326 [0,2,0,0,0,0|1,1,0]=4 21640 B16R1.7596 CCCCCSCC(=O)c1ccccc1F 62a_100000210326_100000204681 [0,2,0,0,0,0|1,1,0]=4 21641 B16R1.7596 CCCCCSCC(=O)c1ccccc1O 62a_100000188908_100000210326 [0,2,0,0,0,0|0,1,0]=3 21642 B16R1.7596 CCCCCSCC(=O)c1ccccc1O 62a_100000210326_100000188908 [0,2,0,0,0,0|0,1,0]=3 21643 B16R1.7596 CCCCNCCC(=O)c1ccccc1F 2230a_100000102301_100000086012 [0,2,0,0,0,0|2,0,0]=4 21644 B16R1.7596 CCCCNCCC(=O)c1ccccc1F 7a_106832991798_100000086012 [0,2,0,0,0,0|2,0,0]=4 21645 B16R1.7596 CCCCNCCC(=O)c1ccccc1O 7a_106832991798_100009873196 [0,2,0,0,0,0|1,0,0]=3 21646 B16R1.7596 CCCCOCCC(=O)c1ccccc1Br 1458a_100000188424_100000743108 [0,2,0,0,0,0|1,0,0]=3 21647 B16R1.7596 CCCCOCCC(=O)c1ccccc1C 1458a_100000212026_100000743108 [0,2,0,0,0,0|1,0,0]=3 21648 B16R1.7596 CCCCOCCC(=O)c1ccccc1Cl 1458a_100000185844_100000743108 [0,2,0,0,0,0|1,0,0]=3 21649 B16R1.7596 CCCCOCCC(=O)c1ccccc1F 1458a_100000188656_100000743108 [0,2,0,0,0,0|1,0,0]=3 21650 B16R1.7596 CCCCOCCC(=O)c1ccccc1F 7a_100000210227_100000086012 [0,2,0,0,0,0|1,0,0]=3 21651 B16R1.7596 CCCCOCCC(=O)c1ccccc1I 1458a_100000187884_100000743108 [0,2,0,0,0,0|1,0,0]=3 21652 B16R1.7596 CCCCOCCC(=O)c1ccccc1O 1458a_100015234032_100000743108 [0,2,0,0,0,0|0,0,0]=2 21653 B16R1.7596 CCCCOCCC(=O)c1ccccc1O 7a_100000210227_100009873196 [0,2,0,0,0,0|0,0,0]=2 21654 B16R1.7596 CCCCOCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000743108 [0,2,0,0,0,0|0,0,1]=3 21655 B16R1.7596 CCCCOCCN(C)c1ccccc1O 269982a_100000033821_100000743108 [0,2,0,0,0,0|2,0,0]=4 21656 B16R1.7596 CCCCOCN[C@H](C)c1ccccc1O 2230a_100025703389_100011995733 [0,2,0,0,0,0|1,0,1]=4 21657 B16R1.7596 CCCCSCCC(=O)c1ccccc1F 62a_100000086012_100000210210 [0,2,0,0,0,0|1,1,0]=4 21658 B16R1.7596 CCCCSCCC(=O)c1ccccc1F 62a_100000210211_100000086012 [0,2,0,0,0,0|1,1,0]=4 21659 B16R1.7596 CCCCSCCC(=O)c1ccccc1O 62a_100000210211_100009873196 [0,2,0,0,0,0|0,1,0]=3 21660 B16R1.7596 CCCNCCNC(=O)c1ccccc1Cl 2230a_100000737833_100000210303 [0,2,0,0,0,0|2,0,0]=4 21661 B16R1.7596 CCCNCCNC(=O)c1ccccc1Cl 34a_100000737833_100000210303 [0,2,0,0,0,0|2,0,0]=4 21662 B16R1.7596 CCCOCCNC(=O)c1ccccc1Br 1626a_100161115042_100000188424 [0,2,0,0,0,0|2,0,0]=4 21663 B16R1.7596 CCCOCCNC(=O)c1ccccc1Br 240690a_100161115042_100000188424 [0,2,0,0,0,0|2,0,0]=4 21664 B16R1.7596 CCCOCCNC(=O)c1ccccc1Br 34a_200000158863_100000210303 [0,2,0,0,0,0|2,0,0]=4 21665 B16R1.7596 CCCOCCNC(=O)c1ccccc1Br 527a_100161115042_100000188424 [0,2,0,0,0,0|2,0,0]=4 21666 B16R1.7596 CCCOCCNC(=O)c1ccccc1Br 7a_200000158863_100000210303 [0,2,0,0,0,0|2,0,0]=4 21667 B16R1.7596 CCCOCCNC(=O)c1ccccc1C 1626a_100161115042_100000212026 [0,2,0,0,0,0|2,0,0]=4 21668 B16R1.7596 CCCOCCNC(=O)c1ccccc1C 240690a_100161115042_100000212026 [0,2,0,0,0,0|2,0,0]=4 21669 B16R1.7596 CCCOCCNC(=O)c1ccccc1C 527a_100161115042_100000212026 [0,2,0,0,0,0|2,0,0]=4 21670 B16R1.7596 CCCOCCNC(=O)c1ccccc1Cl 1626a_100161115042_100000185844 [0,2,0,0,0,0|2,0,0]=4 21671 B16R1.7596 CCCOCCNC(=O)c1ccccc1Cl 240690a_100161115042_100000185844 [0,2,0,0,0,0|2,0,0]=4 21672 B16R1.7596 CCCOCCNC(=O)c1ccccc1Cl 527a_100161115042_100000185844 [0,2,0,0,0,0|2,0,0]=4 21673 B16R1.7596 CCCOCCNC(=O)c1ccccc1F 1626a_100161115042_100000188656 [0,2,0,0,0,0|2,0,0]=4 21674 B16R1.7596 CCCOCCNC(=O)c1ccccc1F 240690a_100161115042_100000188656 [0,2,0,0,0,0|2,0,0]=4 21675 B16R1.7596 CCCOCCNC(=O)c1ccccc1F 527a_100161115042_100000188656 [0,2,0,0,0,0|2,0,0]=4 21676 B16R1.7596 CCCOCCNC(=O)c1ccccc1I 1626a_100161115042_100000187884 [0,2,0,0,0,0|2,0,0]=4 21677 B16R1.7596 CCCOCCNC(=O)c1ccccc1I 240690a_100161115042_100000187884 [0,2,0,0,0,0|2,0,0]=4 21678 B16R1.7596 CCCOCCNC(=O)c1ccccc1I 527a_100161115042_100000187884 [0,2,0,0,0,0|2,0,0]=4 21679 B16R1.7596 CCCOCCNC(=O)c1ccccc1O 240690a_100161115042_100015234032 [0,2,0,0,0,0|1,0,0]=3 21680 B16R1.7596 CCCOCCNC(=O)c1ccccc1[O-] 1626a_100161115042_100009911694 [0,2,0,0,0,0|1,0,1]=4 21681 B16R1.7596 CCCOCCNC(=O)c1ccccc1[O-] 240690a_100161115042_100009911694 [0,2,0,0,0,0|1,0,1]=4 21682 B16R1.7596 CCCOCCNC(=O)c1ccccc1[O-] 527a_100161115042_100009911694 [0,2,0,0,0,0|1,0,1]=4 21683 B16R1.7596 CCCSCCNC(=O)c1ccccc1Br 11a_100020603323_100000188424 [0,2,0,0,0,0|2,0,0]=4 21684 B16R1.7596 CCCSCCNC(=O)c1ccccc1Br 240690a_100020603323_100000188424 [0,2,0,0,0,0|2,0,0]=4 21685 B16R1.7596 CCCSCCNC(=O)c1ccccc1Br 527a_100020603323_100000188424 [0,2,0,0,0,0|2,0,0]=4 21686 B16R1.7596 CCCSCCNC(=O)c1ccccc1C 11a_100020603323_100000212026 [0,2,0,0,0,0|2,0,0]=4 21687 B16R1.7596 CCCSCCNC(=O)c1ccccc1C 240690a_100020603323_100000212026 [0,2,0,0,0,0|2,0,0]=4 21688 B16R1.7596 CCCSCCNC(=O)c1ccccc1C 527a_100020603323_100000212026 [0,2,0,0,0,0|2,0,0]=4 21689 B16R1.7596 CCCSCCNC(=O)c1ccccc1Cl 11a_100020603323_100000185844 [0,2,0,0,0,0|2,0,0]=4 21690 B16R1.7596 CCCSCCNC(=O)c1ccccc1Cl 240690a_100020603323_100000185844 [0,2,0,0,0,0|2,0,0]=4 21691 B16R1.7596 CCCSCCNC(=O)c1ccccc1Cl 527a_100020603323_100000185844 [0,2,0,0,0,0|2,0,0]=4 21692 B16R1.7596 CCCSCCNC(=O)c1ccccc1F 11a_100020603323_100000188656 [0,2,0,0,0,0|2,0,0]=4 21693 B16R1.7596 CCCSCCNC(=O)c1ccccc1F 240690a_100020603323_100000188656 [0,2,0,0,0,0|2,0,0]=4 21694 B16R1.7596 CCCSCCNC(=O)c1ccccc1F 527a_100020603323_100000188656 [0,2,0,0,0,0|2,0,0]=4 21695 B16R1.7596 CCCSCCNC(=O)c1ccccc1I 11a_100020603323_100000187884 [0,2,0,0,0,0|2,0,0]=4 21696 B16R1.7596 CCCSCCNC(=O)c1ccccc1I 240690a_100020603323_100000187884 [0,2,0,0,0,0|2,0,0]=4 21697 B16R1.7596 CCCSCCNC(=O)c1ccccc1I 527a_100020603323_100000187884 [0,2,0,0,0,0|2,0,0]=4 21698 B16R1.7596 CCCSCCNC(=O)c1ccccc1O 240690a_100020603323_100015234032 [0,2,0,0,0,0|1,0,0]=3 21699 B16R1.7596 CCCSCCNC(=O)c1ccccc1[O-] 240690a_100020603323_100009911694 [0,2,0,0,0,0|1,0,1]=4 21700 B16R1.7596 CCCSCCNC(=O)c1ccccc1[O-] 527a_100020603323_100009911694 [0,2,0,0,0,0|1,0,1]=4 21701 B16R1.7596 CCOCCCNC(=O)c1ccccc1Br 11a_100000210961_100000188424 [0,2,0,0,0,0|2,0,0]=4 21702 B16R1.7596 CCOCCCNC(=O)c1ccccc1Br 1626a_100000210961_100000188424 [0,2,0,0,0,0|2,0,0]=4 21703 B16R1.7596 CCOCCCNC(=O)c1ccccc1Br 240690a_100000210961_100000188424 [0,2,0,0,0,0|2,0,0]=4 21704 B16R1.7596 CCOCCCNC(=O)c1ccccc1Br 527a_100000210961_100000188424 [0,2,0,0,0,0|2,0,0]=4 21705 B16R1.7596 CCOCCCNC(=O)c1ccccc1C 11a_100000210961_100000212026 [0,2,0,0,0,0|2,0,0]=4 21706 B16R1.7596 CCOCCCNC(=O)c1ccccc1C 1626a_100000210961_100000212026 [0,2,0,0,0,0|2,0,0]=4 21707 B16R1.7596 CCOCCCNC(=O)c1ccccc1C 240690a_100000210961_100000212026 [0,2,0,0,0,0|2,0,0]=4 21708 B16R1.7596 CCOCCCNC(=O)c1ccccc1C 527a_100000210961_100000212026 [0,2,0,0,0,0|2,0,0]=4 21709 B16R1.7596 CCOCCCNC(=O)c1ccccc1Cl 11a_100000210961_100000185844 [0,2,0,0,0,0|2,0,0]=4 21710 B16R1.7596 CCOCCCNC(=O)c1ccccc1Cl 1626a_100000210961_100000185844 [0,2,0,0,0,0|2,0,0]=4 21711 B16R1.7596 CCOCCCNC(=O)c1ccccc1Cl 240690a_100000210961_100000185844 [0,2,0,0,0,0|2,0,0]=4 21712 B16R1.7596 CCOCCCNC(=O)c1ccccc1Cl 527a_100000210961_100000185844 [0,2,0,0,0,0|2,0,0]=4 21713 B16R1.7596 CCOCCCNC(=O)c1ccccc1F 11a_100000210961_100000188656 [0,2,0,0,0,0|2,0,0]=4 21714 B16R1.7596 CCOCCCNC(=O)c1ccccc1F 1626a_100000210961_100000188656 [0,2,0,0,0,0|2,0,0]=4 21715 B16R1.7596 CCOCCCNC(=O)c1ccccc1F 240690a_100000210961_100000188656 [0,2,0,0,0,0|2,0,0]=4 21716 B16R1.7596 CCOCCCNC(=O)c1ccccc1F 527a_100000210961_100000188656 [0,2,0,0,0,0|2,0,0]=4 21717 B16R1.7596 CCOCCCNC(=O)c1ccccc1I 11a_100000210961_100000187884 [0,2,0,0,0,0|2,0,0]=4 21718 B16R1.7596 CCOCCCNC(=O)c1ccccc1I 1626a_100000210961_100000187884 [0,2,0,0,0,0|2,0,0]=4 21719 B16R1.7596 CCOCCCNC(=O)c1ccccc1I 240690a_100000210961_100000187884 [0,2,0,0,0,0|2,0,0]=4 21720 B16R1.7596 CCOCCCNC(=O)c1ccccc1I 527a_100000210961_100000187884 [0,2,0,0,0,0|2,0,0]=4 21721 B16R1.7596 CCOCCCNC(=O)c1ccccc1N 34a_200011191992_100000210202 [0,2,0,0,0,0|2,0,0]=4 21722 B16R1.7596 CCOCCCNC(=O)c1ccccc1O 240690a_100000210961_100015234032 [0,2,0,0,0,0|1,0,0]=3 21723 B16R1.7596 CCOCCCNC(=O)c1ccccc1[O-] 1626a_100000210961_100009911694 [0,2,0,0,0,0|1,0,1]=4 21724 B16R1.7596 CCOCCCNC(=O)c1ccccc1[O-] 240690a_100000210961_100009911694 [0,2,0,0,0,0|1,0,1]=4 21725 B16R1.7596 CCOCCCNC(=O)c1ccccc1[O-] 527a_100000210961_100009911694 [0,2,0,0,0,0|1,0,1]=4 21726 B16R1.7596 CCOCCNCC(=O)c1ccccc1Br 34a_102516460346_100000199116 [0,2,0,0,0,0|2,0,0]=4 21727 B16R1.7596 CCOCCNCC(=O)c1ccccc1C 2230a_102516460346_100000741374 [0,2,0,0,0,0|2,0,0]=4 21728 B16R1.7596 CCOCCNCC(=O)c1ccccc1C 34a_102516460346_100000741374 [0,2,0,0,0,0|2,0,0]=4 21729 B16R1.7596 CCOCCNCC(=O)c1ccccc1Cl 34a_102516460346_100000211432 [0,2,0,0,0,0|2,0,0]=4 21730 B16R1.7596 CCOCCNCC(=O)c1ccccc1F 34a_102516460346_100000204681 [0,2,0,0,0,0|2,0,0]=4 21731 B16R1.7596 CCOCCNN=C(C)c1ccccc1O 4a_100000732670_100000188907 [0,2,0,0,0,0|2,0,0]=4 21732 B16R1.7596 CCOCCNNC(=O)c1ccccc1Br 22a_100000732670_100000188424 [0,2,0,0,0,0|2,0,0]=4 21733 B16R1.7596 CCOCCNNC(=O)c1ccccc1C 22a_100000732670_100000212026 [0,2,0,0,0,0|2,0,0]=4 21734 B16R1.7596 CCOCCNNC(=O)c1ccccc1Cl 22a_100000732670_100000185844 [0,2,0,0,0,0|2,0,0]=4 21735 B16R1.7596 CCOCCNNC(=O)c1ccccc1F 22a_100000732670_100000188656 [0,2,0,0,0,0|2,0,0]=4 21736 B16R1.7596 CCOCCNNC(=O)c1ccccc1I 22a_100000732670_100000187884 [0,2,0,0,0,0|2,0,0]=4 21737 B16R1.7596 CCOCCNNC(=O)c1ccccc1O 22a_100000732670_100015234032 [0,2,0,0,0,0|1,0,0]=3 21738 B16R1.7596 CCOCCNNC(=O)c1ccccc1[O-] 22a_100000732670_100009911694 [0,2,0,0,0,0|1,0,1]=4 21739 B16R1.7596 CCOCCOCC(=O)c1ccccc1Br 34a_100000210136_100000199116 [0,2,0,0,0,0|1,0,0]=3 21740 B16R1.7596 CCOCCOCC(=O)c1ccccc1C 34a_100000210136_100000741374 [0,2,0,0,0,0|1,0,0]=3 21741 B16R1.7596 CCOCCOCC(=O)c1ccccc1C 7a_100000210136_100000741374 [0,2,0,0,0,0|1,0,0]=3 21742 B16R1.7596 CCOCCOCC(=O)c1ccccc1Cl 34a_100000210136_100000211432 [0,2,0,0,0,0|1,0,0]=3 21743 B16R1.7596 CCOCCOCC(=O)c1ccccc1F 34a_100000210136_100000204681 [0,2,0,0,0,0|1,0,0]=3 21744 B16R1.7596 CCOCCOCC(=O)c1ccccc1F 7a_100000210136_100000204681 [0,2,0,0,0,0|1,0,0]=3 21745 B16R1.7596 CCOCCOCC(=O)c1ccccc1O 7a_100000210136_100000188908 [0,2,0,0,0,0|0,0,0]=2 21746 B16R1.7596 CCOCCSCC(=O)c1ccccc1Br 62a_100000199116_100011215890 [0,2,0,0,0,0|1,1,0]=4 21747 B16R1.7596 CCOCCSCC(=O)c1ccccc1C 62a_100000210147_100000741374 [0,2,0,0,0,0|1,1,0]=4 21748 B16R1.7596 CCOCCSCC(=O)c1ccccc1C 62a_100000741374_100011215890 [0,2,0,0,0,0|1,1,0]=4 21749 B16R1.7596 CCOCCSCC(=O)c1ccccc1Cl 62a_100000210147_100000211432 [0,2,0,0,0,0|1,1,0]=4 21750 B16R1.7596 CCOCCSCC(=O)c1ccccc1Cl 62a_100000211432_100011215890 [0,2,0,0,0,0|1,1,0]=4 21751 B16R1.7596 CCOCCSCC(=O)c1ccccc1F 62a_100000204681_100011215890 [0,2,0,0,0,0|1,1,0]=4 21752 B16R1.7596 CCOCCSCC(=O)c1ccccc1F 62a_100000210147_100000204681 [0,2,0,0,0,0|1,1,0]=4 21753 B16R1.7596 CCOCCSCC(=O)c1ccccc1O 62a_100000188908_100011215890 [0,2,0,0,0,0|0,1,0]=3 21754 B16R1.7596 CCOCCSCC(=O)c1ccccc1O 62a_100000210147_100000188908 [0,2,0,0,0,0|0,1,0]=3 21755 B16R1.7596 CCOCSCCC(=O)c1ccccc1F 62a_100000086012_100000739092 [0,2,0,0,0,0|2,0,0]=4 21756 B16R1.7596 CCOCSCCC(=O)c1ccccc1F 62a_100000739092_100000086012 [0,2,0,0,0,0|2,0,0]=4 21757 B16R1.7596 CCOCSCCC(=O)c1ccccc1O 62a_100000739092_100009873196 [0,2,0,0,0,0|1,0,0]=3 21758 B16R1.7596 CCSCCNCC(=O)c1ccccc1C 2230a_100000106463_100000741374 [0,2,0,0,0,0|2,0,0]=4 21759 B16R1.7596 CCSCCOCC(=O)c1ccccc1Br 34a_100000212035_100000199116 [0,2,0,0,0,0|1,0,0]=3 21760 B16R1.7596 CCSCCOCC(=O)c1ccccc1C 34a_100000212035_100000741374 [0,2,0,0,0,0|1,0,0]=3 21761 B16R1.7596 CCSCCOCC(=O)c1ccccc1C 7a_100000212035_100000741374 [0,2,0,0,0,0|1,0,0]=3 21762 B16R1.7596 CCSCCOCC(=O)c1ccccc1Cl 34a_100000212035_100000211432 [0,2,0,0,0,0|1,0,0]=3 21763 B16R1.7596 CCSCCOCC(=O)c1ccccc1F 34a_100000212035_100000204681 [0,2,0,0,0,0|1,0,0]=3 21764 B16R1.7596 CCSCCOCC(=O)c1ccccc1F 7a_100000212035_100000204681 [0,2,0,0,0,0|1,0,0]=3 21765 B16R1.7596 CCSCCOCC(=O)c1ccccc1O 7a_100000212035_100000188908 [0,2,0,0,0,0|0,0,0]=2 21766 B16R1.7596 CCSCCSCC(=O)c1ccccc1Br 62a_100000199116_100000757381 [0,2,0,0,0,0|1,1,0]=4 21767 B16R1.7596 CCSCCSCC(=O)c1ccccc1C 62a_100000741374_100000757381 [0,2,0,0,0,0|1,1,0]=4 21768 B16R1.7596 CCSCCSCC(=O)c1ccccc1C 62a_100000757381_100000741374 [0,2,0,0,0,0|1,1,0]=4 21769 B16R1.7596 CCSCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000757381 [0,2,0,0,0,0|1,1,0]=4 21770 B16R1.7596 CCSCCSCC(=O)c1ccccc1Cl 62a_100000757381_100000211432 [0,2,0,0,0,0|1,1,0]=4 21771 B16R1.7596 CCSCCSCC(=O)c1ccccc1F 62a_100000204681_100000757381 [0,2,0,0,0,0|1,1,0]=4 21772 B16R1.7596 CCSCCSCC(=O)c1ccccc1F 62a_100000757381_100000204681 [0,2,0,0,0,0|1,1,0]=4 21773 B16R1.7596 CCSCCSCC(=O)c1ccccc1O 62a_100000188908_100000757381 [0,2,0,0,0,0|0,1,0]=3 21774 B16R1.7596 CCSCCSCC(=O)c1ccccc1O 62a_100000757381_100000188908 [0,2,0,0,0,0|0,1,0]=3 21775 B16R1.7596 CNCCCOCC(=O)c1ccccc1Br 34a_100000213112_100000199116 [0,2,0,0,0,0|1,0,0]=3 21776 B16R1.7596 CNCCCOCC(=O)c1ccccc1C 34a_100000213112_100000741374 [0,2,0,0,0,0|1,0,0]=3 21777 B16R1.7596 CNCCCOCC(=O)c1ccccc1Cl 34a_100000213112_100000211432 [0,2,0,0,0,0|1,0,0]=3 21778 B16R1.7596 CNCCCOCC(=O)c1ccccc1F 34a_100000213112_100000204681 [0,2,0,0,0,0|1,0,0]=3 21779 B16R1.7596 COCCCNCC(=O)c1ccccc1Br 34a_100150723488_100000199116 [0,2,0,0,0,0|2,0,0]=4 21780 B16R1.7596 COCCCNCC(=O)c1ccccc1C 34a_100150723488_100000741374 [0,2,0,0,0,0|2,0,0]=4 21781 B16R1.7596 COCCCNCC(=O)c1ccccc1Cl 34a_100150723488_100000211432 [0,2,0,0,0,0|2,0,0]=4 21782 B16R1.7596 COCCCNCC(=O)c1ccccc1F 34a_100150723488_100000204681 [0,2,0,0,0,0|2,0,0]=4 21783 B16R1.7596 COCCCNNC(=O)c1ccccc1Br 22a_100025702787_100000188424 [0,2,0,0,0,0|2,0,0]=4 21784 B16R1.7596 COCCCNNC(=O)c1ccccc1C 22a_100025702787_100000212026 [0,2,0,0,0,0|2,0,0]=4 21785 B16R1.7596 COCCCNNC(=O)c1ccccc1Cl 22a_100025702787_100000185844 [0,2,0,0,0,0|2,0,0]=4 21786 B16R1.7596 COCCCNNC(=O)c1ccccc1F 22a_100025702787_100000188656 [0,2,0,0,0,0|2,0,0]=4 21787 B16R1.7596 COCCCNNC(=O)c1ccccc1I 22a_100025702787_100000187884 [0,2,0,0,0,0|2,0,0]=4 21788 B16R1.7596 COCCCNNC(=O)c1ccccc1O 22a_100025702787_100015234032 [0,2,0,0,0,0|1,0,0]=3 21789 B16R1.7596 COCCCNNC(=O)c1ccccc1[O-] 22a_100025702787_100009911694 [0,2,0,0,0,0|1,0,1]=4 21790 B16R1.7596 COCCCOCC(=O)c1ccccc1Br 34a_100000740835_100000199116 [0,2,0,0,0,0|1,0,0]=3 21791 B16R1.7596 COCCCOCC(=O)c1ccccc1C 34a_100000740835_100000741374 [0,2,0,0,0,0|1,0,0]=3 21792 B16R1.7596 COCCCOCC(=O)c1ccccc1Cl 34a_100000740835_100000211432 [0,2,0,0,0,0|1,0,0]=3 21793 B16R1.7596 COCCCOCC(=O)c1ccccc1F 34a_100000740835_100000204681 [0,2,0,0,0,0|1,0,0]=3 21794 B16R1.7596 COCCCSCC(=O)c1ccccc1Br 62a_100000199116_100000709357 [0,2,0,0,0,0|1,1,0]=4 21795 B16R1.7596 COCCCSCC(=O)c1ccccc1C 62a_100000709357_100000741374 [0,2,0,0,0,0|1,1,0]=4 21796 B16R1.7596 COCCCSCC(=O)c1ccccc1C 62a_100000741374_100000709357 [0,2,0,0,0,0|1,1,0]=4 21797 B16R1.7596 COCCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000709357 [0,2,0,0,0,0|1,1,0]=4 21798 B16R1.7596 COCCCSCC(=O)c1ccccc1Cl 62a_100000709357_100000211432 [0,2,0,0,0,0|1,1,0]=4 21799 B16R1.7596 COCCCSCC(=O)c1ccccc1F 62a_100000204681_100000709357 [0,2,0,0,0,0|1,1,0]=4 21800 B16R1.7596 COCCCSCC(=O)c1ccccc1F 62a_100000709357_100000204681 [0,2,0,0,0,0|1,1,0]=4 21801 B16R1.7596 COCCCSCC(=O)c1ccccc1O 62a_100000188908_100000709357 [0,2,0,0,0,0|0,1,0]=3 21802 B16R1.7596 COCCCSCC(=O)c1ccccc1O 62a_100000709357_100000188908 [0,2,0,0,0,0|0,1,0]=3 21803 B16R1.7596 COCCNCCC(=O)c1ccccc1F 2230a_100000209980_100000086012 [0,2,0,0,0,0|2,0,0]=4 21804 B16R1.7596 COCCOCCC(=O)c1ccccc1Br 1458a_100000188424_100000695917 [0,2,0,0,0,0|2,0,0]=4 21805 B16R1.7596 COCCOCCC(=O)c1ccccc1C 1458a_100000212026_100000695917 [0,2,0,0,0,0|2,0,0]=4 21806 B16R1.7596 COCCOCCC(=O)c1ccccc1Cl 1458a_100000185844_100000695917 [0,2,0,0,0,0|2,0,0]=4 21807 B16R1.7596 COCCOCCC(=O)c1ccccc1F 1458a_100000188656_100000695917 [0,2,0,0,0,0|2,0,0]=4 21808 B16R1.7596 COCCOCCC(=O)c1ccccc1I 1458a_100000187884_100000695917 [0,2,0,0,0,0|2,0,0]=4 21809 B16R1.7596 COCCOCCC(=O)c1ccccc1O 1458a_100015234032_100000695917 [0,2,0,0,0,0|1,0,0]=3 21810 B16R1.7596 COCCOCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000695917 [0,2,0,0,0,0|1,0,1]=4 21811 B16R1.7596 COCCSCCC(=O)c1ccccc1F 62a_100000086012_100000233755 [0,2,0,0,0,0|2,0,0]=4 21812 B16R1.7596 COCCSCCC(=O)c1ccccc1F 62a_100000233755_100000086012 [0,2,0,0,0,0|2,0,0]=4 21813 B16R1.7596 COCCSCCC(=O)c1ccccc1O 62a_100000233755_100009873196 [0,2,0,0,0,0|1,0,0]=3 21814 B16R1.7596 COCNCCNC(=O)c1ccccc1Cl 2230a_100000737833_100000766300 [0,2,0,0,0,0|2,0,0]=4 21815 B16R1.7596 CSCCCNCC(=O)c1ccccc1C 2230a_100000749238_100000741374 [0,2,0,0,0,0|2,0,0]=4 21816 B16R1.7596 CSCCCOCC(=O)c1ccccc1Br 34a_100000690336_100000199116 [0,2,0,0,0,0|1,0,0]=3 21817 B16R1.7596 CSCCCOCC(=O)c1ccccc1C 34a_100000690336_100000741374 [0,2,0,0,0,0|1,0,0]=3 21818 B16R1.7596 CSCCCOCC(=O)c1ccccc1C 7a_100000690336_100000741374 [0,2,0,0,0,0|1,0,0]=3 21819 B16R1.7596 CSCCCOCC(=O)c1ccccc1Cl 34a_100000690336_100000211432 [0,2,0,0,0,0|1,0,0]=3 21820 B16R1.7596 CSCCCOCC(=O)c1ccccc1F 34a_100000690336_100000204681 [0,2,0,0,0,0|1,0,0]=3 21821 B16R1.7596 CSCCCOCC(=O)c1ccccc1F 7a_100000690336_100000204681 [0,2,0,0,0,0|1,0,0]=3 21822 B16R1.7596 CSCCCOCC(=O)c1ccccc1O 7a_100000690336_100000188908 [0,2,0,0,0,0|0,0,0]=2 21823 B16R1.7596 CSCCNCCC(=O)c1ccccc1F 2230a_100020590264_100000086012 [0,2,0,0,0,0|2,0,0]=4 21824 B16R1.7596 CSCCOCCC(=O)c1ccccc1F 7a_100000230434_100000086012 [0,2,0,0,0,0|2,0,0]=4 21825 B16R1.7596 CSCCOCCC(=O)c1ccccc1O 7a_100000230434_100009873196 [0,2,0,0,0,0|1,0,0]=3 21826 B16R1.7596 CSCCSCCC(=O)c1ccccc1F 62a_100000086012_100000751147 [0,2,0,0,0,0|2,0,0]=4 21827 B16R1.7596 CSCCSCCC(=O)c1ccccc1F 62a_100000212216_100000086012 [0,2,0,0,0,0|2,0,0]=4 21828 B16R1.7596 CSCCSCCC(=O)c1ccccc1O 62a_100000212216_100009873196 [0,2,0,0,0,0|1,0,0]=3 21829 B16R1.7596 CSCNCCNC(=O)c1ccccc1Cl 2230a_100000737833_100011218213 [0,2,0,0,0,0|2,0,0]=4 21830 B16R1.7596 CSCNCCNC(=O)c1ccccc1Cl 34a_100000737833_100011218213 [0,2,0,0,0,0|2,0,0]=4 21831 B16R1.7596 CSCOCCNC(=O)c1ccccc1Br 34a_200000158863_100011218213 [0,2,0,0,0,0|2,0,0]=4 21832 B16R1.7596 Cc1ccccc1C(=O)CCCCCC#N 1458a_100000212026_100009813376 [0,2,0,0,0,0|2,0,0]=4 21833 B16R1.7596 Cc1ccccc1C(=O)CCCCCCF 1458a_100000212026_100015922095 [0,2,0,0,0,0|2,0,0]=4 21834 B16R1.7596 Cc1ccccc1C(=O)CCCCCCO 1458a_100000212026_100000766143 [0,2,0,0,0,0|2,0,0]=4 21835 B16R1.7596 Cc1ccccc1C(=O)CNCCCCO 2230a_100000750430_100000741374 [0,2,0,0,0,0|2,0,0]=4 21836 B16R1.7596 Cc1ccccc1C(=O)CNCCCCO 34a_100000750430_100000741374 [0,2,0,0,0,0|2,0,0]=4 21837 B16R1.7596 Cc1ccccc1C(=O)COCCCCBr 34a_100011216708_100000741374 [0,2,0,0,0,0|1,0,0]=3 21838 B16R1.7596 Cc1ccccc1C(=O)COCCCCCl 34a_100000210776_100000741374 [0,2,0,0,0,0|1,0,0]=3 21839 B16R1.7596 Cc1ccccc1C(=O)COCCCCCl 7a_100000210776_100000741374 [0,2,0,0,0,0|1,0,0]=3 21840 B16R1.7596 Cc1ccccc1C(=O)COCCCCF 34a_100011995726_100000741374 [0,2,0,0,0,0|1,0,0]=3 21841 B16R1.7596 Cc1ccccc1C(=O)COCCCCF 7a_100011995726_100000741374 [0,2,0,0,0,0|1,0,0]=3 21842 B16R1.7596 Cc1ccccc1C(=O)COCCCCI 34a_200012148704_100000741374 [0,2,0,0,0,0|1,0,0]=3 21843 B16R1.7596 Cc1ccccc1C(=O)COCCCCN 34a_100000750430_100000741374 [0,2,0,0,0,0|1,0,0]=3 21844 B16R1.7596 Cc1ccccc1C(=O)CSCCCCF 62a_100000729493_100000741374 [0,2,0,0,0,0|1,1,0]=4 21845 B16R1.7596 Cc1ccccc1C(=O)CSCCCCF 62a_100000741374_100000729493 [0,2,0,0,0,0|1,1,0]=4 21846 B16R1.7596 Cc1ccccc1C(=O)CSCCCCO 62a_100000210776_100000741374 [0,2,0,0,0,0|1,1,0]=4 21847 B16R1.7596 Cc1ccccc1C(=O)CSCCCCO 62a_100000741374_100000210776 [0,2,0,0,0,0|1,1,0]=4 21848 B16R1.7596 Cc1ccccc1C(=O)NCCCCC#N 11a_100000751965_100000212026 [0,2,0,0,0,0|2,0,0]=4 21849 B16R1.7596 Cc1ccccc1C(=O)NCCCCC#N 1626a_100000751965_100000212026 [0,2,0,0,0,0|2,0,0]=4 21850 B16R1.7596 Cc1ccccc1C(=O)NCCCCC#N 240690a_100000751965_100000212026 [0,2,0,0,0,0|2,0,0]=4 21851 B16R1.7596 Cc1ccccc1C(=O)NCCCCC#N 527a_100000751965_100000212026 [0,2,0,0,0,0|2,0,0]=4 21852 B16R1.7596 Cc1ccccc1C(=O)NCCCCCO 240690a_100000762737_100000212026 [0,2,0,0,0,0|2,0,0]=4 21853 B16R1.7596 Cc1ccccc1C(=O)NCCOCCO 240690a_100000211614_100000212026 [0,2,0,0,0,0|2,0,0]=4 21854 B16R1.7596 Cc1ccccc1C(=O)NCCSCCO 240690a_100011219999_100000212026 [0,2,0,0,0,0|2,0,0]=4 21855 B16R1.7596 Cc1ccccc1C(=O)NCCSCCO 527a_100011219999_100000212026 [0,2,0,0,0,0|2,0,0]=4 21856 B16R1.7596 N#CCCCCCC(=O)c1ccccc1Br 1458a_100000188424_100009813376 [0,2,0,0,0,0|2,0,0]=4 21857 B16R1.7596 N#CCCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100009813376 [0,2,0,0,0,0|2,0,0]=4 21858 B16R1.7596 N#CCCCCCC(=O)c1ccccc1F 1458a_100000188656_100009813376 [0,2,0,0,0,0|2,0,0]=4 21859 B16R1.7596 N#CCCCCCC(=O)c1ccccc1I 1458a_100000187884_100009813376 [0,2,0,0,0,0|2,0,0]=4 21860 B16R1.7596 N#CCCCCCC(=O)c1ccccc1O 1458a_100015234032_100009813376 [0,2,0,0,0,0|1,0,0]=3 21861 B16R1.7596 N#CCCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100009813376 [0,2,0,0,0,0|1,0,1]=4 21862 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Br 11a_100000751965_100000188424 [0,2,0,0,0,0|2,0,0]=4 21863 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Br 1626a_100000751965_100000188424 [0,2,0,0,0,0|2,0,0]=4 21864 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Br 240690a_100000751965_100000188424 [0,2,0,0,0,0|2,0,0]=4 21865 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Br 527a_100000751965_100000188424 [0,2,0,0,0,0|2,0,0]=4 21866 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Cl 11a_100000751965_100000185844 [0,2,0,0,0,0|2,0,0]=4 21867 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Cl 1626a_100000751965_100000185844 [0,2,0,0,0,0|2,0,0]=4 21868 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Cl 240690a_100000751965_100000185844 [0,2,0,0,0,0|2,0,0]=4 21869 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Cl 527a_100000751965_100000185844 [0,2,0,0,0,0|2,0,0]=4 21870 B16R1.7596 N#CCCCCNC(=O)c1ccccc1F 11a_100000751965_100000188656 [0,2,0,0,0,0|2,0,0]=4 21871 B16R1.7596 N#CCCCCNC(=O)c1ccccc1F 1626a_100000751965_100000188656 [0,2,0,0,0,0|2,0,0]=4 21872 B16R1.7596 N#CCCCCNC(=O)c1ccccc1F 240690a_100000751965_100000188656 [0,2,0,0,0,0|2,0,0]=4 21873 B16R1.7596 N#CCCCCNC(=O)c1ccccc1F 527a_100000751965_100000188656 [0,2,0,0,0,0|2,0,0]=4 21874 B16R1.7596 N#CCCCCNC(=O)c1ccccc1I 11a_100000751965_100000187884 [0,2,0,0,0,0|2,0,0]=4 21875 B16R1.7596 N#CCCCCNC(=O)c1ccccc1I 1626a_100000751965_100000187884 [0,2,0,0,0,0|2,0,0]=4 21876 B16R1.7596 N#CCCCCNC(=O)c1ccccc1I 240690a_100000751965_100000187884 [0,2,0,0,0,0|2,0,0]=4 21877 B16R1.7596 N#CCCCCNC(=O)c1ccccc1I 527a_100000751965_100000187884 [0,2,0,0,0,0|2,0,0]=4 21878 B16R1.7596 N#CCCCCNC(=O)c1ccccc1O 240690a_100000751965_100015234032 [0,2,0,0,0,0|1,0,0]=3 21879 B16R1.7596 N#CCCCCNC(=O)c1ccccc1[O-] 1626a_100000751965_100009911694 [0,2,0,0,0,0|1,0,1]=4 21880 B16R1.7596 N#CCCCCNC(=O)c1ccccc1[O-] 240690a_100000751965_100009911694 [0,2,0,0,0,0|1,0,1]=4 21881 B16R1.7596 N#CCCCCNC(=O)c1ccccc1[O-] 527a_100000751965_100009911694 [0,2,0,0,0,0|1,0,1]=4 21882 B16R1.7596 N#CCCCSCC(=O)c1ccccc1O 62a_100000188908_100000687738 [0,2,0,0,0,0|0,1,1]=4 21883 B16R1.7596 N#CCCCSCC(=O)c1ccccc1O 62a_100000687738_100000188908 [0,2,0,0,0,0|0,1,1]=4 21884 B16R1.7596 N#CCCSCCC(=O)c1ccccc1O 62a_100011215226_100009873196 [0,2,0,0,0,0|1,0,1]=4 21885 B16R1.7596 NCCCCOCC(=O)c1ccccc1Br 34a_100000750430_100000199116 [0,2,0,0,0,0|1,0,0]=3 21886 B16R1.7596 NCCCCOCC(=O)c1ccccc1Cl 34a_100000750430_100000211432 [0,2,0,0,0,0|1,0,0]=3 21887 B16R1.7596 NCCCCOCC(=O)c1ccccc1F 34a_100000750430_100000204681 [0,2,0,0,0,0|1,0,0]=3 21888 B16R1.7596 Nc1ccccc1C(=O)NCCCOCF 34a_200011191992_100015361967 [0,2,0,0,0,0|2,0,0]=4 21889 B16R1.7596 O=C(CCCCCCF)c1ccccc1Br 1458a_100000188424_100015922095 [0,2,0,0,0,0|2,0,0]=4 21890 B16R1.7596 O=C(CCCCCCF)c1ccccc1Cl 1458a_100000185844_100015922095 [0,2,0,0,0,0|2,0,0]=4 21891 B16R1.7596 O=C(CCCCCCF)c1ccccc1F 1458a_100000188656_100015922095 [0,2,0,0,0,0|2,0,0]=4 21892 B16R1.7596 O=C(CCCCCCF)c1ccccc1I 1458a_100000187884_100015922095 [0,2,0,0,0,0|2,0,0]=4 21893 B16R1.7596 O=C(CCCCCCF)c1ccccc1O 1458a_100015234032_100015922095 [0,2,0,0,0,0|1,0,0]=3 21894 B16R1.7596 O=C(CCCCCCF)c1ccccc1[O-] 1458a_100009911694_100015922095 [0,2,0,0,0,0|1,0,1]=4 21895 B16R1.7596 O=C(CCCCCCO)c1ccccc1Br 1458a_100000188424_100000766143 [0,2,0,0,0,0|2,0,0]=4 21896 B16R1.7596 O=C(CCCCCCO)c1ccccc1Cl 1458a_100000185844_100000766143 [0,2,0,0,0,0|2,0,0]=4 21897 B16R1.7596 O=C(CCCCCCO)c1ccccc1F 1458a_100000188656_100000766143 [0,2,0,0,0,0|2,0,0]=4 21898 B16R1.7596 O=C(CCCCCCO)c1ccccc1I 1458a_100000187884_100000766143 [0,2,0,0,0,0|2,0,0]=4 21899 B16R1.7596 O=C(CCCCCCO)c1ccccc1O 1458a_100015234032_100000766143 [0,2,0,0,0,0|1,0,0]=3 21900 B16R1.7596 O=C(CCCCCCO)c1ccccc1[O-] 1458a_100009911694_100000766143 [0,2,0,0,0,0|1,0,1]=4 21901 B16R1.7596 O=C(CCNCCCF)c1ccccc1F 2230a_100015189416_100000086012 [0,2,0,0,0,0|2,0,0]=4 21902 B16R1.7596 O=C(CCSCCCF)c1ccccc1F 62a_100000086012_100011934791 [0,2,0,0,0,0|2,0,0]=4 21903 B16R1.7596 O=C(CCSCCCF)c1ccccc1F 62a_100011934791_100000086012 [0,2,0,0,0,0|2,0,0]=4 21904 B16R1.7596 O=C(CCSCCCF)c1ccccc1O 62a_100011934791_100009873196 [0,2,0,0,0,0|1,0,0]=3 21905 B16R1.7596 O=C(CCSCCCO)c1ccccc1F 62a_100000086012_100011215043 [0,2,0,0,0,0|2,0,0]=4 21906 B16R1.7596 O=C(CCSCCCO)c1ccccc1F 62a_100011215043_100000086012 [0,2,0,0,0,0|2,0,0]=4 21907 B16R1.7596 O=C(CCSCCCO)c1ccccc1O 62a_100011215043_100009873196 [0,2,0,0,0,0|1,0,0]=3 21908 B16R1.7596 O=C(CNCCCCO)c1ccccc1Br 34a_100000750430_100000199116 [0,2,0,0,0,0|2,0,0]=4 21909 B16R1.7596 O=C(CNCCCCO)c1ccccc1Cl 34a_100000750430_100000211432 [0,2,0,0,0,0|2,0,0]=4 21910 B16R1.7596 O=C(CNCCCCO)c1ccccc1F 34a_100000750430_100000204681 [0,2,0,0,0,0|2,0,0]=4 21911 B16R1.7596 O=C(COCCCCBr)c1ccccc1Br 34a_100011216708_100000199116 [0,2,0,0,0,0|1,0,0]=3 21912 B16R1.7596 O=C(COCCCCBr)c1ccccc1Cl 34a_100011216708_100000211432 [0,2,0,0,0,0|1,0,0]=3 21913 B16R1.7596 O=C(COCCCCBr)c1ccccc1F 34a_100011216708_100000204681 [0,2,0,0,0,0|1,0,0]=3 21914 B16R1.7596 O=C(COCCCCCl)c1ccccc1Br 34a_100000210776_100000199116 [0,2,0,0,0,0|1,0,0]=3 21915 B16R1.7596 O=C(COCCCCCl)c1ccccc1Cl 34a_100000210776_100000211432 [0,2,0,0,0,0|1,0,0]=3 21916 B16R1.7596 O=C(COCCCCCl)c1ccccc1F 34a_100000210776_100000204681 [0,2,0,0,0,0|1,0,0]=3 21917 B16R1.7596 O=C(COCCCCCl)c1ccccc1F 7a_100000210776_100000204681 [0,2,0,0,0,0|1,0,0]=3 21918 B16R1.7596 O=C(COCCCCCl)c1ccccc1O 7a_100000210776_100000188908 [0,2,0,0,0,0|0,0,0]=2 21919 B16R1.7596 O=C(COCCCCF)c1ccccc1Br 34a_100011995726_100000199116 [0,2,0,0,0,0|1,0,0]=3 21920 B16R1.7596 O=C(COCCCCF)c1ccccc1Cl 34a_100011995726_100000211432 [0,2,0,0,0,0|1,0,0]=3 21921 B16R1.7596 O=C(COCCCCF)c1ccccc1F 34a_100011995726_100000204681 [0,2,0,0,0,0|1,0,0]=3 21922 B16R1.7596 O=C(COCCCCF)c1ccccc1F 7a_100011995726_100000204681 [0,2,0,0,0,0|1,0,0]=3 21923 B16R1.7596 O=C(COCCCCF)c1ccccc1O 7a_100011995726_100000188908 [0,2,0,0,0,0|0,0,0]=2 21924 B16R1.7596 O=C(COCCCCI)c1ccccc1Br 34a_200012148704_100000199116 [0,2,0,0,0,0|1,0,0]=3 21925 B16R1.7596 O=C(COCCCCI)c1ccccc1Cl 34a_200012148704_100000211432 [0,2,0,0,0,0|1,0,0]=3 21926 B16R1.7596 O=C(COCCCCI)c1ccccc1F 34a_200012148704_100000204681 [0,2,0,0,0,0|1,0,0]=3 21927 B16R1.7596 O=C(CSCCCCF)c1ccccc1Br 62a_100000199116_100000729493 [0,2,0,0,0,0|1,1,0]=4 21928 B16R1.7596 O=C(CSCCCCF)c1ccccc1Cl 62a_100000211432_100000729493 [0,2,0,0,0,0|1,1,0]=4 21929 B16R1.7596 O=C(CSCCCCF)c1ccccc1Cl 62a_100000729493_100000211432 [0,2,0,0,0,0|1,1,0]=4 21930 B16R1.7596 O=C(CSCCCCF)c1ccccc1F 62a_100000204681_100000729493 [0,2,0,0,0,0|1,1,0]=4 21931 B16R1.7596 O=C(CSCCCCF)c1ccccc1F 62a_100000729493_100000204681 [0,2,0,0,0,0|1,1,0]=4 21932 B16R1.7596 O=C(CSCCCCF)c1ccccc1O 62a_100000188908_100000729493 [0,2,0,0,0,0|0,1,0]=3 21933 B16R1.7596 O=C(CSCCCCF)c1ccccc1O 62a_100000729493_100000188908 [0,2,0,0,0,0|0,1,0]=3 21934 B16R1.7596 O=C(CSCCCCO)c1ccccc1Br 62a_100000199116_100000210776 [0,2,0,0,0,0|1,1,0]=4 21935 B16R1.7596 O=C(CSCCCCO)c1ccccc1Cl 62a_100000210776_100000211432 [0,2,0,0,0,0|1,1,0]=4 21936 B16R1.7596 O=C(CSCCCCO)c1ccccc1Cl 62a_100000211432_100000210776 [0,2,0,0,0,0|1,1,0]=4 21937 B16R1.7596 O=C(CSCCCCO)c1ccccc1F 62a_100000204681_100000210776 [0,2,0,0,0,0|1,1,0]=4 21938 B16R1.7596 O=C(CSCCCCO)c1ccccc1F 62a_100000210776_100000204681 [0,2,0,0,0,0|1,1,0]=4 21939 B16R1.7596 O=C(CSCCCCO)c1ccccc1O 62a_100000188908_100000210776 [0,2,0,0,0,0|0,1,0]=3 21940 B16R1.7596 O=C(CSCCCCO)c1ccccc1O 62a_100000210776_100000188908 [0,2,0,0,0,0|0,1,0]=3 21941 B16R1.7596 O=C(NCCCCCO)c1ccccc1Br 240690a_100000762737_100000188424 [0,2,0,0,0,0|2,0,0]=4 21942 B16R1.7596 O=C(NCCCCCO)c1ccccc1Cl 240690a_100000762737_100000185844 [0,2,0,0,0,0|2,0,0]=4 21943 B16R1.7596 O=C(NCCCCCO)c1ccccc1F 240690a_100000762737_100000188656 [0,2,0,0,0,0|2,0,0]=4 21944 B16R1.7596 O=C(NCCCCCO)c1ccccc1I 240690a_100000762737_100000187884 [0,2,0,0,0,0|2,0,0]=4 21945 B16R1.7596 O=C(NCCCCCO)c1ccccc1O 240690a_100000762737_100015234032 [0,2,0,0,0,0|1,0,0]=3 21946 B16R1.7596 O=C(NCCCCCO)c1ccccc1[O-] 240690a_100000762737_100009911694 [0,2,0,0,0,0|1,0,1]=4 21947 B16R1.7596 O=C(NCCNCCF)c1ccccc1Cl 2230a_100000737833_100011217306 [0,2,0,0,0,0|2,0,0]=4 21948 B16R1.7596 O=C(NCCNCCF)c1ccccc1Cl 34a_100000737833_100011217306 [0,2,0,0,0,0|2,0,0]=4 21949 B16R1.7596 O=C(NCCNCCO)c1ccccc1Cl 2230a_100000737833_100000211926 [0,2,0,0,0,0|2,0,0]=4 21950 B16R1.7596 O=C(NCCNCCO)c1ccccc1Cl 34a_100000737833_100000211926 [0,2,0,0,0,0|2,0,0]=4 21951 B16R1.7596 O=C(NCCOCCF)c1ccccc1Br 34a_200000158863_100011217306 [0,2,0,0,0,0|2,0,0]=4 21952 B16R1.7596 O=C(NCCOCCF)c1ccccc1Br 7a_200000158863_100011217306 [0,2,0,0,0,0|2,0,0]=4 21953 B16R1.7596 O=C(NCCOCCO)c1ccccc1Br 240690a_100000211614_100000188424 [0,2,0,0,0,0|2,0,0]=4 21954 B16R1.7596 O=C(NCCOCCO)c1ccccc1Br 34a_200000158863_100000211926 [0,2,0,0,0,0|2,0,0]=4 21955 B16R1.7596 O=C(NCCOCCO)c1ccccc1Br 7a_200000158863_100000211926 [0,2,0,0,0,0|2,0,0]=4 21956 B16R1.7596 O=C(NCCOCCO)c1ccccc1Cl 240690a_100000211614_100000185844 [0,2,0,0,0,0|2,0,0]=4 21957 B16R1.7596 O=C(NCCOCCO)c1ccccc1F 240690a_100000211614_100000188656 [0,2,0,0,0,0|2,0,0]=4 21958 B16R1.7596 O=C(NCCOCCO)c1ccccc1I 240690a_100000211614_100000187884 [0,2,0,0,0,0|2,0,0]=4 21959 B16R1.7596 O=C(NCCOCCO)c1ccccc1O 240690a_100000211614_100015234032 [0,2,0,0,0,0|1,0,0]=3 21960 B16R1.7596 O=C(NCCOCCO)c1ccccc1[O-] 240690a_100000211614_100009911694 [0,2,0,0,0,0|1,0,1]=4 21961 B16R1.7596 O=C(NCCSCCO)c1ccccc1Br 240690a_100011219999_100000188424 [0,2,0,0,0,0|2,0,0]=4 21962 B16R1.7596 O=C(NCCSCCO)c1ccccc1Br 527a_100011219999_100000188424 [0,2,0,0,0,0|2,0,0]=4 21963 B16R1.7596 O=C(NCCSCCO)c1ccccc1Cl 240690a_100011219999_100000185844 [0,2,0,0,0,0|2,0,0]=4 21964 B16R1.7596 O=C(NCCSCCO)c1ccccc1Cl 527a_100011219999_100000185844 [0,2,0,0,0,0|2,0,0]=4 21965 B16R1.7596 O=C(NCCSCCO)c1ccccc1F 240690a_100011219999_100000188656 [0,2,0,0,0,0|2,0,0]=4 21966 B16R1.7596 O=C(NCCSCCO)c1ccccc1F 527a_100011219999_100000188656 [0,2,0,0,0,0|2,0,0]=4 21967 B16R1.7596 O=C(NCCSCCO)c1ccccc1I 240690a_100011219999_100000187884 [0,2,0,0,0,0|2,0,0]=4 21968 B16R1.7596 O=C(NCCSCCO)c1ccccc1I 527a_100011219999_100000187884 [0,2,0,0,0,0|2,0,0]=4 21969 B16R1.7596 O=C(NCCSCCO)c1ccccc1O 240690a_100011219999_100015234032 [0,2,0,0,0,0|1,0,0]=3 21970 B16R1.7596 O=C(NCCSCCO)c1ccccc1[O-] 240690a_100011219999_100009911694 [0,2,0,0,0,0|1,0,1]=4 21971 B16R1.7596 O=C(NCCSCCO)c1ccccc1[O-] 527a_100011219999_100009911694 [0,2,0,0,0,0|1,0,1]=4 21972 B16R1.7596 O=CCCCSCC(=O)c1ccccc1O 62a_100000188908_200011292268 [0,2,0,0,0,0|0,1,1]=4 21973 B16R1.7596 O=CCCCSCC(=O)c1ccccc1O 62a_200011292268_100000188908 [0,2,0,0,0,0|0,1,1]=4 21974 B16R1.7596 [N-]=[N+]=NCCCNC(=O)c1ccccc1O 240690a_100000744732_100015234032 [0,2,0,0,0,0|2,0,0]=4 21975 B16R1.10817 C=C(C)CCOCC(=O)c1ccccc1Br 34a_100000764851_100000199116 [0,2,0,0,0,0|1,0,1]=4 21976 B16R1.10817 C=C(C)CCOCC(=O)c1ccccc1C 34a_100000764851_100000741374 [0,2,0,0,0,0|1,0,1]=4 21977 B16R1.10817 C=C(C)CCOCC(=O)c1ccccc1Cl 34a_100000764851_100000211432 [0,2,0,0,0,0|1,0,1]=4 21978 B16R1.10817 C=C(C)CCOCC(=O)c1ccccc1F 34a_100000764851_100000204681 [0,2,0,0,0,0|1,0,1]=4 21979 B16R1.10817 C=C(C)CCSCC(=O)c1ccccc1O 62a_100000188908_100000730704 [0,2,0,0,0,0|0,1,1]=4 21980 B16R1.10817 C=C(C)CCSCC(=O)c1ccccc1O 62a_100000730704_100000188908 [0,2,0,0,0,0|0,1,1]=4 21981 B16R1.10817 C=C(C)CSCCC(=O)c1ccccc1O 62a_100000748629_100009873196 [0,2,0,0,0,0|1,0,1]=4 21982 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000735457 [0,2,0,0,0,0|2,0,0]=4 21983 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1C 1458a_100000212026_100000735457 [0,2,0,0,0,0|2,0,0]=4 21984 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000735457 [0,2,0,0,0,0|2,0,0]=4 21985 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1F 1458a_100000188656_100000735457 [0,2,0,0,0,0|2,0,0]=4 21986 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1I 1458a_100000187884_100000735457 [0,2,0,0,0,0|2,0,0]=4 21987 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1O 1458a_100015234032_100000735457 [0,2,0,0,0,0|1,0,0]=3 21988 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000735457 [0,2,0,0,0,0|1,0,1]=4 21989 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1Br 34a_100000759926_100000199116 [0,2,0,0,0,0|1,0,1]=4 21990 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1C 34a_100000759926_100000741374 [0,2,0,0,0,0|1,0,1]=4 21991 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1C 7a_100000759926_100000741374 [0,2,0,0,0,0|1,0,1]=4 21992 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1Cl 34a_100000759926_100000211432 [0,2,0,0,0,0|1,0,1]=4 21993 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1F 34a_100000759926_100000204681 [0,2,0,0,0,0|1,0,1]=4 21994 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1F 7a_100000759926_100000204681 [0,2,0,0,0,0|1,0,1]=4 21995 B16R1.10817 CC(=O)CCOCC(=O)c1ccccc1O 7a_100000759926_100000188908 [0,2,0,0,0,0|0,0,1]=3 21996 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1O 62a_100000053229_100000188908 [0,2,0,0,0,0|0,1,1]=4 21997 B16R1.10817 CC(=O)CCSCC(=O)c1ccccc1O 62a_100000188908_100000053229 [0,2,0,0,0,0|0,1,1]=4 21998 B16R1.10817 CC(=O)NCCNC(=O)c1ccccc1O 240690a_100000209853_100015234032 [0,2,0,0,0,0|1,0,1]=4 21999 B16R1.10817 CC(=O)OCCCC(=O)c1ccccc1O 1458a_100015234032_100000042594 [0,2,0,0,0,0|1,0,1]=4 22000 B16R1.10817 CC(=O)OCCNC(=O)c1ccccc1O 240690a_100000724843_100015234032 [0,2,0,0,0,0|1,0,1]=4 22001 B16R1.10817 CC(=O)SCCCC(=O)c1ccccc1O 1458a_100015234032_100000038929 [0,2,0,0,0,0|1,0,1]=4 22002 B16R1.10817 CC(=O)SCCNC(=O)c1ccccc1O 240690a_100020647217_100015234032 [0,2,0,0,0,0|1,0,1]=4 22003 B16R1.10817 CC(=S)OCCCC(=O)c1ccccc1O 1458a_100015234032_200135323944 [0,2,0,0,0,0|1,0,1]=4 22004 B16R1.10817 CC(Br)CCOCC(=O)c1ccccc1Br 34a_100009893172_100000199116 [0,2,0,0,0,0|1,0,0]=3 22005 B16R1.10817 CC(Br)CCOCC(=O)c1ccccc1Cl 34a_100009893172_100000211432 [0,2,0,0,0,0|1,0,0]=3 22006 B16R1.10817 CC(Br)CCOCC(=O)c1ccccc1F 34a_100009893172_100000204681 [0,2,0,0,0,0|1,0,0]=3 22007 B16R1.10817 CC(C)CCCCC(=O)c1ccccc1Br 1458a_100000188424_100011216152 [0,2,0,0,0,0|2,0,0]=4 22008 B16R1.10817 CC(C)CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100011216152 [0,2,0,0,0,0|2,0,0]=4 22009 B16R1.10817 CC(C)CCCCC(=O)c1ccccc1F 1458a_100000188656_100011216152 [0,2,0,0,0,0|2,0,0]=4 22010 B16R1.10817 CC(C)CCCCC(=O)c1ccccc1I 1458a_100000187884_100011216152 [0,2,0,0,0,0|2,0,0]=4 22011 B16R1.10817 CC(C)CCCCC(=O)c1ccccc1O 1458a_100015234032_100011216152 [0,2,0,0,0,0|1,0,0]=3 22012 B16R1.10817 CC(C)CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011216152 [0,2,0,0,0,0|1,0,1]=4 22013 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Br 11a_200000737386_100000188424 [0,2,0,0,0,0|2,0,0]=4 22014 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Br 1626a_200000737386_100000188424 [0,2,0,0,0,0|2,0,0]=4 22015 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Br 240690a_200000737386_100000188424 [0,2,0,0,0,0|2,0,0]=4 22016 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Br 527a_200000737386_100000188424 [0,2,0,0,0,0|2,0,0]=4 22017 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Cl 11a_200000737386_100000185844 [0,2,0,0,0,0|2,0,0]=4 22018 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Cl 1626a_200000737386_100000185844 [0,2,0,0,0,0|2,0,0]=4 22019 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Cl 240690a_200000737386_100000185844 [0,2,0,0,0,0|2,0,0]=4 22020 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1Cl 527a_200000737386_100000185844 [0,2,0,0,0,0|2,0,0]=4 22021 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1F 11a_200000737386_100000188656 [0,2,0,0,0,0|2,0,0]=4 22022 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1F 1626a_200000737386_100000188656 [0,2,0,0,0,0|2,0,0]=4 22023 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1F 240690a_200000737386_100000188656 [0,2,0,0,0,0|2,0,0]=4 22024 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1F 527a_200000737386_100000188656 [0,2,0,0,0,0|2,0,0]=4 22025 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1I 11a_200000737386_100000187884 [0,2,0,0,0,0|2,0,0]=4 22026 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1I 1626a_200000737386_100000187884 [0,2,0,0,0,0|2,0,0]=4 22027 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1I 240690a_200000737386_100000187884 [0,2,0,0,0,0|2,0,0]=4 22028 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1I 527a_200000737386_100000187884 [0,2,0,0,0,0|2,0,0]=4 22029 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1O 240690a_200000737386_100015234032 [0,2,0,0,0,0|1,0,0]=3 22030 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1[O-] 1626a_200000737386_100009911694 [0,2,0,0,0,0|1,0,1]=4 22031 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1[O-] 240690a_200000737386_100009911694 [0,2,0,0,0,0|1,0,1]=4 22032 B16R1.10817 CC(C)CCCNC(=O)c1ccccc1[O-] 527a_200000737386_100009911694 [0,2,0,0,0,0|1,0,1]=4 22033 B16R1.10817 CC(C)CCOCC(=O)c1ccccc1Br 34a_100000210254_100000199116 [0,2,0,0,0,0|1,0,0]=3 22034 B16R1.10817 CC(C)CCOCC(=O)c1ccccc1Cl 34a_100000210254_100000211432 [0,2,0,0,0,0|1,0,0]=3 22035 B16R1.10817 CC(C)CCOCC(=O)c1ccccc1F 34a_100000210254_100000204681 [0,2,0,0,0,0|1,0,0]=3 22036 B16R1.10817 CC(C)CCOCC(=O)c1ccccc1F 7a_100000210254_100000204681 [0,2,0,0,0,0|1,0,0]=3 22037 B16R1.10817 CC(C)CCOCC(=O)c1ccccc1O 7a_100000210254_100000188908 [0,2,0,0,0,0|0,0,0]=2 22038 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1Br 62a_100000199116_100000210312 [0,2,0,0,0,0|1,1,0]=4 22039 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1Cl 62a_100000210312_100000211432 [0,2,0,0,0,0|1,1,0]=4 22040 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210312 [0,2,0,0,0,0|1,1,0]=4 22041 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1F 62a_100000204681_100000210312 [0,2,0,0,0,0|1,1,0]=4 22042 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1F 62a_100000210312_100000204681 [0,2,0,0,0,0|1,1,0]=4 22043 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1O 62a_100000188908_100000210312 [0,2,0,0,0,0|0,1,0]=3 22044 B16R1.10817 CC(C)CCSCC(=O)c1ccccc1O 62a_100000210312_100000188908 [0,2,0,0,0,0|0,1,0]=3 22045 B16R1.10817 CC(C)CNCCC(=O)c1ccccc1F 2230a_100000210953_100000086012 [0,2,0,0,0,0|2,0,0]=4 22046 B16R1.10817 CC(C)CSCCC(=O)c1ccccc1F 62a_100000086012_100000210760 [0,2,0,0,0,0|2,0,0]=4 22047 B16R1.10817 CC(C)CSCCC(=O)c1ccccc1F 62a_100000210624_100000086012 [0,2,0,0,0,0|2,0,0]=4 22048 B16R1.10817 CC(C)CSCCC(=O)c1ccccc1O 62a_100000210624_100009873196 [0,2,0,0,0,0|1,0,0]=3 22049 B16R1.10817 CC(C)NCCNC(=O)c1ccccc1Cl 2230a_100000737833_100000210206 [0,2,0,0,0,0|2,0,0]=4 22050 B16R1.10817 CC(C)NCCNC(=O)c1ccccc1Cl 34a_100000737833_100000210206 [0,2,0,0,0,0|2,0,0]=4 22051 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Br 11a_100000701111_100000188424 [0,2,0,0,0,0|2,0,0]=4 22052 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Br 1626a_100000701111_100000188424 [0,2,0,0,0,0|2,0,0]=4 22053 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Br 240690a_100000701111_100000188424 [0,2,0,0,0,0|2,0,0]=4 22054 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Br 34a_200000158863_100000210206 [0,2,0,0,0,0|2,0,0]=4 22055 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Br 527a_100000701111_100000188424 [0,2,0,0,0,0|2,0,0]=4 22056 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Br 7a_200000158863_100000210206 [0,2,0,0,0,0|2,0,0]=4 22057 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Cl 11a_100000701111_100000185844 [0,2,0,0,0,0|2,0,0]=4 22058 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Cl 1626a_100000701111_100000185844 [0,2,0,0,0,0|2,0,0]=4 22059 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Cl 240690a_100000701111_100000185844 [0,2,0,0,0,0|2,0,0]=4 22060 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1Cl 527a_100000701111_100000185844 [0,2,0,0,0,0|2,0,0]=4 22061 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1F 11a_100000701111_100000188656 [0,2,0,0,0,0|2,0,0]=4 22062 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1F 1626a_100000701111_100000188656 [0,2,0,0,0,0|2,0,0]=4 22063 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1F 240690a_100000701111_100000188656 [0,2,0,0,0,0|2,0,0]=4 22064 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1F 527a_100000701111_100000188656 [0,2,0,0,0,0|2,0,0]=4 22065 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1I 11a_100000701111_100000187884 [0,2,0,0,0,0|2,0,0]=4 22066 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1I 1626a_100000701111_100000187884 [0,2,0,0,0,0|2,0,0]=4 22067 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1I 240690a_100000701111_100000187884 [0,2,0,0,0,0|2,0,0]=4 22068 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1I 527a_100000701111_100000187884 [0,2,0,0,0,0|2,0,0]=4 22069 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1O 240690a_100000701111_100015234032 [0,2,0,0,0,0|1,0,0]=3 22070 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1[O-] 1626a_100000701111_100009911694 [0,2,0,0,0,0|1,0,1]=4 22071 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1[O-] 240690a_100000701111_100009911694 [0,2,0,0,0,0|1,0,1]=4 22072 B16R1.10817 CC(C)OCCNC(=O)c1ccccc1[O-] 527a_100000701111_100009911694 [0,2,0,0,0,0|1,0,1]=4 22073 B16R1.10817 CC(C)OCSCC(=O)c1ccccc1O 62a_100000188908_100000709892 [0,2,0,0,0,0|1,1,0]=4 22074 B16R1.10817 CC(C)OCSCC(=O)c1ccccc1O 62a_100000709892_100000188908 [0,2,0,0,0,0|1,1,0]=4 22075 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Br 11a_100000731138_100000188424 [0,2,0,0,0,0|2,0,0]=4 22076 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Br 1626a_100000731138_100000188424 [0,2,0,0,0,0|2,0,0]=4 22077 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Br 240690a_100000731138_100000188424 [0,2,0,0,0,0|2,0,0]=4 22078 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Br 527a_100000731138_100000188424 [0,2,0,0,0,0|2,0,0]=4 22079 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Cl 11a_100000731138_100000185844 [0,2,0,0,0,0|2,0,0]=4 22080 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Cl 1626a_100000731138_100000185844 [0,2,0,0,0,0|2,0,0]=4 22081 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Cl 240690a_100000731138_100000185844 [0,2,0,0,0,0|2,0,0]=4 22082 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1Cl 527a_100000731138_100000185844 [0,2,0,0,0,0|2,0,0]=4 22083 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1F 11a_100000731138_100000188656 [0,2,0,0,0,0|2,0,0]=4 22084 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1F 1626a_100000731138_100000188656 [0,2,0,0,0,0|2,0,0]=4 22085 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1F 240690a_100000731138_100000188656 [0,2,0,0,0,0|2,0,0]=4 22086 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1F 527a_100000731138_100000188656 [0,2,0,0,0,0|2,0,0]=4 22087 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1I 11a_100000731138_100000187884 [0,2,0,0,0,0|2,0,0]=4 22088 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1I 1626a_100000731138_100000187884 [0,2,0,0,0,0|2,0,0]=4 22089 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1I 240690a_100000731138_100000187884 [0,2,0,0,0,0|2,0,0]=4 22090 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1I 527a_100000731138_100000187884 [0,2,0,0,0,0|2,0,0]=4 22091 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1O 240690a_100000731138_100015234032 [0,2,0,0,0,0|1,0,0]=3 22092 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1[O-] 1626a_100000731138_100009911694 [0,2,0,0,0,0|1,0,1]=4 22093 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1[O-] 240690a_100000731138_100009911694 [0,2,0,0,0,0|1,0,1]=4 22094 B16R1.10817 CC(C)SCCNC(=O)c1ccccc1[O-] 527a_100000731138_100009911694 [0,2,0,0,0,0|1,0,1]=4 22095 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1Br 62a_100000199116_100012276601 [0,2,0,0,0,0|1,1,0]=4 22096 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1Cl 62a_100000211432_100012276601 [0,2,0,0,0,0|1,1,0]=4 22097 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1Cl 62a_100012276601_100000211432 [0,2,0,0,0,0|1,1,0]=4 22098 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1F 62a_100000204681_100012276601 [0,2,0,0,0,0|1,1,0]=4 22099 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1F 62a_100012276601_100000204681 [0,2,0,0,0,0|1,1,0]=4 22100 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1O 62a_100000188908_100012276601 [0,2,0,0,0,0|0,1,0]=3 22101 B16R1.10817 CC(O)CCSCC(=O)c1ccccc1O 62a_100012276601_100000188908 [0,2,0,0,0,0|0,1,0]=3 22102 B16R1.10817 CC(O)CNCCC(=O)c1ccccc1F 2230a_100000210904_100000086012 [0,2,0,0,0,0|2,0,0]=4 22103 B16R1.10817 CC(O)CSCCC(=O)c1ccccc1F 62a_100000086012_100011218427 [0,2,0,0,0,0|2,0,0]=4 22104 B16R1.10817 CC(O)CSCCC(=O)c1ccccc1F 62a_100011218427_100000086012 [0,2,0,0,0,0|2,0,0]=4 22105 B16R1.10817 CC(O)CSCCC(=O)c1ccccc1O 62a_100011218427_100009873196 [0,2,0,0,0,0|1,0,0]=3 22106 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1Br 240690a_102531767803_100000188424 [0,2,0,0,0,0|2,0,0]=4 22107 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1Br 527a_102531767803_100000188424 [0,2,0,0,0,0|2,0,0]=4 22108 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1Cl 240690a_102531767803_100000185844 [0,2,0,0,0,0|2,0,0]=4 22109 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1Cl 527a_102531767803_100000185844 [0,2,0,0,0,0|2,0,0]=4 22110 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1F 240690a_102531767803_100000188656 [0,2,0,0,0,0|2,0,0]=4 22111 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1F 527a_102531767803_100000188656 [0,2,0,0,0,0|2,0,0]=4 22112 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1I 240690a_102531767803_100000187884 [0,2,0,0,0,0|2,0,0]=4 22113 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1I 527a_102531767803_100000187884 [0,2,0,0,0,0|2,0,0]=4 22114 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1O 240690a_102531767803_100015234032 [0,2,0,0,0,0|1,0,0]=3 22115 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1[O-] 240690a_102531767803_100009911694 [0,2,0,0,0,0|1,0,1]=4 22116 B16R1.10817 CN(C)CCCNC(=O)c1ccccc1[O-] 527a_102531767803_100009911694 [0,2,0,0,0,0|1,0,1]=4 22117 B16R1.10817 CN(C)CCCNC(=O)c1cccnc1O 271570a_203496583355_100000159973 [0,2,0,0,0,0|2,0,0]=4 22118 B16R1.10817 CN(C)CCNNC(=O)c1ccccc1O 22a_100000738145_100015234032 [0,2,0,0,0,0|2,0,0]=4 22119 B16R1.10817 CN(C)CCSCC(=O)c1ccccc1O 62a_100000188908_100000755713 [0,2,0,0,0,0|1,1,0]=4 22120 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1Br 11a_200000753449_100000188424 [0,2,0,0,0,0|2,0,0]=4 22121 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1Br 240690a_200000753449_100000188424 [0,2,0,0,0,0|2,0,0]=4 22122 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1Br 527a_200000753449_100000188424 [0,2,0,0,0,0|2,0,0]=4 22123 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1Cl 11a_200000753449_100000185844 [0,2,0,0,0,0|2,0,0]=4 22124 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1Cl 240690a_200000753449_100000185844 [0,2,0,0,0,0|2,0,0]=4 22125 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1Cl 527a_200000753449_100000185844 [0,2,0,0,0,0|2,0,0]=4 22126 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1F 11a_200000753449_100000188656 [0,2,0,0,0,0|2,0,0]=4 22127 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1F 240690a_200000753449_100000188656 [0,2,0,0,0,0|2,0,0]=4 22128 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1F 527a_200000753449_100000188656 [0,2,0,0,0,0|2,0,0]=4 22129 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1I 11a_200000753449_100000187884 [0,2,0,0,0,0|2,0,0]=4 22130 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1I 240690a_200000753449_100000187884 [0,2,0,0,0,0|2,0,0]=4 22131 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1I 527a_200000753449_100000187884 [0,2,0,0,0,0|2,0,0]=4 22132 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1O 240690a_200000753449_100015234032 [0,2,0,0,0,0|1,0,0]=3 22133 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1[O-] 240690a_200000753449_100009911694 [0,2,0,0,0,0|1,0,1]=4 22134 B16R1.10817 CS(=O)CCCNC(=O)c1ccccc1[O-] 527a_200000753449_100009911694 [0,2,0,0,0,0|1,0,1]=4 22135 B16R1.10817 C[C@@H](N)CCOCC(=O)c1ccccc1Br 34a_100000706166_100000199116 [0,2,0,0,0,0|1,0,0]=3 22136 B16R1.10817 C[C@@H](N)CCOCC(=O)c1ccccc1Cl 34a_100000706166_100000211432 [0,2,0,0,0,0|1,0,0]=3 22137 B16R1.10817 C[C@@H](N)CCOCC(=O)c1ccccc1F 34a_100000706166_100000204681 [0,2,0,0,0,0|1,0,0]=3 22138 B16R1.10817 C[C@@H](O)CSCCC(=O)c1ccccc1F 62a_100000086012_100009817552 [0,2,0,0,0,0|2,0,0]=4 22139 B16R1.10817 C[C@@H](O)CSCCC(=O)c1ccccc1F 62a_100009817552_100000086012 [0,2,0,0,0,0|2,0,0]=4 22140 B16R1.10817 C[C@@H](O)CSCCC(=O)c1ccccc1O 62a_100009817552_100009873196 [0,2,0,0,0,0|1,0,0]=3 22141 B16R1.10817 Cc1ccccc1C(=O)CCCCC(C)C 1458a_100000212026_100011216152 [0,2,0,0,0,0|2,0,0]=4 22142 B16R1.10817 Cc1ccccc1C(=O)CNCCC(C)O 2230a_200000755665_100000741374 [0,2,0,0,0,0|2,0,0]=4 22143 B16R1.10817 Cc1ccccc1C(=O)COCCC(C)Br 34a_100009893172_100000741374 [0,2,0,0,0,0|1,0,0]=3 22144 B16R1.10817 Cc1ccccc1C(=O)COCCC(C)C 34a_100000210254_100000741374 [0,2,0,0,0,0|1,0,0]=3 22145 B16R1.10817 Cc1ccccc1C(=O)COCCC(C)C 7a_100000210254_100000741374 [0,2,0,0,0,0|1,0,0]=3 22146 B16R1.10817 Cc1ccccc1C(=O)COCCC(F)F 34a_100103093639_100000741374 [0,2,0,0,0,0|2,0,0]=4 22147 B16R1.10817 Cc1ccccc1C(=O)COCC[C@@H](C)N 34a_100000706166_100000741374 [0,2,0,0,0,0|1,0,0]=3 22148 B16R1.10817 Cc1ccccc1C(=O)CSCCC(C)C 62a_100000210312_100000741374 [0,2,0,0,0,0|1,1,0]=4 22149 B16R1.10817 Cc1ccccc1C(=O)CSCCC(C)C 62a_100000741374_100000210312 [0,2,0,0,0,0|1,1,0]=4 22150 B16R1.10817 Cc1ccccc1C(=O)CSCCC(C)O 62a_100000741374_100012276601 [0,2,0,0,0,0|1,1,0]=4 22151 B16R1.10817 Cc1ccccc1C(=O)CSCCC(C)O 62a_100012276601_100000741374 [0,2,0,0,0,0|1,1,0]=4 22152 B16R1.10817 Cc1ccccc1C(=O)NCCCC(C)C 11a_200000737386_100000212026 [0,2,0,0,0,0|2,0,0]=4 22153 B16R1.10817 Cc1ccccc1C(=O)NCCCC(C)C 1626a_200000737386_100000212026 [0,2,0,0,0,0|2,0,0]=4 22154 B16R1.10817 Cc1ccccc1C(=O)NCCCC(C)C 240690a_200000737386_100000212026 [0,2,0,0,0,0|2,0,0]=4 22155 B16R1.10817 Cc1ccccc1C(=O)NCCCC(C)C 527a_200000737386_100000212026 [0,2,0,0,0,0|2,0,0]=4 22156 B16R1.10817 Cc1ccccc1C(=O)NCCCN(C)C 240690a_102531767803_100000212026 [0,2,0,0,0,0|2,0,0]=4 22157 B16R1.10817 Cc1ccccc1C(=O)NCCCN(C)C 527a_102531767803_100000212026 [0,2,0,0,0,0|2,0,0]=4 22158 B16R1.10817 Cc1ccccc1C(=O)NCCCS(=O)C 11a_200000753449_100000212026 [0,2,0,0,0,0|2,0,0]=4 22159 B16R1.10817 Cc1ccccc1C(=O)NCCCS(=O)C 240690a_200000753449_100000212026 [0,2,0,0,0,0|2,0,0]=4 22160 B16R1.10817 Cc1ccccc1C(=O)NCCCS(=O)C 527a_200000753449_100000212026 [0,2,0,0,0,0|2,0,0]=4 22161 B16R1.10817 Cc1ccccc1C(=O)NCCOC(C)C 11a_100000701111_100000212026 [0,2,0,0,0,0|2,0,0]=4 22162 B16R1.10817 Cc1ccccc1C(=O)NCCOC(C)C 1626a_100000701111_100000212026 [0,2,0,0,0,0|2,0,0]=4 22163 B16R1.10817 Cc1ccccc1C(=O)NCCOC(C)C 240690a_100000701111_100000212026 [0,2,0,0,0,0|2,0,0]=4 22164 B16R1.10817 Cc1ccccc1C(=O)NCCOC(C)C 527a_100000701111_100000212026 [0,2,0,0,0,0|2,0,0]=4 22165 B16R1.10817 Cc1ccccc1C(=O)NCCSC(C)C 11a_100000731138_100000212026 [0,2,0,0,0,0|2,0,0]=4 22166 B16R1.10817 Cc1ccccc1C(=O)NCCSC(C)C 1626a_100000731138_100000212026 [0,2,0,0,0,0|2,0,0]=4 22167 B16R1.10817 Cc1ccccc1C(=O)NCCSC(C)C 240690a_100000731138_100000212026 [0,2,0,0,0,0|2,0,0]=4 22168 B16R1.10817 Cc1ccccc1C(=O)NCCSC(C)C 527a_100000731138_100000212026 [0,2,0,0,0,0|2,0,0]=4 22169 B16R1.10817 NC(=O)CCCNC(=O)c1ccccc1O 240690a_100000739312_100015234032 [0,2,0,0,0,0|1,0,1]=4 22170 B16R1.10817 NC(=O)CCOCC(=O)c1ccccc1O 7a_100000757172_100000188908 [0,2,0,0,0,0|1,0,1]=4 22171 B16R1.10817 O=C(CCCCB(O)O)c1ccccc1O 1458a_100015234032_200009817182 [0,2,0,0,0,0|2,0,0]=4 22172 B16R1.10817 O=C(CCOCC(F)F)c1ccccc1O 1458a_100015234032_200012177212 [0,2,0,0,0,0|2,0,0]=4 22173 B16R1.10817 O=C(CCSCC(F)F)c1ccccc1O 62a_100011934356_100009873196 [0,2,0,0,0,0|2,0,0]=4 22174 B16R1.10817 O=C(COCCC(F)F)c1ccccc1Br 34a_100103093639_100000199116 [0,2,0,0,0,0|2,0,0]=4 22175 B16R1.10817 O=C(COCCC(F)F)c1ccccc1Cl 34a_100103093639_100000211432 [0,2,0,0,0,0|2,0,0]=4 22176 B16R1.10817 O=C(COCCC(F)F)c1ccccc1F 34a_100103093639_100000204681 [0,2,0,0,0,0|2,0,0]=4 22177 B16R1.12779 CCCCCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000164752 [0,2,0,0,0,0|2,0,0]=4 22178 B16R1.12779 COCCCNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165023 [0,2,0,0,0,0|2,0,0]=4 22179 B16R1.16971 C#CC(C)SCCC(=O)c1ccccc1O 62a_200000035995_100009873196 [0,2,0,0,0,0|2,0,0]=4 22180 B16R1.16971 C#C[C@@H](C)OCCC(=O)c1ccccc1O 7a_100009815206_100009873196 [0,2,0,0,0,0|2,0,0]=4 22181 B16R1.16971 C=CC(C)COCC(=O)c1ccccc1O 7a_100011215527_100000188908 [0,2,0,0,0,0|0,0,2]=4 22182 B16R1.16971 C=CC(C)SCCC(=O)c1ccccc1O 62a_100011215867_100009873196 [0,2,0,0,0,0|2,0,0]=4 22183 B16R1.16971 CC(C#N)CNNC(=O)c1ccccc1O 22a_100000045663_100015234032 [0,2,0,0,0,0|2,0,0]=4 22184 B16R1.16971 CC(C#N)SCCC(=O)c1ccccc1O 62a_100000703298_100009873196 [0,2,0,0,0,0|2,0,0]=4 22185 B16R1.16971 CC(CF)OCCC(=O)c1ccccc1O 7a_100016041109_100009873196 [0,2,0,0,0,0|2,0,0]=4 22186 B16R1.16971 CC(CN)COCC(=O)c1ccccc1Br 34a_100000744482_100000199116 [0,2,0,0,0,0|2,0,0]=4 22187 B16R1.16971 CC(CN)COCC(=O)c1ccccc1Cl 34a_100000744482_100000211432 [0,2,0,0,0,0|2,0,0]=4 22188 B16R1.16971 CC(CN)COCC(=O)c1ccccc1F 34a_100000744482_100000204681 [0,2,0,0,0,0|2,0,0]=4 22189 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1Br 240690a_106354213184_100000188424 [0,2,0,0,0,0|2,0,0]=4 22190 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1Br 527a_106354213184_100000188424 [0,2,0,0,0,0|2,0,0]=4 22191 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1Cl 240690a_106354213184_100000185844 [0,2,0,0,0,0|2,0,0]=4 22192 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1Cl 527a_106354213184_100000185844 [0,2,0,0,0,0|2,0,0]=4 22193 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1F 240690a_106354213184_100000188656 [0,2,0,0,0,0|2,0,0]=4 22194 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1F 527a_106354213184_100000188656 [0,2,0,0,0,0|2,0,0]=4 22195 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1I 240690a_106354213184_100000187884 [0,2,0,0,0,0|2,0,0]=4 22196 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1I 527a_106354213184_100000187884 [0,2,0,0,0,0|2,0,0]=4 22197 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1O 240690a_106354213184_100015234032 [0,2,0,0,0,0|1,0,0]=3 22198 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1[O-] 240690a_106354213184_100009911694 [0,2,0,0,0,0|1,0,1]=4 22199 B16R1.16971 CC(CO)CCNC(=O)c1ccccc1[O-] 527a_106354213184_100009911694 [0,2,0,0,0,0|1,0,1]=4 22200 B16R1.16971 CC(CO)SCCC(=O)c1ccccc1O 62a_100012180447_100009873196 [0,2,0,0,0,0|2,0,0]=4 22201 B16R1.16971 CCC(=O)CCNC(=O)c1ccccc1C 1458a_100000195313_100000210202 [0,2,0,0,0,0|2,0,0]=4 22202 B16R1.16971 CCC(=O)CCNC(=O)c1ccccc1Cl 1458a_100000182440_100000210202 [0,2,0,0,0,0|2,0,0]=4 22203 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1Br 34a_100000725409_100000199116 [0,2,0,0,0,0|1,0,1]=4 22204 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1C 34a_100000725409_100000741374 [0,2,0,0,0,0|1,0,1]=4 22205 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1Cl 34a_100000725409_100000211432 [0,2,0,0,0,0|1,0,1]=4 22206 B16R1.16971 CCC(=O)COCC(=O)c1ccccc1F 34a_100000725409_100000204681 [0,2,0,0,0,0|1,0,1]=4 22207 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1O 62a_100000188908_100000747405 [0,2,0,0,0,0|0,1,1]=4 22208 B16R1.16971 CCC(=O)CSCC(=O)c1ccccc1O 62a_100000747405_100000188908 [0,2,0,0,0,0|0,1,1]=4 22209 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Br 11a_100020591266_100000188424 [0,2,0,0,0,0|2,0,0]=4 22210 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Br 1626a_100020591266_100000188424 [0,2,0,0,0,0|2,0,0]=4 22211 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Br 240690a_100020591266_100000188424 [0,2,0,0,0,0|2,0,0]=4 22212 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Br 527a_100020591266_100000188424 [0,2,0,0,0,0|2,0,0]=4 22213 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1C 11a_100020591266_100000212026 [0,2,0,0,0,0|2,0,0]=4 22214 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1C 1626a_100020591266_100000212026 [0,2,0,0,0,0|2,0,0]=4 22215 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1C 240690a_100020591266_100000212026 [0,2,0,0,0,0|2,0,0]=4 22216 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1C 527a_100020591266_100000212026 [0,2,0,0,0,0|2,0,0]=4 22217 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Cl 11a_100020591266_100000185844 [0,2,0,0,0,0|2,0,0]=4 22218 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Cl 1626a_100020591266_100000185844 [0,2,0,0,0,0|2,0,0]=4 22219 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Cl 240690a_100020591266_100000185844 [0,2,0,0,0,0|2,0,0]=4 22220 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1Cl 527a_100020591266_100000185844 [0,2,0,0,0,0|2,0,0]=4 22221 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1F 11a_100020591266_100000188656 [0,2,0,0,0,0|2,0,0]=4 22222 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1F 1626a_100020591266_100000188656 [0,2,0,0,0,0|2,0,0]=4 22223 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1F 240690a_100020591266_100000188656 [0,2,0,0,0,0|2,0,0]=4 22224 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1F 527a_100020591266_100000188656 [0,2,0,0,0,0|2,0,0]=4 22225 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1I 11a_100020591266_100000187884 [0,2,0,0,0,0|2,0,0]=4 22226 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1I 1626a_100020591266_100000187884 [0,2,0,0,0,0|2,0,0]=4 22227 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1I 240690a_100020591266_100000187884 [0,2,0,0,0,0|2,0,0]=4 22228 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1I 527a_100020591266_100000187884 [0,2,0,0,0,0|2,0,0]=4 22229 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1O 240690a_100020591266_100015234032 [0,2,0,0,0,0|1,0,0]=3 22230 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1[O-] 1626a_100020591266_100009911694 [0,2,0,0,0,0|1,0,1]=4 22231 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1[O-] 240690a_100020591266_100009911694 [0,2,0,0,0,0|1,0,1]=4 22232 B16R1.16971 CCC(C)CCNC(=O)c1ccccc1[O-] 527a_100020591266_100009911694 [0,2,0,0,0,0|1,0,1]=4 22233 B16R1.16971 CCC(C)CNCC(=O)c1ccccc1C 2230a_100020588543_100000741374 [0,2,0,0,0,0|2,0,0]=4 22234 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1Br 62a_100000199116_100000748023 [0,2,0,0,0,0|1,1,0]=4 22235 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1C 62a_100000741374_100000748023 [0,2,0,0,0,0|1,1,0]=4 22236 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1C 62a_100000748023_100000741374 [0,2,0,0,0,0|1,1,0]=4 22237 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000748023 [0,2,0,0,0,0|1,1,0]=4 22238 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1Cl 62a_100000748023_100000211432 [0,2,0,0,0,0|1,1,0]=4 22239 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1F 62a_100000204681_100000748023 [0,2,0,0,0,0|1,1,0]=4 22240 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1F 62a_100000748023_100000204681 [0,2,0,0,0,0|1,1,0]=4 22241 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000748023 [0,2,0,0,0,0|0,1,0]=3 22242 B16R1.16971 CCC(C)CSCC(=O)c1ccccc1O 62a_100000748023_100000188908 [0,2,0,0,0,0|0,1,0]=3 22243 B16R1.16971 CCC(C)NCCC(=O)c1ccccc1F 2230a_100000209981_100000086012 [0,2,0,0,0,0|2,0,0]=4 22244 B16R1.16971 CCC(C)OCCC(=O)c1ccccc1F 7a_100000210228_100000086012 [0,2,0,0,0,0|2,0,0]=4 22245 B16R1.16971 CCC(C)OCCC(=O)c1ccccc1O 7a_100000210228_100009873196 [0,2,0,0,0,0|1,0,0]=3 22246 B16R1.16971 CCC(C)SCCC(=O)c1ccccc1F 62a_100000086012_100000758301 [0,2,0,0,0,0|2,0,0]=4 22247 B16R1.16971 CCC(C)SCCC(=O)c1ccccc1F 62a_100000758301_100000086012 [0,2,0,0,0,0|2,0,0]=4 22248 B16R1.16971 CCC(C)SCCC(=O)c1ccccc1O 62a_100000758301_100009873196 [0,2,0,0,0,0|1,0,0]=3 22249 B16R1.16971 CCC(O)CNCC(=O)c1ccccc1C 2230a_100011218483_100000741374 [0,2,0,0,0,0|2,0,0]=4 22250 B16R1.16971 CCC(O)CNN=C(C)c1ccccc1O 4a_100015206393_100000188907 [0,2,0,0,0,0|2,0,0]=4 22251 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1Br 22a_100015206393_100000188424 [0,2,0,0,0,0|2,0,0]=4 22252 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1C 22a_100015206393_100000212026 [0,2,0,0,0,0|2,0,0]=4 22253 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1Cl 22a_100015206393_100000185844 [0,2,0,0,0,0|2,0,0]=4 22254 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1F 22a_100015206393_100000188656 [0,2,0,0,0,0|2,0,0]=4 22255 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1I 22a_100015206393_100000187884 [0,2,0,0,0,0|2,0,0]=4 22256 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1O 22a_100015206393_100015234032 [0,2,0,0,0,0|1,0,0]=3 22257 B16R1.16971 CCC(O)CNNC(=O)c1ccccc1[O-] 22a_100015206393_100009911694 [0,2,0,0,0,0|1,0,1]=4 22258 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1Br 62a_100000199116_100011218378 [0,2,0,0,0,0|1,1,0]=4 22259 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1C 62a_100000741374_100011218378 [0,2,0,0,0,0|1,1,0]=4 22260 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1C 62a_100011218378_100000741374 [0,2,0,0,0,0|1,1,0]=4 22261 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1Cl 62a_100000211432_100011218378 [0,2,0,0,0,0|1,1,0]=4 22262 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1Cl 62a_100011218378_100000211432 [0,2,0,0,0,0|1,1,0]=4 22263 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1F 62a_100000204681_100011218378 [0,2,0,0,0,0|1,1,0]=4 22264 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1F 62a_100011218378_100000204681 [0,2,0,0,0,0|1,1,0]=4 22265 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1O 62a_100000188908_100011218378 [0,2,0,0,0,0|0,1,0]=3 22266 B16R1.16971 CCC(O)CSCC(=O)c1ccccc1O 62a_100011218378_100000188908 [0,2,0,0,0,0|0,1,0]=3 22267 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1Br 1458a_100000188424_100015186262 [0,2,0,0,0,0|2,0,0]=4 22268 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1C 1458a_100000212026_100015186262 [0,2,0,0,0,0|2,0,0]=4 22269 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100015186262 [0,2,0,0,0,0|2,0,0]=4 22270 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1F 1458a_100000188656_100015186262 [0,2,0,0,0,0|2,0,0]=4 22271 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1I 1458a_100000187884_100015186262 [0,2,0,0,0,0|2,0,0]=4 22272 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100015186262 [0,2,0,0,0,0|1,0,0]=3 22273 B16R1.16971 CCN(C)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100015186262 [0,2,0,0,0,0|1,0,1]=4 22274 B16R1.16971 CC[C@H](C)COCC(=O)c1ccccc1C 7a_100009816381_100000741374 [0,2,0,0,0,0|1,0,0]=3 22275 B16R1.16971 CC[C@H](C)COCC(=O)c1ccccc1F 7a_100009816381_100000204681 [0,2,0,0,0,0|1,0,0]=3 22276 B16R1.16971 CC[C@H](C)COCC(=O)c1ccccc1O 7a_100009816381_100000188908 [0,2,0,0,0,0|0,0,0]=2 22277 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1Br 62a_100000199116_100009816398 [0,2,0,0,0,0|1,1,0]=4 22278 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1C 62a_100000741374_100009816398 [0,2,0,0,0,0|1,1,0]=4 22279 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1C 62a_100009816398_100000741374 [0,2,0,0,0,0|1,1,0]=4 22280 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1Cl 62a_100000211432_100009816398 [0,2,0,0,0,0|1,1,0]=4 22281 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1Cl 62a_100009816398_100000211432 [0,2,0,0,0,0|1,1,0]=4 22282 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1F 62a_100000204681_100009816398 [0,2,0,0,0,0|1,1,0]=4 22283 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1F 62a_100009816398_100000204681 [0,2,0,0,0,0|1,1,0]=4 22284 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1O 62a_100000188908_100009816398 [0,2,0,0,0,0|0,1,0]=3 22285 B16R1.16971 CC[C@H](C)CSCC(=O)c1ccccc1O 62a_100009816398_100000188908 [0,2,0,0,0,0|0,1,0]=3 22286 B16R1.16971 CNC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100000741757 [0,2,0,0,0,0|1,0,1]=4 22287 B16R1.16971 CNC(=O)CCNC(=O)c1ccccc1O 240690a_100000738227_100015234032 [0,2,0,0,0,0|1,0,1]=4 22288 B16R1.16971 COC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100011218270 [0,2,0,0,0,0|1,0,1]=4 22289 B16R1.16971 COC(=O)CCNC(=O)c1ccccc1O 188690a_100000683876_100015234032 [0,2,0,0,0,0|1,0,1]=4 22290 B16R1.16971 COC(C)COCC(=O)c1ccccc1Br 34a_100000690652_100000199116 [0,2,0,0,0,0|2,0,0]=4 22291 B16R1.16971 COC(C)COCC(=O)c1ccccc1C 34a_100000690652_100000741374 [0,2,0,0,0,0|2,0,0]=4 22292 B16R1.16971 COC(C)COCC(=O)c1ccccc1Cl 34a_100000690652_100000211432 [0,2,0,0,0,0|2,0,0]=4 22293 B16R1.16971 COC(C)COCC(=O)c1ccccc1F 34a_100000690652_100000204681 [0,2,0,0,0,0|2,0,0]=4 22294 B16R1.16971 COC(C)SCCC(=O)c1ccccc1O 62a_100009879195_100009873196 [0,2,0,0,0,0|2,0,0]=4 22295 B16R1.16971 C[C@@H](CO)CSCC(=O)c1ccccc1O 62a_100000059175_100000188908 [0,2,0,0,0,0|1,1,0]=4 22296 B16R1.16971 C[C@@H](CO)CSCC(=O)c1ccccc1O 62a_100000188908_100000059175 [0,2,0,0,0,0|1,1,0]=4 22297 B16R1.16971 C[C@H](CO)SCCC(=O)c1ccccc1O 62a_100016084084_100009873196 [0,2,0,0,0,0|2,0,0]=4 22298 B16R1.16971 Cc1ccccc1C(=O)COCC(C)CN 34a_100000744482_100000741374 [0,2,0,0,0,0|2,0,0]=4 22299 B16R1.16971 Cc1ccccc1C(=O)COCC(Cl)CCl 34a_100000033668_100000741374 [0,2,0,0,0,0|2,0,0]=4 22300 B16R1.16971 Cc1ccccc1C(=O)COC[C@H](F)CN 34a_100015665980_100000741374 [0,2,0,0,0,0|2,0,0]=4 22301 B16R1.16971 Cc1ccccc1C(=O)NCCC(C)CO 240690a_106354213184_100000212026 [0,2,0,0,0,0|2,0,0]=4 22302 B16R1.16971 Cc1ccccc1C(=O)NCCC(C)CO 527a_106354213184_100000212026 [0,2,0,0,0,0|2,0,0]=4 22303 B16R1.16971 NC[C@@H](F)COCC(=O)c1ccccc1Br 34a_100015665980_100000199116 [0,2,0,0,0,0|2,0,0]=4 22304 B16R1.16971 NC[C@@H](F)COCC(=O)c1ccccc1Cl 34a_100015665980_100000211432 [0,2,0,0,0,0|2,0,0]=4 22305 B16R1.16971 NC[C@@H](F)COCC(=O)c1ccccc1F 34a_100015665980_100000204681 [0,2,0,0,0,0|2,0,0]=4 22306 B16R1.16971 O=C(COCC(Cl)CCl)c1ccccc1Br 34a_100000033668_100000199116 [0,2,0,0,0,0|2,0,0]=4 22307 B16R1.16971 O=C(COCC(Cl)CCl)c1ccccc1Cl 34a_100000033668_100000211432 [0,2,0,0,0,0|2,0,0]=4 22308 B16R1.16971 O=C(COCC(Cl)CCl)c1ccccc1F 34a_100000033668_100000204681 [0,2,0,0,0,0|2,0,0]=4 22309 B16R1.16971 O=C(CSCC(O)CO)c1ccccc1O 62a_100000188908_100011219619 [0,2,0,0,0,0|1,1,0]=4 22310 B16R1.16971 O=C(CSCC(O)CO)c1ccccc1O 62a_100011219619_100000188908 [0,2,0,0,0,0|1,1,0]=4 22311 B16R1.16971 O=C(CSC[C@@H](O)CF)c1ccccc1O 62a_100000188908_100015614560 [0,2,0,0,0,0|1,1,0]=4 22312 B16R1.16971 O=C(CSC[C@@H](O)CF)c1ccccc1O 62a_100015614560_100000188908 [0,2,0,0,0,0|1,1,0]=4 22313 B16R1.16971 O=C(CSC[C@@H](O)CO)c1ccccc1O 62a_100000188908_100009815848 [0,2,0,0,0,0|1,1,0]=4 22314 B16R1.16971 O=C(CSC[C@@H](O)CO)c1ccccc1O 62a_100009815848_100000188908 [0,2,0,0,0,0|1,1,0]=4 22315 B16R1.106955 C#CCCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100010269958 [0,2,0,0,0,0|1,0,1]=4 22316 B16R1.106955 C#CCCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100010269958 [0,2,0,0,0,0|1,0,1]=4 22317 B16R1.106955 C#CCCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100010269958 [0,2,0,0,0,0|1,0,1]=4 22318 B16R1.106955 C#CCCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100010269958 [0,2,0,0,0,0|1,0,1]=4 22319 B16R1.106955 C#CCCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100010269958 [0,2,0,0,0,0|1,0,1]=4 22320 B16R1.106955 C#CCCCNC(=O)c1c(cccc1Br)O 240690a_100000718082_100011935254 [0,2,0,0,0,0|1,0,1]=4 22321 B16R1.106955 C#CCCCNC(=O)c1c(cccc1Br)O 527a_100000718082_100011935254 [0,2,0,0,0,0|1,0,1]=4 22322 B16R1.106955 C#CCCCNC(=O)c1c(cccc1Cl)O 240690a_100000718082_100000745519 [0,2,0,0,0,0|1,0,1]=4 22323 B16R1.106955 C#CCCCNC(=O)c1c(cccc1Cl)O 527a_100000718082_100000745519 [0,2,0,0,0,0|1,0,1]=4 22324 B16R1.106955 C#CCCCNC(=O)c1c(cccc1F)O 527a_100000718082_100000763259 [0,2,0,0,0,0|1,0,1]=4 22325 B16R1.106955 C#CCCCNC(=O)c1c(cccc1O)O 527a_100000718082_100000755285 [0,2,0,0,0,0|1,0,1]=4 22326 B16R1.106955 C=CCCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215482 [0,2,0,0,0,0|1,0,1]=4 22327 B16R1.106955 C=CCCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215482 [0,2,0,0,0,0|1,0,1]=4 22328 B16R1.106955 C=CCCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215482 [0,2,0,0,0,0|1,0,1]=4 22329 B16R1.106955 C=CCCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100011215482 [0,2,0,0,0,0|1,0,1]=4 22330 B16R1.106955 C=CCCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215482 [0,2,0,0,0,0|1,0,1]=4 22331 B16R1.106955 C=CCCCNC(=O)c1c(cccc1Br)O 240690a_100000700776_100011935254 [0,2,0,0,0,0|1,0,1]=4 22332 B16R1.106955 C=CCCCNC(=O)c1c(cccc1Br)O 527a_100000700776_100011935254 [0,2,0,0,0,0|1,0,1]=4 22333 B16R1.106955 C=CCCCNC(=O)c1c(cccc1Cl)O 240690a_100000700776_100000745519 [0,2,0,0,0,0|1,0,1]=4 22334 B16R1.106955 C=CCCCNC(=O)c1c(cccc1Cl)O 527a_100000700776_100000745519 [0,2,0,0,0,0|1,0,1]=4 22335 B16R1.106955 C=CCCCNC(=O)c1c(cccc1F)O 527a_100000700776_100000763259 [0,2,0,0,0,0|1,0,1]=4 22336 B16R1.106955 C=CCCCNC(=O)c1c(cccc1O)O 527a_100000700776_100000755285 [0,2,0,0,0,0|1,0,1]=4 22337 B16R1.106955 CC/C=C\CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100015370543 [0,2,0,0,0,0|1,0,1]=4 22338 B16R1.106955 CC/C=C\CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100015370543 [0,2,0,0,0,0|1,0,1]=4 22339 B16R1.106955 CC/C=C\CCC(=O)c1c(cccc1F)O 1458a_100000763259_100015370543 [0,2,0,0,0,0|1,0,1]=4 22340 B16R1.106955 CC/C=C\CCC(=O)c1c(cccc1O)C 1458a_100011934116_100015370543 [0,2,0,0,0,0|1,0,1]=4 22341 B16R1.106955 CC/C=C\CCC(=O)c1c(cccc1O)O 1458a_100000755285_100015370543 [0,2,0,0,0,0|1,0,1]=4 22342 B16R1.106955 CCCCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210757 [0,2,0,0,0,0|2,0,0]=4 22343 B16R1.106955 CCCCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210757 [0,2,0,0,0,0|2,0,0]=4 22344 B16R1.106955 CCCCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210757 [0,2,0,0,0,0|2,0,0]=4 22345 B16R1.106955 CCCCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210757 [0,2,0,0,0,0|2,0,0]=4 22346 B16R1.106955 CCCCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210757 [0,2,0,0,0,0|1,0,0]=3 22347 B16R1.106955 CCCCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210757 [0,2,0,0,0,0|2,0,0]=4 22348 B16R1.106955 CCCCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210757 [0,2,0,0,0,0|2,0,0]=4 22349 B16R1.106955 CCCCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210757 [0,2,0,0,0,0|2,0,0]=4 22350 B16R1.106955 CCCCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210757 [0,2,0,0,0,0|2,0,0]=4 22351 B16R1.106955 CCCCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210757 [0,2,0,0,0,0|1,0,0]=3 22352 B16R1.106955 CCCCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210757 [0,2,0,0,0,0|2,0,0]=4 22353 B16R1.106955 CCCCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210757 [0,2,0,0,0,0|2,0,0]=4 22354 B16R1.106955 CCCCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210757 [0,2,0,0,0,0|1,0,0]=3 22355 B16R1.106955 CCCCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210757 [0,2,0,0,0,0|2,0,0]=4 22356 B16R1.106955 CCCCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210757 [0,2,0,0,0,0|2,0,0]=4 22357 B16R1.106955 CCCCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210757 [0,2,0,0,0,0|2,0,0]=4 22358 B16R1.106955 CCCCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210757 [0,2,0,0,0,0|2,0,0]=4 22359 B16R1.106955 CCCCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210757 [0,2,0,0,0,0|1,0,0]=3 22360 B16R1.106955 CCCCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210757 [0,2,0,0,0,0|1,0,0]=3 22361 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Br 11a_100000209983_100000690891 [0,2,0,0,0,0|2,0,0]=4 22362 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Br 1626a_100000209983_100000690891 [0,2,0,0,0,0|2,0,0]=4 22363 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Br 240690a_100000209983_100000690891 [0,2,0,0,0,0|2,0,0]=4 22364 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Br 527a_100000209983_100000690891 [0,2,0,0,0,0|2,0,0]=4 22365 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)C 11a_100000209983_100000701904 [0,2,0,0,0,0|2,0,0]=4 22366 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)C 1626a_100000209983_100000701904 [0,2,0,0,0,0|2,0,0]=4 22367 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)C 240690a_100000209983_100000701904 [0,2,0,0,0,0|2,0,0]=4 22368 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)C 527a_100000209983_100000701904 [0,2,0,0,0,0|2,0,0]=4 22369 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Cl 11a_100000209983_100011253703 [0,2,0,0,0,0|2,0,0]=4 22370 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Cl 1626a_100000209983_100011253703 [0,2,0,0,0,0|2,0,0]=4 22371 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Cl 240690a_100000209983_100011253703 [0,2,0,0,0,0|2,0,0]=4 22372 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)Cl 527a_100000209983_100011253703 [0,2,0,0,0,0|2,0,0]=4 22373 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)F 11a_100000209983_100000752694 [0,2,0,0,0,0|2,0,0]=4 22374 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)F 1626a_100000209983_100000752694 [0,2,0,0,0,0|2,0,0]=4 22375 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)F 240690a_100000209983_100000752694 [0,2,0,0,0,0|2,0,0]=4 22376 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)F 527a_100000209983_100000752694 [0,2,0,0,0,0|2,0,0]=4 22377 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)O 240690a_100000209983_100011935254 [0,2,0,0,0,0|1,0,0]=3 22378 B16R1.106955 CCCCCNC(=O)c1c(cccc1Br)O 527a_100000209983_100011935254 [0,2,0,0,0,0|1,0,0]=3 22379 B16R1.106955 CCCCCNC(=O)c1c(cccc1C)C 11a_100000209983_100000758298 [0,2,0,0,0,0|2,0,0]=4 22380 B16R1.106955 CCCCCNC(=O)c1c(cccc1C)C 1626a_100000209983_100000758298 [0,2,0,0,0,0|2,0,0]=4 22381 B16R1.106955 CCCCCNC(=O)c1c(cccc1C)C 240690a_100000209983_100000758298 [0,2,0,0,0,0|2,0,0]=4 22382 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)C 11a_100000209983_100000692601 [0,2,0,0,0,0|2,0,0]=4 22383 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)C 1626a_100000209983_100000692601 [0,2,0,0,0,0|2,0,0]=4 22384 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)C 240690a_100000209983_100000692601 [0,2,0,0,0,0|2,0,0]=4 22385 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)Cl 11a_100000209983_100000210656 [0,2,0,0,0,0|2,0,0]=4 22386 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)Cl 1626a_100000209983_100000210656 [0,2,0,0,0,0|2,0,0]=4 22387 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)Cl 240690a_100000209983_100000210656 [0,2,0,0,0,0|2,0,0]=4 22388 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)F 11a_100000209983_100000210369 [0,2,0,0,0,0|2,0,0]=4 22389 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)F 1626a_100000209983_100000210369 [0,2,0,0,0,0|2,0,0]=4 22390 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)F 240690a_100000209983_100000210369 [0,2,0,0,0,0|2,0,0]=4 22391 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)F 527a_100000209983_100000210369 [0,2,0,0,0,0|2,0,0]=4 22392 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)O 240690a_100000209983_100000745519 [0,2,0,0,0,0|1,0,0]=3 22393 B16R1.106955 CCCCCNC(=O)c1c(cccc1Cl)O 527a_100000209983_100000745519 [0,2,0,0,0,0|1,0,0]=3 22394 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)C 11a_100000209983_100000762013 [0,2,0,0,0,0|2,0,0]=4 22395 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)C 1626a_100000209983_100000762013 [0,2,0,0,0,0|2,0,0]=4 22396 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)C 240690a_100000209983_100000762013 [0,2,0,0,0,0|2,0,0]=4 22397 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)C 527a_100000209983_100000762013 [0,2,0,0,0,0|2,0,0]=4 22398 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)F 11a_100000209983_100000210804 [0,2,0,0,0,0|2,0,0]=4 22399 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)F 1626a_100000209983_100000210804 [0,2,0,0,0,0|2,0,0]=4 22400 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)F 240690a_100000209983_100000210804 [0,2,0,0,0,0|2,0,0]=4 22401 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)F 527a_100000209983_100000210804 [0,2,0,0,0,0|2,0,0]=4 22402 B16R1.106955 CCCCCNC(=O)c1c(cccc1F)O 527a_100000209983_100000763259 [0,2,0,0,0,0|1,0,0]=3 22403 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Br 11a_100000209983_100010232521 [0,2,0,0,0,0|2,0,0]=4 22404 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Br 1626a_100000209983_100010232521 [0,2,0,0,0,0|2,0,0]=4 22405 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Br 240690a_100000209983_100010232521 [0,2,0,0,0,0|2,0,0]=4 22406 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Br 527a_100000209983_100010232521 [0,2,0,0,0,0|2,0,0]=4 22407 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)C 11a_100000209983_100000688020 [0,2,0,0,0,0|2,0,0]=4 22408 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)C 1626a_100000209983_100000688020 [0,2,0,0,0,0|2,0,0]=4 22409 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)C 240690a_100000209983_100000688020 [0,2,0,0,0,0|2,0,0]=4 22410 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Cl 11a_100000209983_100000702859 [0,2,0,0,0,0|2,0,0]=4 22411 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Cl 1626a_100000209983_100000702859 [0,2,0,0,0,0|2,0,0]=4 22412 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Cl 240690a_100000209983_100000702859 [0,2,0,0,0,0|2,0,0]=4 22413 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)Cl 527a_100000209983_100000702859 [0,2,0,0,0,0|2,0,0]=4 22414 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)F 11a_100000209983_100000023732 [0,2,0,0,0,0|2,0,0]=4 22415 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)F 1626a_100000209983_100000023732 [0,2,0,0,0,0|2,0,0]=4 22416 B16R1.106955 CCCCCNC(=O)c1c(cccc1I)F 240690a_100000209983_100000023732 [0,2,0,0,0,0|2,0,0]=4 22417 B16R1.106955 CCCCCNC(=O)c1c(cccc1O)O 527a_100000209983_100000755285 [0,2,0,0,0,0|1,0,0]=3 22418 B16R1.106955 CCCCNCC(=O)c1c(cccc1Cl)Cl 2230a_100000102301_100012340516 [0,2,0,0,0,0|2,0,0]=4 22419 B16R1.106955 CCCCNCC(=O)c1c(cccc1Cl)F 2230a_100000102301_100011219195 [0,2,0,0,0,0|2,0,0]=4 22420 B16R1.106955 CCCCNN=C(C)c1c(cccc1Br)O 4a_100025702795_100010174959 [0,2,0,0,0,0|2,0,0]=4 22421 B16R1.106955 CCCCNN=C(C)c1c(cccc1Cl)O 4a_100025702795_100000730630 [0,2,0,0,0,0|2,0,0]=4 22422 B16R1.106955 CCCCNN=C(C)c1c(cccc1F)O 4a_100025702795_100011216272 [0,2,0,0,0,0|2,0,0]=4 22423 B16R1.106955 CCCCNN=C(C)c1c(cccc1O)C 4a_100025702795_100009860897 [0,2,0,0,0,0|2,0,0]=4 22424 B16R1.106955 CCCCNN=C(C)c1c(cccc1O)O 4a_100025702795_100000691522 [0,2,0,0,0,0|2,0,0]=4 22425 B16R1.106955 CCCCNNC(=O)c1c(cccc1Br)Br 22a_100025702795_100000690891 [0,2,0,0,0,0|2,0,0]=4 22426 B16R1.106955 CCCCNNC(=O)c1c(cccc1Br)C 22a_100025702795_100000701904 [0,2,0,0,0,0|2,0,0]=4 22427 B16R1.106955 CCCCNNC(=O)c1c(cccc1Br)Cl 22a_100025702795_100011253703 [0,2,0,0,0,0|2,0,0]=4 22428 B16R1.106955 CCCCNNC(=O)c1c(cccc1Br)F 22a_100025702795_100000752694 [0,2,0,0,0,0|2,0,0]=4 22429 B16R1.106955 CCCCNNC(=O)c1c(cccc1Br)O 22a_100025702795_100011935254 [0,2,0,0,0,0|1,0,0]=3 22430 B16R1.106955 CCCCNNC(=O)c1c(cccc1C)C 22a_100025702795_100000758298 [0,2,0,0,0,0|2,0,0]=4 22431 B16R1.106955 CCCCNNC(=O)c1c(cccc1Cl)C 22a_100025702795_100000692601 [0,2,0,0,0,0|2,0,0]=4 22432 B16R1.106955 CCCCNNC(=O)c1c(cccc1Cl)Cl 22a_100025702795_100000210656 [0,2,0,0,0,0|2,0,0]=4 22433 B16R1.106955 CCCCNNC(=O)c1c(cccc1Cl)F 22a_100025702795_100000210369 [0,2,0,0,0,0|2,0,0]=4 22434 B16R1.106955 CCCCNNC(=O)c1c(cccc1Cl)O 22a_100025702795_100000745519 [0,2,0,0,0,0|1,0,0]=3 22435 B16R1.106955 CCCCNNC(=O)c1c(cccc1F)C 22a_100025702795_100000762013 [0,2,0,0,0,0|2,0,0]=4 22436 B16R1.106955 CCCCNNC(=O)c1c(cccc1F)F 22a_100025702795_100000210804 [0,2,0,0,0,0|2,0,0]=4 22437 B16R1.106955 CCCCNNC(=O)c1c(cccc1F)O 22a_100025702795_100000763259 [0,2,0,0,0,0|1,0,0]=3 22438 B16R1.106955 CCCCNNC(=O)c1c(cccc1I)Br 22a_100025702795_100010232521 [0,2,0,0,0,0|2,0,0]=4 22439 B16R1.106955 CCCCNNC(=O)c1c(cccc1I)C 22a_100025702795_100000688020 [0,2,0,0,0,0|2,0,0]=4 22440 B16R1.106955 CCCCNNC(=O)c1c(cccc1I)Cl 22a_100025702795_100000702859 [0,2,0,0,0,0|2,0,0]=4 22441 B16R1.106955 CCCCNNC(=O)c1c(cccc1I)F 22a_100025702795_100000023732 [0,2,0,0,0,0|2,0,0]=4 22442 B16R1.106955 CCCCNNC(=O)c1c(cccc1O)C 22a_100025702795_100011934116 [0,2,0,0,0,0|1,0,0]=3 22443 B16R1.106955 CCCCOCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011995733 [0,2,0,0,0,0|1,0,0]=3 22444 B16R1.106955 CCCCOCC(=O)c1c(cccc1Br)C 1458a_100000701904_100011995733 [0,2,0,0,0,0|1,0,0]=3 22445 B16R1.106955 CCCCOCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011995733 [0,2,0,0,0,0|1,0,0]=3 22446 B16R1.106955 CCCCOCC(=O)c1c(cccc1Br)F 1458a_100000752694_100011995733 [0,2,0,0,0,0|1,0,0]=3 22447 B16R1.106955 CCCCOCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011995733 [0,2,0,0,0,0|0,0,0]=2 22448 B16R1.106955 CCCCOCC(=O)c1c(cccc1C)C 1458a_100000758298_100011995733 [0,2,0,0,0,0|1,0,0]=3 22449 B16R1.106955 CCCCOCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100011995733 [0,2,0,0,0,0|1,0,0]=3 22450 B16R1.106955 CCCCOCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011995733 [0,2,0,0,0,0|1,0,0]=3 22451 B16R1.106955 CCCCOCC(=O)c1c(cccc1Cl)Cl 34a_100000210227_100012340516 [0,2,0,0,0,0|1,0,0]=3 22452 B16R1.106955 CCCCOCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011995733 [0,2,0,0,0,0|1,0,0]=3 22453 B16R1.106955 CCCCOCC(=O)c1c(cccc1Cl)F 34a_100000210227_100011219195 [0,2,0,0,0,0|1,0,0]=3 22454 B16R1.106955 CCCCOCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011995733 [0,2,0,0,0,0|0,0,0]=2 22455 B16R1.106955 CCCCOCC(=O)c1c(cccc1F)C 1458a_100000762013_100011995733 [0,2,0,0,0,0|1,0,0]=3 22456 B16R1.106955 CCCCOCC(=O)c1c(cccc1F)F 1458a_100000210804_100011995733 [0,2,0,0,0,0|1,0,0]=3 22457 B16R1.106955 CCCCOCC(=O)c1c(cccc1F)F 34a_100000210227_100000199083 [0,2,0,0,0,0|1,0,0]=3 22458 B16R1.106955 CCCCOCC(=O)c1c(cccc1F)O 1458a_100000763259_100011995733 [0,2,0,0,0,0|0,0,0]=2 22459 B16R1.106955 CCCCOCC(=O)c1c(cccc1I)Br 1458a_100010232521_100011995733 [0,2,0,0,0,0|1,0,0]=3 22460 B16R1.106955 CCCCOCC(=O)c1c(cccc1I)C 1458a_100000688020_100011995733 [0,2,0,0,0,0|1,0,0]=3 22461 B16R1.106955 CCCCOCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011995733 [0,2,0,0,0,0|1,0,0]=3 22462 B16R1.106955 CCCCOCC(=O)c1c(cccc1I)F 1458a_100000023732_100011995733 [0,2,0,0,0,0|1,0,0]=3 22463 B16R1.106955 CCCCOCC(=O)c1c(cccc1O)C 1458a_100011934116_100011995733 [0,2,0,0,0,0|0,0,0]=2 22464 B16R1.106955 CCCCOCC(=O)c1c(cccc1O)O 1458a_100000755285_100011995733 [0,2,0,0,0,0|0,0,0]=2 22465 B16R1.106955 CCCCSCC(=O)c1c(cccc1Cl)Cl 62a_100012340516_100000210210 [0,2,0,0,0,0|1,1,0]=4 22466 B16R1.106955 CCCCSCC(=O)c1c(cccc1Cl)F 62a_100000210211_100011219195 [0,2,0,0,0,0|1,1,0]=4 22467 B16R1.106955 CCCCSCC(=O)c1c(cccc1Cl)F 62a_100011219195_100000210210 [0,2,0,0,0,0|1,1,0]=4 22468 B16R1.106955 CCCCSCC(=O)c1c(cccc1F)F 62a_100000199083_100000210210 [0,2,0,0,0,0|1,1,0]=4 22469 B16R1.106955 CCCCSCC(=O)c1c(cccc1F)F 62a_100000210211_100000199083 [0,2,0,0,0,0|1,1,0]=4 22470 B16R1.106955 CCCOCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011215938 [0,2,0,0,0,0|2,0,0]=4 22471 B16R1.106955 CCCOCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100011215938 [0,2,0,0,0,0|2,0,0]=4 22472 B16R1.106955 CCCOCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011215938 [0,2,0,0,0,0|2,0,0]=4 22473 B16R1.106955 CCCOCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100011215938 [0,2,0,0,0,0|2,0,0]=4 22474 B16R1.106955 CCCOCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215938 [0,2,0,0,0,0|1,0,0]=3 22475 B16R1.106955 CCCOCCC(=O)c1c(cccc1C)C 1458a_100000758298_100011215938 [0,2,0,0,0,0|2,0,0]=4 22476 B16R1.106955 CCCOCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100011215938 [0,2,0,0,0,0|2,0,0]=4 22477 B16R1.106955 CCCOCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011215938 [0,2,0,0,0,0|2,0,0]=4 22478 B16R1.106955 CCCOCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011215938 [0,2,0,0,0,0|2,0,0]=4 22479 B16R1.106955 CCCOCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215938 [0,2,0,0,0,0|1,0,0]=3 22480 B16R1.106955 CCCOCCC(=O)c1c(cccc1F)C 1458a_100000762013_100011215938 [0,2,0,0,0,0|2,0,0]=4 22481 B16R1.106955 CCCOCCC(=O)c1c(cccc1F)F 1458a_100000210804_100011215938 [0,2,0,0,0,0|2,0,0]=4 22482 B16R1.106955 CCCOCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215938 [0,2,0,0,0,0|1,0,0]=3 22483 B16R1.106955 CCCOCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100011215938 [0,2,0,0,0,0|2,0,0]=4 22484 B16R1.106955 CCCOCCC(=O)c1c(cccc1I)C 1458a_100000688020_100011215938 [0,2,0,0,0,0|2,0,0]=4 22485 B16R1.106955 CCCOCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011215938 [0,2,0,0,0,0|2,0,0]=4 22486 B16R1.106955 CCCOCCC(=O)c1c(cccc1I)F 1458a_100000023732_100011215938 [0,2,0,0,0,0|2,0,0]=4 22487 B16R1.106955 CCCOCCC(=O)c1c(cccc1O)C 1458a_100011934116_100011215938 [0,2,0,0,0,0|1,0,0]=3 22488 B16R1.106955 CCCOCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215938 [0,2,0,0,0,0|1,0,0]=3 22489 B16R1.106955 CCOCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100012232248 [0,2,0,0,0,0|2,0,0]=4 22490 B16R1.106955 CCOCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100012232248 [0,2,0,0,0,0|2,0,0]=4 22491 B16R1.106955 CCOCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100012232248 [0,2,0,0,0,0|2,0,0]=4 22492 B16R1.106955 CCOCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100012232248 [0,2,0,0,0,0|2,0,0]=4 22493 B16R1.106955 CCOCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100012232248 [0,2,0,0,0,0|1,0,0]=3 22494 B16R1.106955 CCOCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100012232248 [0,2,0,0,0,0|2,0,0]=4 22495 B16R1.106955 CCOCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100012232248 [0,2,0,0,0,0|2,0,0]=4 22496 B16R1.106955 CCOCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100012232248 [0,2,0,0,0,0|2,0,0]=4 22497 B16R1.106955 CCOCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100012232248 [0,2,0,0,0,0|2,0,0]=4 22498 B16R1.106955 CCOCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100012232248 [0,2,0,0,0,0|1,0,0]=3 22499 B16R1.106955 CCOCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100012232248 [0,2,0,0,0,0|2,0,0]=4 22500 B16R1.106955 CCOCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100012232248 [0,2,0,0,0,0|2,0,0]=4 22501 B16R1.106955 CCOCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100012232248 [0,2,0,0,0,0|1,0,0]=3 22502 B16R1.106955 CCOCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100012232248 [0,2,0,0,0,0|2,0,0]=4 22503 B16R1.106955 CCOCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100012232248 [0,2,0,0,0,0|2,0,0]=4 22504 B16R1.106955 CCOCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100012232248 [0,2,0,0,0,0|2,0,0]=4 22505 B16R1.106955 CCOCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100012232248 [0,2,0,0,0,0|2,0,0]=4 22506 B16R1.106955 CCOCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100012232248 [0,2,0,0,0,0|1,0,0]=3 22507 B16R1.106955 CCOCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100012232248 [0,2,0,0,0,0|1,0,0]=3 22508 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Br 11a_100011200944_100000690891 [0,2,0,0,0,0|2,0,0]=4 22509 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Br 1626a_102516460346_100000690891 [0,2,0,0,0,0|2,0,0]=4 22510 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Br 240690a_100011200944_100000690891 [0,2,0,0,0,0|2,0,0]=4 22511 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Br 527a_100011200944_100000690891 [0,2,0,0,0,0|2,0,0]=4 22512 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)C 11a_100011200944_100000701904 [0,2,0,0,0,0|2,0,0]=4 22513 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)C 1626a_102516460346_100000701904 [0,2,0,0,0,0|2,0,0]=4 22514 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)C 240690a_100011200944_100000701904 [0,2,0,0,0,0|2,0,0]=4 22515 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)C 527a_100011200944_100000701904 [0,2,0,0,0,0|2,0,0]=4 22516 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Cl 11a_100011200944_100011253703 [0,2,0,0,0,0|2,0,0]=4 22517 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Cl 1626a_102516460346_100011253703 [0,2,0,0,0,0|2,0,0]=4 22518 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Cl 240690a_100011200944_100011253703 [0,2,0,0,0,0|2,0,0]=4 22519 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)Cl 527a_100011200944_100011253703 [0,2,0,0,0,0|2,0,0]=4 22520 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)F 11a_100011200944_100000752694 [0,2,0,0,0,0|2,0,0]=4 22521 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)F 1626a_102516460346_100000752694 [0,2,0,0,0,0|2,0,0]=4 22522 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)F 240690a_100011200944_100000752694 [0,2,0,0,0,0|2,0,0]=4 22523 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)F 527a_100011200944_100000752694 [0,2,0,0,0,0|2,0,0]=4 22524 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)O 240690a_100011200944_100011935254 [0,2,0,0,0,0|1,0,0]=3 22525 B16R1.106955 CCOCCNC(=O)c1c(cccc1Br)O 527a_100011200944_100011935254 [0,2,0,0,0,0|1,0,0]=3 22526 B16R1.106955 CCOCCNC(=O)c1c(cccc1C)C 11a_100011200944_100000758298 [0,2,0,0,0,0|2,0,0]=4 22527 B16R1.106955 CCOCCNC(=O)c1c(cccc1C)C 1626a_102516460346_100000758298 [0,2,0,0,0,0|2,0,0]=4 22528 B16R1.106955 CCOCCNC(=O)c1c(cccc1C)C 240690a_100011200944_100000758298 [0,2,0,0,0,0|2,0,0]=4 22529 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)C 11a_100011200944_100000692601 [0,2,0,0,0,0|2,0,0]=4 22530 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)C 1626a_102516460346_100000692601 [0,2,0,0,0,0|2,0,0]=4 22531 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)C 240690a_100011200944_100000692601 [0,2,0,0,0,0|2,0,0]=4 22532 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)Cl 11a_100011200944_100000210656 [0,2,0,0,0,0|2,0,0]=4 22533 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)Cl 1626a_102516460346_100000210656 [0,2,0,0,0,0|2,0,0]=4 22534 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)Cl 240690a_100011200944_100000210656 [0,2,0,0,0,0|2,0,0]=4 22535 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)F 11a_100011200944_100000210369 [0,2,0,0,0,0|2,0,0]=4 22536 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)F 1626a_102516460346_100000210369 [0,2,0,0,0,0|2,0,0]=4 22537 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)F 240690a_100011200944_100000210369 [0,2,0,0,0,0|2,0,0]=4 22538 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)F 527a_100011200944_100000210369 [0,2,0,0,0,0|2,0,0]=4 22539 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)O 240690a_100011200944_100000745519 [0,2,0,0,0,0|1,0,0]=3 22540 B16R1.106955 CCOCCNC(=O)c1c(cccc1Cl)O 527a_100011200944_100000745519 [0,2,0,0,0,0|1,0,0]=3 22541 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)C 11a_100011200944_100000762013 [0,2,0,0,0,0|2,0,0]=4 22542 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)C 1626a_102516460346_100000762013 [0,2,0,0,0,0|2,0,0]=4 22543 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)C 240690a_100011200944_100000762013 [0,2,0,0,0,0|2,0,0]=4 22544 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)C 527a_100011200944_100000762013 [0,2,0,0,0,0|2,0,0]=4 22545 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)F 11a_100011200944_100000210804 [0,2,0,0,0,0|2,0,0]=4 22546 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)F 1626a_102516460346_100000210804 [0,2,0,0,0,0|2,0,0]=4 22547 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)F 240690a_100011200944_100000210804 [0,2,0,0,0,0|2,0,0]=4 22548 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)F 527a_100011200944_100000210804 [0,2,0,0,0,0|2,0,0]=4 22549 B16R1.106955 CCOCCNC(=O)c1c(cccc1F)O 527a_100011200944_100000763259 [0,2,0,0,0,0|1,0,0]=3 22550 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Br 11a_100011200944_100010232521 [0,2,0,0,0,0|2,0,0]=4 22551 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Br 1626a_102516460346_100010232521 [0,2,0,0,0,0|2,0,0]=4 22552 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Br 240690a_100011200944_100010232521 [0,2,0,0,0,0|2,0,0]=4 22553 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Br 527a_100011200944_100010232521 [0,2,0,0,0,0|2,0,0]=4 22554 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)C 11a_100011200944_100000688020 [0,2,0,0,0,0|2,0,0]=4 22555 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)C 1626a_102516460346_100000688020 [0,2,0,0,0,0|2,0,0]=4 22556 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)C 240690a_100011200944_100000688020 [0,2,0,0,0,0|2,0,0]=4 22557 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Cl 11a_100011200944_100000702859 [0,2,0,0,0,0|2,0,0]=4 22558 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Cl 1626a_102516460346_100000702859 [0,2,0,0,0,0|2,0,0]=4 22559 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Cl 240690a_100011200944_100000702859 [0,2,0,0,0,0|2,0,0]=4 22560 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)Cl 527a_100011200944_100000702859 [0,2,0,0,0,0|2,0,0]=4 22561 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)F 11a_100011200944_100000023732 [0,2,0,0,0,0|2,0,0]=4 22562 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)F 1626a_102516460346_100000023732 [0,2,0,0,0,0|2,0,0]=4 22563 B16R1.106955 CCOCCNC(=O)c1c(cccc1I)F 240690a_100011200944_100000023732 [0,2,0,0,0,0|2,0,0]=4 22564 B16R1.106955 CCOCCNC(=O)c1c(cccc1O)O 527a_100011200944_100000755285 [0,2,0,0,0,0|1,0,0]=3 22565 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Br 11a_100000106463_100000690891 [0,2,0,0,0,0|2,0,0]=4 22566 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Br 1626a_100000106463_100000690891 [0,2,0,0,0,0|2,0,0]=4 22567 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Br 240690a_100000106463_100000690891 [0,2,0,0,0,0|2,0,0]=4 22568 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Br 527a_100000106463_100000690891 [0,2,0,0,0,0|2,0,0]=4 22569 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)C 11a_100000106463_100000701904 [0,2,0,0,0,0|2,0,0]=4 22570 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)C 1626a_100000106463_100000701904 [0,2,0,0,0,0|2,0,0]=4 22571 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)C 240690a_100000106463_100000701904 [0,2,0,0,0,0|2,0,0]=4 22572 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)C 527a_100000106463_100000701904 [0,2,0,0,0,0|2,0,0]=4 22573 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Cl 11a_100000106463_100011253703 [0,2,0,0,0,0|2,0,0]=4 22574 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Cl 1626a_100000106463_100011253703 [0,2,0,0,0,0|2,0,0]=4 22575 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Cl 240690a_100000106463_100011253703 [0,2,0,0,0,0|2,0,0]=4 22576 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)Cl 527a_100000106463_100011253703 [0,2,0,0,0,0|2,0,0]=4 22577 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)F 11a_100000106463_100000752694 [0,2,0,0,0,0|2,0,0]=4 22578 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)F 1626a_100000106463_100000752694 [0,2,0,0,0,0|2,0,0]=4 22579 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)F 240690a_100000106463_100000752694 [0,2,0,0,0,0|2,0,0]=4 22580 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)F 527a_100000106463_100000752694 [0,2,0,0,0,0|2,0,0]=4 22581 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)O 240690a_100000106463_100011935254 [0,2,0,0,0,0|1,0,0]=3 22582 B16R1.106955 CCSCCNC(=O)c1c(cccc1Br)O 527a_100000106463_100011935254 [0,2,0,0,0,0|1,0,0]=3 22583 B16R1.106955 CCSCCNC(=O)c1c(cccc1C)C 11a_100000106463_100000758298 [0,2,0,0,0,0|2,0,0]=4 22584 B16R1.106955 CCSCCNC(=O)c1c(cccc1C)C 1626a_100000106463_100000758298 [0,2,0,0,0,0|2,0,0]=4 22585 B16R1.106955 CCSCCNC(=O)c1c(cccc1C)C 240690a_100000106463_100000758298 [0,2,0,0,0,0|2,0,0]=4 22586 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)C 11a_100000106463_100000692601 [0,2,0,0,0,0|2,0,0]=4 22587 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)C 1626a_100000106463_100000692601 [0,2,0,0,0,0|2,0,0]=4 22588 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)C 240690a_100000106463_100000692601 [0,2,0,0,0,0|2,0,0]=4 22589 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)Cl 11a_100000106463_100000210656 [0,2,0,0,0,0|2,0,0]=4 22590 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)Cl 1626a_100000106463_100000210656 [0,2,0,0,0,0|2,0,0]=4 22591 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)Cl 240690a_100000106463_100000210656 [0,2,0,0,0,0|2,0,0]=4 22592 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)F 11a_100000106463_100000210369 [0,2,0,0,0,0|2,0,0]=4 22593 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)F 1626a_100000106463_100000210369 [0,2,0,0,0,0|2,0,0]=4 22594 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)F 240690a_100000106463_100000210369 [0,2,0,0,0,0|2,0,0]=4 22595 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)F 527a_100000106463_100000210369 [0,2,0,0,0,0|2,0,0]=4 22596 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)O 240690a_100000106463_100000745519 [0,2,0,0,0,0|1,0,0]=3 22597 B16R1.106955 CCSCCNC(=O)c1c(cccc1Cl)O 527a_100000106463_100000745519 [0,2,0,0,0,0|1,0,0]=3 22598 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)C 11a_100000106463_100000762013 [0,2,0,0,0,0|2,0,0]=4 22599 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)C 1626a_100000106463_100000762013 [0,2,0,0,0,0|2,0,0]=4 22600 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)C 240690a_100000106463_100000762013 [0,2,0,0,0,0|2,0,0]=4 22601 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)C 527a_100000106463_100000762013 [0,2,0,0,0,0|2,0,0]=4 22602 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)F 11a_100000106463_100000210804 [0,2,0,0,0,0|2,0,0]=4 22603 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)F 1626a_100000106463_100000210804 [0,2,0,0,0,0|2,0,0]=4 22604 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)F 240690a_100000106463_100000210804 [0,2,0,0,0,0|2,0,0]=4 22605 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)F 527a_100000106463_100000210804 [0,2,0,0,0,0|2,0,0]=4 22606 B16R1.106955 CCSCCNC(=O)c1c(cccc1F)O 527a_100000106463_100000763259 [0,2,0,0,0,0|1,0,0]=3 22607 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Br 11a_100000106463_100010232521 [0,2,0,0,0,0|2,0,0]=4 22608 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Br 1626a_100000106463_100010232521 [0,2,0,0,0,0|2,0,0]=4 22609 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Br 240690a_100000106463_100010232521 [0,2,0,0,0,0|2,0,0]=4 22610 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Br 527a_100000106463_100010232521 [0,2,0,0,0,0|2,0,0]=4 22611 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)C 11a_100000106463_100000688020 [0,2,0,0,0,0|2,0,0]=4 22612 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)C 1626a_100000106463_100000688020 [0,2,0,0,0,0|2,0,0]=4 22613 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)C 240690a_100000106463_100000688020 [0,2,0,0,0,0|2,0,0]=4 22614 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Cl 11a_100000106463_100000702859 [0,2,0,0,0,0|2,0,0]=4 22615 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Cl 1626a_100000106463_100000702859 [0,2,0,0,0,0|2,0,0]=4 22616 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Cl 240690a_100000106463_100000702859 [0,2,0,0,0,0|2,0,0]=4 22617 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)Cl 527a_100000106463_100000702859 [0,2,0,0,0,0|2,0,0]=4 22618 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)F 11a_100000106463_100000023732 [0,2,0,0,0,0|2,0,0]=4 22619 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)F 1626a_100000106463_100000023732 [0,2,0,0,0,0|2,0,0]=4 22620 B16R1.106955 CCSCCNC(=O)c1c(cccc1I)F 240690a_100000106463_100000023732 [0,2,0,0,0,0|2,0,0]=4 22621 B16R1.106955 CCSCCNC(=O)c1c(cccc1O)O 527a_100000106463_100000755285 [0,2,0,0,0,0|1,0,0]=3 22622 B16R1.106955 COCCCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000755781 [0,2,0,0,0,0|2,0,0]=4 22623 B16R1.106955 COCCCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000755781 [0,2,0,0,0,0|2,0,0]=4 22624 B16R1.106955 COCCCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000755781 [0,2,0,0,0,0|2,0,0]=4 22625 B16R1.106955 COCCCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000755781 [0,2,0,0,0,0|2,0,0]=4 22626 B16R1.106955 COCCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000755781 [0,2,0,0,0,0|1,0,0]=3 22627 B16R1.106955 COCCCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000755781 [0,2,0,0,0,0|2,0,0]=4 22628 B16R1.106955 COCCCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000755781 [0,2,0,0,0,0|2,0,0]=4 22629 B16R1.106955 COCCCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000755781 [0,2,0,0,0,0|2,0,0]=4 22630 B16R1.106955 COCCCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000755781 [0,2,0,0,0,0|2,0,0]=4 22631 B16R1.106955 COCCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000755781 [0,2,0,0,0,0|1,0,0]=3 22632 B16R1.106955 COCCCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000755781 [0,2,0,0,0,0|2,0,0]=4 22633 B16R1.106955 COCCCCC(=O)c1c(cccc1F)F 1458a_100000210804_100000755781 [0,2,0,0,0,0|2,0,0]=4 22634 B16R1.106955 COCCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000755781 [0,2,0,0,0,0|1,0,0]=3 22635 B16R1.106955 COCCCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000755781 [0,2,0,0,0,0|2,0,0]=4 22636 B16R1.106955 COCCCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000755781 [0,2,0,0,0,0|2,0,0]=4 22637 B16R1.106955 COCCCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000755781 [0,2,0,0,0,0|2,0,0]=4 22638 B16R1.106955 COCCCCC(=O)c1c(cccc1I)F 1458a_100000023732_100000755781 [0,2,0,0,0,0|2,0,0]=4 22639 B16R1.106955 COCCCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000755781 [0,2,0,0,0,0|1,0,0]=3 22640 B16R1.106955 COCCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000755781 [0,2,0,0,0,0|1,0,0]=3 22641 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)Br 1626a_100150723488_100000690891 [0,2,0,0,0,0|2,0,0]=4 22642 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)Br 240690a_100150723488_100000690891 [0,2,0,0,0,0|2,0,0]=4 22643 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)Br 527a_100150723488_100000690891 [0,2,0,0,0,0|2,0,0]=4 22644 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)C 1626a_100150723488_100000701904 [0,2,0,0,0,0|2,0,0]=4 22645 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)C 240690a_100150723488_100000701904 [0,2,0,0,0,0|2,0,0]=4 22646 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)C 527a_100150723488_100000701904 [0,2,0,0,0,0|2,0,0]=4 22647 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)Cl 1626a_100150723488_100011253703 [0,2,0,0,0,0|2,0,0]=4 22648 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)Cl 240690a_100150723488_100011253703 [0,2,0,0,0,0|2,0,0]=4 22649 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)Cl 527a_100150723488_100011253703 [0,2,0,0,0,0|2,0,0]=4 22650 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)F 1626a_100150723488_100000752694 [0,2,0,0,0,0|2,0,0]=4 22651 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)F 240690a_100150723488_100000752694 [0,2,0,0,0,0|2,0,0]=4 22652 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)F 527a_100150723488_100000752694 [0,2,0,0,0,0|2,0,0]=4 22653 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)O 240690a_100150723488_100011935254 [0,2,0,0,0,0|1,0,0]=3 22654 B16R1.106955 COCCCNC(=O)c1c(cccc1Br)O 527a_100150723488_100011935254 [0,2,0,0,0,0|1,0,0]=3 22655 B16R1.106955 COCCCNC(=O)c1c(cccc1C)C 1626a_100150723488_100000758298 [0,2,0,0,0,0|2,0,0]=4 22656 B16R1.106955 COCCCNC(=O)c1c(cccc1C)C 240690a_100150723488_100000758298 [0,2,0,0,0,0|2,0,0]=4 22657 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)C 1626a_100150723488_100000692601 [0,2,0,0,0,0|2,0,0]=4 22658 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)C 240690a_100150723488_100000692601 [0,2,0,0,0,0|2,0,0]=4 22659 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)Cl 1626a_100150723488_100000210656 [0,2,0,0,0,0|2,0,0]=4 22660 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)Cl 240690a_100150723488_100000210656 [0,2,0,0,0,0|2,0,0]=4 22661 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)F 1626a_100150723488_100000210369 [0,2,0,0,0,0|2,0,0]=4 22662 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)F 240690a_100150723488_100000210369 [0,2,0,0,0,0|2,0,0]=4 22663 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)F 527a_100150723488_100000210369 [0,2,0,0,0,0|2,0,0]=4 22664 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)O 240690a_100150723488_100000745519 [0,2,0,0,0,0|1,0,0]=3 22665 B16R1.106955 COCCCNC(=O)c1c(cccc1Cl)O 527a_100150723488_100000745519 [0,2,0,0,0,0|1,0,0]=3 22666 B16R1.106955 COCCCNC(=O)c1c(cccc1F)C 1626a_100150723488_100000762013 [0,2,0,0,0,0|2,0,0]=4 22667 B16R1.106955 COCCCNC(=O)c1c(cccc1F)C 240690a_100150723488_100000762013 [0,2,0,0,0,0|2,0,0]=4 22668 B16R1.106955 COCCCNC(=O)c1c(cccc1F)C 527a_100150723488_100000762013 [0,2,0,0,0,0|2,0,0]=4 22669 B16R1.106955 COCCCNC(=O)c1c(cccc1F)F 1626a_100150723488_100000210804 [0,2,0,0,0,0|2,0,0]=4 22670 B16R1.106955 COCCCNC(=O)c1c(cccc1F)F 240690a_100150723488_100000210804 [0,2,0,0,0,0|2,0,0]=4 22671 B16R1.106955 COCCCNC(=O)c1c(cccc1F)F 527a_100150723488_100000210804 [0,2,0,0,0,0|2,0,0]=4 22672 B16R1.106955 COCCCNC(=O)c1c(cccc1F)O 527a_100150723488_100000763259 [0,2,0,0,0,0|1,0,0]=3 22673 B16R1.106955 COCCCNC(=O)c1c(cccc1I)Br 1626a_100150723488_100010232521 [0,2,0,0,0,0|2,0,0]=4 22674 B16R1.106955 COCCCNC(=O)c1c(cccc1I)Br 240690a_100150723488_100010232521 [0,2,0,0,0,0|2,0,0]=4 22675 B16R1.106955 COCCCNC(=O)c1c(cccc1I)Br 527a_100150723488_100010232521 [0,2,0,0,0,0|2,0,0]=4 22676 B16R1.106955 COCCCNC(=O)c1c(cccc1I)C 1626a_100150723488_100000688020 [0,2,0,0,0,0|2,0,0]=4 22677 B16R1.106955 COCCCNC(=O)c1c(cccc1I)C 240690a_100150723488_100000688020 [0,2,0,0,0,0|2,0,0]=4 22678 B16R1.106955 COCCCNC(=O)c1c(cccc1I)Cl 1626a_100150723488_100000702859 [0,2,0,0,0,0|2,0,0]=4 22679 B16R1.106955 COCCCNC(=O)c1c(cccc1I)Cl 240690a_100150723488_100000702859 [0,2,0,0,0,0|2,0,0]=4 22680 B16R1.106955 COCCCNC(=O)c1c(cccc1I)Cl 527a_100150723488_100000702859 [0,2,0,0,0,0|2,0,0]=4 22681 B16R1.106955 COCCCNC(=O)c1c(cccc1I)F 1626a_100150723488_100000023732 [0,2,0,0,0,0|2,0,0]=4 22682 B16R1.106955 COCCCNC(=O)c1c(cccc1I)F 240690a_100150723488_100000023732 [0,2,0,0,0,0|2,0,0]=4 22683 B16R1.106955 COCCCNC(=O)c1c(cccc1O)O 527a_100150723488_100000755285 [0,2,0,0,0,0|1,0,0]=3 22684 B16R1.106955 COCCNNC(=O)c1c(cccc1Br)O 22a_100000741390_100011935254 [0,2,0,0,0,0|2,0,0]=4 22685 B16R1.106955 COCCNNC(=O)c1c(cccc1Cl)O 22a_100000741390_100000745519 [0,2,0,0,0,0|2,0,0]=4 22686 B16R1.106955 COCCNNC(=O)c1c(cccc1F)O 22a_100000741390_100000763259 [0,2,0,0,0,0|2,0,0]=4 22687 B16R1.106955 COCCNNC(=O)c1c(cccc1O)C 22a_100000741390_100011934116 [0,2,0,0,0,0|2,0,0]=4 22688 B16R1.106955 COCCOCC(=O)c1c(cccc1Cl)Cl 34a_100000210237_100012340516 [0,2,0,0,0,0|2,0,0]=4 22689 B16R1.106955 COCCOCC(=O)c1c(cccc1Cl)F 34a_100000210237_100011219195 [0,2,0,0,0,0|2,0,0]=4 22690 B16R1.106955 COCCOCC(=O)c1c(cccc1F)F 34a_100000210237_100000199083 [0,2,0,0,0,0|2,0,0]=4 22691 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Br 11a_100000749238_100000690891 [0,2,0,0,0,0|2,0,0]=4 22692 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Br 1626a_100000749238_100000690891 [0,2,0,0,0,0|2,0,0]=4 22693 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Br 240690a_100000749238_100000690891 [0,2,0,0,0,0|2,0,0]=4 22694 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Br 527a_100000749238_100000690891 [0,2,0,0,0,0|2,0,0]=4 22695 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)C 11a_100000749238_100000701904 [0,2,0,0,0,0|2,0,0]=4 22696 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)C 1626a_100000749238_100000701904 [0,2,0,0,0,0|2,0,0]=4 22697 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)C 240690a_100000749238_100000701904 [0,2,0,0,0,0|2,0,0]=4 22698 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)C 527a_100000749238_100000701904 [0,2,0,0,0,0|2,0,0]=4 22699 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Cl 11a_100000749238_100011253703 [0,2,0,0,0,0|2,0,0]=4 22700 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Cl 1626a_100000749238_100011253703 [0,2,0,0,0,0|2,0,0]=4 22701 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Cl 240690a_100000749238_100011253703 [0,2,0,0,0,0|2,0,0]=4 22702 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)Cl 527a_100000749238_100011253703 [0,2,0,0,0,0|2,0,0]=4 22703 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)F 11a_100000749238_100000752694 [0,2,0,0,0,0|2,0,0]=4 22704 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)F 1626a_100000749238_100000752694 [0,2,0,0,0,0|2,0,0]=4 22705 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)F 240690a_100000749238_100000752694 [0,2,0,0,0,0|2,0,0]=4 22706 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)F 527a_100000749238_100000752694 [0,2,0,0,0,0|2,0,0]=4 22707 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)O 240690a_100000749238_100011935254 [0,2,0,0,0,0|1,0,0]=3 22708 B16R1.106955 CSCCCNC(=O)c1c(cccc1Br)O 527a_100000749238_100011935254 [0,2,0,0,0,0|1,0,0]=3 22709 B16R1.106955 CSCCCNC(=O)c1c(cccc1C)C 11a_100000749238_100000758298 [0,2,0,0,0,0|2,0,0]=4 22710 B16R1.106955 CSCCCNC(=O)c1c(cccc1C)C 1626a_100000749238_100000758298 [0,2,0,0,0,0|2,0,0]=4 22711 B16R1.106955 CSCCCNC(=O)c1c(cccc1C)C 240690a_100000749238_100000758298 [0,2,0,0,0,0|2,0,0]=4 22712 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)C 11a_100000749238_100000692601 [0,2,0,0,0,0|2,0,0]=4 22713 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)C 1626a_100000749238_100000692601 [0,2,0,0,0,0|2,0,0]=4 22714 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)C 240690a_100000749238_100000692601 [0,2,0,0,0,0|2,0,0]=4 22715 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)Cl 11a_100000749238_100000210656 [0,2,0,0,0,0|2,0,0]=4 22716 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)Cl 1626a_100000749238_100000210656 [0,2,0,0,0,0|2,0,0]=4 22717 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)Cl 240690a_100000749238_100000210656 [0,2,0,0,0,0|2,0,0]=4 22718 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)F 11a_100000749238_100000210369 [0,2,0,0,0,0|2,0,0]=4 22719 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)F 1626a_100000749238_100000210369 [0,2,0,0,0,0|2,0,0]=4 22720 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)F 240690a_100000749238_100000210369 [0,2,0,0,0,0|2,0,0]=4 22721 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)F 527a_100000749238_100000210369 [0,2,0,0,0,0|2,0,0]=4 22722 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)O 240690a_100000749238_100000745519 [0,2,0,0,0,0|1,0,0]=3 22723 B16R1.106955 CSCCCNC(=O)c1c(cccc1Cl)O 527a_100000749238_100000745519 [0,2,0,0,0,0|1,0,0]=3 22724 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)C 11a_100000749238_100000762013 [0,2,0,0,0,0|2,0,0]=4 22725 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)C 1626a_100000749238_100000762013 [0,2,0,0,0,0|2,0,0]=4 22726 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)C 240690a_100000749238_100000762013 [0,2,0,0,0,0|2,0,0]=4 22727 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)C 527a_100000749238_100000762013 [0,2,0,0,0,0|2,0,0]=4 22728 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)F 11a_100000749238_100000210804 [0,2,0,0,0,0|2,0,0]=4 22729 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)F 1626a_100000749238_100000210804 [0,2,0,0,0,0|2,0,0]=4 22730 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)F 240690a_100000749238_100000210804 [0,2,0,0,0,0|2,0,0]=4 22731 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)F 527a_100000749238_100000210804 [0,2,0,0,0,0|2,0,0]=4 22732 B16R1.106955 CSCCCNC(=O)c1c(cccc1F)O 527a_100000749238_100000763259 [0,2,0,0,0,0|1,0,0]=3 22733 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Br 11a_100000749238_100010232521 [0,2,0,0,0,0|2,0,0]=4 22734 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Br 1626a_100000749238_100010232521 [0,2,0,0,0,0|2,0,0]=4 22735 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Br 240690a_100000749238_100010232521 [0,2,0,0,0,0|2,0,0]=4 22736 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Br 527a_100000749238_100010232521 [0,2,0,0,0,0|2,0,0]=4 22737 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)C 11a_100000749238_100000688020 [0,2,0,0,0,0|2,0,0]=4 22738 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)C 1626a_100000749238_100000688020 [0,2,0,0,0,0|2,0,0]=4 22739 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)C 240690a_100000749238_100000688020 [0,2,0,0,0,0|2,0,0]=4 22740 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Cl 11a_100000749238_100000702859 [0,2,0,0,0,0|2,0,0]=4 22741 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Cl 1626a_100000749238_100000702859 [0,2,0,0,0,0|2,0,0]=4 22742 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Cl 240690a_100000749238_100000702859 [0,2,0,0,0,0|2,0,0]=4 22743 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)Cl 527a_100000749238_100000702859 [0,2,0,0,0,0|2,0,0]=4 22744 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)F 11a_100000749238_100000023732 [0,2,0,0,0,0|2,0,0]=4 22745 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)F 1626a_100000749238_100000023732 [0,2,0,0,0,0|2,0,0]=4 22746 B16R1.106955 CSCCCNC(=O)c1c(cccc1I)F 240690a_100000749238_100000023732 [0,2,0,0,0,0|2,0,0]=4 22747 B16R1.106955 CSCCCNC(=O)c1c(cccc1O)O 527a_100000749238_100000755285 [0,2,0,0,0,0|1,0,0]=3 22748 B16R1.106955 CSCCOCC(=O)c1c(cccc1Cl)Cl 34a_100000230434_100012340516 [0,2,0,0,0,0|2,0,0]=4 22749 B16R1.106955 CSCCOCC(=O)c1c(cccc1Cl)F 34a_100000230434_100011219195 [0,2,0,0,0,0|2,0,0]=4 22750 B16R1.106955 CSCCOCC(=O)c1c(cccc1F)F 34a_100000230434_100000199083 [0,2,0,0,0,0|2,0,0]=4 22751 B16R1.106955 Cc1cccc(c1C(=O)CCCCC#N)O 1458a_100011934116_100000211819 [0,2,0,0,0,0|1,0,1]=4 22752 B16R1.106955 Cc1cccc(c1C(=O)CCCCCF)Br 1458a_100000701904_100000729378 [0,2,0,0,0,0|2,0,0]=4 22753 B16R1.106955 Cc1cccc(c1C(=O)CCCCCF)C 1458a_100000758298_100000729378 [0,2,0,0,0,0|2,0,0]=4 22754 B16R1.106955 Cc1cccc(c1C(=O)CCCCCF)Cl 1458a_100000692601_100000729378 [0,2,0,0,0,0|2,0,0]=4 22755 B16R1.106955 Cc1cccc(c1C(=O)CCCCCF)F 1458a_100000762013_100000729378 [0,2,0,0,0,0|2,0,0]=4 22756 B16R1.106955 Cc1cccc(c1C(=O)CCCCCF)I 1458a_100000688020_100000729378 [0,2,0,0,0,0|2,0,0]=4 22757 B16R1.106955 Cc1cccc(c1C(=O)CCCCCF)O 1458a_100011934116_100000729378 [0,2,0,0,0,0|1,0,0]=3 22758 B16R1.106955 Cc1cccc(c1C(=O)CCCCCO)Br 1458a_100000701904_100000746330 [0,2,0,0,0,0|2,0,0]=4 22759 B16R1.106955 Cc1cccc(c1C(=O)CCCCCO)C 1458a_100000758298_100000746330 [0,2,0,0,0,0|2,0,0]=4 22760 B16R1.106955 Cc1cccc(c1C(=O)CCCCCO)Cl 1458a_100000692601_100000746330 [0,2,0,0,0,0|2,0,0]=4 22761 B16R1.106955 Cc1cccc(c1C(=O)CCCCCO)F 1458a_100000762013_100000746330 [0,2,0,0,0,0|2,0,0]=4 22762 B16R1.106955 Cc1cccc(c1C(=O)CCCCCO)I 1458a_100000688020_100000746330 [0,2,0,0,0,0|2,0,0]=4 22763 B16R1.106955 Cc1cccc(c1C(=O)CCCCCO)O 1458a_100011934116_100000746330 [0,2,0,0,0,0|1,0,0]=3 22764 B16R1.106955 Cc1cccc(c1C(=O)CCOCCO)O 1458a_100011934116_100011215305 [0,2,0,0,0,0|2,0,0]=4 22765 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)Br 240690a_100000750430_100000701904 [0,2,0,0,0,0|2,0,0]=4 22766 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)Br 527a_100000750430_100000701904 [0,2,0,0,0,0|2,0,0]=4 22767 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)C 240690a_100000750430_100000758298 [0,2,0,0,0,0|2,0,0]=4 22768 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)Cl 240690a_100000750430_100000692601 [0,2,0,0,0,0|2,0,0]=4 22769 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)F 240690a_100000750430_100000762013 [0,2,0,0,0,0|2,0,0]=4 22770 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)F 527a_100000750430_100000762013 [0,2,0,0,0,0|2,0,0]=4 22771 B16R1.106955 Cc1cccc(c1C(=O)NCCCCO)I 240690a_100000750430_100000688020 [0,2,0,0,0,0|2,0,0]=4 22772 B16R1.106955 N#CCCCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000211819 [0,2,0,0,0,0|1,0,1]=4 22773 B16R1.106955 N#CCCCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000211819 [0,2,0,0,0,0|1,0,1]=4 22774 B16R1.106955 N#CCCCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000211819 [0,2,0,0,0,0|1,0,1]=4 22775 B16R1.106955 N#CCCCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000211819 [0,2,0,0,0,0|1,0,1]=4 22776 B16R1.106955 NCCCOCC(=O)c1c(cccc1Cl)Cl 34a_100000182051_100012340516 [0,2,0,0,0,0|2,0,0]=4 22777 B16R1.106955 NCCCOCC(=O)c1c(cccc1Cl)F 34a_100000182051_100011219195 [0,2,0,0,0,0|2,0,0]=4 22778 B16R1.106955 NCCCOCC(=O)c1c(cccc1F)F 34a_100000182051_100000199083 [0,2,0,0,0,0|2,0,0]=4 22779 B16R1.106955 O=C(CCCCCF)c1c(cccc1Br)Br 1458a_100000690891_100000729378 [0,2,0,0,0,0|2,0,0]=4 22780 B16R1.106955 O=C(CCCCCF)c1c(cccc1Br)Cl 1458a_100011253703_100000729378 [0,2,0,0,0,0|2,0,0]=4 22781 B16R1.106955 O=C(CCCCCF)c1c(cccc1Br)F 1458a_100000752694_100000729378 [0,2,0,0,0,0|2,0,0]=4 22782 B16R1.106955 O=C(CCCCCF)c1c(cccc1Br)O 1458a_100011935254_100000729378 [0,2,0,0,0,0|1,0,0]=3 22783 B16R1.106955 O=C(CCCCCF)c1c(cccc1Cl)Cl 1458a_100000210656_100000729378 [0,2,0,0,0,0|2,0,0]=4 22784 B16R1.106955 O=C(CCCCCF)c1c(cccc1Cl)F 1458a_100000210369_100000729378 [0,2,0,0,0,0|2,0,0]=4 22785 B16R1.106955 O=C(CCCCCF)c1c(cccc1Cl)O 1458a_100000745519_100000729378 [0,2,0,0,0,0|1,0,0]=3 22786 B16R1.106955 O=C(CCCCCF)c1c(cccc1F)F 1458a_100000210804_100000729378 [0,2,0,0,0,0|2,0,0]=4 22787 B16R1.106955 O=C(CCCCCF)c1c(cccc1F)O 1458a_100000763259_100000729378 [0,2,0,0,0,0|1,0,0]=3 22788 B16R1.106955 O=C(CCCCCF)c1c(cccc1I)Br 1458a_100010232521_100000729378 [0,2,0,0,0,0|2,0,0]=4 22789 B16R1.106955 O=C(CCCCCF)c1c(cccc1I)Cl 1458a_100000702859_100000729378 [0,2,0,0,0,0|2,0,0]=4 22790 B16R1.106955 O=C(CCCCCF)c1c(cccc1I)F 1458a_100000023732_100000729378 [0,2,0,0,0,0|2,0,0]=4 22791 B16R1.106955 O=C(CCCCCF)c1c(cccc1O)O 1458a_100000755285_100000729378 [0,2,0,0,0,0|1,0,0]=3 22792 B16R1.106955 O=C(CCCCCO)c1c(cccc1Br)Br 1458a_100000690891_100000746330 [0,2,0,0,0,0|2,0,0]=4 22793 B16R1.106955 O=C(CCCCCO)c1c(cccc1Br)Cl 1458a_100011253703_100000746330 [0,2,0,0,0,0|2,0,0]=4 22794 B16R1.106955 O=C(CCCCCO)c1c(cccc1Br)F 1458a_100000752694_100000746330 [0,2,0,0,0,0|2,0,0]=4 22795 B16R1.106955 O=C(CCCCCO)c1c(cccc1Br)O 1458a_100011935254_100000746330 [0,2,0,0,0,0|1,0,0]=3 22796 B16R1.106955 O=C(CCCCCO)c1c(cccc1Cl)Cl 1458a_100000210656_100000746330 [0,2,0,0,0,0|2,0,0]=4 22797 B16R1.106955 O=C(CCCCCO)c1c(cccc1Cl)F 1458a_100000210369_100000746330 [0,2,0,0,0,0|2,0,0]=4 22798 B16R1.106955 O=C(CCCCCO)c1c(cccc1Cl)O 1458a_100000745519_100000746330 [0,2,0,0,0,0|1,0,0]=3 22799 B16R1.106955 O=C(CCCCCO)c1c(cccc1F)F 1458a_100000210804_100000746330 [0,2,0,0,0,0|2,0,0]=4 22800 B16R1.106955 O=C(CCCCCO)c1c(cccc1F)O 1458a_100000763259_100000746330 [0,2,0,0,0,0|1,0,0]=3 22801 B16R1.106955 O=C(CCCCCO)c1c(cccc1I)Br 1458a_100010232521_100000746330 [0,2,0,0,0,0|2,0,0]=4 22802 B16R1.106955 O=C(CCCCCO)c1c(cccc1I)Cl 1458a_100000702859_100000746330 [0,2,0,0,0,0|2,0,0]=4 22803 B16R1.106955 O=C(CCCCCO)c1c(cccc1I)F 1458a_100000023732_100000746330 [0,2,0,0,0,0|2,0,0]=4 22804 B16R1.106955 O=C(CCCCCO)c1c(cccc1O)O 1458a_100000755285_100000746330 [0,2,0,0,0,0|1,0,0]=3 22805 B16R1.106955 O=C(CCOCCO)c1c(cccc1Br)O 1458a_100011935254_100011215305 [0,2,0,0,0,0|2,0,0]=4 22806 B16R1.106955 O=C(CCOCCO)c1c(cccc1Cl)O 1458a_100000745519_100011215305 [0,2,0,0,0,0|2,0,0]=4 22807 B16R1.106955 O=C(CCOCCO)c1c(cccc1F)O 1458a_100000763259_100011215305 [0,2,0,0,0,0|2,0,0]=4 22808 B16R1.106955 O=C(CCOCCO)c1c(cccc1O)O 1458a_100000755285_100011215305 [0,2,0,0,0,0|2,0,0]=4 22809 B16R1.106955 O=C(COCCCBr)c1c(cccc1Cl)Cl 34a_100011217188_100012340516 [0,2,0,0,0,0|2,0,0]=4 22810 B16R1.106955 O=C(COCCCBr)c1c(cccc1Cl)F 34a_100011217188_100011219195 [0,2,0,0,0,0|2,0,0]=4 22811 B16R1.106955 O=C(COCCCBr)c1c(cccc1F)F 34a_100011217188_100000199083 [0,2,0,0,0,0|2,0,0]=4 22812 B16R1.106955 O=C(COCCCCl)c1c(cccc1Cl)Cl 34a_100000230001_100012340516 [0,2,0,0,0,0|2,0,0]=4 22813 B16R1.106955 O=C(COCCCCl)c1c(cccc1Cl)F 34a_100000230001_100011219195 [0,2,0,0,0,0|2,0,0]=4 22814 B16R1.106955 O=C(COCCCCl)c1c(cccc1F)F 34a_100000230001_100000199083 [0,2,0,0,0,0|2,0,0]=4 22815 B16R1.106955 O=C(COCCCF)c1c(cccc1Cl)Cl 34a_100000759539_100012340516 [0,2,0,0,0,0|2,0,0]=4 22816 B16R1.106955 O=C(COCCCF)c1c(cccc1Cl)F 34a_100000759539_100011219195 [0,2,0,0,0,0|2,0,0]=4 22817 B16R1.106955 O=C(COCCCF)c1c(cccc1F)F 34a_100000759539_100000199083 [0,2,0,0,0,0|2,0,0]=4 22818 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)Br 240690a_100000750430_100000690891 [0,2,0,0,0,0|2,0,0]=4 22819 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)Br 527a_100000750430_100000690891 [0,2,0,0,0,0|2,0,0]=4 22820 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)Cl 240690a_100000750430_100011253703 [0,2,0,0,0,0|2,0,0]=4 22821 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)Cl 527a_100000750430_100011253703 [0,2,0,0,0,0|2,0,0]=4 22822 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)F 240690a_100000750430_100000752694 [0,2,0,0,0,0|2,0,0]=4 22823 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)F 527a_100000750430_100000752694 [0,2,0,0,0,0|2,0,0]=4 22824 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)O 240690a_100000750430_100011935254 [0,2,0,0,0,0|1,0,0]=3 22825 B16R1.106955 O=C(NCCCCO)c1c(cccc1Br)O 527a_100000750430_100011935254 [0,2,0,0,0,0|1,0,0]=3 22826 B16R1.106955 O=C(NCCCCO)c1c(cccc1Cl)Cl 240690a_100000750430_100000210656 [0,2,0,0,0,0|2,0,0]=4 22827 B16R1.106955 O=C(NCCCCO)c1c(cccc1Cl)F 240690a_100000750430_100000210369 [0,2,0,0,0,0|2,0,0]=4 22828 B16R1.106955 O=C(NCCCCO)c1c(cccc1Cl)F 527a_100000750430_100000210369 [0,2,0,0,0,0|2,0,0]=4 22829 B16R1.106955 O=C(NCCCCO)c1c(cccc1Cl)O 240690a_100000750430_100000745519 [0,2,0,0,0,0|1,0,0]=3 22830 B16R1.106955 O=C(NCCCCO)c1c(cccc1Cl)O 527a_100000750430_100000745519 [0,2,0,0,0,0|1,0,0]=3 22831 B16R1.106955 O=C(NCCCCO)c1c(cccc1F)F 240690a_100000750430_100000210804 [0,2,0,0,0,0|2,0,0]=4 22832 B16R1.106955 O=C(NCCCCO)c1c(cccc1F)F 527a_100000750430_100000210804 [0,2,0,0,0,0|2,0,0]=4 22833 B16R1.106955 O=C(NCCCCO)c1c(cccc1F)O 527a_100000750430_100000763259 [0,2,0,0,0,0|1,0,0]=3 22834 B16R1.106955 O=C(NCCCCO)c1c(cccc1I)Br 240690a_100000750430_100010232521 [0,2,0,0,0,0|2,0,0]=4 22835 B16R1.106955 O=C(NCCCCO)c1c(cccc1I)Br 527a_100000750430_100010232521 [0,2,0,0,0,0|2,0,0]=4 22836 B16R1.106955 O=C(NCCCCO)c1c(cccc1I)Cl 240690a_100000750430_100000702859 [0,2,0,0,0,0|2,0,0]=4 22837 B16R1.106955 O=C(NCCCCO)c1c(cccc1I)Cl 527a_100000750430_100000702859 [0,2,0,0,0,0|2,0,0]=4 22838 B16R1.106955 O=C(NCCCCO)c1c(cccc1I)F 240690a_100000750430_100000023732 [0,2,0,0,0,0|2,0,0]=4 22839 B16R1.106955 O=C(NCCCCO)c1c(cccc1O)O 527a_100000750430_100000755285 [0,2,0,0,0,0|1,0,0]=3 22840 B16R1.10467 CC(C)(CO)CNC(=O)c1ccccc1O 240690a_100020635058_100015234032 [0,2,0,0,0,0|2,0,0]=4 22841 B16R1.10467 CCC(C)(C)OCC(=O)c1ccccc1O 7a_100000210230_100000188908 [0,2,0,0,0,0|2,0,0]=4 22842 B16R1.10467 CCC(C)(C)SCC(=O)c1ccccc1O 62a_100000032637_100000188908 [0,2,0,0,0,0|2,0,0]=4 22843 B16R1.10467 CCC(C)(C)SCC(=O)c1ccccc1O 62a_100000188908_100000032637 [0,2,0,0,0,0|2,0,0]=4 22844 B16R1.10467 CCS(=O)(=O)CCC(=O)c1ccccc1O 1458a_100015234032_100000756660 [0,2,0,0,0,0|2,0,0]=4 22845 B16R1.10467 COC(C)(C)CNC(=O)c1ccccc1O 240690a_100000763424_100015234032 [0,2,0,0,0,0|2,0,0]=4 22846 B16R1.10467 O=C(NCC(F)(F)CO)c1ccccc1O 240690a_100000703232_100015234032 [0,2,0,0,0,0|2,0,0]=4 22847 B16R1.10819 CC(C)C(=O)CNC(=O)c1ccccc1O 1458a_100011193979_100000210206 [0,2,0,0,0,0|1,0,1]=4 22848 B16R1.10819 CC(C)C(C)OCC(=O)c1ccccc1O 7a_100000748068_100000188908 [0,2,0,0,0,0|2,0,0]=4 22849 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1Br 11a_100000759067_100000188424 [0,2,0,0,0,0|2,0,0]=4 22850 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1Br 240690a_100000759067_100000188424 [0,2,0,0,0,0|2,0,0]=4 22851 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1Br 527a_100000759067_100000188424 [0,2,0,0,0,0|2,0,0]=4 22852 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1Cl 11a_100000759067_100000185844 [0,2,0,0,0,0|2,0,0]=4 22853 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1Cl 240690a_100000759067_100000185844 [0,2,0,0,0,0|2,0,0]=4 22854 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1Cl 527a_100000759067_100000185844 [0,2,0,0,0,0|2,0,0]=4 22855 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1F 11a_100000759067_100000188656 [0,2,0,0,0,0|2,0,0]=4 22856 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1F 240690a_100000759067_100000188656 [0,2,0,0,0,0|2,0,0]=4 22857 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1F 527a_100000759067_100000188656 [0,2,0,0,0,0|2,0,0]=4 22858 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1I 11a_100000759067_100000187884 [0,2,0,0,0,0|2,0,0]=4 22859 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1I 240690a_100000759067_100000187884 [0,2,0,0,0,0|2,0,0]=4 22860 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1I 527a_100000759067_100000187884 [0,2,0,0,0,0|2,0,0]=4 22861 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1O 240690a_100000759067_100015234032 [0,2,0,0,0,0|1,0,0]=3 22862 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1[O-] 240690a_100000759067_100009911694 [0,2,0,0,0,0|1,0,1]=4 22863 B16R1.10819 CC(C)C(O)CNC(=O)c1ccccc1[O-] 527a_100000759067_100009911694 [0,2,0,0,0,0|1,0,1]=4 22864 B16R1.10819 CC(C)N(C)CCC(=O)c1ccccc1O 269982a_200000211004_100009873196 [0,2,0,0,0,0|2,0,0]=4 22865 B16R1.10819 CC(COC(=O)c1ccccc1Br)N(C)C 270004a_100102631434_201991511838 [0,2,0,0,0,0|2,0,0]=4 22866 B16R1.10819 Cc1ccccc1C(=O)NCC(O)C(C)C 11a_100000759067_100000212026 [0,2,0,0,0,0|2,0,0]=4 22867 B16R1.10819 Cc1ccccc1C(=O)NCC(O)C(C)C 240690a_100000759067_100000212026 [0,2,0,0,0,0|2,0,0]=4 22868 B16R1.10819 Cc1ccccc1C(=O)NCC(O)C(C)C 527a_100000759067_100000212026 [0,2,0,0,0,0|2,0,0]=4 22869 B16R1.14189 C#CC(CC)OCC(=O)c1ccccc1O 7a_100000758843_100000188908 [0,2,0,0,0,0|2,0,0]=4 22870 B16R1.14189 C=CC(CC)OCC(=O)c1ccccc1O 7a_100000766422_100000188908 [0,2,0,0,0,0|2,0,0]=4 22871 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Br 11a_100102946423_100000188424 [0,2,0,0,0,0|2,0,0]=4 22872 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Br 1626a_100102946423_100000188424 [0,2,0,0,0,0|2,0,0]=4 22873 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Br 240690a_100102946423_100000188424 [0,2,0,0,0,0|2,0,0]=4 22874 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Br 527a_100102946423_100000188424 [0,2,0,0,0,0|2,0,0]=4 22875 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1C 11a_100102946423_100000212026 [0,2,0,0,0,0|2,0,0]=4 22876 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1C 1626a_100102946423_100000212026 [0,2,0,0,0,0|2,0,0]=4 22877 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1C 240690a_100102946423_100000212026 [0,2,0,0,0,0|2,0,0]=4 22878 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1C 527a_100102946423_100000212026 [0,2,0,0,0,0|2,0,0]=4 22879 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Cl 11a_100102946423_100000185844 [0,2,0,0,0,0|2,0,0]=4 22880 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Cl 1626a_100102946423_100000185844 [0,2,0,0,0,0|2,0,0]=4 22881 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Cl 240690a_100102946423_100000185844 [0,2,0,0,0,0|2,0,0]=4 22882 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1Cl 527a_100102946423_100000185844 [0,2,0,0,0,0|2,0,0]=4 22883 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1F 11a_100102946423_100000188656 [0,2,0,0,0,0|2,0,0]=4 22884 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1F 1626a_100102946423_100000188656 [0,2,0,0,0,0|2,0,0]=4 22885 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1F 240690a_100102946423_100000188656 [0,2,0,0,0,0|2,0,0]=4 22886 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1F 527a_100102946423_100000188656 [0,2,0,0,0,0|2,0,0]=4 22887 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1I 11a_100102946423_100000187884 [0,2,0,0,0,0|2,0,0]=4 22888 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1I 1626a_100102946423_100000187884 [0,2,0,0,0,0|2,0,0]=4 22889 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1I 240690a_100102946423_100000187884 [0,2,0,0,0,0|2,0,0]=4 22890 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1I 527a_100102946423_100000187884 [0,2,0,0,0,0|2,0,0]=4 22891 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1O 240690a_100102946423_100015234032 [0,2,0,0,0,0|1,0,0]=3 22892 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1[O-] 1626a_100102946423_100009911694 [0,2,0,0,0,0|1,0,1]=4 22893 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1[O-] 240690a_100102946423_100009911694 [0,2,0,0,0,0|1,0,1]=4 22894 B16R1.14189 CCC(CC)CNC(=O)c1ccccc1[O-] 527a_100102946423_100009911694 [0,2,0,0,0,0|1,0,1]=4 22895 B16R1.14189 CCC(CC)NNC(=O)c1ccccc1O 22a_100000756293_100015234032 [0,2,0,0,0,0|2,0,0]=4 22896 B16R1.14189 CCC(CC)OCC(=O)c1ccccc1O 7a_100000688536_100000188908 [0,2,0,0,0,0|2,0,0]=4 22897 B16R1.14189 CCC(CC)SCC(=O)c1ccccc1O 62a_100000188908_100000210505 [0,2,0,0,0,0|2,0,0]=4 22898 B16R1.14189 CCC(CC)SCC(=O)c1ccccc1O 62a_100000210505_100000188908 [0,2,0,0,0,0|2,0,0]=4 22899 B16R1.14189 CCC(CNC(=O)c1ccccc1Br)OC 11a_100000731041_100000188424 [0,2,0,0,0,0|2,0,0]=4 22900 B16R1.14189 CCC(CNC(=O)c1ccccc1Br)OC 1626a_100000731041_100000188424 [0,2,0,0,0,0|2,0,0]=4 22901 B16R1.14189 CCC(CNC(=O)c1ccccc1Br)OC 240690a_100000731041_100000188424 [0,2,0,0,0,0|2,0,0]=4 22902 B16R1.14189 CCC(CNC(=O)c1ccccc1Br)OC 527a_100000731041_100000188424 [0,2,0,0,0,0|2,0,0]=4 22903 B16R1.14189 CCC(CNC(=O)c1ccccc1C)OC 11a_100000731041_100000212026 [0,2,0,0,0,0|2,0,0]=4 22904 B16R1.14189 CCC(CNC(=O)c1ccccc1C)OC 1626a_100000731041_100000212026 [0,2,0,0,0,0|2,0,0]=4 22905 B16R1.14189 CCC(CNC(=O)c1ccccc1C)OC 240690a_100000731041_100000212026 [0,2,0,0,0,0|2,0,0]=4 22906 B16R1.14189 CCC(CNC(=O)c1ccccc1C)OC 527a_100000731041_100000212026 [0,2,0,0,0,0|2,0,0]=4 22907 B16R1.14189 CCC(CNC(=O)c1ccccc1Cl)OC 11a_100000731041_100000185844 [0,2,0,0,0,0|2,0,0]=4 22908 B16R1.14189 CCC(CNC(=O)c1ccccc1Cl)OC 1626a_100000731041_100000185844 [0,2,0,0,0,0|2,0,0]=4 22909 B16R1.14189 CCC(CNC(=O)c1ccccc1Cl)OC 240690a_100000731041_100000185844 [0,2,0,0,0,0|2,0,0]=4 22910 B16R1.14189 CCC(CNC(=O)c1ccccc1Cl)OC 527a_100000731041_100000185844 [0,2,0,0,0,0|2,0,0]=4 22911 B16R1.14189 CCC(CNC(=O)c1ccccc1F)OC 11a_100000731041_100000188656 [0,2,0,0,0,0|2,0,0]=4 22912 B16R1.14189 CCC(CNC(=O)c1ccccc1F)OC 1626a_100000731041_100000188656 [0,2,0,0,0,0|2,0,0]=4 22913 B16R1.14189 CCC(CNC(=O)c1ccccc1F)OC 240690a_100000731041_100000188656 [0,2,0,0,0,0|2,0,0]=4 22914 B16R1.14189 CCC(CNC(=O)c1ccccc1F)OC 527a_100000731041_100000188656 [0,2,0,0,0,0|2,0,0]=4 22915 B16R1.14189 CCC(CNC(=O)c1ccccc1I)OC 11a_100000731041_100000187884 [0,2,0,0,0,0|2,0,0]=4 22916 B16R1.14189 CCC(CNC(=O)c1ccccc1I)OC 1626a_100000731041_100000187884 [0,2,0,0,0,0|2,0,0]=4 22917 B16R1.14189 CCC(CNC(=O)c1ccccc1I)OC 240690a_100000731041_100000187884 [0,2,0,0,0,0|2,0,0]=4 22918 B16R1.14189 CCC(CNC(=O)c1ccccc1I)OC 527a_100000731041_100000187884 [0,2,0,0,0,0|2,0,0]=4 22919 B16R1.14189 CCC(CNC(=O)c1ccccc1O)OC 240690a_100000731041_100015234032 [0,2,0,0,0,0|1,0,0]=3 22920 B16R1.14189 CCC(CNC(=O)c1ccccc1[O-])OC 1626a_100000731041_100009911694 [0,2,0,0,0,0|1,0,1]=4 22921 B16R1.14189 CCC(CNC(=O)c1ccccc1[O-])OC 240690a_100000731041_100009911694 [0,2,0,0,0,0|1,0,1]=4 22922 B16R1.14189 CCC(CNC(=O)c1ccccc1[O-])OC 527a_100000731041_100009911694 [0,2,0,0,0,0|1,0,1]=4 22923 B16R1.14189 CCN(CC)CCC(=O)c1ccccc1O 1458a_100015234032_100000700428 [0,2,0,0,0,0|2,0,0]=4 22924 B16R1.14189 CCN(CC)CCC(=O)c1ccccc1O 269956a_100000042499_100009873196 [0,2,0,0,0,0|2,0,0]=4 22925 B16R1.14189 CCN(CC)CCC(=O)c1ccccc1O 269982a_100000724800_100009873196 [0,2,0,0,0,0|2,0,0]=4 22926 B16R1.14189 COC(CCC(=O)c1ccccc1O)OC 1458a_100015234032_100000139399 [0,2,0,0,0,0|2,0,0]=4 22927 B16R1.14189 COC(CNC(=O)c1ccccc1O)OC 240690a_100000210479_100015234032 [0,2,0,0,0,0|2,0,0]=4 22928 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Br 11a_100000753921_100000188424 [0,2,0,0,0,0|2,0,0]=4 22929 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Br 1626a_100000753921_100000188424 [0,2,0,0,0,0|2,0,0]=4 22930 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Br 240690a_100000753921_100000188424 [0,2,0,0,0,0|2,0,0]=4 22931 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Br 527a_100000753921_100000188424 [0,2,0,0,0,0|2,0,0]=4 22932 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1C 11a_100000753921_100000212026 [0,2,0,0,0,0|2,0,0]=4 22933 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1C 1626a_100000753921_100000212026 [0,2,0,0,0,0|2,0,0]=4 22934 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1C 240690a_100000753921_100000212026 [0,2,0,0,0,0|2,0,0]=4 22935 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1C 527a_100000753921_100000212026 [0,2,0,0,0,0|2,0,0]=4 22936 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Cl 11a_100000753921_100000185844 [0,2,0,0,0,0|2,0,0]=4 22937 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Cl 1626a_100000753921_100000185844 [0,2,0,0,0,0|2,0,0]=4 22938 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Cl 240690a_100000753921_100000185844 [0,2,0,0,0,0|2,0,0]=4 22939 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1Cl 527a_100000753921_100000185844 [0,2,0,0,0,0|2,0,0]=4 22940 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1F 11a_100000753921_100000188656 [0,2,0,0,0,0|2,0,0]=4 22941 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1F 1626a_100000753921_100000188656 [0,2,0,0,0,0|2,0,0]=4 22942 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1F 240690a_100000753921_100000188656 [0,2,0,0,0,0|2,0,0]=4 22943 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1F 527a_100000753921_100000188656 [0,2,0,0,0,0|2,0,0]=4 22944 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1I 11a_100000753921_100000187884 [0,2,0,0,0,0|2,0,0]=4 22945 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1I 1626a_100000753921_100000187884 [0,2,0,0,0,0|2,0,0]=4 22946 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1I 240690a_100000753921_100000187884 [0,2,0,0,0,0|2,0,0]=4 22947 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1I 527a_100000753921_100000187884 [0,2,0,0,0,0|2,0,0]=4 22948 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1O 240690a_100000753921_100015234032 [0,2,0,0,0,0|1,0,0]=3 22949 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1[O-] 1626a_100000753921_100009911694 [0,2,0,0,0,0|1,0,1]=4 22950 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1[O-] 240690a_100000753921_100009911694 [0,2,0,0,0,0|1,0,1]=4 22951 B16R1.16913 CCC(C)CN(C)C(=O)c1ccccc1[O-] 527a_100000753921_100009911694 [0,2,0,0,0,0|1,0,1]=4 22952 B16R1.16913 CN(CC(O)CO)C(=O)c1ccccc1O 240690a_100011216503_100015234032 [0,2,0,0,0,0|2,0,0]=4 22953 B16R1.131047 CC(CO)CNC(=O)c1c(cccc1Br)O 240690a_100000744482_100011935254 [0,2,0,0,0,0|2,0,0]=4 22954 B16R1.131047 CC(CO)CNC(=O)c1c(cccc1Br)O 527a_100000744482_100011935254 [0,2,0,0,0,0|2,0,0]=4 22955 B16R1.131047 CC(CO)CNC(=O)c1c(cccc1Cl)O 240690a_100000744482_100000745519 [0,2,0,0,0,0|2,0,0]=4 22956 B16R1.131047 CC(CO)CNC(=O)c1c(cccc1Cl)O 527a_100000744482_100000745519 [0,2,0,0,0,0|2,0,0]=4 22957 B16R1.131047 CC(CO)CNC(=O)c1c(cccc1F)O 527a_100000744482_100000763259 [0,2,0,0,0,0|2,0,0]=4 22958 B16R1.131047 CC(CO)CNC(=O)c1c(cccc1O)O 527a_100000744482_100000755285 [0,2,0,0,0,0|2,0,0]=4 22959 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Br 11a_100020588543_100000690891 [0,2,0,0,0,0|2,0,0]=4 22960 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Br 1626a_100020588543_100000690891 [0,2,0,0,0,0|2,0,0]=4 22961 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Br 240690a_100020588543_100000690891 [0,2,0,0,0,0|2,0,0]=4 22962 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Br 527a_100020588543_100000690891 [0,2,0,0,0,0|2,0,0]=4 22963 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)C 11a_100020588543_100000701904 [0,2,0,0,0,0|2,0,0]=4 22964 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)C 1626a_100020588543_100000701904 [0,2,0,0,0,0|2,0,0]=4 22965 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)C 240690a_100020588543_100000701904 [0,2,0,0,0,0|2,0,0]=4 22966 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)C 527a_100020588543_100000701904 [0,2,0,0,0,0|2,0,0]=4 22967 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Cl 11a_100020588543_100011253703 [0,2,0,0,0,0|2,0,0]=4 22968 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Cl 1626a_100020588543_100011253703 [0,2,0,0,0,0|2,0,0]=4 22969 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Cl 240690a_100020588543_100011253703 [0,2,0,0,0,0|2,0,0]=4 22970 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)Cl 527a_100020588543_100011253703 [0,2,0,0,0,0|2,0,0]=4 22971 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)F 11a_100020588543_100000752694 [0,2,0,0,0,0|2,0,0]=4 22972 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)F 1626a_100020588543_100000752694 [0,2,0,0,0,0|2,0,0]=4 22973 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)F 240690a_100020588543_100000752694 [0,2,0,0,0,0|2,0,0]=4 22974 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)F 527a_100020588543_100000752694 [0,2,0,0,0,0|2,0,0]=4 22975 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)O 240690a_100020588543_100011935254 [0,2,0,0,0,0|1,0,0]=3 22976 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Br)O 527a_100020588543_100011935254 [0,2,0,0,0,0|1,0,0]=3 22977 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1C)C 11a_100020588543_100000758298 [0,2,0,0,0,0|2,0,0]=4 22978 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1C)C 1626a_100020588543_100000758298 [0,2,0,0,0,0|2,0,0]=4 22979 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1C)C 240690a_100020588543_100000758298 [0,2,0,0,0,0|2,0,0]=4 22980 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)C 11a_100020588543_100000692601 [0,2,0,0,0,0|2,0,0]=4 22981 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)C 1626a_100020588543_100000692601 [0,2,0,0,0,0|2,0,0]=4 22982 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)C 240690a_100020588543_100000692601 [0,2,0,0,0,0|2,0,0]=4 22983 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)Cl 11a_100020588543_100000210656 [0,2,0,0,0,0|2,0,0]=4 22984 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)Cl 1626a_100020588543_100000210656 [0,2,0,0,0,0|2,0,0]=4 22985 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)Cl 240690a_100020588543_100000210656 [0,2,0,0,0,0|2,0,0]=4 22986 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)F 11a_100020588543_100000210369 [0,2,0,0,0,0|2,0,0]=4 22987 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)F 1626a_100020588543_100000210369 [0,2,0,0,0,0|2,0,0]=4 22988 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)F 240690a_100020588543_100000210369 [0,2,0,0,0,0|2,0,0]=4 22989 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)F 527a_100020588543_100000210369 [0,2,0,0,0,0|2,0,0]=4 22990 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)O 240690a_100020588543_100000745519 [0,2,0,0,0,0|1,0,0]=3 22991 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1Cl)O 527a_100020588543_100000745519 [0,2,0,0,0,0|1,0,0]=3 22992 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)C 11a_100020588543_100000762013 [0,2,0,0,0,0|2,0,0]=4 22993 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)C 1626a_100020588543_100000762013 [0,2,0,0,0,0|2,0,0]=4 22994 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)C 240690a_100020588543_100000762013 [0,2,0,0,0,0|2,0,0]=4 22995 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)C 527a_100020588543_100000762013 [0,2,0,0,0,0|2,0,0]=4 22996 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)F 11a_100020588543_100000210804 [0,2,0,0,0,0|2,0,0]=4 22997 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)F 1626a_100020588543_100000210804 [0,2,0,0,0,0|2,0,0]=4 22998 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)F 240690a_100020588543_100000210804 [0,2,0,0,0,0|2,0,0]=4 22999 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)F 527a_100020588543_100000210804 [0,2,0,0,0,0|2,0,0]=4 23000 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1F)O 527a_100020588543_100000763259 [0,2,0,0,0,0|1,0,0]=3 23001 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Br 11a_100020588543_100010232521 [0,2,0,0,0,0|2,0,0]=4 23002 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Br 1626a_100020588543_100010232521 [0,2,0,0,0,0|2,0,0]=4 23003 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Br 240690a_100020588543_100010232521 [0,2,0,0,0,0|2,0,0]=4 23004 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Br 527a_100020588543_100010232521 [0,2,0,0,0,0|2,0,0]=4 23005 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)C 11a_100020588543_100000688020 [0,2,0,0,0,0|2,0,0]=4 23006 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)C 1626a_100020588543_100000688020 [0,2,0,0,0,0|2,0,0]=4 23007 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)C 240690a_100020588543_100000688020 [0,2,0,0,0,0|2,0,0]=4 23008 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Cl 11a_100020588543_100000702859 [0,2,0,0,0,0|2,0,0]=4 23009 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Cl 1626a_100020588543_100000702859 [0,2,0,0,0,0|2,0,0]=4 23010 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Cl 240690a_100020588543_100000702859 [0,2,0,0,0,0|2,0,0]=4 23011 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)Cl 527a_100020588543_100000702859 [0,2,0,0,0,0|2,0,0]=4 23012 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)F 11a_100020588543_100000023732 [0,2,0,0,0,0|2,0,0]=4 23013 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)F 1626a_100020588543_100000023732 [0,2,0,0,0,0|2,0,0]=4 23014 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1I)F 240690a_100020588543_100000023732 [0,2,0,0,0,0|2,0,0]=4 23015 B16R1.131047 CCC(C)CNC(=O)c1c(cccc1O)O 527a_100020588543_100000755285 [0,2,0,0,0,0|1,0,0]=3 23016 B16R1.131047 CCC(C)NNC(=O)c1c(cccc1Br)O 22a_100000718999_100011935254 [0,2,0,0,0,0|2,0,0]=4 23017 B16R1.131047 CCC(C)NNC(=O)c1c(cccc1Cl)O 22a_100000718999_100000745519 [0,2,0,0,0,0|2,0,0]=4 23018 B16R1.131047 CCC(C)NNC(=O)c1c(cccc1F)O 22a_100000718999_100000763259 [0,2,0,0,0,0|2,0,0]=4 23019 B16R1.131047 CCC(C)NNC(=O)c1c(cccc1O)C 22a_100000718999_100011934116 [0,2,0,0,0,0|2,0,0]=4 23020 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)Br 11a_100011218483_100000690891 [0,2,0,0,0,0|2,0,0]=4 23021 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)Br 240690a_100011218483_100000690891 [0,2,0,0,0,0|2,0,0]=4 23022 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)Br 527a_100011218483_100000690891 [0,2,0,0,0,0|2,0,0]=4 23023 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)C 11a_100011218483_100000701904 [0,2,0,0,0,0|2,0,0]=4 23024 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)C 240690a_100011218483_100000701904 [0,2,0,0,0,0|2,0,0]=4 23025 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)C 527a_100011218483_100000701904 [0,2,0,0,0,0|2,0,0]=4 23026 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)Cl 11a_100011218483_100011253703 [0,2,0,0,0,0|2,0,0]=4 23027 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)Cl 240690a_100011218483_100011253703 [0,2,0,0,0,0|2,0,0]=4 23028 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)Cl 527a_100011218483_100011253703 [0,2,0,0,0,0|2,0,0]=4 23029 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)F 11a_100011218483_100000752694 [0,2,0,0,0,0|2,0,0]=4 23030 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)F 240690a_100011218483_100000752694 [0,2,0,0,0,0|2,0,0]=4 23031 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)F 527a_100011218483_100000752694 [0,2,0,0,0,0|2,0,0]=4 23032 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)O 240690a_100011218483_100011935254 [0,2,0,0,0,0|1,0,0]=3 23033 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Br)O 527a_100011218483_100011935254 [0,2,0,0,0,0|1,0,0]=3 23034 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1C)C 11a_100011218483_100000758298 [0,2,0,0,0,0|2,0,0]=4 23035 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1C)C 240690a_100011218483_100000758298 [0,2,0,0,0,0|2,0,0]=4 23036 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)C 11a_100011218483_100000692601 [0,2,0,0,0,0|2,0,0]=4 23037 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)C 240690a_100011218483_100000692601 [0,2,0,0,0,0|2,0,0]=4 23038 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)Cl 11a_100011218483_100000210656 [0,2,0,0,0,0|2,0,0]=4 23039 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)Cl 240690a_100011218483_100000210656 [0,2,0,0,0,0|2,0,0]=4 23040 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)F 11a_100011218483_100000210369 [0,2,0,0,0,0|2,0,0]=4 23041 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)F 240690a_100011218483_100000210369 [0,2,0,0,0,0|2,0,0]=4 23042 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)F 527a_100011218483_100000210369 [0,2,0,0,0,0|2,0,0]=4 23043 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)O 240690a_100011218483_100000745519 [0,2,0,0,0,0|1,0,0]=3 23044 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1Cl)O 527a_100011218483_100000745519 [0,2,0,0,0,0|1,0,0]=3 23045 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)C 11a_100011218483_100000762013 [0,2,0,0,0,0|2,0,0]=4 23046 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)C 240690a_100011218483_100000762013 [0,2,0,0,0,0|2,0,0]=4 23047 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)C 527a_100011218483_100000762013 [0,2,0,0,0,0|2,0,0]=4 23048 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)F 11a_100011218483_100000210804 [0,2,0,0,0,0|2,0,0]=4 23049 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)F 240690a_100011218483_100000210804 [0,2,0,0,0,0|2,0,0]=4 23050 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)F 527a_100011218483_100000210804 [0,2,0,0,0,0|2,0,0]=4 23051 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1F)O 527a_100011218483_100000763259 [0,2,0,0,0,0|1,0,0]=3 23052 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)Br 11a_100011218483_100010232521 [0,2,0,0,0,0|2,0,0]=4 23053 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)Br 240690a_100011218483_100010232521 [0,2,0,0,0,0|2,0,0]=4 23054 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)Br 527a_100011218483_100010232521 [0,2,0,0,0,0|2,0,0]=4 23055 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)C 11a_100011218483_100000688020 [0,2,0,0,0,0|2,0,0]=4 23056 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)C 240690a_100011218483_100000688020 [0,2,0,0,0,0|2,0,0]=4 23057 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)Cl 11a_100011218483_100000702859 [0,2,0,0,0,0|2,0,0]=4 23058 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)Cl 240690a_100011218483_100000702859 [0,2,0,0,0,0|2,0,0]=4 23059 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)Cl 527a_100011218483_100000702859 [0,2,0,0,0,0|2,0,0]=4 23060 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)F 11a_100011218483_100000023732 [0,2,0,0,0,0|2,0,0]=4 23061 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1I)F 240690a_100011218483_100000023732 [0,2,0,0,0,0|2,0,0]=4 23062 B16R1.131047 CCC(O)CNC(=O)c1c(cccc1O)O 527a_100011218483_100000755285 [0,2,0,0,0,0|1,0,0]=3 23063 B16R1.131047 CO[C@H](C)CNC(=O)c1c(cccc1Br)O 240690a_100020591295_100011935254 [0,2,0,0,0,0|2,0,0]=4 23064 B16R1.131047 CO[C@H](C)CNC(=O)c1c(cccc1Br)O 527a_100020591295_100011935254 [0,2,0,0,0,0|2,0,0]=4 23065 B16R1.131047 CO[C@H](C)CNC(=O)c1c(cccc1Cl)O 240690a_100020591295_100000745519 [0,2,0,0,0,0|2,0,0]=4 23066 B16R1.131047 CO[C@H](C)CNC(=O)c1c(cccc1Cl)O 527a_100020591295_100000745519 [0,2,0,0,0,0|2,0,0]=4 23067 B16R1.131047 CO[C@H](C)CNC(=O)c1c(cccc1F)O 527a_100020591295_100000763259 [0,2,0,0,0,0|2,0,0]=4 23068 B16R1.131047 CO[C@H](C)CNC(=O)c1c(cccc1O)O 527a_100020591295_100000755285 [0,2,0,0,0,0|2,0,0]=4 23069 B16R1.131047 O=C(NC[C@@H](F)CO)c1c(cccc1Br)O 240690a_100015665980_100011935254 [0,2,0,0,0,0|2,0,0]=4 23070 B16R1.131047 O=C(NC[C@@H](F)CO)c1c(cccc1Br)O 527a_100015665980_100011935254 [0,2,0,0,0,0|2,0,0]=4 23071 B16R1.131047 O=C(NC[C@@H](F)CO)c1c(cccc1Cl)O 240690a_100015665980_100000745519 [0,2,0,0,0,0|2,0,0]=4 23072 B16R1.131047 O=C(NC[C@@H](F)CO)c1c(cccc1Cl)O 527a_100015665980_100000745519 [0,2,0,0,0,0|2,0,0]=4 23073 B16R1.131047 O=C(NC[C@@H](F)CO)c1c(cccc1F)O 527a_100015665980_100000763259 [0,2,0,0,0,0|2,0,0]=4 23074 B16R1.131047 O=C(NC[C@@H](F)CO)c1c(cccc1O)O 527a_100015665980_100000755285 [0,2,0,0,0,0|2,0,0]=4 23075 B16R1.131047 O=C(NC[C@H](O)CO)c1c(cccc1Br)O 240690a_100020644852_100011935254 [0,2,0,0,0,0|2,0,0]=4 23076 B16R1.131047 O=C(NC[C@H](O)CO)c1c(cccc1Br)O 527a_100020644852_100011935254 [0,2,0,0,0,0|2,0,0]=4 23077 B16R1.131047 O=C(NC[C@H](O)CO)c1c(cccc1Cl)O 240690a_100020644852_100000745519 [0,2,0,0,0,0|2,0,0]=4 23078 B16R1.131047 O=C(NC[C@H](O)CO)c1c(cccc1Cl)O 527a_100020644852_100000745519 [0,2,0,0,0,0|2,0,0]=4 23079 B16R1.131047 O=C(NC[C@H](O)CO)c1c(cccc1F)O 527a_100020644852_100000763259 [0,2,0,0,0,0|2,0,0]=4 23080 B16R1.131047 O=C(NC[C@H](O)CO)c1c(cccc1O)O 527a_100020644852_100000755285 [0,2,0,0,0,0|2,0,0]=4 23081 B16R1.10818 CC(C)CCC(C)C(=O)c1ccccc1Br 1458a_100000188424_100011261404 [0,2,0,0,0,0|2,0,0]=4 23082 B16R1.10818 CC(C)CCC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100011261404 [0,2,0,0,0,0|2,0,0]=4 23083 B16R1.10818 CC(C)CCC(C)C(=O)c1ccccc1F 1458a_100000188656_100011261404 [0,2,0,0,0,0|2,0,0]=4 23084 B16R1.10818 CC(C)CCC(C)C(=O)c1ccccc1I 1458a_100000187884_100011261404 [0,2,0,0,0,0|2,0,0]=4 23085 B16R1.10818 CC(C)CCC(C)C(=O)c1ccccc1O 1458a_100015234032_100011261404 [0,2,0,0,0,0|1,0,0]=3 23086 B16R1.10818 CC(C)CCC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100011261404 [0,2,0,0,0,0|1,0,1]=4 23087 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Br 11a_100000742789_100000188424 [0,2,0,0,0,0|2,0,0]=4 23088 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Br 1626a_100000742789_100000188424 [0,2,0,0,0,0|2,0,0]=4 23089 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Br 240690a_100000742789_100000188424 [0,2,0,0,0,0|2,0,0]=4 23090 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Br 527a_100000742789_100000188424 [0,2,0,0,0,0|2,0,0]=4 23091 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Cl 11a_100000742789_100000185844 [0,2,0,0,0,0|2,0,0]=4 23092 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Cl 1626a_100000742789_100000185844 [0,2,0,0,0,0|2,0,0]=4 23093 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Cl 240690a_100000742789_100000185844 [0,2,0,0,0,0|2,0,0]=4 23094 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1Cl 527a_100000742789_100000185844 [0,2,0,0,0,0|2,0,0]=4 23095 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1F 11a_100000742789_100000188656 [0,2,0,0,0,0|2,0,0]=4 23096 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1F 1626a_100000742789_100000188656 [0,2,0,0,0,0|2,0,0]=4 23097 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1F 240690a_100000742789_100000188656 [0,2,0,0,0,0|2,0,0]=4 23098 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1F 527a_100000742789_100000188656 [0,2,0,0,0,0|2,0,0]=4 23099 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1I 11a_100000742789_100000187884 [0,2,0,0,0,0|2,0,0]=4 23100 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1I 1626a_100000742789_100000187884 [0,2,0,0,0,0|2,0,0]=4 23101 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1I 240690a_100000742789_100000187884 [0,2,0,0,0,0|2,0,0]=4 23102 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1I 527a_100000742789_100000187884 [0,2,0,0,0,0|2,0,0]=4 23103 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1O 240690a_100000742789_100015234032 [0,2,0,0,0,0|1,0,0]=3 23104 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1[O-] 1626a_100000742789_100009911694 [0,2,0,0,0,0|1,0,1]=4 23105 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1[O-] 240690a_100000742789_100009911694 [0,2,0,0,0,0|1,0,1]=4 23106 B16R1.10818 CC(C)CCN(C)C(=O)c1ccccc1[O-] 527a_100000742789_100009911694 [0,2,0,0,0,0|1,0,1]=4 23107 B16R1.10818 CN(C)CCN(C)C(=O)c1ccccc1O 240690a_100000225618_100015234032 [0,2,0,0,0,0|2,0,0]=4 23108 B16R1.10818 Cc1ccccc1C(=O)C(C)CCC(C)C 1458a_100000212026_100011261404 [0,2,0,0,0,0|2,0,0]=4 23109 B16R1.10818 Cc1ccccc1C(=O)N(C)CCC(C)C 11a_100000742789_100000212026 [0,2,0,0,0,0|2,0,0]=4 23110 B16R1.10818 Cc1ccccc1C(=O)N(C)CCC(C)C 1626a_100000742789_100000212026 [0,2,0,0,0,0|2,0,0]=4 23111 B16R1.10818 Cc1ccccc1C(=O)N(C)CCC(C)C 240690a_100000742789_100000212026 [0,2,0,0,0,0|2,0,0]=4 23112 B16R1.10818 Cc1ccccc1C(=O)N(C)CCC(C)C 527a_100000742789_100000212026 [0,2,0,0,0,0|2,0,0]=4 23113 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1Br 1458a_100000188424_200011216223 [0,2,0,0,0,0|2,0,0]=4 23114 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1C 1458a_100000212026_200011216223 [0,2,0,0,0,0|2,0,0]=4 23115 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1Cl 1458a_100000185844_200011216223 [0,2,0,0,0,0|2,0,0]=4 23116 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1F 1458a_100000188656_200011216223 [0,2,0,0,0,0|2,0,0]=4 23117 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1I 1458a_100000187884_200011216223 [0,2,0,0,0,0|2,0,0]=4 23118 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1O 1458a_100015234032_200011216223 [0,2,0,0,0,0|1,0,0]=3 23119 B16R1.17802 CCCCC(CC)C(=O)c1ccccc1[O-] 1458a_100009911694_200011216223 [0,2,0,0,0,0|1,0,1]=4 23120 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Br 11a_100000207695_100000188424 [0,2,0,0,0,0|2,0,0]=4 23121 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Br 1626a_100000207695_100000188424 [0,2,0,0,0,0|2,0,0]=4 23122 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Br 240690a_100000207695_100000188424 [0,2,0,0,0,0|2,0,0]=4 23123 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Br 527a_100000207695_100000188424 [0,2,0,0,0,0|2,0,0]=4 23124 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1C 11a_100000207695_100000212026 [0,2,0,0,0,0|2,0,0]=4 23125 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1C 1626a_100000207695_100000212026 [0,2,0,0,0,0|2,0,0]=4 23126 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1C 240690a_100000207695_100000212026 [0,2,0,0,0,0|2,0,0]=4 23127 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1C 527a_100000207695_100000212026 [0,2,0,0,0,0|2,0,0]=4 23128 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Cl 11a_100000207695_100000185844 [0,2,0,0,0,0|2,0,0]=4 23129 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Cl 1626a_100000207695_100000185844 [0,2,0,0,0,0|2,0,0]=4 23130 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Cl 240690a_100000207695_100000185844 [0,2,0,0,0,0|2,0,0]=4 23131 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1Cl 527a_100000207695_100000185844 [0,2,0,0,0,0|2,0,0]=4 23132 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1F 11a_100000207695_100000188656 [0,2,0,0,0,0|2,0,0]=4 23133 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1F 1626a_100000207695_100000188656 [0,2,0,0,0,0|2,0,0]=4 23134 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1F 240690a_100000207695_100000188656 [0,2,0,0,0,0|2,0,0]=4 23135 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1F 527a_100000207695_100000188656 [0,2,0,0,0,0|2,0,0]=4 23136 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1I 11a_100000207695_100000187884 [0,2,0,0,0,0|2,0,0]=4 23137 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1I 1626a_100000207695_100000187884 [0,2,0,0,0,0|2,0,0]=4 23138 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1I 240690a_100000207695_100000187884 [0,2,0,0,0,0|2,0,0]=4 23139 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1I 527a_100000207695_100000187884 [0,2,0,0,0,0|2,0,0]=4 23140 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1O 240690a_100000207695_100015234032 [0,2,0,0,0,0|1,0,0]=3 23141 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1[O-] 1626a_100000207695_100009911694 [0,2,0,0,0,0|1,0,1]=4 23142 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1[O-] 240690a_100000207695_100009911694 [0,2,0,0,0,0|1,0,1]=4 23143 B16R1.17802 CCCCN(CC)C(=O)c1ccccc1[O-] 527a_100000207695_100009911694 [0,2,0,0,0,0|1,0,1]=4 23144 B16R1.17802 CCN(CCOC)C(=O)c1ccccc1O 240690a_100000731262_100015234032 [0,2,0,0,0,0|2,0,0]=4 23145 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Br)Br 1458a_100000690891_200011215066 [0,2,0,0,0,0|2,0,0]=4 23146 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Br)C 1458a_100000701904_200011215066 [0,2,0,0,0,0|2,0,0]=4 23147 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Br)Cl 1458a_100011253703_200011215066 [0,2,0,0,0,0|2,0,0]=4 23148 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Br)F 1458a_100000752694_200011215066 [0,2,0,0,0,0|2,0,0]=4 23149 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Br)O 1458a_100011935254_200011215066 [0,2,0,0,0,0|1,0,0]=3 23150 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1C)C 1458a_100000758298_200011215066 [0,2,0,0,0,0|2,0,0]=4 23151 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Cl)C 1458a_100000692601_200011215066 [0,2,0,0,0,0|2,0,0]=4 23152 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200011215066 [0,2,0,0,0,0|2,0,0]=4 23153 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Cl)F 1458a_100000210369_200011215066 [0,2,0,0,0,0|2,0,0]=4 23154 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1Cl)O 1458a_100000745519_200011215066 [0,2,0,0,0,0|1,0,0]=3 23155 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1F)C 1458a_100000762013_200011215066 [0,2,0,0,0,0|2,0,0]=4 23156 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1F)F 1458a_100000210804_200011215066 [0,2,0,0,0,0|2,0,0]=4 23157 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1F)O 1458a_100000763259_200011215066 [0,2,0,0,0,0|1,0,0]=3 23158 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1I)Br 1458a_100010232521_200011215066 [0,2,0,0,0,0|2,0,0]=4 23159 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1I)C 1458a_100000688020_200011215066 [0,2,0,0,0,0|2,0,0]=4 23160 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1I)Cl 1458a_100000702859_200011215066 [0,2,0,0,0,0|2,0,0]=4 23161 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1I)F 1458a_100000023732_200011215066 [0,2,0,0,0,0|2,0,0]=4 23162 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1O)C 1458a_100011934116_200011215066 [0,2,0,0,0,0|1,0,0]=3 23163 B16R1.131163 CCCCC(C)C(=O)c1c(cccc1O)O 1458a_100000755285_200011215066 [0,2,0,0,0,0|1,0,0]=3 23164 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Br 11a_100000207549_100000690891 [0,2,0,0,0,0|2,0,0]=4 23165 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Br 1626a_100000207549_100000690891 [0,2,0,0,0,0|2,0,0]=4 23166 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Br 240690a_100000207549_100000690891 [0,2,0,0,0,0|2,0,0]=4 23167 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Br 527a_100000207549_100000690891 [0,2,0,0,0,0|2,0,0]=4 23168 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)C 11a_100000207549_100000701904 [0,2,0,0,0,0|2,0,0]=4 23169 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)C 1626a_100000207549_100000701904 [0,2,0,0,0,0|2,0,0]=4 23170 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)C 240690a_100000207549_100000701904 [0,2,0,0,0,0|2,0,0]=4 23171 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)C 527a_100000207549_100000701904 [0,2,0,0,0,0|2,0,0]=4 23172 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Cl 11a_100000207549_100011253703 [0,2,0,0,0,0|2,0,0]=4 23173 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Cl 1626a_100000207549_100011253703 [0,2,0,0,0,0|2,0,0]=4 23174 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Cl 240690a_100000207549_100011253703 [0,2,0,0,0,0|2,0,0]=4 23175 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)Cl 527a_100000207549_100011253703 [0,2,0,0,0,0|2,0,0]=4 23176 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)F 11a_100000207549_100000752694 [0,2,0,0,0,0|2,0,0]=4 23177 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)F 1626a_100000207549_100000752694 [0,2,0,0,0,0|2,0,0]=4 23178 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)F 240690a_100000207549_100000752694 [0,2,0,0,0,0|2,0,0]=4 23179 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)F 527a_100000207549_100000752694 [0,2,0,0,0,0|2,0,0]=4 23180 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)O 240690a_100000207549_100011935254 [0,2,0,0,0,0|1,0,0]=3 23181 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Br)O 527a_100000207549_100011935254 [0,2,0,0,0,0|1,0,0]=3 23182 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1C)C 11a_100000207549_100000758298 [0,2,0,0,0,0|2,0,0]=4 23183 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1C)C 1626a_100000207549_100000758298 [0,2,0,0,0,0|2,0,0]=4 23184 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1C)C 240690a_100000207549_100000758298 [0,2,0,0,0,0|2,0,0]=4 23185 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)C 11a_100000207549_100000692601 [0,2,0,0,0,0|2,0,0]=4 23186 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)C 1626a_100000207549_100000692601 [0,2,0,0,0,0|2,0,0]=4 23187 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)C 240690a_100000207549_100000692601 [0,2,0,0,0,0|2,0,0]=4 23188 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)Cl 11a_100000207549_100000210656 [0,2,0,0,0,0|2,0,0]=4 23189 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)Cl 1626a_100000207549_100000210656 [0,2,0,0,0,0|2,0,0]=4 23190 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)Cl 240690a_100000207549_100000210656 [0,2,0,0,0,0|2,0,0]=4 23191 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)F 11a_100000207549_100000210369 [0,2,0,0,0,0|2,0,0]=4 23192 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)F 1626a_100000207549_100000210369 [0,2,0,0,0,0|2,0,0]=4 23193 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)F 240690a_100000207549_100000210369 [0,2,0,0,0,0|2,0,0]=4 23194 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)F 527a_100000207549_100000210369 [0,2,0,0,0,0|2,0,0]=4 23195 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)O 240690a_100000207549_100000745519 [0,2,0,0,0,0|1,0,0]=3 23196 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1Cl)O 527a_100000207549_100000745519 [0,2,0,0,0,0|1,0,0]=3 23197 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)C 11a_100000207549_100000762013 [0,2,0,0,0,0|2,0,0]=4 23198 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)C 1626a_100000207549_100000762013 [0,2,0,0,0,0|2,0,0]=4 23199 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)C 240690a_100000207549_100000762013 [0,2,0,0,0,0|2,0,0]=4 23200 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)C 527a_100000207549_100000762013 [0,2,0,0,0,0|2,0,0]=4 23201 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)F 11a_100000207549_100000210804 [0,2,0,0,0,0|2,0,0]=4 23202 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)F 1626a_100000207549_100000210804 [0,2,0,0,0,0|2,0,0]=4 23203 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)F 240690a_100000207549_100000210804 [0,2,0,0,0,0|2,0,0]=4 23204 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)F 527a_100000207549_100000210804 [0,2,0,0,0,0|2,0,0]=4 23205 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1F)O 527a_100000207549_100000763259 [0,2,0,0,0,0|1,0,0]=3 23206 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Br 11a_100000207549_100010232521 [0,2,0,0,0,0|2,0,0]=4 23207 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Br 1626a_100000207549_100010232521 [0,2,0,0,0,0|2,0,0]=4 23208 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Br 240690a_100000207549_100010232521 [0,2,0,0,0,0|2,0,0]=4 23209 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Br 527a_100000207549_100010232521 [0,2,0,0,0,0|2,0,0]=4 23210 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)C 11a_100000207549_100000688020 [0,2,0,0,0,0|2,0,0]=4 23211 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)C 1626a_100000207549_100000688020 [0,2,0,0,0,0|2,0,0]=4 23212 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)C 240690a_100000207549_100000688020 [0,2,0,0,0,0|2,0,0]=4 23213 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Cl 11a_100000207549_100000702859 [0,2,0,0,0,0|2,0,0]=4 23214 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Cl 1626a_100000207549_100000702859 [0,2,0,0,0,0|2,0,0]=4 23215 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Cl 240690a_100000207549_100000702859 [0,2,0,0,0,0|2,0,0]=4 23216 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)Cl 527a_100000207549_100000702859 [0,2,0,0,0,0|2,0,0]=4 23217 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)F 11a_100000207549_100000023732 [0,2,0,0,0,0|2,0,0]=4 23218 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)F 1626a_100000207549_100000023732 [0,2,0,0,0,0|2,0,0]=4 23219 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1I)F 240690a_100000207549_100000023732 [0,2,0,0,0,0|2,0,0]=4 23220 B16R1.131163 CCCCN(C)C(=O)c1c(cccc1O)O 527a_100000207549_100000755285 [0,2,0,0,0,0|1,0,0]=3 23221 B16R1.131163 CN(CCCO)C(=O)c1c(cccc1Br)O 240690a_100000213112_100011935254 [0,2,0,0,0,0|2,0,0]=4 23222 B16R1.131163 CN(CCCO)C(=O)c1c(cccc1Br)O 527a_100000213112_100011935254 [0,2,0,0,0,0|2,0,0]=4 23223 B16R1.131163 CN(CCCO)C(=O)c1c(cccc1Cl)O 240690a_100000213112_100000745519 [0,2,0,0,0,0|2,0,0]=4 23224 B16R1.131163 CN(CCCO)C(=O)c1c(cccc1Cl)O 527a_100000213112_100000745519 [0,2,0,0,0,0|2,0,0]=4 23225 B16R1.131163 CN(CCCO)C(=O)c1c(cccc1F)O 527a_100000213112_100000763259 [0,2,0,0,0,0|2,0,0]=4 23226 B16R1.131163 CN(CCCO)C(=O)c1c(cccc1O)O 527a_100000213112_100000755285 [0,2,0,0,0,0|2,0,0]=4 23227 B16R1.131163 COCCN(C)C(=O)c1c(cccc1Br)O 240690a_100000743101_100011935254 [0,2,0,0,0,0|2,0,0]=4 23228 B16R1.131163 COCCN(C)C(=O)c1c(cccc1Br)O 527a_100000743101_100011935254 [0,2,0,0,0,0|2,0,0]=4 23229 B16R1.131163 COCCN(C)C(=O)c1c(cccc1Cl)O 240690a_100000743101_100000745519 [0,2,0,0,0,0|2,0,0]=4 23230 B16R1.131163 COCCN(C)C(=O)c1c(cccc1Cl)O 527a_100000743101_100000745519 [0,2,0,0,0,0|2,0,0]=4 23231 B16R1.131163 COCCN(C)C(=O)c1c(cccc1F)O 527a_100000743101_100000763259 [0,2,0,0,0,0|2,0,0]=4 23232 B16R1.131163 COCCN(C)C(=O)c1c(cccc1O)O 527a_100000743101_100000755285 [0,2,0,0,0,0|2,0,0]=4 23233 B16R1.131163 CSCCN(C)C(=O)c1c(cccc1Br)O 240690a_100000686725_100011935254 [0,2,0,0,0,0|2,0,0]=4 23234 B16R1.131163 CSCCN(C)C(=O)c1c(cccc1Br)O 527a_100000686725_100011935254 [0,2,0,0,0,0|2,0,0]=4 23235 B16R1.131163 CSCCN(C)C(=O)c1c(cccc1Cl)O 240690a_100000686725_100000745519 [0,2,0,0,0,0|2,0,0]=4 23236 B16R1.131163 CSCCN(C)C(=O)c1c(cccc1Cl)O 527a_100000686725_100000745519 [0,2,0,0,0,0|2,0,0]=4 23237 B16R1.131163 CSCCN(C)C(=O)c1c(cccc1F)O 527a_100000686725_100000763259 [0,2,0,0,0,0|2,0,0]=4 23238 B16R1.131163 CSCCN(C)C(=O)c1c(cccc1O)O 527a_100000686725_100000755285 [0,2,0,0,0,0|2,0,0]=4 23239 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Br 11a_100000738805_100000188424 [0,2,0,0,0,0|2,0,0]=4 23240 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Br 1626a_100000738805_100000188424 [0,2,0,0,0,0|2,0,0]=4 23241 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Br 240690a_100000738805_100000188424 [0,2,0,0,0,0|2,0,0]=4 23242 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Br 527a_100000738805_100000188424 [0,2,0,0,0,0|2,0,0]=4 23243 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Cl 11a_100000738805_100000185844 [0,2,0,0,0,0|2,0,0]=4 23244 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Cl 1626a_100000738805_100000185844 [0,2,0,0,0,0|2,0,0]=4 23245 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Cl 240690a_100000738805_100000185844 [0,2,0,0,0,0|2,0,0]=4 23246 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1Cl 527a_100000738805_100000185844 [0,2,0,0,0,0|2,0,0]=4 23247 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1F 11a_100000738805_100000188656 [0,2,0,0,0,0|2,0,0]=4 23248 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1F 1626a_100000738805_100000188656 [0,2,0,0,0,0|2,0,0]=4 23249 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1F 240690a_100000738805_100000188656 [0,2,0,0,0,0|2,0,0]=4 23250 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1F 527a_100000738805_100000188656 [0,2,0,0,0,0|2,0,0]=4 23251 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1I 11a_100000738805_100000187884 [0,2,0,0,0,0|2,0,0]=4 23252 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1I 1626a_100000738805_100000187884 [0,2,0,0,0,0|2,0,0]=4 23253 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1I 240690a_100000738805_100000187884 [0,2,0,0,0,0|2,0,0]=4 23254 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1I 527a_100000738805_100000187884 [0,2,0,0,0,0|2,0,0]=4 23255 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1O 240690a_100000738805_100015234032 [0,2,0,0,0,0|1,0,0]=3 23256 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1[O-] 1626a_100000738805_100009911694 [0,2,0,0,0,0|1,0,1]=4 23257 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1[O-] 240690a_100000738805_100009911694 [0,2,0,0,0,0|1,0,1]=4 23258 B16R1.7397 CC(C)(C)CCNC(=O)c1ccccc1[O-] 527a_100000738805_100009911694 [0,2,0,0,0,0|1,0,1]=4 23259 B16R1.7397 CC(C)(C)CSCC(=O)c1ccccc1O 62a_100000188908_100011219605 [0,2,0,0,0,0|2,0,0]=4 23260 B16R1.7397 CC(C)(C)CSCC(=O)c1ccccc1O 62a_100011219605_100000188908 [0,2,0,0,0,0|2,0,0]=4 23261 B16R1.7397 CC(C)(C)OCCC(=O)c1ccccc1O 7a_100015890283_100009873196 [0,2,0,0,0,0|2,0,0]=4 23262 B16R1.7397 CC(C)(C)SCCC(=O)c1ccccc1O 62a_100000211941_100009873196 [0,2,0,0,0,0|2,0,0]=4 23263 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Br 11a_100016253952_100000188424 [0,2,0,0,0,0|2,0,0]=4 23264 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Br 1626a_100016253952_100000188424 [0,2,0,0,0,0|2,0,0]=4 23265 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Br 240690a_100016253952_100000188424 [0,2,0,0,0,0|2,0,0]=4 23266 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Br 527a_100016253952_100000188424 [0,2,0,0,0,0|2,0,0]=4 23267 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Cl 11a_100016253952_100000185844 [0,2,0,0,0,0|2,0,0]=4 23268 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Cl 1626a_100016253952_100000185844 [0,2,0,0,0,0|2,0,0]=4 23269 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Cl 240690a_100016253952_100000185844 [0,2,0,0,0,0|2,0,0]=4 23270 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1Cl 527a_100016253952_100000185844 [0,2,0,0,0,0|2,0,0]=4 23271 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1F 11a_100016253952_100000188656 [0,2,0,0,0,0|2,0,0]=4 23272 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1F 1626a_100016253952_100000188656 [0,2,0,0,0,0|2,0,0]=4 23273 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1F 240690a_100016253952_100000188656 [0,2,0,0,0,0|2,0,0]=4 23274 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1F 527a_100016253952_100000188656 [0,2,0,0,0,0|2,0,0]=4 23275 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1I 11a_100016253952_100000187884 [0,2,0,0,0,0|2,0,0]=4 23276 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1I 1626a_100016253952_100000187884 [0,2,0,0,0,0|2,0,0]=4 23277 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1I 240690a_100016253952_100000187884 [0,2,0,0,0,0|2,0,0]=4 23278 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1I 527a_100016253952_100000187884 [0,2,0,0,0,0|2,0,0]=4 23279 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1O 240690a_100016253952_100015234032 [0,2,0,0,0,0|1,0,0]=3 23280 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1[O-] 1626a_100016253952_100009911694 [0,2,0,0,0,0|1,0,1]=4 23281 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1[O-] 240690a_100016253952_100009911694 [0,2,0,0,0,0|1,0,1]=4 23282 B16R1.7397 CC(C)(F)CCNC(=O)c1ccccc1[O-] 527a_100016253952_100009911694 [0,2,0,0,0,0|1,0,1]=4 23283 B16R1.7397 CC(C)(F)CSCC(=O)c1ccccc1O 62a_100000188908_100011997219 [0,2,0,0,0,0|2,0,0]=4 23284 B16R1.7397 CC(C)(F)CSCC(=O)c1ccccc1O 62a_100011997219_100000188908 [0,2,0,0,0,0|2,0,0]=4 23285 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1Br 1626a_100000707701_100000188424 [0,2,0,0,0,0|2,0,0]=4 23286 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1Br 527a_100000707701_100000188424 [0,2,0,0,0,0|2,0,0]=4 23287 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1Cl 1626a_100000707701_100000185844 [0,2,0,0,0,0|2,0,0]=4 23288 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1Cl 527a_100000707701_100000185844 [0,2,0,0,0,0|2,0,0]=4 23289 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1F 1626a_100000707701_100000188656 [0,2,0,0,0,0|2,0,0]=4 23290 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1F 527a_100000707701_100000188656 [0,2,0,0,0,0|2,0,0]=4 23291 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1I 1626a_100000707701_100000187884 [0,2,0,0,0,0|2,0,0]=4 23292 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1I 527a_100000707701_100000187884 [0,2,0,0,0,0|2,0,0]=4 23293 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1[O-] 1626a_100000707701_100009911694 [0,2,0,0,0,0|1,0,1]=4 23294 B16R1.7397 CC(C)(O)CCNC(=O)c1ccccc1[O-] 527a_100000707701_100009911694 [0,2,0,0,0,0|1,0,1]=4 23295 B16R1.7397 CC(C)(O)CSCC(=O)c1ccccc1O 62a_100000188908_100000764493 [0,2,0,0,0,0|2,0,0]=4 23296 B16R1.7397 CC(C)(O)CSCC(=O)c1ccccc1O 62a_100000764493_100000188908 [0,2,0,0,0,0|2,0,0]=4 23297 B16R1.7397 CS(=O)(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100000754308 [0,2,0,0,0,0|2,0,0]=4 23298 B16R1.7397 CS(=O)(=O)CCNC(=O)c1ccccc1O 240690a_100000740961_100015234032 [0,2,0,0,0,0|2,0,0]=4 23299 B16R1.7397 C[N+](C)(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100016990835 [0,2,0,0,0,0|2,0,0]=4 23300 B16R1.7397 C[N+](C)(C)CCNC(=O)c1ccccc1O 240690a_100000106457_100015234032 [0,2,0,0,0,0|2,0,0]=4 23301 B16R1.7397 C[Si](C)(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100011219597 [0,2,0,0,0,0|1,1,0]=4 23302 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)C 11a_100000738805_100000212026 [0,2,0,0,0,0|2,0,0]=4 23303 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)C 1626a_100000738805_100000212026 [0,2,0,0,0,0|2,0,0]=4 23304 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)C 240690a_100000738805_100000212026 [0,2,0,0,0,0|2,0,0]=4 23305 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)C 527a_100000738805_100000212026 [0,2,0,0,0,0|2,0,0]=4 23306 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)F 11a_100016253952_100000212026 [0,2,0,0,0,0|2,0,0]=4 23307 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)F 1626a_100016253952_100000212026 [0,2,0,0,0,0|2,0,0]=4 23308 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)F 240690a_100016253952_100000212026 [0,2,0,0,0,0|2,0,0]=4 23309 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)F 527a_100016253952_100000212026 [0,2,0,0,0,0|2,0,0]=4 23310 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)O 1626a_100000707701_100000212026 [0,2,0,0,0,0|2,0,0]=4 23311 B16R1.7397 Cc1ccccc1C(=O)NCCC(C)(C)O 527a_100000707701_100000212026 [0,2,0,0,0,0|2,0,0]=4 23312 B16R1.7397 O=C(CCCC(F)(F)F)c1ccccc1O 1458a_100015234032_100011216173 [0,2,0,0,0,0|2,0,0]=4 23313 B16R1.7397 O=C(NCCC(F)(F)F)c1ccccc1O 240690a_100000740434_100015234032 [0,2,0,0,0,0|2,0,0]=4 23314 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011215641 [0,2,0,0,0,0|1,0,1]=4 23315 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011215641 [0,2,0,0,0,0|1,0,1]=4 23316 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011215641 [0,2,0,0,0,0|1,0,1]=4 23317 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100011215641 [0,2,0,0,0,0|1,0,1]=4 23318 B16R1.44936 CC(=O)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011215641 [0,2,0,0,0,0|1,0,1]=4 23319 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100011214892 [0,2,0,0,0,0|2,0,0]=4 23320 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100011214892 [0,2,0,0,0,0|2,0,0]=4 23321 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_100011214892 [0,2,0,0,0,0|2,0,0]=4 23322 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100011214892 [0,2,0,0,0,0|1,0,0]=3 23323 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100011214892 [0,2,0,0,0,0|2,0,0]=4 23324 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100011214892 [0,2,0,0,0,0|2,0,0]=4 23325 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100011214892 [0,2,0,0,0,0|1,0,0]=3 23326 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1F)F 1458a_100000210804_100011214892 [0,2,0,0,0,0|2,0,0]=4 23327 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100011214892 [0,2,0,0,0,0|1,0,0]=3 23328 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_100011214892 [0,2,0,0,0,0|2,0,0]=4 23329 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100011214892 [0,2,0,0,0,0|2,0,0]=4 23330 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1I)F 1458a_100000023732_100011214892 [0,2,0,0,0,0|2,0,0]=4 23331 B16R1.44936 CC(C)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100011214892 [0,2,0,0,0,0|1,0,0]=3 23332 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Br 11a_100000210545_100000690891 [0,2,0,0,0,0|2,0,0]=4 23333 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Br 1626a_100000210545_100000690891 [0,2,0,0,0,0|2,0,0]=4 23334 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Br 240690a_100000210545_100000690891 [0,2,0,0,0,0|2,0,0]=4 23335 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Br 527a_100000210545_100000690891 [0,2,0,0,0,0|2,0,0]=4 23336 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Cl 11a_100000210545_100011253703 [0,2,0,0,0,0|2,0,0]=4 23337 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Cl 1626a_100000210545_100011253703 [0,2,0,0,0,0|2,0,0]=4 23338 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Cl 240690a_100000210545_100011253703 [0,2,0,0,0,0|2,0,0]=4 23339 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)Cl 527a_100000210545_100011253703 [0,2,0,0,0,0|2,0,0]=4 23340 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)F 11a_100000210545_100000752694 [0,2,0,0,0,0|2,0,0]=4 23341 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)F 1626a_100000210545_100000752694 [0,2,0,0,0,0|2,0,0]=4 23342 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)F 240690a_100000210545_100000752694 [0,2,0,0,0,0|2,0,0]=4 23343 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)F 527a_100000210545_100000752694 [0,2,0,0,0,0|2,0,0]=4 23344 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)O 240690a_100000210545_100011935254 [0,2,0,0,0,0|1,0,0]=3 23345 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Br)O 527a_100000210545_100011935254 [0,2,0,0,0,0|1,0,0]=3 23346 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)Cl 11a_100000210545_100000210656 [0,2,0,0,0,0|2,0,0]=4 23347 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)Cl 1626a_100000210545_100000210656 [0,2,0,0,0,0|2,0,0]=4 23348 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)Cl 240690a_100000210545_100000210656 [0,2,0,0,0,0|2,0,0]=4 23349 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)F 11a_100000210545_100000210369 [0,2,0,0,0,0|2,0,0]=4 23350 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)F 1626a_100000210545_100000210369 [0,2,0,0,0,0|2,0,0]=4 23351 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)F 240690a_100000210545_100000210369 [0,2,0,0,0,0|2,0,0]=4 23352 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)F 527a_100000210545_100000210369 [0,2,0,0,0,0|2,0,0]=4 23353 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)O 240690a_100000210545_100000745519 [0,2,0,0,0,0|1,0,0]=3 23354 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1Cl)O 527a_100000210545_100000745519 [0,2,0,0,0,0|1,0,0]=3 23355 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1F)F 11a_100000210545_100000210804 [0,2,0,0,0,0|2,0,0]=4 23356 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1F)F 1626a_100000210545_100000210804 [0,2,0,0,0,0|2,0,0]=4 23357 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1F)F 240690a_100000210545_100000210804 [0,2,0,0,0,0|2,0,0]=4 23358 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1F)F 527a_100000210545_100000210804 [0,2,0,0,0,0|2,0,0]=4 23359 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1F)O 527a_100000210545_100000763259 [0,2,0,0,0,0|1,0,0]=3 23360 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Br 11a_100000210545_100010232521 [0,2,0,0,0,0|2,0,0]=4 23361 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Br 1626a_100000210545_100010232521 [0,2,0,0,0,0|2,0,0]=4 23362 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Br 240690a_100000210545_100010232521 [0,2,0,0,0,0|2,0,0]=4 23363 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Br 527a_100000210545_100010232521 [0,2,0,0,0,0|2,0,0]=4 23364 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Cl 11a_100000210545_100000702859 [0,2,0,0,0,0|2,0,0]=4 23365 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Cl 1626a_100000210545_100000702859 [0,2,0,0,0,0|2,0,0]=4 23366 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Cl 240690a_100000210545_100000702859 [0,2,0,0,0,0|2,0,0]=4 23367 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)Cl 527a_100000210545_100000702859 [0,2,0,0,0,0|2,0,0]=4 23368 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)F 11a_100000210545_100000023732 [0,2,0,0,0,0|2,0,0]=4 23369 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)F 1626a_100000210545_100000023732 [0,2,0,0,0,0|2,0,0]=4 23370 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1I)F 240690a_100000210545_100000023732 [0,2,0,0,0,0|2,0,0]=4 23371 B16R1.44936 CC(C)CCNC(=O)c1c(cccc1O)O 527a_100000210545_100000755285 [0,2,0,0,0,0|1,0,0]=3 23372 B16R1.44936 CC(C)CNNC(=O)c1c(cccc1Br)O 22a_100000696102_100011935254 [0,2,0,0,0,0|2,0,0]=4 23373 B16R1.44936 CC(C)CNNC(=O)c1c(cccc1Cl)O 22a_100000696102_100000745519 [0,2,0,0,0,0|2,0,0]=4 23374 B16R1.44936 CC(C)CNNC(=O)c1c(cccc1F)O 22a_100000696102_100000763259 [0,2,0,0,0,0|2,0,0]=4 23375 B16R1.44936 CC(C)OCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000211751 [0,2,0,0,0,0|2,0,0]=4 23376 B16R1.44936 CC(C)OCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000211751 [0,2,0,0,0,0|2,0,0]=4 23377 B16R1.44936 CC(C)OCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000211751 [0,2,0,0,0,0|2,0,0]=4 23378 B16R1.44936 CC(C)OCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000211751 [0,2,0,0,0,0|2,0,0]=4 23379 B16R1.44936 CC(C)SCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000730970 [0,2,0,0,0,0|2,0,0]=4 23380 B16R1.44936 CC(C)SCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000730970 [0,2,0,0,0,0|2,0,0]=4 23381 B16R1.44936 CC(C)SCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000730970 [0,2,0,0,0,0|2,0,0]=4 23382 B16R1.44936 CC(C)SCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000730970 [0,2,0,0,0,0|2,0,0]=4 23383 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000718107 [0,2,0,0,0,0|2,0,0]=4 23384 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000718107 [0,2,0,0,0,0|2,0,0]=4 23385 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Br)F 1458a_100000752694_200000718107 [0,2,0,0,0,0|2,0,0]=4 23386 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_200000718107 [0,2,0,0,0,0|1,0,0]=3 23387 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000718107 [0,2,0,0,0,0|2,0,0]=4 23388 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000718107 [0,2,0,0,0,0|2,0,0]=4 23389 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000718107 [0,2,0,0,0,0|1,0,0]=3 23390 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1F)F 1458a_100000210804_200000718107 [0,2,0,0,0,0|2,0,0]=4 23391 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_200000718107 [0,2,0,0,0,0|1,0,0]=3 23392 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1I)Br 1458a_100010232521_200000718107 [0,2,0,0,0,0|2,0,0]=4 23393 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000718107 [0,2,0,0,0,0|2,0,0]=4 23394 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1I)F 1458a_100000023732_200000718107 [0,2,0,0,0,0|2,0,0]=4 23395 B16R1.44936 CC(O)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_200000718107 [0,2,0,0,0,0|1,0,0]=3 23396 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)Br 240690a_200000755665_100000690891 [0,2,0,0,0,0|2,0,0]=4 23397 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)Br 527a_200000755665_100000690891 [0,2,0,0,0,0|2,0,0]=4 23398 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)Cl 240690a_200000755665_100011253703 [0,2,0,0,0,0|2,0,0]=4 23399 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)Cl 527a_200000755665_100011253703 [0,2,0,0,0,0|2,0,0]=4 23400 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)F 240690a_200000755665_100000752694 [0,2,0,0,0,0|2,0,0]=4 23401 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)F 527a_200000755665_100000752694 [0,2,0,0,0,0|2,0,0]=4 23402 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)O 240690a_200000755665_100011935254 [0,2,0,0,0,0|1,0,0]=3 23403 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Br)O 527a_200000755665_100011935254 [0,2,0,0,0,0|1,0,0]=3 23404 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)Cl 240690a_200000755665_100000210656 [0,2,0,0,0,0|2,0,0]=4 23405 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)F 240690a_200000755665_100000210369 [0,2,0,0,0,0|2,0,0]=4 23406 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)F 527a_200000755665_100000210369 [0,2,0,0,0,0|2,0,0]=4 23407 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)O 240690a_200000755665_100000745519 [0,2,0,0,0,0|1,0,0]=3 23408 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1Cl)O 527a_200000755665_100000745519 [0,2,0,0,0,0|1,0,0]=3 23409 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1F)F 240690a_200000755665_100000210804 [0,2,0,0,0,0|2,0,0]=4 23410 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1F)F 527a_200000755665_100000210804 [0,2,0,0,0,0|2,0,0]=4 23411 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1F)O 527a_200000755665_100000763259 [0,2,0,0,0,0|1,0,0]=3 23412 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1I)Br 240690a_200000755665_100010232521 [0,2,0,0,0,0|2,0,0]=4 23413 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1I)Br 527a_200000755665_100010232521 [0,2,0,0,0,0|2,0,0]=4 23414 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1I)Cl 240690a_200000755665_100000702859 [0,2,0,0,0,0|2,0,0]=4 23415 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1I)Cl 527a_200000755665_100000702859 [0,2,0,0,0,0|2,0,0]=4 23416 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1I)F 240690a_200000755665_100000023732 [0,2,0,0,0,0|2,0,0]=4 23417 B16R1.44936 CC(O)CCNC(=O)c1c(cccc1O)O 527a_200000755665_100000755285 [0,2,0,0,0,0|1,0,0]=3 23418 B16R1.44936 CC(O)CNNC(=O)c1c(cccc1Br)O 22a_200000730056_100011935254 [0,2,0,0,0,0|2,0,0]=4 23419 B16R1.44936 CC(O)CNNC(=O)c1c(cccc1Cl)O 22a_200000730056_100000745519 [0,2,0,0,0,0|2,0,0]=4 23420 B16R1.44936 CC(O)CNNC(=O)c1c(cccc1F)O 22a_200000730056_100000763259 [0,2,0,0,0,0|2,0,0]=4 23421 B16R1.44936 CN(C)CCCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000695564 [0,2,0,0,0,0|2,0,0]=4 23422 B16R1.44936 CN(C)CCCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000695564 [0,2,0,0,0,0|2,0,0]=4 23423 B16R1.44936 CN(C)CCCC(=O)c1c(cccc1F)O 1458a_100000763259_100000695564 [0,2,0,0,0,0|2,0,0]=4 23424 B16R1.44936 CN(C)CCCC(=O)c1c(cccc1O)O 1458a_100000755285_100000695564 [0,2,0,0,0,0|2,0,0]=4 23425 B16R1.44936 CN(C)CCNC(=O)c1c(cccc1Br)O 240690a_100000210585_100011935254 [0,2,0,0,0,0|2,0,0]=4 23426 B16R1.44936 CN(C)CCNC(=O)c1c(cccc1Br)O 527a_100000210585_100011935254 [0,2,0,0,0,0|2,0,0]=4 23427 B16R1.44936 CN(C)CCNC(=O)c1c(cccc1Cl)O 240690a_100000210585_100000745519 [0,2,0,0,0,0|2,0,0]=4 23428 B16R1.44936 CN(C)CCNC(=O)c1c(cccc1Cl)O 527a_100000210585_100000745519 [0,2,0,0,0,0|2,0,0]=4 23429 B16R1.44936 CN(C)CCNC(=O)c1c(cccc1F)O 527a_100000210585_100000763259 [0,2,0,0,0,0|2,0,0]=4 23430 B16R1.44936 CN(C)CCNC(=O)c1c(cccc1O)O 527a_100000210585_100000755285 [0,2,0,0,0,0|2,0,0]=4 23431 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)C)Br 1458a_100000701904_100011214892 [0,2,0,0,0,0|2,0,0]=4 23432 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)C)C 1458a_100000758298_100011214892 [0,2,0,0,0,0|2,0,0]=4 23433 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)C)Cl 1458a_100000692601_100011214892 [0,2,0,0,0,0|2,0,0]=4 23434 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)C)F 1458a_100000762013_100011214892 [0,2,0,0,0,0|2,0,0]=4 23435 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)C)I 1458a_100000688020_100011214892 [0,2,0,0,0,0|2,0,0]=4 23436 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)C)O 1458a_100011934116_100011214892 [0,2,0,0,0,0|1,0,0]=3 23437 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)Br 1458a_100000701904_200000718107 [0,2,0,0,0,0|2,0,0]=4 23438 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)C 1458a_100000758298_200000718107 [0,2,0,0,0,0|2,0,0]=4 23439 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)Cl 1458a_100000692601_200000718107 [0,2,0,0,0,0|2,0,0]=4 23440 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)F 1458a_100000762013_200000718107 [0,2,0,0,0,0|2,0,0]=4 23441 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)I 1458a_100000688020_200000718107 [0,2,0,0,0,0|2,0,0]=4 23442 B16R1.44936 Cc1cccc(c1C(=O)CCCC(C)O)O 1458a_100011934116_200000718107 [0,2,0,0,0,0|1,0,0]=3 23443 B16R1.44936 Cc1cccc(c1C(=O)CCCN(C)C)O 1458a_100011934116_100000695564 [0,2,0,0,0,0|2,0,0]=4 23444 B16R1.44936 Cc1cccc(c1C(=O)CCOC(C)C)O 1458a_100011934116_100000211751 [0,2,0,0,0,0|2,0,0]=4 23445 B16R1.44936 Cc1cccc(c1C(=O)CCSC(C)C)O 1458a_100011934116_100000730970 [0,2,0,0,0,0|2,0,0]=4 23446 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Br 11a_100000210545_100000701904 [0,2,0,0,0,0|2,0,0]=4 23447 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Br 1626a_100000210545_100000701904 [0,2,0,0,0,0|2,0,0]=4 23448 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Br 240690a_100000210545_100000701904 [0,2,0,0,0,0|2,0,0]=4 23449 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Br 527a_100000210545_100000701904 [0,2,0,0,0,0|2,0,0]=4 23450 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)C 11a_100000210545_100000758298 [0,2,0,0,0,0|2,0,0]=4 23451 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)C 1626a_100000210545_100000758298 [0,2,0,0,0,0|2,0,0]=4 23452 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)C 240690a_100000210545_100000758298 [0,2,0,0,0,0|2,0,0]=4 23453 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Cl 11a_100000210545_100000692601 [0,2,0,0,0,0|2,0,0]=4 23454 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000692601 [0,2,0,0,0,0|2,0,0]=4 23455 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000692601 [0,2,0,0,0,0|2,0,0]=4 23456 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)F 11a_100000210545_100000762013 [0,2,0,0,0,0|2,0,0]=4 23457 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)F 1626a_100000210545_100000762013 [0,2,0,0,0,0|2,0,0]=4 23458 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)F 240690a_100000210545_100000762013 [0,2,0,0,0,0|2,0,0]=4 23459 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)F 527a_100000210545_100000762013 [0,2,0,0,0,0|2,0,0]=4 23460 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)I 11a_100000210545_100000688020 [0,2,0,0,0,0|2,0,0]=4 23461 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)I 1626a_100000210545_100000688020 [0,2,0,0,0,0|2,0,0]=4 23462 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)C)I 240690a_100000210545_100000688020 [0,2,0,0,0,0|2,0,0]=4 23463 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)Br 240690a_200000755665_100000701904 [0,2,0,0,0,0|2,0,0]=4 23464 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)Br 527a_200000755665_100000701904 [0,2,0,0,0,0|2,0,0]=4 23465 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)C 240690a_200000755665_100000758298 [0,2,0,0,0,0|2,0,0]=4 23466 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)Cl 240690a_200000755665_100000692601 [0,2,0,0,0,0|2,0,0]=4 23467 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)F 240690a_200000755665_100000762013 [0,2,0,0,0,0|2,0,0]=4 23468 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)F 527a_200000755665_100000762013 [0,2,0,0,0,0|2,0,0]=4 23469 B16R1.44936 Cc1cccc(c1C(=O)NCCC(C)O)I 240690a_200000755665_100000688020 [0,2,0,0,0,0|2,0,0]=4 23470 B16R1.44936 Cc1cccc(c1C(=O)NNCC(C)C)O 22a_100000696102_100011934116 [0,2,0,0,0,0|2,0,0]=4 23471 B16R1.44936 Cc1cccc(c1C(=O)NNCC(C)O)O 22a_200000730056_100011934116 [0,2,0,0,0,0|2,0,0]=4 23472 B14R1.903 C=C(C)c1ccccc1OCCCC 271570a_100000694244_100000230755 [0,0,1,1,0,0|2,0,0]=4 23473 B14R1.86 CCCCCC(=O)C=Cc1cccs1 1458a_100000182767_100000210326 [0,0,1,1,0,0|1,1,0]=4 23474 B14R1.86 CCCCNC(=O)C=Cc1cccs1 11a_100000102301_100000182767 [0,0,1,1,0,0|1,1,0]=4 23475 B14R1.86 CCCCNC(=O)C=Cc1cccs1 1626a_100000102301_100000182767 [0,0,1,1,0,0|1,1,0]=4 23476 B14R1.86 CCCCNC(=O)C=Cc1cccs1 240690a_100000102301_100000182767 [0,0,1,1,0,0|1,1,0]=4 23477 B14R1.86 CCCCOC(=O)CSc1ccco1 62a_100000211628_100009814098 [0,0,1,1,0,0|1,0,1]=4 23478 B14R1.86 CCCCOC(=O)CSc1ccco1 62a_100009814098_100000211628 [0,0,1,1,0,0|1,0,1]=4 23479 B14R1.86 CCCNNC(=O)C=Cc1ccco1 22a_100000740057_100000720202 [0,0,1,1,0,0|2,0,0]=4 23480 B14R1.898 CC=Cc1cccc(c1)OCCCC 271570a_100016259895_200011212284 [0,0,1,1,0,0|2,0,0]=4 23481 B14R1.898 CC=Cc1cccc(n1)OCCCC 271570a_100016259895_200011960251 [0,0,1,1,0,0|2,0,0]=4 23482 B14R2.114 O=C(c1ccccc1)C2CCCC2 1458a_100000185807_100000179811 [1,0,0,1,0,0|1,0,0]=3 23483 B14R2.114 O=C(c1ccccc1)C2CCOC2 1458a_100000185807_100000690089 [1,0,0,1,0,0|2,0,0]=4 23484 B14R2.114 O=C(c1ccccc1)N2CCCC2 240690a_100000188435_100000185807 [1,0,0,1,0,0|1,0,0]=3 23485 B14R2.114 O=C(c1ccccc1)N2CCCC2 527a_100000188435_100000185807 [1,0,0,1,0,0|1,0,0]=3 23486 B14R2.114 O=C(c1ccccc1)N2CCSC2 11a_100011215254_100000185807 [1,0,0,1,0,0|2,0,0]=4 23487 B14R2.114 O=C(c1ccccc1)N2CCSC2 240690a_100011215254_100000185807 [1,0,0,1,0,0|2,0,0]=4 23488 B14R2.114 O=C(c1ccccc1)N2CCSC2 527a_100011215254_100000185807 [1,0,0,1,0,0|2,0,0]=4 23489 B14R2.335 CC1CCN1C(=O)c2ccccc2 11a_100000755817_100000185807 [1,0,0,1,0,0|1,0,0]=3 23490 B14R2.335 CC1CCN1C(=O)c2ccccc2 240690a_100000755817_100000185807 [1,0,0,1,0,0|1,0,0]=3 23491 B14R2.335 CC1CCN1C(=O)c2ccccc2 527a_100000755817_100000185807 [1,0,0,1,0,0|1,0,0]=3 23492 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 240690a_100015190264_100000185807 [1,0,0,1,0,0|2,0,0]=4 23493 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 527a_100015190264_100000185807 [1,0,0,1,0,0|2,0,0]=4 23494 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 11a_100025746932_100000185807 [1,0,0,1,0,0|2,0,0]=4 23495 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 1626a_100025746932_100000185807 [1,0,0,1,0,0|2,0,0]=4 23496 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 240690a_100025746932_100000185807 [1,0,0,1,0,0|2,0,0]=4 23497 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 527a_100025746932_100000185807 [1,0,0,1,0,0|2,0,0]=4 23498 B14R2.510 CCNC1CC(=O)c2c1cccc2 2230a_100015525214_100010208147 [1,0,0,1,0,0|2,0,0]=4 23499 B14R2.510 CCNC1OC(=O)c2c1cccc2 2230a_100015525214_100009813457 [1,0,0,1,0,0|1,0,0]=3 23500 B14R2.510 CCSC1CC(=O)c2c1cccc2 62a_100000210202_100010208147 [1,0,0,1,0,0|2,0,0]=4 23501 B14R2.510 CCSC1CC(=O)c2c1cccc2 62a_100010208147_100000210202 [1,0,0,1,0,0|2,0,0]=4 23502 B14R2.510 CCSC1OC(=O)c2c1cccc2 62a_100000210202_100009813457 [1,0,0,1,0,0|1,0,0]=3 23503 B14R2.510 O=C1OC(c2c1cccc2)SCF 62a_100015361967_100009813457 [1,0,0,1,0,0|2,0,0]=4 23504 B14R2.792 CC(OCC1CC1)c2ccccc2 34a_100000211283_100000211855 [1,0,0,1,0,0|1,0,1]=4 23505 B14R2.792 C[C@@H](OCC1CC1)c2ccccc2 34a_100000761318_100000742324 [1,0,0,1,0,0|1,0,1]=4 23506 B14R2.792 C[C@@H](OCC1CC1)c2ccccc2 7a_100000761318_100000742324 [1,0,0,1,0,0|1,0,1]=4 23507 B14R2.792 O=C(CCC1CC1)c2ccccc2 1458a_100000185807_100000694398 [1,0,0,1,0,0|1,0,0]=3 23508 B14R2.792 O=C(CCC1CO1)c2ccccc2 1458a_100000185807_100000732470 [1,0,0,1,0,0|2,0,0]=4 23509 B14R2.792 O=C(CSC1CC1)c2ccccc2 62a_100000211460_100000211595 [1,0,0,1,0,0|2,0,0]=4 23510 B14R2.792 O=C(NCC1CC1)c2ccccc2 11a_100000735609_100000185807 [1,0,0,1,0,0|1,0,0]=3 23511 B14R2.792 O=C(NCC1CC1)c2ccccc2 1626a_100000735609_100000185807 [1,0,0,1,0,0|1,0,0]=3 23512 B14R2.792 O=C(NCC1CC1)c2ccccc2 240690a_100000735609_100000185807 [1,0,0,1,0,0|1,0,0]=3 23513 B14R2.792 O=C(NCC1CC1)c2ccccc2 527a_100000735609_100000185807 [1,0,0,1,0,0|1,0,0]=3 23514 B14R2.792 O=C(NNC1CC1)c2ccccc2 22a_100000701032_100000185807 [1,0,0,1,0,0|2,0,0]=4 23515 B14R2.794 CC(OC1CCC1)c2ccccc2 34a_100000748187_100000211855 [1,0,0,1,0,0|1,0,1]=4 23516 B14R2.794 C[C@@H](OC1CCC1)c2ccccc2 34a_100000761318_100000749161 [1,0,0,1,0,0|1,0,1]=4 23517 B14R2.794 O=C(CC1CCC1)c2ccccc2 1458a_100000185807_100000763275 [1,0,0,1,0,0|1,0,0]=3 23518 B14R2.794 O=C(CC1CCO1)c2ccccc2 1458a_100000185807_100000103362 [1,0,0,1,0,0|2,0,0]=4 23519 B14R2.794 O=C(CC1COC1)c2ccccc2 1458a_100000185807_100010264016 [1,0,0,1,0,0|2,0,0]=4 23520 B14R2.794 O=C(CN1CCC1)c2ccccc2 269982a_100000754969_100000211460 [1,0,0,1,0,0|2,0,0]=4 23521 B14R2.794 O=C(NC1CCC1)c2ccccc2 11a_100000749019_100000185807 [1,0,0,1,0,0|1,0,0]=3 23522 B14R2.794 O=C(NC1CCC1)c2ccccc2 1626a_100000749019_100000185807 [1,0,0,1,0,0|1,0,0]=3 23523 B14R2.794 O=C(NC1CCC1)c2ccccc2 240690a_100000749019_100000185807 [1,0,0,1,0,0|1,0,0]=3 23524 B14R2.794 O=C(NC1CCC1)c2ccccc2 527a_100000749019_100000185807 [1,0,0,1,0,0|1,0,0]=3 23525 B14R2.794 O=C(NC1COC1)c2ccccc2 11a_100016991112_100000185807 [1,0,0,1,0,0|2,0,0]=4 23526 B14R2.794 O=C(NC1COC1)c2ccccc2 1626a_100016991112_100000185807 [1,0,0,1,0,0|2,0,0]=4 23527 B14R2.794 O=C(NC1COC1)c2ccccc2 240690a_100016991112_100000185807 [1,0,0,1,0,0|2,0,0]=4 23528 B14R2.794 O=C(NC1COC1)c2ccccc2 527a_100016991112_100000185807 [1,0,0,1,0,0|2,0,0]=4 23529 B14R2.794 O=C(NC1CSC1)c2ccccc2 11a_100016994217_100000185807 [1,0,0,1,0,0|2,0,0]=4 23530 B14R2.794 O=C(NC1CSC1)c2ccccc2 1626a_100016994217_100000185807 [1,0,0,1,0,0|2,0,0]=4 23531 B14R2.794 O=C(NC1CSC1)c2ccccc2 240690a_100016994217_100000185807 [1,0,0,1,0,0|2,0,0]=4 23532 B14R2.794 O=C(NC1CSC1)c2ccccc2 527a_100016994217_100000185807 [1,0,0,1,0,0|2,0,0]=4 23533 B14R2.1131 COC1CCC(=O)c2c1cccc2 7a_100000100557_200000210301 [1,0,0,1,0,0|2,0,0]=4 23534 B14R2.1131 [13CH3]OC1CCC(=O)c2c1cccc2 7a_100000100557_200025704644 [1,0,0,1,0,0|2,0,0]=4 23535 B14R2.1253 C1=C(CCCCC1)c2ccccc2 271570a_200009888920_100000210277 [1,0,0,1,0,0|2,0,0]=4 23536 B14R2.16538 CCCCOC1Cc2c1cccc2 7a_100000210227_100009813401 [1,0,0,1,0,0|1,0,1]=4 23537 B14R2.24 Brc1ccccc1C2=CCCCC2 271570a_100000062251_100000695589 [1,0,0,1,0,0|2,0,0]=4 23538 B14R2.24 Brc1ccccc1C2=CCCCO2 271570a_100010177797_100000695589 [1,0,0,1,0,0|1,0,1]=4 23539 B14R2.24 Cc1ccccc1C2=CCCCC2 271570a_100000062251_100000210755 [1,0,0,1,0,0|2,0,0]=4 23540 B14R2.24 Cc1ccccc1C2=CCCCO2 271570a_100010177797_100000210755 [1,0,0,1,0,0|1,0,1]=4 23541 B14R2.24 Clc1ccccc1C2=CCCCC2 271570a_100000062251_100000764095 [1,0,0,1,0,0|2,0,0]=4 23542 B14R2.24 Clc1ccccc1C2=CCCCO2 271570a_100010177797_100000764095 [1,0,0,1,0,0|1,0,1]=4 23543 B14R2.24 Fc1ccccc1C2=CCCCC2 271570a_100000062251_100011215700 [1,0,0,1,0,0|2,0,0]=4 23544 B14R2.24 Fc1ccccc1C2=CCCCO2 271570a_100010177797_100011215700 [1,0,0,1,0,0|1,0,1]=4 23545 B14R2.24 Nc1ccccc1C2=CCCCC2 271570a_100000062251_100000210017 [1,0,0,1,0,0|2,0,0]=4 23546 B14R2.24 Nc1ccccc1C2=CCCCO2 271570a_100010177797_100000210017 [1,0,0,1,0,0|1,0,1]=4 23547 B14R2.24 Oc1ccccc1B2OCCCO2 271570a_203496583355_103437846672 [1,0,0,1,0,0|2,0,0]=4 23548 B14R2.24 Oc1ccccc1C2=CCCCC2 271570a_100000062251_100000739446 [1,0,0,1,0,0|1,0,0]=3 23549 B14R2.24 Oc1ccccc1C2=CCCCO2 271570a_100010177797_100000739446 [1,0,0,1,0,0|0,0,1]=3 23550 B14R2.24 Oc1ccccc1C2=CCNCC2 271570a_100000731432_100000739446 [1,0,0,1,0,0|2,0,0]=4 23551 B14R2.24 Oc1ccccc1C2=CCOCC2 271570a_100000070234_100000739446 [1,0,0,1,0,0|2,0,0]=4 23552 B14R2.24 Oc1ccccc1C2=CCSCC2 271570a_100010232141_100000739446 [1,0,0,1,0,0|2,0,0]=4 23553 B14R2.24 Oc1ccccc1C2=COCCC2 271570a_100010175576_100000739446 [1,0,0,1,0,0|2,0,0]=4 23554 B14R2.24 Oc1ccccc1C2CCCCC2 271570a_203496583355_200009813743 [1,0,0,1,0,0|1,0,1]=4 23555 B14R2.24 Oc1ccccc1C2CCCCN2 271570a_203496583355_100010004825 [1,0,0,1,0,0|1,0,1]=4 23556 B14R2.24 Oc1ccccc1N2CCCCC2 271570a_203496583355_100159312943 [1,0,0,1,0,0|2,0,0]=4 23557 B14R2.24 Oc1cccnc1C2=CCCCC2 271570a_100000062251_100000034122 [1,0,0,1,0,0|2,0,0]=4 23558 B14R2.24 Oc1cccnc1C2=CCCCO2 271570a_100010177797_100000034122 [1,0,0,1,0,0|1,0,1]=4 23559 B14R2.24 Oc1cnccc1C2=CCCCC2 271570a_100000062251_100009817591 [1,0,0,1,0,0|2,0,0]=4 23560 B14R2.24 Oc1cnccc1C2=CCCCO2 271570a_100010177797_100009817591 [1,0,0,1,0,0|1,0,1]=4 23561 B14R2.50 Brc1ccccc1C=C2CCCC2 271570a_100010378317_100000695589 [1,0,0,1,0,0|2,0,0]=4 23562 B14R2.50 Cc1ccccc1C=C2CCCC2 271570a_100010378317_100000210755 [1,0,0,1,0,0|2,0,0]=4 23563 B14R2.50 Clc1ccccc1C=C2CCCC2 271570a_100010378317_100000764095 [1,0,0,1,0,0|2,0,0]=4 23564 B14R2.50 Fc1ccccc1C=C2CCCC2 271570a_100010378317_100011215700 [1,0,0,1,0,0|2,0,0]=4 23565 B14R2.50 Nc1ccccc1C=C2CCCC2 271570a_100010378317_100000210017 [1,0,0,1,0,0|2,0,0]=4 23566 B14R2.50 Oc1ccccc1C=C2CCCC2 271570a_100010378317_100000739446 [1,0,0,1,0,0|1,0,0]=3 23567 B14R2.50 Oc1ccccc1NC2CCCC2 34a_100000185747_100000179811 [1,0,0,1,0,0|2,0,0]=4 23568 B14R2.50 Oc1ccccc1OC2CCCC2 271570a_203496583355_100011214840 [1,0,0,1,0,0|2,0,0]=4 23569 B14R2.50 Oc1ccccc1SC2CCCC2 62a_100000739446_100000179811 [1,0,0,1,0,0|2,0,0]=4 23570 B14R2.50 Oc1ccccc1SC2CCCC2 62a_100011217020_100000739446 [1,0,0,1,0,0|2,0,0]=4 23571 B14R2.50 Oc1cccnc1C=C2CCCC2 271570a_100010378317_100000034122 [1,0,0,1,0,0|2,0,0]=4 23572 B14R2.50 Oc1cnccc1C=C2CCCC2 271570a_100010378317_100009817591 [1,0,0,1,0,0|2,0,0]=4 23573 B14R2.67 CCCCc1cc2ccccc2[nH]1 271570a_100020621405_100010232065 [1,0,0,1,0,0|2,0,0]=4 23574 B14R2.67 CCCCc1cc2ccccc2o1 271570a_100020621405_100010159458 [1,0,0,1,0,0|1,0,0]=3 23575 B14R2.67 CCCCc1cc2ccccc2s1 271570a_100020621405_100009816949 [1,0,0,1,0,0|1,1,0]=4 23576 B14R2.67 CCCSc1cc2ccccc2o1 62a_100000210303_100010159458 [1,0,0,1,0,0|2,0,0]=4 23577 B14R2.67 CCNCc1cc2ccccc2o1 207a_100015525214_100000229944 [1,0,0,1,0,0|2,0,0]=4 23578 B14R2.67 CCNCc1cc2ccccc2o1 270004a_100015525214_100000229944 [1,0,0,1,0,0|2,0,0]=4 23579 B14R2.67 CCOCc1cc2ccccc2o1 34a_100000233474_100000210202 [1,0,0,1,0,0|2,0,0]=4 23580 B14R2.67 CCOCc1cc2ccccc2o1 7a_100000233474_100000210202 [1,0,0,1,0,0|2,0,0]=4 23581 B14R2.67 COCCc1cc2ccccc2o1 34a_100011996023_200000210301 [1,0,0,1,0,0|2,0,0]=4 23582 B14R2.67 COCCc1cc2ccccc2o1 7a_100011996023_200000210301 [1,0,0,1,0,0|2,0,0]=4 23583 B14R2.67 [13CH3]OCCc1cc2ccccc2o1 34a_100011996023_200025704644 [1,0,0,1,0,0|2,0,0]=4 23584 B14R2.67 [13CH3]OCCc1cc2ccccc2o1 7a_100011996023_200025704644 [1,0,0,1,0,0|2,0,0]=4 23585 B14R2.4622 Brc1ccccc1COCC2CC2 34a_100000211283_100000184730 [1,0,0,1,0,0|1,0,1]=4 23586 B14R2.4622 Brc1ccccc1COCC2CC2 34a_100000756307_100000742324 [1,0,0,1,0,0|1,0,1]=4 23587 B14R2.4622 Brc1ccccc1COCC2CC2 7a_100000756307_100000742324 [1,0,0,1,0,0|1,0,1]=4 23588 B14R2.4622 Cc1ccccc1COCC2CC2 34a_100000211283_100000211839 [1,0,0,1,0,0|1,0,1]=4 23589 B14R2.4622 Cc1ccccc1COCC2CC2 34a_100000698903_100000742324 [1,0,0,1,0,0|1,0,1]=4 23590 B14R2.4622 Cc1ccccc1COCC2CC2 7a_100000698903_100000742324 [1,0,0,1,0,0|1,0,1]=4 23591 B14R2.4622 Clc1ccccc1COCC2CC2 34a_100000210847_100000742324 [1,0,0,1,0,0|1,0,1]=4 23592 B14R2.4622 Clc1ccccc1COCC2CC2 34a_100000211283_100000187162 [1,0,0,1,0,0|1,0,1]=4 23593 B14R2.4622 Clc1ccccc1COCC2CC2 7a_100000210847_100000742324 [1,0,0,1,0,0|1,0,1]=4 23594 B14R2.4622 Fc1ccccc1COCC2CC2 34a_100000211283_100000211605 [1,0,0,1,0,0|1,0,1]=4 23595 B14R2.4622 Fc1ccccc1COCC2CC2 34a_100000211962_100000742324 [1,0,0,1,0,0|1,0,1]=4 23596 B14R2.4622 Fc1ccccc1COCC2CC2 7a_100000211962_100000742324 [1,0,0,1,0,0|1,0,1]=4 23597 B14R2.4622 Ic1ccccc1COCC2CC2 34a_100000187465_100000742324 [1,0,0,1,0,0|1,0,1]=4 23598 B14R2.4622 Ic1ccccc1COCC2CC2 34a_100000211283_100011215278 [1,0,0,1,0,0|1,0,1]=4 23599 B14R2.4622 Ic1ccccc1COCC2CC2 7a_100000187465_100000742324 [1,0,0,1,0,0|1,0,1]=4 23600 B14R2.4622 Nc1ccccc1COCC2CC2 34a_100000212039_100000742324 [1,0,0,1,0,0|1,0,1]=4 23601 B14R2.4622 Oc1ccccc1C=NNC2CC2 4a_100000701032_100000185834 [1,0,0,1,0,0|2,0,0]=4 23602 B14R2.4622 Oc1ccccc1CNCC2CC2 269862a_100000185550_100000741477 [1,0,0,1,0,0|1,0,1]=4 23603 B14R2.4622 Oc1ccccc1CNCC2CC2 34a_100000185550_100000742324 [1,0,0,1,0,0|1,0,1]=4 23604 B14R2.4622 Oc1ccccc1NCCC2CC2 34a_100000185747_100000694398 [1,0,0,1,0,0|2,0,0]=4 23605 B14R2.4622 Oc1ccccc1SCCC2CC2 62a_100000739446_100000764125 [1,0,0,1,0,0|2,0,0]=4 23606 B14R2.4622 Oc1ccccc1SCCC2CC2 62a_100000764125_100000739446 [1,0,0,1,0,0|2,0,0]=4 23607 B14R2.4622 Oc1cccnc1COCC2CC2 34a_100000211283_200020655725 [1,0,0,1,0,0|1,0,1]=4 23608 B14R2.4634 Brc1ccccc1COC2CCC2 34a_100000748187_100000184730 [1,0,0,1,0,0|1,0,1]=4 23609 B14R2.4634 Brc1ccccc1COC2CCC2 34a_100000756307_100000749161 [1,0,0,1,0,0|1,0,1]=4 23610 B14R2.4634 Cc1ccccc1COC2CCC2 34a_100000698903_100000749161 [1,0,0,1,0,0|1,0,1]=4 23611 B14R2.4634 Cc1ccccc1COC2CCC2 34a_100000748187_100000211839 [1,0,0,1,0,0|1,0,1]=4 23612 B14R2.4634 Clc1ccccc1COC2CCC2 34a_100000210847_100000749161 [1,0,0,1,0,0|1,0,1]=4 23613 B14R2.4634 Clc1ccccc1COC2CCC2 34a_100000748187_100000187162 [1,0,0,1,0,0|1,0,1]=4 23614 B14R2.4634 Fc1ccccc1COC2CCC2 34a_100000211962_100000749161 [1,0,0,1,0,0|1,0,1]=4 23615 B14R2.4634 Fc1ccccc1COC2CCC2 34a_100000748187_100000211605 [1,0,0,1,0,0|1,0,1]=4 23616 B14R2.4634 Ic1ccccc1COC2CCC2 34a_100000187465_100000749161 [1,0,0,1,0,0|1,0,1]=4 23617 B14R2.4634 Ic1ccccc1COC2CCC2 34a_100000748187_100011215278 [1,0,0,1,0,0|1,0,1]=4 23618 B14R2.4634 Nc1ccccc1COC2CCC2 34a_100000212039_100000749161 [1,0,0,1,0,0|1,0,1]=4 23619 B14R2.4634 Oc1ccccc1CNC2CCC2 270004a_100000185550_100000241760 [1,0,0,1,0,0|1,0,1]=4 23620 B14R2.4634 Oc1ccccc1CNC2CCC2 34a_100000185550_100000749161 [1,0,0,1,0,0|1,0,1]=4 23621 B14R2.4634 Oc1ccccc1NCC2CCC2 34a_100000185747_100000763275 [1,0,0,1,0,0|2,0,0]=4 23622 B14R2.4634 Oc1ccccc1SCC2CCC2 62a_100000739446_100000763275 [1,0,0,1,0,0|2,0,0]=4 23623 B14R2.4634 Oc1ccccc1SCC2CCC2 62a_100000763275_100000739446 [1,0,0,1,0,0|2,0,0]=4 23624 B14R2.4634 Oc1cccnc1COC2CCC2 34a_100000748187_200020655725 [1,0,0,1,0,0|1,0,1]=4 23625 B14R2.3 CCCCc1coc2c1cccc2 271570a_100020621405_100009812202 [1,0,0,1,0,0|1,0,0]=3 23626 B14R2.3 CCCCc1coc2c1nccc2 271570a_100020621405_100009889148 [1,0,0,1,0,0|2,0,0]=4 23627 B14R2.3 CCCCc1csc2c1cccc2 271570a_100020621405_100009813928 [1,0,0,1,0,0|1,1,0]=4 23628 B14R2.3 CCCCc1n[nH]c2c1cccc2 271570a_100020621405_100000050141 [1,0,0,1,0,0|2,0,0]=4 23629 B14R2.3 CCCOc1csc2c1cccc2 34a_100000077758_100000210303 [1,0,0,1,0,0|1,1,0]=4 23630 B14R2.3 CCCOc1csc2c1cccc2 7a_100000077758_100000210303 [1,0,0,1,0,0|1,1,0]=4 23631 B14R2.3 CCCSc1coc2c1cccc2 62a_100000210303_100009812202 [1,0,0,1,0,0|1,1,0]=4 23632 B14R2.3 CCCSc1noc2c1cccc2 62a_100000210303_200000703156 [1,0,0,1,0,0|1,1,0]=4 23633 B14R2.3 CCCSc1noc2c1cccc2 62a_200000703156_100000210303 [1,0,0,1,0,0|1,1,0]=4 23634 B14R2.3 CCNCc1coc2c1cccc2 207a_100015525214_100000688544 [1,0,0,1,0,0|2,0,0]=4 23635 B14R2.3 CCNCc1coc2c1cccc2 270004a_100015525214_100000688544 [1,0,0,1,0,0|2,0,0]=4 23636 B14R2.3 CCOCc1noc2c1cccc2 34a_100121572206_100009813815 [1,0,0,1,0,0|2,0,0]=4 23637 B14R2.3 CCSCc1noc2c1cccc2 62a_100000210202_100009813815 [1,0,0,1,0,0|2,0,0]=4 23638 B14R2.3 CCSCc1noc2c1cccc2 62a_100009813815_100000210202 [1,0,0,1,0,0|2,0,0]=4 23639 B14R2.3 CNCCc1coc2c1cccc2 2230a_100011934666_200000210301 [1,0,0,1,0,0|2,0,0]=4 23640 B14R2.3 CNCCc1coc2c1cccc2 34a_100011934666_200000210301 [1,0,0,1,0,0|2,0,0]=4 23641 B14R2.3 [13CH3]NCCc1coc2c1cccc2 2230a_100011934666_200025704644 [1,0,0,1,0,0|2,0,0]=4 23642 B14R2.3 [13CH3]NCCc1coc2c1cccc2 34a_100011934666_200025704644 [1,0,0,1,0,0|2,0,0]=4 23643 B14R2.44 CCSC1Cc2ccccc2C1=O 62a_100000210202_100011218503 [1,0,0,1,0,0|2,0,0]=4 23644 B14R2.44 CCSC1Cc2ccccc2C1=O 62a_100011218503_100000210202 [1,0,0,1,0,0|2,0,0]=4 23645 B14R2.4633 CN(CC1CC1)c2ccccc2O 269982a_100000033821_100000756562 [1,0,0,1,0,0|2,0,0]=4 23646 B14R2.4633 Cc1ccccc1C(=O)CC2CC2 1458a_100000212026_100000742324 [1,0,0,1,0,0|1,0,0]=3 23647 B14R2.4633 Cc1ccccc1C(=O)CC2CO2 1458a_100000212026_100011216344 [1,0,0,1,0,0|2,0,0]=4 23648 B14R2.4633 Cc1ccccc1C(=O)CC2CS2 1458a_100000212026_100000031435 [1,0,0,1,0,0|2,0,0]=4 23649 B14R2.4633 Cc1ccccc1C(=O)C[C@@H]2CO2 1458a_100000212026_100000745022 [1,0,0,1,0,0|2,0,0]=4 23650 B14R2.4633 Cc1ccccc1C(=O)NC2CC2 1626a_100000212008_100000212026 [1,0,0,1,0,0|2,0,0]=4 23651 B14R2.4633 Cc1ccccc1C(=O)NC2CC2 240690a_100000212008_100000212026 [1,0,0,1,0,0|2,0,0]=4 23652 B14R2.4633 Cc1ccccc1C(=O)NC2CC2 527a_100000212008_100000212026 [1,0,0,1,0,0|2,0,0]=4 23653 B14R2.4633 O=C(CC1CC1)c2ccccc2Br 1458a_100000188424_100000742324 [1,0,0,1,0,0|1,0,0]=3 23654 B14R2.4633 O=C(CC1CC1)c2ccccc2Cl 1458a_100000185844_100000742324 [1,0,0,1,0,0|1,0,0]=3 23655 B14R2.4633 O=C(CC1CC1)c2ccccc2F 1458a_100000188656_100000742324 [1,0,0,1,0,0|1,0,0]=3 23656 B14R2.4633 O=C(CC1CC1)c2ccccc2I 1458a_100000187884_100000742324 [1,0,0,1,0,0|1,0,0]=3 23657 B14R2.4633 O=C(CC1CC1)c2ccccc2O 1458a_100015234032_100000742324 [1,0,0,1,0,0|0,0,0]=2 23658 B14R2.4633 O=C(CC1CC1)c2ccccc2[O-] 1458a_100009911694_100000742324 [1,0,0,1,0,0|0,0,1]=3 23659 B14R2.4633 O=C(CC1CO1)c2ccccc2Br 1458a_100000188424_100011216344 [1,0,0,1,0,0|2,0,0]=4 23660 B14R2.4633 O=C(CC1CO1)c2ccccc2Cl 1458a_100000185844_100011216344 [1,0,0,1,0,0|2,0,0]=4 23661 B14R2.4633 O=C(CC1CO1)c2ccccc2F 1458a_100000188656_100011216344 [1,0,0,1,0,0|2,0,0]=4 23662 B14R2.4633 O=C(CC1CO1)c2ccccc2I 1458a_100000187884_100011216344 [1,0,0,1,0,0|2,0,0]=4 23663 B14R2.4633 O=C(CC1CO1)c2ccccc2O 1458a_100015234032_100011216344 [1,0,0,1,0,0|1,0,0]=3 23664 B14R2.4633 O=C(CC1CO1)c2ccccc2[O-] 1458a_100009911694_100011216344 [1,0,0,1,0,0|1,0,1]=4 23665 B14R2.4633 O=C(CC1CS1)c2ccccc2Br 1458a_100000188424_100000031435 [1,0,0,1,0,0|2,0,0]=4 23666 B14R2.4633 O=C(CC1CS1)c2ccccc2Cl 1458a_100000185844_100000031435 [1,0,0,1,0,0|2,0,0]=4 23667 B14R2.4633 O=C(CC1CS1)c2ccccc2F 1458a_100000188656_100000031435 [1,0,0,1,0,0|2,0,0]=4 23668 B14R2.4633 O=C(CC1CS1)c2ccccc2I 1458a_100000187884_100000031435 [1,0,0,1,0,0|2,0,0]=4 23669 B14R2.4633 O=C(CC1CS1)c2ccccc2O 1458a_100015234032_100000031435 [1,0,0,1,0,0|1,0,0]=3 23670 B14R2.4633 O=C(CC1CS1)c2ccccc2[O-] 1458a_100009911694_100000031435 [1,0,0,1,0,0|1,0,1]=4 23671 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2Br 1458a_100000188424_100000745022 [1,0,0,1,0,0|2,0,0]=4 23672 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2Cl 1458a_100000185844_100000745022 [1,0,0,1,0,0|2,0,0]=4 23673 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2F 1458a_100000188656_100000745022 [1,0,0,1,0,0|2,0,0]=4 23674 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2I 1458a_100000187884_100000745022 [1,0,0,1,0,0|2,0,0]=4 23675 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2O 1458a_100015234032_100000745022 [1,0,0,1,0,0|1,0,0]=3 23676 B14R2.4633 O=C(C[C@@H]1CO1)c2ccccc2[O-] 1458a_100009911694_100000745022 [1,0,0,1,0,0|1,0,1]=4 23677 B14R2.4633 O=C(NC1CC1)c2ccccc2Br 1626a_100000212008_100000188424 [1,0,0,1,0,0|2,0,0]=4 23678 B14R2.4633 O=C(NC1CC1)c2ccccc2Br 240690a_100000212008_100000188424 [1,0,0,1,0,0|2,0,0]=4 23679 B14R2.4633 O=C(NC1CC1)c2ccccc2Br 527a_100000212008_100000188424 [1,0,0,1,0,0|2,0,0]=4 23680 B14R2.4633 O=C(NC1CC1)c2ccccc2Cl 1626a_100000212008_100000185844 [1,0,0,1,0,0|2,0,0]=4 23681 B14R2.4633 O=C(NC1CC1)c2ccccc2Cl 240690a_100000212008_100000185844 [1,0,0,1,0,0|2,0,0]=4 23682 B14R2.4633 O=C(NC1CC1)c2ccccc2Cl 527a_100000212008_100000185844 [1,0,0,1,0,0|2,0,0]=4 23683 B14R2.4633 O=C(NC1CC1)c2ccccc2F 1626a_100000212008_100000188656 [1,0,0,1,0,0|2,0,0]=4 23684 B14R2.4633 O=C(NC1CC1)c2ccccc2F 240690a_100000212008_100000188656 [1,0,0,1,0,0|2,0,0]=4 23685 B14R2.4633 O=C(NC1CC1)c2ccccc2F 527a_100000212008_100000188656 [1,0,0,1,0,0|2,0,0]=4 23686 B14R2.4633 O=C(NC1CC1)c2ccccc2I 1626a_100000212008_100000187884 [1,0,0,1,0,0|2,0,0]=4 23687 B14R2.4633 O=C(NC1CC1)c2ccccc2I 240690a_100000212008_100000187884 [1,0,0,1,0,0|2,0,0]=4 23688 B14R2.4633 O=C(NC1CC1)c2ccccc2I 527a_100000212008_100000187884 [1,0,0,1,0,0|2,0,0]=4 23689 B14R2.4633 O=C(NC1CC1)c2ccccc2O 240690a_100000212008_100015234032 [1,0,0,1,0,0|1,0,0]=3 23690 B14R2.4633 O=C(NC1CC1)c2ccccc2O 271570a_203496583355_200000155669 [1,0,0,1,0,0|1,0,0]=3 23691 B14R2.4633 O=C(NC1CC1)c2ccccc2[O-] 1626a_100000212008_100009911694 [1,0,0,1,0,0|1,0,1]=4 23692 B14R2.4633 O=C(NC1CC1)c2ccccc2[O-] 240690a_100000212008_100009911694 [1,0,0,1,0,0|1,0,1]=4 23693 B14R2.4633 O=C(NC1CC1)c2ccccc2[O-] 527a_100000212008_100009911694 [1,0,0,1,0,0|1,0,1]=4 23694 B14R2.4633 O=C(NC1CC1)c2cccnc2O 271570a_203496583355_100000160638 [1,0,0,1,0,0|2,0,0]=4 23695 B14R2.21545 CN(c1ccccc1O)C2CCC2 269982a_100000033821_100000749161 [1,0,0,1,0,0|2,0,0]=4 23696 B14R2.21545 Cc1ccccc1C(=O)C2CCC2 1458a_100000212026_100000749161 [1,0,0,1,0,0|1,0,0]=3 23697 B14R2.21545 Cc1ccccc1C(=O)C2COC2 1458a_100000212026_100000687716 [1,0,0,1,0,0|2,0,0]=4 23698 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 11a_100000754969_100000212026 [1,0,0,1,0,0|2,0,0]=4 23699 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 240690a_100000754969_100000212026 [1,0,0,1,0,0|2,0,0]=4 23700 B14R2.21545 Cc1ccccc1C(=O)N2CCC2 527a_100000754969_100000212026 [1,0,0,1,0,0|2,0,0]=4 23701 B14R2.21545 O=C(c1ccccc1Br)C2CCC2 1458a_100000188424_100000749161 [1,0,0,1,0,0|1,0,0]=3 23702 B14R2.21545 O=C(c1ccccc1Br)C2COC2 1458a_100000188424_100000687716 [1,0,0,1,0,0|2,0,0]=4 23703 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 11a_100000754969_100000188424 [1,0,0,1,0,0|2,0,0]=4 23704 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 240690a_100000754969_100000188424 [1,0,0,1,0,0|2,0,0]=4 23705 B14R2.21545 O=C(c1ccccc1Br)N2CCC2 527a_100000754969_100000188424 [1,0,0,1,0,0|2,0,0]=4 23706 B14R2.21545 O=C(c1ccccc1Cl)C2CCC2 1458a_100000185844_100000749161 [1,0,0,1,0,0|1,0,0]=3 23707 B14R2.21545 O=C(c1ccccc1Cl)C2COC2 1458a_100000185844_100000687716 [1,0,0,1,0,0|2,0,0]=4 23708 B14R2.21545 O=C(c1ccccc1Cl)N2CCC2 11a_100000754969_100000185844 [1,0,0,1,0,0|2,0,0]=4 23709 B14R2.21545 O=C(c1ccccc1Cl)N2CCC2 240690a_100000754969_100000185844 [1,0,0,1,0,0|2,0,0]=4 23710 B14R2.21545 O=C(c1ccccc1Cl)N2CCC2 527a_100000754969_100000185844 [1,0,0,1,0,0|2,0,0]=4 23711 B14R2.21545 O=C(c1ccccc1F)C2CCC2 1458a_100000188656_100000749161 [1,0,0,1,0,0|1,0,0]=3 23712 B14R2.21545 O=C(c1ccccc1F)C2COC2 1458a_100000188656_100000687716 [1,0,0,1,0,0|2,0,0]=4 23713 B14R2.21545 O=C(c1ccccc1F)N2CCC2 11a_100000754969_100000188656 [1,0,0,1,0,0|2,0,0]=4 23714 B14R2.21545 O=C(c1ccccc1F)N2CCC2 240690a_100000754969_100000188656 [1,0,0,1,0,0|2,0,0]=4 23715 B14R2.21545 O=C(c1ccccc1F)N2CCC2 527a_100000754969_100000188656 [1,0,0,1,0,0|2,0,0]=4 23716 B14R2.21545 O=C(c1ccccc1I)C2CCC2 1458a_100000187884_100000749161 [1,0,0,1,0,0|1,0,0]=3 23717 B14R2.21545 O=C(c1ccccc1I)C2COC2 1458a_100000187884_100000687716 [1,0,0,1,0,0|2,0,0]=4 23718 B14R2.21545 O=C(c1ccccc1I)N2CCC2 11a_100000754969_100000187884 [1,0,0,1,0,0|2,0,0]=4 23719 B14R2.21545 O=C(c1ccccc1I)N2CCC2 240690a_100000754969_100000187884 [1,0,0,1,0,0|2,0,0]=4 23720 B14R2.21545 O=C(c1ccccc1I)N2CCC2 527a_100000754969_100000187884 [1,0,0,1,0,0|2,0,0]=4 23721 B14R2.21545 O=C(c1ccccc1O)C2CCC2 1458a_100015234032_100000749161 [1,0,0,1,0,0|0,0,0]=2 23722 B14R2.21545 O=C(c1ccccc1O)C2COC2 1458a_100015234032_100000687716 [1,0,0,1,0,0|1,0,0]=3 23723 B14R2.21545 O=C(c1ccccc1O)N2CCC2 240690a_100000754969_100015234032 [1,0,0,1,0,0|1,0,0]=3 23724 B14R2.21545 O=C(c1ccccc1[O-])C2CCC2 1458a_100009911694_100000749161 [1,0,0,1,0,0|0,0,1]=3 23725 B14R2.21545 O=C(c1ccccc1[O-])C2COC2 1458a_100009911694_100000687716 [1,0,0,1,0,0|1,0,1]=4 23726 B14R2.21545 O=C(c1ccccc1[O-])N2CCC2 240690a_100000754969_100009911694 [1,0,0,1,0,0|1,0,1]=4 23727 B14R2.21545 O=C(c1ccccc1[O-])N2CCC2 527a_100000754969_100009911694 [1,0,0,1,0,0|1,0,1]=4 23728 B14R2.308 O=C(c1cscc1O)N2CCCC2 271570a_203496583355_100015400795 [0,0,0,1,1,0|2,0,0]=4 23729 B16R2.1056 CCCCc1cc2ccccc2oc1=O 271570a_100020621405_200000187772 [0,0,0,1,0,1|2,0,0]=4 23730 B16R2.2441 CCCCOc1ccc2ccccc2c1 34a_100000185828_100000210210 [0,0,0,1,0,1|2,0,0]=4 23731 B16R2.2441 CCCCOc1ccc2ccccc2c1 7a_100000185828_100000210211 [0,0,0,1,0,1|2,0,0]=4 23732 B16R2.2441 CCCCOc1cnc2ccccc2c1 34a_100011934006_100000210210 [0,0,0,1,0,1|2,0,0]=4 23733 B16R2.2441 CCCCOc1cnc2ccccc2c1 7a_100011934006_100000210211 [0,0,0,1,0,1|2,0,0]=4 23734 B16R2.2957 Cc1ccccc1CC(=O)C2CCCC2 1458a_100000210718_100000211839 [0,0,0,1,0,1|2,0,0]=4 23735 B16R2.2957 Cc1ccccc1CC(=O)C2CCCC2 1458a_100000212180_100000179811 [0,0,0,1,0,1|2,0,0]=4 23736 B16R2.2957 Cc1ccccc1CC(=O)N2CCCC2 240690a_100000188435_100000212180 [0,0,0,1,0,1|2,0,0]=4 23737 B16R2.2957 Cc1ccccc1CC(=O)N2CCCC2 527a_100000188435_100000212180 [0,0,0,1,0,1|2,0,0]=4 23738 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 11a_100015192222_100000210718 [0,0,0,1,0,1|2,0,0]=4 23739 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 1626a_100015192222_100000210718 [0,0,0,1,0,1|2,0,0]=4 23740 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 22a_100015192222_100000210718 [0,0,0,1,0,1|2,0,0]=4 23741 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 527a_100015192222_100000210718 [0,0,0,1,0,1|2,0,0]=4 23742 B16R2.2957 Cc1ccccc1NC(=O)N2CCCC2 2430a_100015192222_100000188435 [0,0,0,1,0,1|2,0,0]=4 23743 B16R2.2957 O=C(Cc1ccccc1Br)C2CCCC2 1458a_100000210718_100000184730 [0,0,0,1,0,1|2,0,0]=4 23744 B16R2.2957 O=C(Cc1ccccc1Br)C2CCCC2 1458a_100000751119_100000179811 [0,0,0,1,0,1|2,0,0]=4 23745 B16R2.2957 O=C(Cc1ccccc1Br)N2CCCC2 240690a_100000188435_100000751119 [0,0,0,1,0,1|2,0,0]=4 23746 B16R2.2957 O=C(Cc1ccccc1Br)N2CCCC2 527a_100000188435_100000751119 [0,0,0,1,0,1|2,0,0]=4 23747 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCCC2 1458a_100000183793_100000179811 [0,0,0,1,0,1|2,0,0]=4 23748 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCCC2 1458a_100000210718_100000187162 [0,0,0,1,0,1|2,0,0]=4 23749 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCCC2 240690a_100000188435_100000183793 [0,0,0,1,0,1|2,0,0]=4 23750 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCCC2 527a_100000188435_100000183793 [0,0,0,1,0,1|2,0,0]=4 23751 B16R2.2957 O=C(Cc1ccccc1F)C2CCCC2 1458a_100000210718_100000187165 [0,0,0,1,0,1|2,0,0]=4 23752 B16R2.2957 O=C(Cc1ccccc1F)C2CCCC2 1458a_100000212012_100000179811 [0,0,0,1,0,1|2,0,0]=4 23753 B16R2.2957 O=C(Cc1ccccc1F)N2CCCC2 240690a_100000188435_100000212012 [0,0,0,1,0,1|2,0,0]=4 23754 B16R2.2957 O=C(Cc1ccccc1F)N2CCCC2 527a_100000188435_100000212012 [0,0,0,1,0,1|2,0,0]=4 23755 B16R2.2957 O=C(Cc1ccccc1I)C2CCCC2 1458a_100000036491_100000179811 [0,0,0,1,0,1|2,0,0]=4 23756 B16R2.2957 O=C(Cc1ccccc1I)C2CCCC2 1458a_100000210718_100011216222 [0,0,0,1,0,1|2,0,0]=4 23757 B16R2.2957 O=C(Cc1ccccc1I)N2CCCC2 240690a_100000188435_100000036491 [0,0,0,1,0,1|2,0,0]=4 23758 B16R2.2957 O=C(Cc1ccccc1I)N2CCCC2 527a_100000188435_100000036491 [0,0,0,1,0,1|2,0,0]=4 23759 B16R2.2957 O=C(Cc1ccccc1O)C2CCCC2 1458a_100000743006_100000179811 [0,0,0,1,0,1|1,0,0]=3 23760 B16R2.2957 O=C(Cc1ccccc1O)C2CCOC2 1458a_100000743006_100000690089 [0,0,0,1,0,1|2,0,0]=4 23761 B16R2.2957 O=C(Cc1ccccc1O)N2CCCC2 240690a_100000188435_100000743006 [0,0,0,1,0,1|1,0,0]=3 23762 B16R2.2957 O=C(Cc1ccccc1O)N2CCCC2 527a_100000188435_100000743006 [0,0,0,1,0,1|1,0,0]=3 23763 B16R2.2957 O=C(Cc1ccccc1O)N2CCSC2 240690a_100011215254_100000743006 [0,0,0,1,0,1|2,0,0]=4 23764 B16R2.2957 O=C(Cc1ccccc1O)N2CCSC2 527a_100011215254_100000743006 [0,0,0,1,0,1|2,0,0]=4 23765 B16R2.2957 O=C(Cc1ncccc1O)C2CCCC2 1458a_100000210718_200020655725 [0,0,0,1,0,1|2,0,0]=4 23766 B16R2.2957 O=C(Nc1ccccc1Br)C2CCCC2 11a_100000210017_100000210718 [0,0,0,1,0,1|2,0,0]=4 23767 B16R2.2957 O=C(Nc1ccccc1Br)C2CCCC2 1626a_100000210017_100000210718 [0,0,0,1,0,1|2,0,0]=4 23768 B16R2.2957 O=C(Nc1ccccc1Br)N2CCCC2 2430a_100000210017_100000188435 [0,0,0,1,0,1|2,0,0]=4 23769 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 11a_100000185783_100000210718 [0,0,0,1,0,1|2,0,0]=4 23770 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 1626a_100000185783_100000210718 [0,0,0,1,0,1|2,0,0]=4 23771 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 22a_100000185783_100000210718 [0,0,0,1,0,1|2,0,0]=4 23772 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 527a_100000185783_100000210718 [0,0,0,1,0,1|2,0,0]=4 23773 B16R2.2957 O=C(Nc1ccccc1Cl)N2CCCC2 2430a_100000185783_100000188435 [0,0,0,1,0,1|2,0,0]=4 23774 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 11a_100000210422_100000210718 [0,0,0,1,0,1|2,0,0]=4 23775 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 1626a_100000210422_100000210718 [0,0,0,1,0,1|2,0,0]=4 23776 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 22a_100000210422_100000210718 [0,0,0,1,0,1|2,0,0]=4 23777 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 527a_100000210422_100000210718 [0,0,0,1,0,1|2,0,0]=4 23778 B16R2.2957 O=C(Nc1ccccc1F)N2CCCC2 2430a_100000210422_100000188435 [0,0,0,1,0,1|2,0,0]=4 23779 B16R2.2957 O=C(Nc1ccccc1I)C2CCCC2 11a_100000210053_100000210718 [0,0,0,1,0,1|2,0,0]=4 23780 B16R2.2957 O=C(Nc1ccccc1I)C2CCCC2 1626a_100000210053_100000210718 [0,0,0,1,0,1|2,0,0]=4 23781 B16R2.2957 O=C(Nc1ccccc1I)N2CCCC2 2430a_100000210053_100000188435 [0,0,0,1,0,1|2,0,0]=4 23782 B16R2.2957 O=C(Nc1ccccc1O)C2=CCCC2 22a_100000185747_100000038896 [0,0,0,1,0,1|1,0,1]=4 23783 B16R2.2957 O=C(Nc1ccccc1O)C2CCCC2 22a_100000185747_100000210718 [0,0,0,1,0,1|1,0,0]=3 23784 B16R2.2957 O=C(Nc1ccccc1O)C2CCCC2 527a_100000185747_100000210718 [0,0,0,1,0,1|1,0,0]=3 23785 B16R2.2957 O=C(Nc1ccccc1O)C2CCCS2 22a_100000185747_100012002731 [0,0,0,1,0,1|2,0,0]=4 23786 B16R2.2957 O=C(Nc1ccccc1O)C2CCCS2 527a_100000185747_100012002731 [0,0,0,1,0,1|2,0,0]=4 23787 B16R2.2957 O=C(Nc1ccccc1O)C2CCOC2 22a_100000185747_100011219752 [0,0,0,1,0,1|2,0,0]=4 23788 B16R2.2957 O=C(Nc1ccccc1O)C2CCOC2 527a_100000185747_100011219752 [0,0,0,1,0,1|2,0,0]=4 23789 B16R2.2957 O=C(Nc1ccccc1O)N2CCCC2 2430a_100000185747_100000188435 [0,0,0,1,0,1|1,0,0]=3 23790 B16R2.2957 O=C(Nc1ccccc1O)N2CCSC2 2430a_100000185747_100011215254 [0,0,0,1,0,1|2,0,0]=4 23791 B16R2.2957 O=C(Nc1ccccc1O)[C@@H]2CCCO2 22a_100000185747_100000686382 [0,0,0,1,0,1|2,0,0]=4 23792 B16R2.2957 O=C(Nc1ccccc1O)[C@@H]2CCCO2 527a_100000185747_100000686382 [0,0,0,1,0,1|2,0,0]=4 23793 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Br 11a_100000755817_100000751119 [0,0,0,1,0,1|2,0,0]=4 23794 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Br 240690a_100000755817_100000751119 [0,0,0,1,0,1|2,0,0]=4 23795 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Br 527a_100000755817_100000751119 [0,0,0,1,0,1|2,0,0]=4 23796 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Cl 11a_100000755817_100000183793 [0,0,0,1,0,1|2,0,0]=4 23797 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Cl 240690a_100000755817_100000183793 [0,0,0,1,0,1|2,0,0]=4 23798 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Cl 527a_100000755817_100000183793 [0,0,0,1,0,1|2,0,0]=4 23799 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2F 11a_100000755817_100000212012 [0,0,0,1,0,1|2,0,0]=4 23800 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2F 240690a_100000755817_100000212012 [0,0,0,1,0,1|2,0,0]=4 23801 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2F 527a_100000755817_100000212012 [0,0,0,1,0,1|2,0,0]=4 23802 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2I 11a_100000755817_100000036491 [0,0,0,1,0,1|2,0,0]=4 23803 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2I 240690a_100000755817_100000036491 [0,0,0,1,0,1|2,0,0]=4 23804 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2I 527a_100000755817_100000036491 [0,0,0,1,0,1|2,0,0]=4 23805 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2O 240690a_100000755817_100000743006 [0,0,0,1,0,1|1,0,0]=3 23806 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2O 527a_100000755817_100000743006 [0,0,0,1,0,1|1,0,0]=3 23807 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2Br 2430a_100000210017_100000755817 [0,0,0,1,0,1|2,0,0]=4 23808 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2Cl 2430a_100000185783_100000755817 [0,0,0,1,0,1|2,0,0]=4 23809 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2F 2430a_100000210422_100000755817 [0,0,0,1,0,1|2,0,0]=4 23810 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2I 2430a_100000210053_100000755817 [0,0,0,1,0,1|2,0,0]=4 23811 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2O 2430a_100000185747_100000755817 [0,0,0,1,0,1|1,0,0]=3 23812 B16R2.12425 Cc1ccccc1CC(=O)N2CCC2C 11a_100000755817_100000212180 [0,0,0,1,0,1|2,0,0]=4 23813 B16R2.12425 Cc1ccccc1CC(=O)N2CCC2C 240690a_100000755817_100000212180 [0,0,0,1,0,1|2,0,0]=4 23814 B16R2.12425 Cc1ccccc1CC(=O)N2CCC2C 527a_100000755817_100000212180 [0,0,0,1,0,1|2,0,0]=4 23815 B16R2.12425 Cc1ccccc1NC(=O)N2CCC2C 2430a_100015192222_100000755817 [0,0,0,1,0,1|2,0,0]=4 23816 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000743006 [0,0,0,1,0,1|2,0,0]=4 23817 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000743006 [0,0,0,1,0,1|2,0,0]=4 23818 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000743006 [0,0,0,1,0,1|2,0,0]=4 23819 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@H]2F 527a_100025746932_100000743006 [0,0,0,1,0,1|2,0,0]=4 23820 B16R2.12471 O=C(Nc1ccccc1O)N[C@@H]2C[C@@H]2F 2430a_100000185747_100015190264 [0,0,0,1,0,1|2,0,0]=4 23821 B16R2.12471 O=C(Nc1ccccc1O)N[C@@H]2C[C@H]2F 2430a_100000185747_100025746932 [0,0,0,1,0,1|2,0,0]=4 23822 B16R2.24867 Cc1ccccc1CC(=O)CCC2CC2 1458a_100000212180_100000694398 [0,0,0,1,0,1|2,0,0]=4 23823 B16R2.24867 Cc1ccccc1CC(=O)CCC2CC2 1458a_100000756386_100000211839 [0,0,0,1,0,1|2,0,0]=4 23824 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 11a_100000735609_100000212180 [0,0,0,1,0,1|2,0,0]=4 23825 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 1626a_100000735609_100000212180 [0,0,0,1,0,1|2,0,0]=4 23826 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 240690a_100000735609_100000212180 [0,0,0,1,0,1|2,0,0]=4 23827 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 527a_100000735609_100000212180 [0,0,0,1,0,1|2,0,0]=4 23828 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 11a_100015192222_100000756386 [0,0,0,1,0,1|2,0,0]=4 23829 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 1626a_100015192222_100000756386 [0,0,0,1,0,1|2,0,0]=4 23830 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 22a_100015192222_100000756386 [0,0,0,1,0,1|2,0,0]=4 23831 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 527a_100015192222_100000756386 [0,0,0,1,0,1|2,0,0]=4 23832 B16R2.24867 Cc1ccccc1NC(=O)NCC2CC2 2430a_100015192222_100000735609 [0,0,0,1,0,1|2,0,0]=4 23833 B16R2.24867 O=C(C=CC1CC1)Nc2ccccc2O 22a_100000185747_100102529529 [0,0,0,1,0,1|1,0,1]=4 23834 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Br 1458a_100000751119_100000694398 [0,0,0,1,0,1|2,0,0]=4 23835 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Br 1458a_100000756386_100000184730 [0,0,0,1,0,1|2,0,0]=4 23836 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Cl 1458a_100000183793_100000694398 [0,0,0,1,0,1|2,0,0]=4 23837 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Cl 1458a_100000756386_100000187162 [0,0,0,1,0,1|2,0,0]=4 23838 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2F 1458a_100000212012_100000694398 [0,0,0,1,0,1|2,0,0]=4 23839 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2F 1458a_100000756386_100000187165 [0,0,0,1,0,1|2,0,0]=4 23840 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2I 1458a_100000036491_100000694398 [0,0,0,1,0,1|2,0,0]=4 23841 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2I 1458a_100000756386_100011216222 [0,0,0,1,0,1|2,0,0]=4 23842 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2O 1458a_100000743006_100000694398 [0,0,0,1,0,1|1,0,0]=3 23843 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2O 1458a_100000756386_200020655725 [0,0,0,1,0,1|2,0,0]=4 23844 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br 11a_100000210017_100000756386 [0,0,0,1,0,1|2,0,0]=4 23845 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br 1626a_100000210017_100000756386 [0,0,0,1,0,1|2,0,0]=4 23846 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 11a_100000185783_100000756386 [0,0,0,1,0,1|2,0,0]=4 23847 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 1626a_100000185783_100000756386 [0,0,0,1,0,1|2,0,0]=4 23848 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 22a_100000185783_100000756386 [0,0,0,1,0,1|2,0,0]=4 23849 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 527a_100000185783_100000756386 [0,0,0,1,0,1|2,0,0]=4 23850 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 11a_100000210422_100000756386 [0,0,0,1,0,1|2,0,0]=4 23851 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 1626a_100000210422_100000756386 [0,0,0,1,0,1|2,0,0]=4 23852 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 22a_100000210422_100000756386 [0,0,0,1,0,1|2,0,0]=4 23853 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 527a_100000210422_100000756386 [0,0,0,1,0,1|2,0,0]=4 23854 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2I 11a_100000210053_100000756386 [0,0,0,1,0,1|2,0,0]=4 23855 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2I 1626a_100000210053_100000756386 [0,0,0,1,0,1|2,0,0]=4 23856 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2O 22a_100000185747_100000756386 [0,0,0,1,0,1|1,0,0]=3 23857 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2O 527a_100000185747_100000756386 [0,0,0,1,0,1|1,0,0]=3 23858 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2O 1458a_100000743006_100000732470 [0,0,0,1,0,1|2,0,0]=4 23859 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 11a_100000735609_100000751119 [0,0,0,1,0,1|2,0,0]=4 23860 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 240690a_100000735609_100000751119 [0,0,0,1,0,1|2,0,0]=4 23861 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 527a_100000735609_100000751119 [0,0,0,1,0,1|2,0,0]=4 23862 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 11a_100000735609_100000183793 [0,0,0,1,0,1|2,0,0]=4 23863 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 1626a_100000735609_100000183793 [0,0,0,1,0,1|2,0,0]=4 23864 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 240690a_100000735609_100000183793 [0,0,0,1,0,1|2,0,0]=4 23865 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 527a_100000735609_100000183793 [0,0,0,1,0,1|2,0,0]=4 23866 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 11a_100000735609_100000212012 [0,0,0,1,0,1|2,0,0]=4 23867 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 1626a_100000735609_100000212012 [0,0,0,1,0,1|2,0,0]=4 23868 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 240690a_100000735609_100000212012 [0,0,0,1,0,1|2,0,0]=4 23869 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 527a_100000735609_100000212012 [0,0,0,1,0,1|2,0,0]=4 23870 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 11a_100000735609_100000036491 [0,0,0,1,0,1|2,0,0]=4 23871 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 1626a_100000735609_100000036491 [0,0,0,1,0,1|2,0,0]=4 23872 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 240690a_100000735609_100000036491 [0,0,0,1,0,1|2,0,0]=4 23873 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 527a_100000735609_100000036491 [0,0,0,1,0,1|2,0,0]=4 23874 B16R2.24867 O=C(Cc1ccccc1O)NCC2CC2 240690a_100000735609_100000743006 [0,0,0,1,0,1|1,0,0]=3 23875 B16R2.24867 O=C(Cc1ccccc1O)NCC2CC2 527a_100000735609_100000743006 [0,0,0,1,0,1|1,0,0]=3 23876 B16R2.24867 O=C(Cc1ccccc1O)NNC2CC2 22a_100000701032_100000743006 [0,0,0,1,0,1|2,0,0]=4 23877 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2Br 2430a_100000210017_100000735609 [0,0,0,1,0,1|2,0,0]=4 23878 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2Cl 2430a_100000185783_100000735609 [0,0,0,1,0,1|2,0,0]=4 23879 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2F 2430a_100000210422_100000735609 [0,0,0,1,0,1|2,0,0]=4 23880 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2I 2430a_100000210053_100000735609 [0,0,0,1,0,1|2,0,0]=4 23881 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2O 2430a_100000185747_100000735609 [0,0,0,1,0,1|1,0,0]=3 23882 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2Br 1458a_200011661523_100000184730 [0,0,0,1,0,1|2,0,0]=4 23883 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2C 1458a_200011661523_100000211839 [0,0,0,1,0,1|2,0,0]=4 23884 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2Cl 1458a_200011661523_100000187162 [0,0,0,1,0,1|2,0,0]=4 23885 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2F 1458a_200011661523_100000187165 [0,0,0,1,0,1|2,0,0]=4 23886 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2I 1458a_200011661523_100011216222 [0,0,0,1,0,1|2,0,0]=4 23887 B16R2.35800 CCC1CC1C(=O)Cc2ncccc2O 1458a_200011661523_200020655725 [0,0,0,1,0,1|2,0,0]=4 23888 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Br 11a_100000210017_200011661523 [0,0,0,1,0,1|2,0,0]=4 23889 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Br 1626a_100000210017_200011661523 [0,0,0,1,0,1|2,0,0]=4 23890 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 11a_100015192222_200011661523 [0,0,0,1,0,1|2,0,0]=4 23891 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 1626a_100015192222_200011661523 [0,0,0,1,0,1|2,0,0]=4 23892 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 22a_100015192222_200011661523 [0,0,0,1,0,1|2,0,0]=4 23893 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 527a_100015192222_200011661523 [0,0,0,1,0,1|2,0,0]=4 23894 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 11a_100000185783_200011661523 [0,0,0,1,0,1|2,0,0]=4 23895 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 1626a_100000185783_200011661523 [0,0,0,1,0,1|2,0,0]=4 23896 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 22a_100000185783_200011661523 [0,0,0,1,0,1|2,0,0]=4 23897 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 527a_100000185783_200011661523 [0,0,0,1,0,1|2,0,0]=4 23898 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 11a_100000210422_200011661523 [0,0,0,1,0,1|2,0,0]=4 23899 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 1626a_100000210422_200011661523 [0,0,0,1,0,1|2,0,0]=4 23900 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 22a_100000210422_200011661523 [0,0,0,1,0,1|2,0,0]=4 23901 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 527a_100000210422_200011661523 [0,0,0,1,0,1|2,0,0]=4 23902 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2I 11a_100000210053_200011661523 [0,0,0,1,0,1|2,0,0]=4 23903 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2I 1626a_100000210053_200011661523 [0,0,0,1,0,1|2,0,0]=4 23904 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2O 22a_100000185747_200011661523 [0,0,0,1,0,1|1,0,0]=3 23905 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2O 527a_100000185747_200011661523 [0,0,0,1,0,1|1,0,0]=3 23906 B16R2.43746 CCCCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000210326 [0,0,0,1,0,1|2,0,0]=4 23907 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 11a_100000102301_200000238571 [0,0,0,1,0,1|2,0,0]=4 23908 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 1626a_100000102301_200000238571 [0,0,0,1,0,1|2,0,0]=4 23909 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 240690a_100000102301_200000238571 [0,0,0,1,0,1|2,0,0]=4 23910 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 527a_100000102301_200000238571 [0,0,0,1,0,1|2,0,0]=4 23911 B16R2.84031 Cc1ccccc1CC(=O)CC2CCC2 1458a_100000212180_100000763275 [0,0,0,1,0,1|2,0,0]=4 23912 B16R2.84031 Cc1ccccc1CC(=O)CC2CCC2 1458a_100000763092_100000211839 [0,0,0,1,0,1|2,0,0]=4 23913 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 11a_100000749019_100000212180 [0,0,0,1,0,1|2,0,0]=4 23914 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 1626a_100000749019_100000212180 [0,0,0,1,0,1|2,0,0]=4 23915 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 240690a_100000749019_100000212180 [0,0,0,1,0,1|2,0,0]=4 23916 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 527a_100000749019_100000212180 [0,0,0,1,0,1|2,0,0]=4 23917 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 11a_100015192222_100000763092 [0,0,0,1,0,1|2,0,0]=4 23918 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 1626a_100015192222_100000763092 [0,0,0,1,0,1|2,0,0]=4 23919 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 22a_100015192222_100000763092 [0,0,0,1,0,1|2,0,0]=4 23920 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 527a_100015192222_100000763092 [0,0,0,1,0,1|2,0,0]=4 23921 B16R2.84031 Cc1ccccc1NC(=O)NC2CCC2 2430a_100015192222_100000749019 [0,0,0,1,0,1|2,0,0]=4 23922 B16R2.84031 O=C(C=C1CCC1)Nc2ccccc2O 22a_100000185747_100000686340 [0,0,0,1,0,1|1,0,1]=4 23923 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Br 11a_100000210017_100000763092 [0,0,0,1,0,1|2,0,0]=4 23924 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Br 1626a_100000210017_100000763092 [0,0,0,1,0,1|2,0,0]=4 23925 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 11a_100000185783_100000763092 [0,0,0,1,0,1|2,0,0]=4 23926 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 1626a_100000185783_100000763092 [0,0,0,1,0,1|2,0,0]=4 23927 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 22a_100000185783_100000763092 [0,0,0,1,0,1|2,0,0]=4 23928 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 527a_100000185783_100000763092 [0,0,0,1,0,1|2,0,0]=4 23929 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 11a_100000210422_100000763092 [0,0,0,1,0,1|2,0,0]=4 23930 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 1626a_100000210422_100000763092 [0,0,0,1,0,1|2,0,0]=4 23931 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 22a_100000210422_100000763092 [0,0,0,1,0,1|2,0,0]=4 23932 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 527a_100000210422_100000763092 [0,0,0,1,0,1|2,0,0]=4 23933 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2I 11a_100000210053_100000763092 [0,0,0,1,0,1|2,0,0]=4 23934 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2I 1626a_100000210053_100000763092 [0,0,0,1,0,1|2,0,0]=4 23935 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2O 22a_100000185747_100000763092 [0,0,0,1,0,1|1,0,0]=3 23936 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2O 527a_100000185747_100000763092 [0,0,0,1,0,1|1,0,0]=3 23937 B16R2.84031 O=C(CC1COC1)Nc2ccccc2O 22a_100000185747_100000687760 [0,0,0,1,0,1|2,0,0]=4 23938 B16R2.84031 O=C(CN1CCC1)Nc2ccccc2O 269982a_100000754969_100000014494 [0,0,0,1,0,1|2,0,0]=4 23939 B16R2.84031 O=C(Cc1ccccc1Br)CC2CCC2 1458a_100000751119_100000763275 [0,0,0,1,0,1|2,0,0]=4 23940 B16R2.84031 O=C(Cc1ccccc1Br)CC2CCC2 1458a_100000763092_100000184730 [0,0,0,1,0,1|2,0,0]=4 23941 B16R2.84031 O=C(Cc1ccccc1Br)NC2CCC2 11a_100000749019_100000751119 [0,0,0,1,0,1|2,0,0]=4 23942 B16R2.84031 O=C(Cc1ccccc1Br)NC2CCC2 240690a_100000749019_100000751119 [0,0,0,1,0,1|2,0,0]=4 23943 B16R2.84031 O=C(Cc1ccccc1Br)NC2CCC2 527a_100000749019_100000751119 [0,0,0,1,0,1|2,0,0]=4 23944 B16R2.84031 O=C(Cc1ccccc1Cl)CC2CCC2 1458a_100000183793_100000763275 [0,0,0,1,0,1|2,0,0]=4 23945 B16R2.84031 O=C(Cc1ccccc1Cl)CC2CCC2 1458a_100000763092_100000187162 [0,0,0,1,0,1|2,0,0]=4 23946 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 11a_100000749019_100000183793 [0,0,0,1,0,1|2,0,0]=4 23947 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 1626a_100000749019_100000183793 [0,0,0,1,0,1|2,0,0]=4 23948 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 240690a_100000749019_100000183793 [0,0,0,1,0,1|2,0,0]=4 23949 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 527a_100000749019_100000183793 [0,0,0,1,0,1|2,0,0]=4 23950 B16R2.84031 O=C(Cc1ccccc1F)CC2CCC2 1458a_100000212012_100000763275 [0,0,0,1,0,1|2,0,0]=4 23951 B16R2.84031 O=C(Cc1ccccc1F)CC2CCC2 1458a_100000763092_100000187165 [0,0,0,1,0,1|2,0,0]=4 23952 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 11a_100000749019_100000212012 [0,0,0,1,0,1|2,0,0]=4 23953 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 1626a_100000749019_100000212012 [0,0,0,1,0,1|2,0,0]=4 23954 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 240690a_100000749019_100000212012 [0,0,0,1,0,1|2,0,0]=4 23955 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 527a_100000749019_100000212012 [0,0,0,1,0,1|2,0,0]=4 23956 B16R2.84031 O=C(Cc1ccccc1I)CC2CCC2 1458a_100000036491_100000763275 [0,0,0,1,0,1|2,0,0]=4 23957 B16R2.84031 O=C(Cc1ccccc1I)CC2CCC2 1458a_100000763092_100011216222 [0,0,0,1,0,1|2,0,0]=4 23958 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 11a_100000749019_100000036491 [0,0,0,1,0,1|2,0,0]=4 23959 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 1626a_100000749019_100000036491 [0,0,0,1,0,1|2,0,0]=4 23960 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 240690a_100000749019_100000036491 [0,0,0,1,0,1|2,0,0]=4 23961 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 527a_100000749019_100000036491 [0,0,0,1,0,1|2,0,0]=4 23962 B16R2.84031 O=C(Cc1ccccc1O)CC2CCC2 1458a_100000743006_100000763275 [0,0,0,1,0,1|1,0,0]=3 23963 B16R2.84031 O=C(Cc1ccccc1O)CC2CCO2 1458a_100000743006_100000103362 [0,0,0,1,0,1|2,0,0]=4 23964 B16R2.84031 O=C(Cc1ccccc1O)CC2COC2 1458a_100000743006_100010264016 [0,0,0,1,0,1|2,0,0]=4 23965 B16R2.84031 O=C(Cc1ccccc1O)NC2CCC2 240690a_100000749019_100000743006 [0,0,0,1,0,1|1,0,0]=3 23966 B16R2.84031 O=C(Cc1ccccc1O)NC2CCC2 527a_100000749019_100000743006 [0,0,0,1,0,1|1,0,0]=3 23967 B16R2.84031 O=C(Cc1ccccc1O)NC2COC2 240690a_100016991112_100000743006 [0,0,0,1,0,1|2,0,0]=4 23968 B16R2.84031 O=C(Cc1ccccc1O)NC2COC2 527a_100016991112_100000743006 [0,0,0,1,0,1|2,0,0]=4 23969 B16R2.84031 O=C(Cc1ccccc1O)NC2CSC2 240690a_100016994217_100000743006 [0,0,0,1,0,1|2,0,0]=4 23970 B16R2.84031 O=C(Cc1ccccc1O)NC2CSC2 527a_100016994217_100000743006 [0,0,0,1,0,1|2,0,0]=4 23971 B16R2.84031 O=C(Cc1ncccc1O)CC2CCC2 1458a_100000763092_200020655725 [0,0,0,1,0,1|2,0,0]=4 23972 B16R2.84031 O=C(Nc1ccccc1Br)NC2CCC2 2430a_100000210017_100000749019 [0,0,0,1,0,1|2,0,0]=4 23973 B16R2.84031 O=C(Nc1ccccc1Cl)NC2CCC2 2430a_100000185783_100000749019 [0,0,0,1,0,1|2,0,0]=4 23974 B16R2.84031 O=C(Nc1ccccc1F)NC2CCC2 2430a_100000210422_100000749019 [0,0,0,1,0,1|2,0,0]=4 23975 B16R2.84031 O=C(Nc1ccccc1I)NC2CCC2 2430a_100000210053_100000749019 [0,0,0,1,0,1|2,0,0]=4 23976 B16R2.84031 O=C(Nc1ccccc1O)NC2CCC2 2430a_100000185747_100000749019 [0,0,0,1,0,1|1,0,0]=3 23977 B16R2.84031 O=C(Nc1ccccc1O)NC2COC2 2430a_100000185747_100016991112 [0,0,0,1,0,1|2,0,0]=4 23978 B16R2.84031 O=C(Nc1ccccc1O)NC2CSC2 2430a_100000185747_100016994217 [0,0,0,1,0,1|2,0,0]=4 23979 B16R2.149 CCCCOc1noc2c1cccc2C 34a_100000041175_100000210210 [0,1,0,1,0,0|1,0,0]=3 23980 B16R2.149 COCCOc1noc2c1cccc2C 34a_100000041175_100011201679 [0,1,0,1,0,0|2,0,0]=4 23981 B16R2.149 CSCCOc1noc2c1cccc2C 34a_100000041175_100000212216 [0,1,0,1,0,0|2,0,0]=4 23982 B16R2.149 Cc1cccc2c1onc2OCCCF 34a_100000041175_100011934791 [0,1,0,1,0,0|2,0,0]=4 23983 B16R2.149 Cc1cccc2c1onc2OCCCO 34a_100000041175_100000230001 [0,1,0,1,0,0|2,0,0]=4 23984 B16R2.261 Cc1c(cccc1C(=O)C2CCCC2)Br 1458a_100000760464_100000179811 [0,1,0,1,0,0|2,0,0]=4 23985 B16R2.261 Cc1c(cccc1C(=O)C2CCCC2)Cl 1458a_100000690184_100000179811 [0,1,0,1,0,0|2,0,0]=4 23986 B16R2.261 Cc1c(cccc1C(=O)C2CCCC2)F 1458a_100011218272_100000179811 [0,1,0,1,0,0|2,0,0]=4 23987 B16R2.261 Cc1c(cccc1C(=O)C2CCCC2)I 1458a_100000751865_100000179811 [0,1,0,1,0,0|2,0,0]=4 23988 B16R2.261 Cc1c(cccc1C(=O)C2CCCC2)O 1458a_100000766327_100000179811 [0,1,0,1,0,0|2,0,0]=4 23989 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)Br 240690a_100000188435_100000760464 [0,1,0,1,0,0|2,0,0]=4 23990 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)Br 527a_100000188435_100000760464 [0,1,0,1,0,0|2,0,0]=4 23991 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)Cl 240690a_100000188435_100000690184 [0,1,0,1,0,0|2,0,0]=4 23992 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)Cl 527a_100000188435_100000690184 [0,1,0,1,0,0|2,0,0]=4 23993 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)F 240690a_100000188435_100011218272 [0,1,0,1,0,0|2,0,0]=4 23994 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)F 527a_100000188435_100011218272 [0,1,0,1,0,0|2,0,0]=4 23995 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)I 240690a_100000188435_100000751865 [0,1,0,1,0,0|2,0,0]=4 23996 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)I 527a_100000188435_100000751865 [0,1,0,1,0,0|2,0,0]=4 23997 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)O 240690a_100000188435_100000766327 [0,1,0,1,0,0|2,0,0]=4 23998 B16R2.261 Cc1c(cccc1C(=O)N2CCCC2)O 527a_100000188435_100000766327 [0,1,0,1,0,0|2,0,0]=4 23999 B16R2.261 Cc1cccc(c1Br)C(=O)C2CCCC2 1458a_100000692419_100000179811 [0,1,0,1,0,0|2,0,0]=4 24000 B16R2.261 Cc1cccc(c1Br)C(=O)N2CCCC2 240690a_100000188435_100000692419 [0,1,0,1,0,0|2,0,0]=4 24001 B16R2.261 Cc1cccc(c1Br)C(=O)N2CCCC2 527a_100000188435_100000692419 [0,1,0,1,0,0|2,0,0]=4 24002 B16R2.261 Cc1cccc(c1C)C(=O)C2CCCC2 1458a_100000183679_100000179811 [0,1,0,1,0,0|2,0,0]=4 24003 B16R2.261 Cc1cccc(c1C)C(=O)N2CCCC2 240690a_100000188435_100000183679 [0,1,0,1,0,0|2,0,0]=4 24004 B16R2.261 Cc1cccc(c1C)C(=O)N2CCCC2 527a_100000188435_100000183679 [0,1,0,1,0,0|2,0,0]=4 24005 B16R2.261 Cc1cccc(c1Cl)C(=O)C2CCCC2 1458a_100000693142_100000179811 [0,1,0,1,0,0|2,0,0]=4 24006 B16R2.261 Cc1cccc(c1Cl)C(=O)N2CCCC2 240690a_100000188435_100000693142 [0,1,0,1,0,0|2,0,0]=4 24007 B16R2.261 Cc1cccc(c1Cl)C(=O)N2CCCC2 527a_100000188435_100000693142 [0,1,0,1,0,0|2,0,0]=4 24008 B16R2.261 Cc1cccc(c1F)C(=O)C2CCCC2 1458a_100000766181_100000179811 [0,1,0,1,0,0|2,0,0]=4 24009 B16R2.261 Cc1cccc(c1F)C(=O)N2CCCC2 240690a_100000188435_100000766181 [0,1,0,1,0,0|2,0,0]=4 24010 B16R2.261 Cc1cccc(c1F)C(=O)N2CCCC2 527a_100000188435_100000766181 [0,1,0,1,0,0|2,0,0]=4 24011 B16R2.261 Cc1cccc(c1I)C(=O)C2CCCC2 1458a_100000739377_100000179811 [0,1,0,1,0,0|2,0,0]=4 24012 B16R2.261 Cc1cccc(c1I)C(=O)N2CCCC2 240690a_100000188435_100000739377 [0,1,0,1,0,0|2,0,0]=4 24013 B16R2.261 Cc1cccc(c1I)C(=O)N2CCCC2 527a_100000188435_100000739377 [0,1,0,1,0,0|2,0,0]=4 24014 B16R2.261 Cc1cccc(c1O)C(=O)C2CCCC2 1458a_100000183896_100000179811 [0,1,0,1,0,0|1,0,0]=3 24015 B16R2.261 Cc1cccc(c1O)C(=O)C2CCOC2 1458a_100000183896_100000690089 [0,1,0,1,0,0|2,0,0]=4 24016 B16R2.261 Cc1cccc(c1O)C(=O)N2CCCC2 240690a_100000188435_100000183896 [0,1,0,1,0,0|1,0,0]=3 24017 B16R2.261 Cc1cccc(c1O)C(=O)N2CCCC2 527a_100000188435_100000183896 [0,1,0,1,0,0|1,0,0]=3 24018 B16R2.261 Cc1cccc(c1O)C(=O)N2CCSC2 240690a_100011215254_100000183896 [0,1,0,1,0,0|2,0,0]=4 24019 B16R2.261 Cc1cccc(c1O)C(=O)N2CCSC2 527a_100011215254_100000183896 [0,1,0,1,0,0|2,0,0]=4 24020 B16R2.261 O=C(c1cccc(c1Br)Br)C2CCCC2 1458a_100012360534_100000179811 [0,1,0,1,0,0|2,0,0]=4 24021 B16R2.261 O=C(c1cccc(c1Br)Br)N2CCCC2 240690a_100000188435_100012360534 [0,1,0,1,0,0|2,0,0]=4 24022 B16R2.261 O=C(c1cccc(c1Br)Br)N2CCCC2 527a_100000188435_100012360534 [0,1,0,1,0,0|2,0,0]=4 24023 B16R2.261 O=C(c1cccc(c1Br)Cl)C2CCCC2 1458a_100012339722_100000179811 [0,1,0,1,0,0|2,0,0]=4 24024 B16R2.261 O=C(c1cccc(c1Br)Cl)N2CCCC2 240690a_100000188435_100012339722 [0,1,0,1,0,0|2,0,0]=4 24025 B16R2.261 O=C(c1cccc(c1Br)Cl)N2CCCC2 527a_100000188435_100012339722 [0,1,0,1,0,0|2,0,0]=4 24026 B16R2.261 O=C(c1cccc(c1Br)F)C2CCCC2 1458a_100011217547_100000179811 [0,1,0,1,0,0|2,0,0]=4 24027 B16R2.261 O=C(c1cccc(c1Br)F)N2CCCC2 240690a_100000188435_100011217547 [0,1,0,1,0,0|2,0,0]=4 24028 B16R2.261 O=C(c1cccc(c1Br)F)N2CCCC2 527a_100000188435_100011217547 [0,1,0,1,0,0|2,0,0]=4 24029 B16R2.261 O=C(c1cccc(c1Br)I)C2CCCC2 1458a_100010232522_100000179811 [0,1,0,1,0,0|2,0,0]=4 24030 B16R2.261 O=C(c1cccc(c1Br)I)N2CCCC2 240690a_100000188435_100010232522 [0,1,0,1,0,0|2,0,0]=4 24031 B16R2.261 O=C(c1cccc(c1Br)I)N2CCCC2 527a_100000188435_100010232522 [0,1,0,1,0,0|2,0,0]=4 24032 B16R2.261 O=C(c1cccc(c1Br)O)C2CCCC2 1458a_100010230362_100000179811 [0,1,0,1,0,0|2,0,0]=4 24033 B16R2.261 O=C(c1cccc(c1Br)O)N2CCCC2 240690a_100000188435_100010230362 [0,1,0,1,0,0|2,0,0]=4 24034 B16R2.261 O=C(c1cccc(c1Br)O)N2CCCC2 527a_100000188435_100010230362 [0,1,0,1,0,0|2,0,0]=4 24035 B16R2.261 O=C(c1cccc(c1Cl)Br)C2CCCC2 1458a_100000760540_100000179811 [0,1,0,1,0,0|2,0,0]=4 24036 B16R2.261 O=C(c1cccc(c1Cl)Br)N2CCCC2 240690a_100000188435_100000760540 [0,1,0,1,0,0|2,0,0]=4 24037 B16R2.261 O=C(c1cccc(c1Cl)Br)N2CCCC2 527a_100000188435_100000760540 [0,1,0,1,0,0|2,0,0]=4 24038 B16R2.261 O=C(c1cccc(c1Cl)Cl)C2CCCC2 1458a_100000183631_100000179811 [0,1,0,1,0,0|2,0,0]=4 24039 B16R2.261 O=C(c1cccc(c1Cl)Cl)N2CCCC2 240690a_100000188435_100000183631 [0,1,0,1,0,0|2,0,0]=4 24040 B16R2.261 O=C(c1cccc(c1Cl)Cl)N2CCCC2 527a_100000188435_100000183631 [0,1,0,1,0,0|2,0,0]=4 24041 B16R2.261 O=C(c1cccc(c1Cl)F)C2CCCC2 1458a_100000759904_100000179811 [0,1,0,1,0,0|2,0,0]=4 24042 B16R2.261 O=C(c1cccc(c1Cl)F)N2CCCC2 240690a_100000188435_100000759904 [0,1,0,1,0,0|2,0,0]=4 24043 B16R2.261 O=C(c1cccc(c1Cl)F)N2CCCC2 527a_100000188435_100000759904 [0,1,0,1,0,0|2,0,0]=4 24044 B16R2.261 O=C(c1cccc(c1Cl)I)C2CCCC2 1458a_100010176783_100000179811 [0,1,0,1,0,0|2,0,0]=4 24045 B16R2.261 O=C(c1cccc(c1Cl)I)N2CCCC2 240690a_100000188435_100010176783 [0,1,0,1,0,0|2,0,0]=4 24046 B16R2.261 O=C(c1cccc(c1Cl)I)N2CCCC2 527a_100000188435_100010176783 [0,1,0,1,0,0|2,0,0]=4 24047 B16R2.261 O=C(c1cccc(c1Cl)O)C2CCCC2 1458a_100000092362_100000179811 [0,1,0,1,0,0|2,0,0]=4 24048 B16R2.261 O=C(c1cccc(c1Cl)O)N2CCCC2 240690a_100000188435_100000092362 [0,1,0,1,0,0|2,0,0]=4 24049 B16R2.261 O=C(c1cccc(c1Cl)O)N2CCCC2 527a_100000188435_100000092362 [0,1,0,1,0,0|2,0,0]=4 24050 B16R2.261 O=C(c1cccc(c1F)Br)C2CCCC2 1458a_100000756403_100000179811 [0,1,0,1,0,0|2,0,0]=4 24051 B16R2.261 O=C(c1cccc(c1F)Br)N2CCCC2 240690a_100000188435_100000756403 [0,1,0,1,0,0|2,0,0]=4 24052 B16R2.261 O=C(c1cccc(c1F)Br)N2CCCC2 527a_100000188435_100000756403 [0,1,0,1,0,0|2,0,0]=4 24053 B16R2.261 O=C(c1cccc(c1F)Cl)C2CCCC2 1458a_100000688816_100000179811 [0,1,0,1,0,0|2,0,0]=4 24054 B16R2.261 O=C(c1cccc(c1F)Cl)N2CCCC2 240690a_100000188435_100000688816 [0,1,0,1,0,0|2,0,0]=4 24055 B16R2.261 O=C(c1cccc(c1F)Cl)N2CCCC2 527a_100000188435_100000688816 [0,1,0,1,0,0|2,0,0]=4 24056 B16R2.261 O=C(c1cccc(c1F)F)C2CCCC2 1458a_100000748134_100000179811 [0,1,0,1,0,0|2,0,0]=4 24057 B16R2.261 O=C(c1cccc(c1F)F)N2CCCC2 240690a_100000188435_100000748134 [0,1,0,1,0,0|2,0,0]=4 24058 B16R2.261 O=C(c1cccc(c1F)F)N2CCCC2 527a_100000188435_100000748134 [0,1,0,1,0,0|2,0,0]=4 24059 B16R2.261 O=C(c1cccc(c1F)I)C2CCCC2 1458a_100010185205_100000179811 [0,1,0,1,0,0|2,0,0]=4 24060 B16R2.261 O=C(c1cccc(c1F)I)N2CCCC2 240690a_100000188435_100010185205 [0,1,0,1,0,0|2,0,0]=4 24061 B16R2.261 O=C(c1cccc(c1F)I)N2CCCC2 527a_100000188435_100010185205 [0,1,0,1,0,0|2,0,0]=4 24062 B16R2.261 O=C(c1cccc(c1F)O)C2CCCC2 1458a_100000037433_100000179811 [0,1,0,1,0,0|2,0,0]=4 24063 B16R2.261 O=C(c1cccc(c1F)O)N2CCCC2 240690a_100000188435_100000037433 [0,1,0,1,0,0|2,0,0]=4 24064 B16R2.261 O=C(c1cccc(c1F)O)N2CCCC2 527a_100000188435_100000037433 [0,1,0,1,0,0|2,0,0]=4 24065 B16R2.261 O=C(c1cccc(c1I)Br)C2CCCC2 1458a_100000688019_100000179811 [0,1,0,1,0,0|2,0,0]=4 24066 B16R2.261 O=C(c1cccc(c1I)Br)N2CCCC2 240690a_100000188435_100000688019 [0,1,0,1,0,0|2,0,0]=4 24067 B16R2.261 O=C(c1cccc(c1I)Br)N2CCCC2 527a_100000188435_100000688019 [0,1,0,1,0,0|2,0,0]=4 24068 B16R2.261 O=C(c1cccc(c1I)Cl)C2CCCC2 1458a_100010176784_100000179811 [0,1,0,1,0,0|2,0,0]=4 24069 B16R2.261 O=C(c1cccc(c1I)Cl)N2CCCC2 240690a_100000188435_100010176784 [0,1,0,1,0,0|2,0,0]=4 24070 B16R2.261 O=C(c1cccc(c1I)Cl)N2CCCC2 527a_100000188435_100010176784 [0,1,0,1,0,0|2,0,0]=4 24071 B16R2.261 O=C(c1cccc(c1I)F)C2CCCC2 1458a_100000690930_100000179811 [0,1,0,1,0,0|2,0,0]=4 24072 B16R2.261 O=C(c1cccc(c1I)F)N2CCCC2 240690a_100000188435_100000690930 [0,1,0,1,0,0|2,0,0]=4 24073 B16R2.261 O=C(c1cccc(c1I)F)N2CCCC2 527a_100000188435_100000690930 [0,1,0,1,0,0|2,0,0]=4 24074 B16R2.261 O=C(c1cccc(c1I)O)C2CCCC2 1458a_100010084636_100000179811 [0,1,0,1,0,0|2,0,0]=4 24075 B16R2.261 O=C(c1cccc(c1I)O)N2CCCC2 527a_100000188435_100010084636 [0,1,0,1,0,0|2,0,0]=4 24076 B16R2.261 O=C(c1cccc(c1O)Br)C2CCCC2 1458a_100000752940_100000179811 [0,1,0,1,0,0|1,0,0]=3 24077 B16R2.261 O=C(c1cccc(c1O)Br)C2CCOC2 1458a_100000752940_100000690089 [0,1,0,1,0,0|2,0,0]=4 24078 B16R2.261 O=C(c1cccc(c1O)Br)N2CCCC2 240690a_100000188435_100000752940 [0,1,0,1,0,0|1,0,0]=3 24079 B16R2.261 O=C(c1cccc(c1O)Br)N2CCCC2 527a_100000188435_100000752940 [0,1,0,1,0,0|1,0,0]=3 24080 B16R2.261 O=C(c1cccc(c1O)Br)N2CCSC2 240690a_100011215254_100000752940 [0,1,0,1,0,0|2,0,0]=4 24081 B16R2.261 O=C(c1cccc(c1O)Br)N2CCSC2 527a_100011215254_100000752940 [0,1,0,1,0,0|2,0,0]=4 24082 B16R2.261 O=C(c1cccc(c1O)Cl)C2CCCC2 1458a_100000742801_100000179811 [0,1,0,1,0,0|1,0,0]=3 24083 B16R2.261 O=C(c1cccc(c1O)Cl)C2CCOC2 1458a_100000742801_100000690089 [0,1,0,1,0,0|2,0,0]=4 24084 B16R2.261 O=C(c1cccc(c1O)Cl)N2CCCC2 240690a_100000188435_100000742801 [0,1,0,1,0,0|1,0,0]=3 24085 B16R2.261 O=C(c1cccc(c1O)Cl)N2CCCC2 527a_100000188435_100000742801 [0,1,0,1,0,0|1,0,0]=3 24086 B16R2.261 O=C(c1cccc(c1O)Cl)N2CCSC2 240690a_100011215254_100000742801 [0,1,0,1,0,0|2,0,0]=4 24087 B16R2.261 O=C(c1cccc(c1O)Cl)N2CCSC2 527a_100011215254_100000742801 [0,1,0,1,0,0|2,0,0]=4 24088 B16R2.261 O=C(c1cccc(c1O)F)C2CCCC2 1458a_100011217230_100000179811 [0,1,0,1,0,0|1,0,0]=3 24089 B16R2.261 O=C(c1cccc(c1O)F)C2CCOC2 1458a_100011217230_100000690089 [0,1,0,1,0,0|2,0,0]=4 24090 B16R2.261 O=C(c1cccc(c1O)F)N2CCCC2 240690a_100000188435_100011217230 [0,1,0,1,0,0|1,0,0]=3 24091 B16R2.261 O=C(c1cccc(c1O)F)N2CCCC2 527a_100000188435_100011217230 [0,1,0,1,0,0|1,0,0]=3 24092 B16R2.261 O=C(c1cccc(c1O)F)N2CCSC2 240690a_100011215254_100011217230 [0,1,0,1,0,0|2,0,0]=4 24093 B16R2.261 O=C(c1cccc(c1O)F)N2CCSC2 527a_100011215254_100011217230 [0,1,0,1,0,0|2,0,0]=4 24094 B16R2.261 O=C(c1cccc(c1O)O)C2CCCC2 1458a_100000690420_100000179811 [0,1,0,1,0,0|1,0,0]=3 24095 B16R2.261 O=C(c1cccc(c1O)O)C2CCOC2 1458a_100000690420_100000690089 [0,1,0,1,0,0|2,0,0]=4 24096 B16R2.261 O=C(c1cccc(c1O)O)N2CCCC2 527a_100000188435_100000690420 [0,1,0,1,0,0|1,0,0]=3 24097 B16R2.261 O=C(c1cccc(c1O)O)N2CCSC2 527a_100011215254_100000690420 [0,1,0,1,0,0|2,0,0]=4 24098 B16R2.11935 Cc1cccc(c1O)C2=CCCCCC2 271570a_200009888920_100009817157 [0,1,0,1,0,0|2,0,0]=4 24099 B16R2.11935 Nc1cccc(c1O)C2=CCCCCC2 271570a_200009888920_100011934915 [0,1,0,1,0,0|2,0,0]=4 24100 B16R2.11935 Oc1c(cccc1C2=CCCCCC2)Br 271570a_200009888920_100010084509 [0,1,0,1,0,0|2,0,0]=4 24101 B16R2.11935 Oc1c(cccc1C2=CCCCCC2)Cl 271570a_200009888920_100010202889 [0,1,0,1,0,0|2,0,0]=4 24102 B16R2.11935 Oc1c(cccc1C2=CCCCCC2)F 271570a_200009888920_100009813666 [0,1,0,1,0,0|2,0,0]=4 24103 B16R2.11935 Oc1cccc(c1O)C2=CCCCCC2 271570a_200009888920_100009815950 [0,1,0,1,0,0|2,0,0]=4 24104 B16R2.11944 Cc1cccc(c1O)C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000183896 [0,1,0,1,0,0|2,0,0]=4 24105 B16R2.11944 Cc1cccc(c1O)C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000183896 [0,1,0,1,0,0|2,0,0]=4 24106 B16R2.11944 Cc1cccc(c1O)C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000183896 [0,1,0,1,0,0|2,0,0]=4 24107 B16R2.11944 Cc1cccc(c1O)C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000183896 [0,1,0,1,0,0|2,0,0]=4 24108 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)Br 240690a_100015190264_100000752940 [0,1,0,1,0,0|2,0,0]=4 24109 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)Br 527a_100015190264_100000752940 [0,1,0,1,0,0|2,0,0]=4 24110 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)Cl 240690a_100015190264_100000742801 [0,1,0,1,0,0|2,0,0]=4 24111 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)Cl 527a_100015190264_100000742801 [0,1,0,1,0,0|2,0,0]=4 24112 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)F 240690a_100015190264_100011217230 [0,1,0,1,0,0|2,0,0]=4 24113 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)F 527a_100015190264_100011217230 [0,1,0,1,0,0|2,0,0]=4 24114 B16R2.11944 O=C(N[C@@H]1C[C@@H]1F)c2cccc(c2O)O 527a_100015190264_100000690420 [0,1,0,1,0,0|2,0,0]=4 24115 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)Br 240690a_100025746932_100000752940 [0,1,0,1,0,0|2,0,0]=4 24116 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)Br 527a_100025746932_100000752940 [0,1,0,1,0,0|2,0,0]=4 24117 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)Cl 240690a_100025746932_100000742801 [0,1,0,1,0,0|2,0,0]=4 24118 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)Cl 527a_100025746932_100000742801 [0,1,0,1,0,0|2,0,0]=4 24119 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)F 240690a_100025746932_100011217230 [0,1,0,1,0,0|2,0,0]=4 24120 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)F 527a_100025746932_100011217230 [0,1,0,1,0,0|2,0,0]=4 24121 B16R2.11944 O=C(N[C@@H]1C[C@H]1F)c2cccc(c2O)O 527a_100025746932_100000690420 [0,1,0,1,0,0|2,0,0]=4 24122 B16R2.11967 Cc1c(cccc1C(=O)CCC2CC2)Br 1458a_100000760464_100000694398 [0,1,0,1,0,0|2,0,0]=4 24123 B16R2.11967 Cc1c(cccc1C(=O)CCC2CC2)Cl 1458a_100000690184_100000694398 [0,1,0,1,0,0|2,0,0]=4 24124 B16R2.11967 Cc1c(cccc1C(=O)CCC2CC2)F 1458a_100011218272_100000694398 [0,1,0,1,0,0|2,0,0]=4 24125 B16R2.11967 Cc1c(cccc1C(=O)CCC2CC2)I 1458a_100000751865_100000694398 [0,1,0,1,0,0|2,0,0]=4 24126 B16R2.11967 Cc1c(cccc1C(=O)CCC2CC2)O 1458a_100000766327_100000694398 [0,1,0,1,0,0|2,0,0]=4 24127 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Br 11a_100000735609_100000760464 [0,1,0,1,0,0|2,0,0]=4 24128 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Br 1626a_100000735609_100000760464 [0,1,0,1,0,0|2,0,0]=4 24129 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Br 240690a_100000735609_100000760464 [0,1,0,1,0,0|2,0,0]=4 24130 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Br 527a_100000735609_100000760464 [0,1,0,1,0,0|2,0,0]=4 24131 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Cl 11a_100000735609_100000690184 [0,1,0,1,0,0|2,0,0]=4 24132 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Cl 1626a_100000735609_100000690184 [0,1,0,1,0,0|2,0,0]=4 24133 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Cl 240690a_100000735609_100000690184 [0,1,0,1,0,0|2,0,0]=4 24134 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)Cl 527a_100000735609_100000690184 [0,1,0,1,0,0|2,0,0]=4 24135 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)F 11a_100000735609_100011218272 [0,1,0,1,0,0|2,0,0]=4 24136 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)F 1626a_100000735609_100011218272 [0,1,0,1,0,0|2,0,0]=4 24137 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)F 240690a_100000735609_100011218272 [0,1,0,1,0,0|2,0,0]=4 24138 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)F 527a_100000735609_100011218272 [0,1,0,1,0,0|2,0,0]=4 24139 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)I 11a_100000735609_100000751865 [0,1,0,1,0,0|2,0,0]=4 24140 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)I 1626a_100000735609_100000751865 [0,1,0,1,0,0|2,0,0]=4 24141 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)I 240690a_100000735609_100000751865 [0,1,0,1,0,0|2,0,0]=4 24142 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)I 527a_100000735609_100000751865 [0,1,0,1,0,0|2,0,0]=4 24143 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)O 240690a_100000735609_100000766327 [0,1,0,1,0,0|2,0,0]=4 24144 B16R2.11967 Cc1c(cccc1C(=O)NCC2CC2)O 527a_100000735609_100000766327 [0,1,0,1,0,0|2,0,0]=4 24145 B16R2.11967 Cc1cccc(c1Br)C(=O)CCC2CC2 1458a_100000692419_100000694398 [0,1,0,1,0,0|2,0,0]=4 24146 B16R2.11967 Cc1cccc(c1Br)C(=O)NCC2CC2 11a_100000735609_100000692419 [0,1,0,1,0,0|2,0,0]=4 24147 B16R2.11967 Cc1cccc(c1Br)C(=O)NCC2CC2 1626a_100000735609_100000692419 [0,1,0,1,0,0|2,0,0]=4 24148 B16R2.11967 Cc1cccc(c1Br)C(=O)NCC2CC2 240690a_100000735609_100000692419 [0,1,0,1,0,0|2,0,0]=4 24149 B16R2.11967 Cc1cccc(c1Br)C(=O)NCC2CC2 527a_100000735609_100000692419 [0,1,0,1,0,0|2,0,0]=4 24150 B16R2.11967 Cc1cccc(c1C)C(=O)CCC2CC2 1458a_100000183679_100000694398 [0,1,0,1,0,0|2,0,0]=4 24151 B16R2.11967 Cc1cccc(c1C)C(=O)NCC2CC2 11a_100000735609_100000183679 [0,1,0,1,0,0|2,0,0]=4 24152 B16R2.11967 Cc1cccc(c1C)C(=O)NCC2CC2 1626a_100000735609_100000183679 [0,1,0,1,0,0|2,0,0]=4 24153 B16R2.11967 Cc1cccc(c1C)C(=O)NCC2CC2 240690a_100000735609_100000183679 [0,1,0,1,0,0|2,0,0]=4 24154 B16R2.11967 Cc1cccc(c1C)C(=O)NCC2CC2 527a_100000735609_100000183679 [0,1,0,1,0,0|2,0,0]=4 24155 B16R2.11967 Cc1cccc(c1Cl)C(=O)CCC2CC2 1458a_100000693142_100000694398 [0,1,0,1,0,0|2,0,0]=4 24156 B16R2.11967 Cc1cccc(c1Cl)C(=O)NCC2CC2 11a_100000735609_100000693142 [0,1,0,1,0,0|2,0,0]=4 24157 B16R2.11967 Cc1cccc(c1Cl)C(=O)NCC2CC2 1626a_100000735609_100000693142 [0,1,0,1,0,0|2,0,0]=4 24158 B16R2.11967 Cc1cccc(c1Cl)C(=O)NCC2CC2 240690a_100000735609_100000693142 [0,1,0,1,0,0|2,0,0]=4 24159 B16R2.11967 Cc1cccc(c1Cl)C(=O)NCC2CC2 527a_100000735609_100000693142 [0,1,0,1,0,0|2,0,0]=4 24160 B16R2.11967 Cc1cccc(c1F)C(=O)CCC2CC2 1458a_100000766181_100000694398 [0,1,0,1,0,0|2,0,0]=4 24161 B16R2.11967 Cc1cccc(c1F)C(=O)NCC2CC2 11a_100000735609_100000766181 [0,1,0,1,0,0|2,0,0]=4 24162 B16R2.11967 Cc1cccc(c1F)C(=O)NCC2CC2 1626a_100000735609_100000766181 [0,1,0,1,0,0|2,0,0]=4 24163 B16R2.11967 Cc1cccc(c1F)C(=O)NCC2CC2 240690a_100000735609_100000766181 [0,1,0,1,0,0|2,0,0]=4 24164 B16R2.11967 Cc1cccc(c1F)C(=O)NCC2CC2 527a_100000735609_100000766181 [0,1,0,1,0,0|2,0,0]=4 24165 B16R2.11967 Cc1cccc(c1I)C(=O)CCC2CC2 1458a_100000739377_100000694398 [0,1,0,1,0,0|2,0,0]=4 24166 B16R2.11967 Cc1cccc(c1I)C(=O)NCC2CC2 11a_100000735609_100000739377 [0,1,0,1,0,0|2,0,0]=4 24167 B16R2.11967 Cc1cccc(c1I)C(=O)NCC2CC2 1626a_100000735609_100000739377 [0,1,0,1,0,0|2,0,0]=4 24168 B16R2.11967 Cc1cccc(c1I)C(=O)NCC2CC2 240690a_100000735609_100000739377 [0,1,0,1,0,0|2,0,0]=4 24169 B16R2.11967 Cc1cccc(c1I)C(=O)NCC2CC2 527a_100000735609_100000739377 [0,1,0,1,0,0|2,0,0]=4 24170 B16R2.11967 Cc1cccc(c1O)C(=O)CCC2CC2 1458a_100000183896_100000694398 [0,1,0,1,0,0|1,0,0]=3 24171 B16R2.11967 Cc1cccc(c1O)C(=O)CCC2CO2 1458a_100000183896_100000732470 [0,1,0,1,0,0|2,0,0]=4 24172 B16R2.11967 Cc1cccc(c1O)C(=O)NCC2CC2 240690a_100000735609_100000183896 [0,1,0,1,0,0|1,0,0]=3 24173 B16R2.11967 Cc1cccc(c1O)C(=O)NCC2CC2 527a_100000735609_100000183896 [0,1,0,1,0,0|1,0,0]=3 24174 B16R2.11967 Cc1cccc(c1O)C(=O)NNC2CC2 22a_100000701032_100000183896 [0,1,0,1,0,0|2,0,0]=4 24175 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Br)Br 1458a_100012360534_100000694398 [0,1,0,1,0,0|2,0,0]=4 24176 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Br)Cl 1458a_100012339722_100000694398 [0,1,0,1,0,0|2,0,0]=4 24177 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Br)F 1458a_100011217547_100000694398 [0,1,0,1,0,0|2,0,0]=4 24178 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Br)I 1458a_100010232522_100000694398 [0,1,0,1,0,0|2,0,0]=4 24179 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Br)O 1458a_100010230362_100000694398 [0,1,0,1,0,0|2,0,0]=4 24180 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Cl)Br 1458a_100000760540_100000694398 [0,1,0,1,0,0|2,0,0]=4 24181 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Cl)Cl 1458a_100000183631_100000694398 [0,1,0,1,0,0|2,0,0]=4 24182 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Cl)F 1458a_100000759904_100000694398 [0,1,0,1,0,0|2,0,0]=4 24183 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Cl)I 1458a_100010176783_100000694398 [0,1,0,1,0,0|2,0,0]=4 24184 B16R2.11967 O=C(CCC1CC1)c2cccc(c2Cl)O 1458a_100000092362_100000694398 [0,1,0,1,0,0|2,0,0]=4 24185 B16R2.11967 O=C(CCC1CC1)c2cccc(c2F)Br 1458a_100000756403_100000694398 [0,1,0,1,0,0|2,0,0]=4 24186 B16R2.11967 O=C(CCC1CC1)c2cccc(c2F)Cl 1458a_100000688816_100000694398 [0,1,0,1,0,0|2,0,0]=4 24187 B16R2.11967 O=C(CCC1CC1)c2cccc(c2F)F 1458a_100000748134_100000694398 [0,1,0,1,0,0|2,0,0]=4 24188 B16R2.11967 O=C(CCC1CC1)c2cccc(c2F)I 1458a_100010185205_100000694398 [0,1,0,1,0,0|2,0,0]=4 24189 B16R2.11967 O=C(CCC1CC1)c2cccc(c2F)O 1458a_100000037433_100000694398 [0,1,0,1,0,0|2,0,0]=4 24190 B16R2.11967 O=C(CCC1CC1)c2cccc(c2I)Br 1458a_100000688019_100000694398 [0,1,0,1,0,0|2,0,0]=4 24191 B16R2.11967 O=C(CCC1CC1)c2cccc(c2I)Cl 1458a_100010176784_100000694398 [0,1,0,1,0,0|2,0,0]=4 24192 B16R2.11967 O=C(CCC1CC1)c2cccc(c2I)F 1458a_100000690930_100000694398 [0,1,0,1,0,0|2,0,0]=4 24193 B16R2.11967 O=C(CCC1CC1)c2cccc(c2I)O 1458a_100010084636_100000694398 [0,1,0,1,0,0|2,0,0]=4 24194 B16R2.11967 O=C(CCC1CC1)c2cccc(c2O)Br 1458a_100000752940_100000694398 [0,1,0,1,0,0|1,0,0]=3 24195 B16R2.11967 O=C(CCC1CC1)c2cccc(c2O)Cl 1458a_100000742801_100000694398 [0,1,0,1,0,0|1,0,0]=3 24196 B16R2.11967 O=C(CCC1CC1)c2cccc(c2O)F 1458a_100011217230_100000694398 [0,1,0,1,0,0|1,0,0]=3 24197 B16R2.11967 O=C(CCC1CC1)c2cccc(c2O)O 1458a_100000690420_100000694398 [0,1,0,1,0,0|1,0,0]=3 24198 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)Br 1458a_100000752940_100000732470 [0,1,0,1,0,0|2,0,0]=4 24199 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)Cl 1458a_100000742801_100000732470 [0,1,0,1,0,0|2,0,0]=4 24200 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)F 1458a_100011217230_100000732470 [0,1,0,1,0,0|2,0,0]=4 24201 B16R2.11967 O=C(CCC1CO1)c2cccc(c2O)O 1458a_100000690420_100000732470 [0,1,0,1,0,0|2,0,0]=4 24202 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Br 11a_100000735609_100012360534 [0,1,0,1,0,0|2,0,0]=4 24203 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Br 1626a_100000735609_100012360534 [0,1,0,1,0,0|2,0,0]=4 24204 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Br 240690a_100000735609_100012360534 [0,1,0,1,0,0|2,0,0]=4 24205 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Br 527a_100000735609_100012360534 [0,1,0,1,0,0|2,0,0]=4 24206 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Cl 11a_100000735609_100012339722 [0,1,0,1,0,0|2,0,0]=4 24207 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Cl 1626a_100000735609_100012339722 [0,1,0,1,0,0|2,0,0]=4 24208 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Cl 240690a_100000735609_100012339722 [0,1,0,1,0,0|2,0,0]=4 24209 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)Cl 527a_100000735609_100012339722 [0,1,0,1,0,0|2,0,0]=4 24210 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)F 11a_100000735609_100011217547 [0,1,0,1,0,0|2,0,0]=4 24211 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)F 1626a_100000735609_100011217547 [0,1,0,1,0,0|2,0,0]=4 24212 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)F 240690a_100000735609_100011217547 [0,1,0,1,0,0|2,0,0]=4 24213 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)F 527a_100000735609_100011217547 [0,1,0,1,0,0|2,0,0]=4 24214 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)I 11a_100000735609_100010232522 [0,1,0,1,0,0|2,0,0]=4 24215 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)I 1626a_100000735609_100010232522 [0,1,0,1,0,0|2,0,0]=4 24216 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)I 240690a_100000735609_100010232522 [0,1,0,1,0,0|2,0,0]=4 24217 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)I 527a_100000735609_100010232522 [0,1,0,1,0,0|2,0,0]=4 24218 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)O 240690a_100000735609_100010230362 [0,1,0,1,0,0|2,0,0]=4 24219 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Br)O 527a_100000735609_100010230362 [0,1,0,1,0,0|2,0,0]=4 24220 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Br 11a_100000735609_100000760540 [0,1,0,1,0,0|2,0,0]=4 24221 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Br 1626a_100000735609_100000760540 [0,1,0,1,0,0|2,0,0]=4 24222 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Br 240690a_100000735609_100000760540 [0,1,0,1,0,0|2,0,0]=4 24223 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Br 527a_100000735609_100000760540 [0,1,0,1,0,0|2,0,0]=4 24224 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Cl 11a_100000735609_100000183631 [0,1,0,1,0,0|2,0,0]=4 24225 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Cl 1626a_100000735609_100000183631 [0,1,0,1,0,0|2,0,0]=4 24226 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Cl 240690a_100000735609_100000183631 [0,1,0,1,0,0|2,0,0]=4 24227 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)Cl 527a_100000735609_100000183631 [0,1,0,1,0,0|2,0,0]=4 24228 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)F 11a_100000735609_100000759904 [0,1,0,1,0,0|2,0,0]=4 24229 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)F 1626a_100000735609_100000759904 [0,1,0,1,0,0|2,0,0]=4 24230 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)F 240690a_100000735609_100000759904 [0,1,0,1,0,0|2,0,0]=4 24231 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)F 527a_100000735609_100000759904 [0,1,0,1,0,0|2,0,0]=4 24232 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)I 11a_100000735609_100010176783 [0,1,0,1,0,0|2,0,0]=4 24233 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)I 1626a_100000735609_100010176783 [0,1,0,1,0,0|2,0,0]=4 24234 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)I 240690a_100000735609_100010176783 [0,1,0,1,0,0|2,0,0]=4 24235 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)I 527a_100000735609_100010176783 [0,1,0,1,0,0|2,0,0]=4 24236 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)O 240690a_100000735609_100000092362 [0,1,0,1,0,0|2,0,0]=4 24237 B16R2.11967 O=C(NCC1CC1)c2cccc(c2Cl)O 527a_100000735609_100000092362 [0,1,0,1,0,0|2,0,0]=4 24238 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Br 11a_100000735609_100000756403 [0,1,0,1,0,0|2,0,0]=4 24239 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Br 1626a_100000735609_100000756403 [0,1,0,1,0,0|2,0,0]=4 24240 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Br 240690a_100000735609_100000756403 [0,1,0,1,0,0|2,0,0]=4 24241 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Br 527a_100000735609_100000756403 [0,1,0,1,0,0|2,0,0]=4 24242 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Cl 11a_100000735609_100000688816 [0,1,0,1,0,0|2,0,0]=4 24243 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Cl 1626a_100000735609_100000688816 [0,1,0,1,0,0|2,0,0]=4 24244 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Cl 240690a_100000735609_100000688816 [0,1,0,1,0,0|2,0,0]=4 24245 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)Cl 527a_100000735609_100000688816 [0,1,0,1,0,0|2,0,0]=4 24246 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)F 11a_100000735609_100000748134 [0,1,0,1,0,0|2,0,0]=4 24247 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)F 1626a_100000735609_100000748134 [0,1,0,1,0,0|2,0,0]=4 24248 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)F 240690a_100000735609_100000748134 [0,1,0,1,0,0|2,0,0]=4 24249 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)F 527a_100000735609_100000748134 [0,1,0,1,0,0|2,0,0]=4 24250 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)I 11a_100000735609_100010185205 [0,1,0,1,0,0|2,0,0]=4 24251 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)I 1626a_100000735609_100010185205 [0,1,0,1,0,0|2,0,0]=4 24252 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)I 240690a_100000735609_100010185205 [0,1,0,1,0,0|2,0,0]=4 24253 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)I 527a_100000735609_100010185205 [0,1,0,1,0,0|2,0,0]=4 24254 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)O 240690a_100000735609_100000037433 [0,1,0,1,0,0|2,0,0]=4 24255 B16R2.11967 O=C(NCC1CC1)c2cccc(c2F)O 527a_100000735609_100000037433 [0,1,0,1,0,0|2,0,0]=4 24256 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Br 11a_100000735609_100000688019 [0,1,0,1,0,0|2,0,0]=4 24257 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Br 1626a_100000735609_100000688019 [0,1,0,1,0,0|2,0,0]=4 24258 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Br 240690a_100000735609_100000688019 [0,1,0,1,0,0|2,0,0]=4 24259 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Br 527a_100000735609_100000688019 [0,1,0,1,0,0|2,0,0]=4 24260 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Cl 11a_100000735609_100010176784 [0,1,0,1,0,0|2,0,0]=4 24261 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Cl 1626a_100000735609_100010176784 [0,1,0,1,0,0|2,0,0]=4 24262 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Cl 240690a_100000735609_100010176784 [0,1,0,1,0,0|2,0,0]=4 24263 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)Cl 527a_100000735609_100010176784 [0,1,0,1,0,0|2,0,0]=4 24264 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)F 11a_100000735609_100000690930 [0,1,0,1,0,0|2,0,0]=4 24265 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)F 1626a_100000735609_100000690930 [0,1,0,1,0,0|2,0,0]=4 24266 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)F 240690a_100000735609_100000690930 [0,1,0,1,0,0|2,0,0]=4 24267 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)F 527a_100000735609_100000690930 [0,1,0,1,0,0|2,0,0]=4 24268 B16R2.11967 O=C(NCC1CC1)c2cccc(c2I)O 527a_100000735609_100010084636 [0,1,0,1,0,0|2,0,0]=4 24269 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)Br 240690a_100000735609_100000752940 [0,1,0,1,0,0|1,0,0]=3 24270 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)Br 527a_100000735609_100000752940 [0,1,0,1,0,0|1,0,0]=3 24271 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)Cl 240690a_100000735609_100000742801 [0,1,0,1,0,0|1,0,0]=3 24272 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)Cl 527a_100000735609_100000742801 [0,1,0,1,0,0|1,0,0]=3 24273 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)F 240690a_100000735609_100011217230 [0,1,0,1,0,0|1,0,0]=3 24274 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)F 527a_100000735609_100011217230 [0,1,0,1,0,0|1,0,0]=3 24275 B16R2.11967 O=C(NCC1CC1)c2cccc(c2O)O 527a_100000735609_100000690420 [0,1,0,1,0,0|1,0,0]=3 24276 B16R2.11967 O=C(NNC1CC1)c2cccc(c2O)Br 22a_100000701032_100000752940 [0,1,0,1,0,0|2,0,0]=4 24277 B16R2.11967 O=C(NNC1CC1)c2cccc(c2O)Cl 22a_100000701032_100000742801 [0,1,0,1,0,0|2,0,0]=4 24278 B16R2.11967 O=C(NNC1CC1)c2cccc(c2O)F 22a_100000701032_100011217230 [0,1,0,1,0,0|2,0,0]=4 24279 B16R2.11967 O=C(NNC1CC1)c2cccc(c2O)O 22a_100000701032_100000690420 [0,1,0,1,0,0|2,0,0]=4 24280 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)Br 11a_100000755817_100012360534 [0,1,0,1,0,0|2,0,0]=4 24281 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)Br 240690a_100000755817_100012360534 [0,1,0,1,0,0|2,0,0]=4 24282 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)Br 527a_100000755817_100012360534 [0,1,0,1,0,0|2,0,0]=4 24283 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)Cl 11a_100000755817_100012339722 [0,1,0,1,0,0|2,0,0]=4 24284 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)Cl 240690a_100000755817_100012339722 [0,1,0,1,0,0|2,0,0]=4 24285 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)Cl 527a_100000755817_100012339722 [0,1,0,1,0,0|2,0,0]=4 24286 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)F 11a_100000755817_100011217547 [0,1,0,1,0,0|2,0,0]=4 24287 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)F 240690a_100000755817_100011217547 [0,1,0,1,0,0|2,0,0]=4 24288 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)F 527a_100000755817_100011217547 [0,1,0,1,0,0|2,0,0]=4 24289 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)I 11a_100000755817_100010232522 [0,1,0,1,0,0|2,0,0]=4 24290 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)I 240690a_100000755817_100010232522 [0,1,0,1,0,0|2,0,0]=4 24291 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)I 527a_100000755817_100010232522 [0,1,0,1,0,0|2,0,0]=4 24292 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)O 240690a_100000755817_100010230362 [0,1,0,1,0,0|2,0,0]=4 24293 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Br)O 527a_100000755817_100010230362 [0,1,0,1,0,0|2,0,0]=4 24294 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)Br 11a_100000755817_100000760540 [0,1,0,1,0,0|2,0,0]=4 24295 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)Br 240690a_100000755817_100000760540 [0,1,0,1,0,0|2,0,0]=4 24296 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)Br 527a_100000755817_100000760540 [0,1,0,1,0,0|2,0,0]=4 24297 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)Cl 11a_100000755817_100000183631 [0,1,0,1,0,0|2,0,0]=4 24298 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)Cl 240690a_100000755817_100000183631 [0,1,0,1,0,0|2,0,0]=4 24299 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)Cl 527a_100000755817_100000183631 [0,1,0,1,0,0|2,0,0]=4 24300 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)F 11a_100000755817_100000759904 [0,1,0,1,0,0|2,0,0]=4 24301 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)F 240690a_100000755817_100000759904 [0,1,0,1,0,0|2,0,0]=4 24302 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)F 527a_100000755817_100000759904 [0,1,0,1,0,0|2,0,0]=4 24303 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)I 11a_100000755817_100010176783 [0,1,0,1,0,0|2,0,0]=4 24304 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)I 240690a_100000755817_100010176783 [0,1,0,1,0,0|2,0,0]=4 24305 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)I 527a_100000755817_100010176783 [0,1,0,1,0,0|2,0,0]=4 24306 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)O 240690a_100000755817_100000092362 [0,1,0,1,0,0|2,0,0]=4 24307 B16R2.25785 CC1CCN1C(=O)c2cccc(c2Cl)O 527a_100000755817_100000092362 [0,1,0,1,0,0|2,0,0]=4 24308 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)Br 11a_100000755817_100000756403 [0,1,0,1,0,0|2,0,0]=4 24309 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)Br 240690a_100000755817_100000756403 [0,1,0,1,0,0|2,0,0]=4 24310 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)Br 527a_100000755817_100000756403 [0,1,0,1,0,0|2,0,0]=4 24311 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)Cl 11a_100000755817_100000688816 [0,1,0,1,0,0|2,0,0]=4 24312 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)Cl 240690a_100000755817_100000688816 [0,1,0,1,0,0|2,0,0]=4 24313 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)Cl 527a_100000755817_100000688816 [0,1,0,1,0,0|2,0,0]=4 24314 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)F 11a_100000755817_100000748134 [0,1,0,1,0,0|2,0,0]=4 24315 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)F 240690a_100000755817_100000748134 [0,1,0,1,0,0|2,0,0]=4 24316 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)F 527a_100000755817_100000748134 [0,1,0,1,0,0|2,0,0]=4 24317 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)I 11a_100000755817_100010185205 [0,1,0,1,0,0|2,0,0]=4 24318 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)I 240690a_100000755817_100010185205 [0,1,0,1,0,0|2,0,0]=4 24319 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)I 527a_100000755817_100010185205 [0,1,0,1,0,0|2,0,0]=4 24320 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)O 240690a_100000755817_100000037433 [0,1,0,1,0,0|2,0,0]=4 24321 B16R2.25785 CC1CCN1C(=O)c2cccc(c2F)O 527a_100000755817_100000037433 [0,1,0,1,0,0|2,0,0]=4 24322 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)Br 11a_100000755817_100000688019 [0,1,0,1,0,0|2,0,0]=4 24323 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)Br 240690a_100000755817_100000688019 [0,1,0,1,0,0|2,0,0]=4 24324 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)Br 527a_100000755817_100000688019 [0,1,0,1,0,0|2,0,0]=4 24325 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)Cl 11a_100000755817_100010176784 [0,1,0,1,0,0|2,0,0]=4 24326 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)Cl 240690a_100000755817_100010176784 [0,1,0,1,0,0|2,0,0]=4 24327 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)Cl 527a_100000755817_100010176784 [0,1,0,1,0,0|2,0,0]=4 24328 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)F 11a_100000755817_100000690930 [0,1,0,1,0,0|2,0,0]=4 24329 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)F 240690a_100000755817_100000690930 [0,1,0,1,0,0|2,0,0]=4 24330 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)F 527a_100000755817_100000690930 [0,1,0,1,0,0|2,0,0]=4 24331 B16R2.25785 CC1CCN1C(=O)c2cccc(c2I)O 527a_100000755817_100010084636 [0,1,0,1,0,0|2,0,0]=4 24332 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)Br 240690a_100000755817_100000752940 [0,1,0,1,0,0|1,0,0]=3 24333 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)Br 527a_100000755817_100000752940 [0,1,0,1,0,0|1,0,0]=3 24334 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)Cl 240690a_100000755817_100000742801 [0,1,0,1,0,0|1,0,0]=3 24335 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)Cl 527a_100000755817_100000742801 [0,1,0,1,0,0|1,0,0]=3 24336 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)F 240690a_100000755817_100011217230 [0,1,0,1,0,0|1,0,0]=3 24337 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)F 527a_100000755817_100011217230 [0,1,0,1,0,0|1,0,0]=3 24338 B16R2.25785 CC1CCN1C(=O)c2cccc(c2O)O 527a_100000755817_100000690420 [0,1,0,1,0,0|1,0,0]=3 24339 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)Br 11a_100000755817_100000760464 [0,1,0,1,0,0|2,0,0]=4 24340 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)Br 240690a_100000755817_100000760464 [0,1,0,1,0,0|2,0,0]=4 24341 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)Br 527a_100000755817_100000760464 [0,1,0,1,0,0|2,0,0]=4 24342 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)Cl 11a_100000755817_100000690184 [0,1,0,1,0,0|2,0,0]=4 24343 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)Cl 240690a_100000755817_100000690184 [0,1,0,1,0,0|2,0,0]=4 24344 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)Cl 527a_100000755817_100000690184 [0,1,0,1,0,0|2,0,0]=4 24345 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)F 11a_100000755817_100011218272 [0,1,0,1,0,0|2,0,0]=4 24346 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)F 240690a_100000755817_100011218272 [0,1,0,1,0,0|2,0,0]=4 24347 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)F 527a_100000755817_100011218272 [0,1,0,1,0,0|2,0,0]=4 24348 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)I 11a_100000755817_100000751865 [0,1,0,1,0,0|2,0,0]=4 24349 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)I 240690a_100000755817_100000751865 [0,1,0,1,0,0|2,0,0]=4 24350 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)I 527a_100000755817_100000751865 [0,1,0,1,0,0|2,0,0]=4 24351 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)O 240690a_100000755817_100000766327 [0,1,0,1,0,0|2,0,0]=4 24352 B16R2.25785 Cc1c(cccc1C(=O)N2CCC2C)O 527a_100000755817_100000766327 [0,1,0,1,0,0|2,0,0]=4 24353 B16R2.25785 Cc1cccc(c1Br)C(=O)N2CCC2C 11a_100000755817_100000692419 [0,1,0,1,0,0|2,0,0]=4 24354 B16R2.25785 Cc1cccc(c1Br)C(=O)N2CCC2C 240690a_100000755817_100000692419 [0,1,0,1,0,0|2,0,0]=4 24355 B16R2.25785 Cc1cccc(c1Br)C(=O)N2CCC2C 527a_100000755817_100000692419 [0,1,0,1,0,0|2,0,0]=4 24356 B16R2.25785 Cc1cccc(c1C)C(=O)N2CCC2C 11a_100000755817_100000183679 [0,1,0,1,0,0|2,0,0]=4 24357 B16R2.25785 Cc1cccc(c1C)C(=O)N2CCC2C 240690a_100000755817_100000183679 [0,1,0,1,0,0|2,0,0]=4 24358 B16R2.25785 Cc1cccc(c1C)C(=O)N2CCC2C 527a_100000755817_100000183679 [0,1,0,1,0,0|2,0,0]=4 24359 B16R2.25785 Cc1cccc(c1Cl)C(=O)N2CCC2C 11a_100000755817_100000693142 [0,1,0,1,0,0|2,0,0]=4 24360 B16R2.25785 Cc1cccc(c1Cl)C(=O)N2CCC2C 240690a_100000755817_100000693142 [0,1,0,1,0,0|2,0,0]=4 24361 B16R2.25785 Cc1cccc(c1Cl)C(=O)N2CCC2C 527a_100000755817_100000693142 [0,1,0,1,0,0|2,0,0]=4 24362 B16R2.25785 Cc1cccc(c1F)C(=O)N2CCC2C 11a_100000755817_100000766181 [0,1,0,1,0,0|2,0,0]=4 24363 B16R2.25785 Cc1cccc(c1F)C(=O)N2CCC2C 240690a_100000755817_100000766181 [0,1,0,1,0,0|2,0,0]=4 24364 B16R2.25785 Cc1cccc(c1F)C(=O)N2CCC2C 527a_100000755817_100000766181 [0,1,0,1,0,0|2,0,0]=4 24365 B16R2.25785 Cc1cccc(c1I)C(=O)N2CCC2C 11a_100000755817_100000739377 [0,1,0,1,0,0|2,0,0]=4 24366 B16R2.25785 Cc1cccc(c1I)C(=O)N2CCC2C 240690a_100000755817_100000739377 [0,1,0,1,0,0|2,0,0]=4 24367 B16R2.25785 Cc1cccc(c1I)C(=O)N2CCC2C 527a_100000755817_100000739377 [0,1,0,1,0,0|2,0,0]=4 24368 B16R2.25785 Cc1cccc(c1O)C(=O)N2CCC2C 240690a_100000755817_100000183896 [0,1,0,1,0,0|1,0,0]=3 24369 B16R2.25785 Cc1cccc(c1O)C(=O)N2CCC2C 527a_100000755817_100000183896 [0,1,0,1,0,0|1,0,0]=3 24370 B16R2.80751 Cc1c(cccc1C(=O)CC2CCC2)Br 1458a_100000760464_100000763275 [0,1,0,1,0,0|2,0,0]=4 24371 B16R2.80751 Cc1c(cccc1C(=O)CC2CCC2)Cl 1458a_100000690184_100000763275 [0,1,0,1,0,0|2,0,0]=4 24372 B16R2.80751 Cc1c(cccc1C(=O)CC2CCC2)F 1458a_100011218272_100000763275 [0,1,0,1,0,0|2,0,0]=4 24373 B16R2.80751 Cc1c(cccc1C(=O)CC2CCC2)I 1458a_100000751865_100000763275 [0,1,0,1,0,0|2,0,0]=4 24374 B16R2.80751 Cc1c(cccc1C(=O)CC2CCC2)O 1458a_100000766327_100000763275 [0,1,0,1,0,0|2,0,0]=4 24375 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Br 11a_100000749019_100000760464 [0,1,0,1,0,0|2,0,0]=4 24376 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Br 1626a_100000749019_100000760464 [0,1,0,1,0,0|2,0,0]=4 24377 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Br 240690a_100000749019_100000760464 [0,1,0,1,0,0|2,0,0]=4 24378 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Br 527a_100000749019_100000760464 [0,1,0,1,0,0|2,0,0]=4 24379 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Cl 11a_100000749019_100000690184 [0,1,0,1,0,0|2,0,0]=4 24380 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Cl 1626a_100000749019_100000690184 [0,1,0,1,0,0|2,0,0]=4 24381 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Cl 240690a_100000749019_100000690184 [0,1,0,1,0,0|2,0,0]=4 24382 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)Cl 527a_100000749019_100000690184 [0,1,0,1,0,0|2,0,0]=4 24383 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)F 11a_100000749019_100011218272 [0,1,0,1,0,0|2,0,0]=4 24384 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)F 1626a_100000749019_100011218272 [0,1,0,1,0,0|2,0,0]=4 24385 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)F 240690a_100000749019_100011218272 [0,1,0,1,0,0|2,0,0]=4 24386 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)F 527a_100000749019_100011218272 [0,1,0,1,0,0|2,0,0]=4 24387 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)I 11a_100000749019_100000751865 [0,1,0,1,0,0|2,0,0]=4 24388 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)I 1626a_100000749019_100000751865 [0,1,0,1,0,0|2,0,0]=4 24389 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)I 240690a_100000749019_100000751865 [0,1,0,1,0,0|2,0,0]=4 24390 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)I 527a_100000749019_100000751865 [0,1,0,1,0,0|2,0,0]=4 24391 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)O 240690a_100000749019_100000766327 [0,1,0,1,0,0|2,0,0]=4 24392 B16R2.80751 Cc1c(cccc1C(=O)NC2CCC2)O 527a_100000749019_100000766327 [0,1,0,1,0,0|2,0,0]=4 24393 B16R2.80751 Cc1cccc(c1Br)C(=O)CC2CCC2 1458a_100000692419_100000763275 [0,1,0,1,0,0|2,0,0]=4 24394 B16R2.80751 Cc1cccc(c1Br)C(=O)NC2CCC2 11a_100000749019_100000692419 [0,1,0,1,0,0|2,0,0]=4 24395 B16R2.80751 Cc1cccc(c1Br)C(=O)NC2CCC2 1626a_100000749019_100000692419 [0,1,0,1,0,0|2,0,0]=4 24396 B16R2.80751 Cc1cccc(c1Br)C(=O)NC2CCC2 240690a_100000749019_100000692419 [0,1,0,1,0,0|2,0,0]=4 24397 B16R2.80751 Cc1cccc(c1Br)C(=O)NC2CCC2 527a_100000749019_100000692419 [0,1,0,1,0,0|2,0,0]=4 24398 B16R2.80751 Cc1cccc(c1C)C(=O)CC2CCC2 1458a_100000183679_100000763275 [0,1,0,1,0,0|2,0,0]=4 24399 B16R2.80751 Cc1cccc(c1C)C(=O)NC2CCC2 11a_100000749019_100000183679 [0,1,0,1,0,0|2,0,0]=4 24400 B16R2.80751 Cc1cccc(c1C)C(=O)NC2CCC2 1626a_100000749019_100000183679 [0,1,0,1,0,0|2,0,0]=4 24401 B16R2.80751 Cc1cccc(c1C)C(=O)NC2CCC2 240690a_100000749019_100000183679 [0,1,0,1,0,0|2,0,0]=4 24402 B16R2.80751 Cc1cccc(c1C)C(=O)NC2CCC2 527a_100000749019_100000183679 [0,1,0,1,0,0|2,0,0]=4 24403 B16R2.80751 Cc1cccc(c1Cl)C(=O)CC2CCC2 1458a_100000693142_100000763275 [0,1,0,1,0,0|2,0,0]=4 24404 B16R2.80751 Cc1cccc(c1Cl)C(=O)NC2CCC2 11a_100000749019_100000693142 [0,1,0,1,0,0|2,0,0]=4 24405 B16R2.80751 Cc1cccc(c1Cl)C(=O)NC2CCC2 1626a_100000749019_100000693142 [0,1,0,1,0,0|2,0,0]=4 24406 B16R2.80751 Cc1cccc(c1Cl)C(=O)NC2CCC2 240690a_100000749019_100000693142 [0,1,0,1,0,0|2,0,0]=4 24407 B16R2.80751 Cc1cccc(c1Cl)C(=O)NC2CCC2 527a_100000749019_100000693142 [0,1,0,1,0,0|2,0,0]=4 24408 B16R2.80751 Cc1cccc(c1F)C(=O)CC2CCC2 1458a_100000766181_100000763275 [0,1,0,1,0,0|2,0,0]=4 24409 B16R2.80751 Cc1cccc(c1F)C(=O)NC2CCC2 11a_100000749019_100000766181 [0,1,0,1,0,0|2,0,0]=4 24410 B16R2.80751 Cc1cccc(c1F)C(=O)NC2CCC2 1626a_100000749019_100000766181 [0,1,0,1,0,0|2,0,0]=4 24411 B16R2.80751 Cc1cccc(c1F)C(=O)NC2CCC2 240690a_100000749019_100000766181 [0,1,0,1,0,0|2,0,0]=4 24412 B16R2.80751 Cc1cccc(c1F)C(=O)NC2CCC2 527a_100000749019_100000766181 [0,1,0,1,0,0|2,0,0]=4 24413 B16R2.80751 Cc1cccc(c1I)C(=O)CC2CCC2 1458a_100000739377_100000763275 [0,1,0,1,0,0|2,0,0]=4 24414 B16R2.80751 Cc1cccc(c1I)C(=O)NC2CCC2 11a_100000749019_100000739377 [0,1,0,1,0,0|2,0,0]=4 24415 B16R2.80751 Cc1cccc(c1I)C(=O)NC2CCC2 1626a_100000749019_100000739377 [0,1,0,1,0,0|2,0,0]=4 24416 B16R2.80751 Cc1cccc(c1I)C(=O)NC2CCC2 240690a_100000749019_100000739377 [0,1,0,1,0,0|2,0,0]=4 24417 B16R2.80751 Cc1cccc(c1I)C(=O)NC2CCC2 527a_100000749019_100000739377 [0,1,0,1,0,0|2,0,0]=4 24418 B16R2.80751 Cc1cccc(c1O)C(=O)CC2CCC2 1458a_100000183896_100000763275 [0,1,0,1,0,0|1,0,0]=3 24419 B16R2.80751 Cc1cccc(c1O)C(=O)CC2CCO2 1458a_100000183896_100000103362 [0,1,0,1,0,0|2,0,0]=4 24420 B16R2.80751 Cc1cccc(c1O)C(=O)CC2COC2 1458a_100000183896_100010264016 [0,1,0,1,0,0|2,0,0]=4 24421 B16R2.80751 Cc1cccc(c1O)C(=O)NC2CCC2 240690a_100000749019_100000183896 [0,1,0,1,0,0|1,0,0]=3 24422 B16R2.80751 Cc1cccc(c1O)C(=O)NC2CCC2 527a_100000749019_100000183896 [0,1,0,1,0,0|1,0,0]=3 24423 B16R2.80751 Cc1cccc(c1O)C(=O)NC2COC2 240690a_100016991112_100000183896 [0,1,0,1,0,0|2,0,0]=4 24424 B16R2.80751 Cc1cccc(c1O)C(=O)NC2COC2 527a_100016991112_100000183896 [0,1,0,1,0,0|2,0,0]=4 24425 B16R2.80751 Cc1cccc(c1O)C(=O)NC2CSC2 240690a_100016994217_100000183896 [0,1,0,1,0,0|2,0,0]=4 24426 B16R2.80751 Cc1cccc(c1O)C(=O)NC2CSC2 527a_100016994217_100000183896 [0,1,0,1,0,0|2,0,0]=4 24427 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Br)Br 1458a_100012360534_100000763275 [0,1,0,1,0,0|2,0,0]=4 24428 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Br)Cl 1458a_100012339722_100000763275 [0,1,0,1,0,0|2,0,0]=4 24429 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Br)F 1458a_100011217547_100000763275 [0,1,0,1,0,0|2,0,0]=4 24430 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Br)I 1458a_100010232522_100000763275 [0,1,0,1,0,0|2,0,0]=4 24431 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Br)O 1458a_100010230362_100000763275 [0,1,0,1,0,0|2,0,0]=4 24432 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Cl)Br 1458a_100000760540_100000763275 [0,1,0,1,0,0|2,0,0]=4 24433 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Cl)Cl 1458a_100000183631_100000763275 [0,1,0,1,0,0|2,0,0]=4 24434 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Cl)F 1458a_100000759904_100000763275 [0,1,0,1,0,0|2,0,0]=4 24435 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Cl)I 1458a_100010176783_100000763275 [0,1,0,1,0,0|2,0,0]=4 24436 B16R2.80751 O=C(CC1CCC1)c2cccc(c2Cl)O 1458a_100000092362_100000763275 [0,1,0,1,0,0|2,0,0]=4 24437 B16R2.80751 O=C(CC1CCC1)c2cccc(c2F)Br 1458a_100000756403_100000763275 [0,1,0,1,0,0|2,0,0]=4 24438 B16R2.80751 O=C(CC1CCC1)c2cccc(c2F)Cl 1458a_100000688816_100000763275 [0,1,0,1,0,0|2,0,0]=4 24439 B16R2.80751 O=C(CC1CCC1)c2cccc(c2F)F 1458a_100000748134_100000763275 [0,1,0,1,0,0|2,0,0]=4 24440 B16R2.80751 O=C(CC1CCC1)c2cccc(c2F)I 1458a_100010185205_100000763275 [0,1,0,1,0,0|2,0,0]=4 24441 B16R2.80751 O=C(CC1CCC1)c2cccc(c2F)O 1458a_100000037433_100000763275 [0,1,0,1,0,0|2,0,0]=4 24442 B16R2.80751 O=C(CC1CCC1)c2cccc(c2I)Br 1458a_100000688019_100000763275 [0,1,0,1,0,0|2,0,0]=4 24443 B16R2.80751 O=C(CC1CCC1)c2cccc(c2I)Cl 1458a_100010176784_100000763275 [0,1,0,1,0,0|2,0,0]=4 24444 B16R2.80751 O=C(CC1CCC1)c2cccc(c2I)F 1458a_100000690930_100000763275 [0,1,0,1,0,0|2,0,0]=4 24445 B16R2.80751 O=C(CC1CCC1)c2cccc(c2I)O 1458a_100010084636_100000763275 [0,1,0,1,0,0|2,0,0]=4 24446 B16R2.80751 O=C(CC1CCC1)c2cccc(c2O)Br 1458a_100000752940_100000763275 [0,1,0,1,0,0|1,0,0]=3 24447 B16R2.80751 O=C(CC1CCC1)c2cccc(c2O)Cl 1458a_100000742801_100000763275 [0,1,0,1,0,0|1,0,0]=3 24448 B16R2.80751 O=C(CC1CCC1)c2cccc(c2O)F 1458a_100011217230_100000763275 [0,1,0,1,0,0|1,0,0]=3 24449 B16R2.80751 O=C(CC1CCC1)c2cccc(c2O)O 1458a_100000690420_100000763275 [0,1,0,1,0,0|1,0,0]=3 24450 B16R2.80751 O=C(CC1CCO1)c2cccc(c2O)Br 1458a_100000752940_100000103362 [0,1,0,1,0,0|2,0,0]=4 24451 B16R2.80751 O=C(CC1CCO1)c2cccc(c2O)Cl 1458a_100000742801_100000103362 [0,1,0,1,0,0|2,0,0]=4 24452 B16R2.80751 O=C(CC1CCO1)c2cccc(c2O)F 1458a_100011217230_100000103362 [0,1,0,1,0,0|2,0,0]=4 24453 B16R2.80751 O=C(CC1CCO1)c2cccc(c2O)O 1458a_100000690420_100000103362 [0,1,0,1,0,0|2,0,0]=4 24454 B16R2.80751 O=C(CC1COC1)c2cccc(c2O)Br 1458a_100000752940_100010264016 [0,1,0,1,0,0|2,0,0]=4 24455 B16R2.80751 O=C(CC1COC1)c2cccc(c2O)Cl 1458a_100000742801_100010264016 [0,1,0,1,0,0|2,0,0]=4 24456 B16R2.80751 O=C(CC1COC1)c2cccc(c2O)F 1458a_100011217230_100010264016 [0,1,0,1,0,0|2,0,0]=4 24457 B16R2.80751 O=C(CC1COC1)c2cccc(c2O)O 1458a_100000690420_100010264016 [0,1,0,1,0,0|2,0,0]=4 24458 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Br 11a_100000749019_100012360534 [0,1,0,1,0,0|2,0,0]=4 24459 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Br 1626a_100000749019_100012360534 [0,1,0,1,0,0|2,0,0]=4 24460 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Br 240690a_100000749019_100012360534 [0,1,0,1,0,0|2,0,0]=4 24461 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Br 527a_100000749019_100012360534 [0,1,0,1,0,0|2,0,0]=4 24462 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Cl 11a_100000749019_100012339722 [0,1,0,1,0,0|2,0,0]=4 24463 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Cl 1626a_100000749019_100012339722 [0,1,0,1,0,0|2,0,0]=4 24464 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Cl 240690a_100000749019_100012339722 [0,1,0,1,0,0|2,0,0]=4 24465 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)Cl 527a_100000749019_100012339722 [0,1,0,1,0,0|2,0,0]=4 24466 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)F 11a_100000749019_100011217547 [0,1,0,1,0,0|2,0,0]=4 24467 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)F 1626a_100000749019_100011217547 [0,1,0,1,0,0|2,0,0]=4 24468 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)F 240690a_100000749019_100011217547 [0,1,0,1,0,0|2,0,0]=4 24469 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)F 527a_100000749019_100011217547 [0,1,0,1,0,0|2,0,0]=4 24470 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)I 11a_100000749019_100010232522 [0,1,0,1,0,0|2,0,0]=4 24471 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)I 1626a_100000749019_100010232522 [0,1,0,1,0,0|2,0,0]=4 24472 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)I 240690a_100000749019_100010232522 [0,1,0,1,0,0|2,0,0]=4 24473 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)I 527a_100000749019_100010232522 [0,1,0,1,0,0|2,0,0]=4 24474 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)O 240690a_100000749019_100010230362 [0,1,0,1,0,0|2,0,0]=4 24475 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Br)O 527a_100000749019_100010230362 [0,1,0,1,0,0|2,0,0]=4 24476 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Br 11a_100000749019_100000760540 [0,1,0,1,0,0|2,0,0]=4 24477 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Br 1626a_100000749019_100000760540 [0,1,0,1,0,0|2,0,0]=4 24478 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Br 240690a_100000749019_100000760540 [0,1,0,1,0,0|2,0,0]=4 24479 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Br 527a_100000749019_100000760540 [0,1,0,1,0,0|2,0,0]=4 24480 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Cl 11a_100000749019_100000183631 [0,1,0,1,0,0|2,0,0]=4 24481 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Cl 1626a_100000749019_100000183631 [0,1,0,1,0,0|2,0,0]=4 24482 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Cl 240690a_100000749019_100000183631 [0,1,0,1,0,0|2,0,0]=4 24483 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)Cl 527a_100000749019_100000183631 [0,1,0,1,0,0|2,0,0]=4 24484 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)F 11a_100000749019_100000759904 [0,1,0,1,0,0|2,0,0]=4 24485 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)F 1626a_100000749019_100000759904 [0,1,0,1,0,0|2,0,0]=4 24486 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)F 240690a_100000749019_100000759904 [0,1,0,1,0,0|2,0,0]=4 24487 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)F 527a_100000749019_100000759904 [0,1,0,1,0,0|2,0,0]=4 24488 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)I 11a_100000749019_100010176783 [0,1,0,1,0,0|2,0,0]=4 24489 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)I 1626a_100000749019_100010176783 [0,1,0,1,0,0|2,0,0]=4 24490 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)I 240690a_100000749019_100010176783 [0,1,0,1,0,0|2,0,0]=4 24491 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)I 527a_100000749019_100010176783 [0,1,0,1,0,0|2,0,0]=4 24492 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)O 240690a_100000749019_100000092362 [0,1,0,1,0,0|2,0,0]=4 24493 B16R2.80751 O=C(NC1CCC1)c2cccc(c2Cl)O 527a_100000749019_100000092362 [0,1,0,1,0,0|2,0,0]=4 24494 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Br 11a_100000749019_100000756403 [0,1,0,1,0,0|2,0,0]=4 24495 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Br 1626a_100000749019_100000756403 [0,1,0,1,0,0|2,0,0]=4 24496 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Br 240690a_100000749019_100000756403 [0,1,0,1,0,0|2,0,0]=4 24497 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Br 527a_100000749019_100000756403 [0,1,0,1,0,0|2,0,0]=4 24498 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Cl 11a_100000749019_100000688816 [0,1,0,1,0,0|2,0,0]=4 24499 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Cl 1626a_100000749019_100000688816 [0,1,0,1,0,0|2,0,0]=4 24500 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Cl 240690a_100000749019_100000688816 [0,1,0,1,0,0|2,0,0]=4 24501 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)Cl 527a_100000749019_100000688816 [0,1,0,1,0,0|2,0,0]=4 24502 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)F 11a_100000749019_100000748134 [0,1,0,1,0,0|2,0,0]=4 24503 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)F 1626a_100000749019_100000748134 [0,1,0,1,0,0|2,0,0]=4 24504 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)F 240690a_100000749019_100000748134 [0,1,0,1,0,0|2,0,0]=4 24505 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)F 527a_100000749019_100000748134 [0,1,0,1,0,0|2,0,0]=4 24506 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)I 11a_100000749019_100010185205 [0,1,0,1,0,0|2,0,0]=4 24507 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)I 1626a_100000749019_100010185205 [0,1,0,1,0,0|2,0,0]=4 24508 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)I 240690a_100000749019_100010185205 [0,1,0,1,0,0|2,0,0]=4 24509 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)I 527a_100000749019_100010185205 [0,1,0,1,0,0|2,0,0]=4 24510 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)O 240690a_100000749019_100000037433 [0,1,0,1,0,0|2,0,0]=4 24511 B16R2.80751 O=C(NC1CCC1)c2cccc(c2F)O 527a_100000749019_100000037433 [0,1,0,1,0,0|2,0,0]=4 24512 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Br 11a_100000749019_100000688019 [0,1,0,1,0,0|2,0,0]=4 24513 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Br 1626a_100000749019_100000688019 [0,1,0,1,0,0|2,0,0]=4 24514 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Br 240690a_100000749019_100000688019 [0,1,0,1,0,0|2,0,0]=4 24515 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Br 527a_100000749019_100000688019 [0,1,0,1,0,0|2,0,0]=4 24516 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Cl 11a_100000749019_100010176784 [0,1,0,1,0,0|2,0,0]=4 24517 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Cl 1626a_100000749019_100010176784 [0,1,0,1,0,0|2,0,0]=4 24518 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Cl 240690a_100000749019_100010176784 [0,1,0,1,0,0|2,0,0]=4 24519 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)Cl 527a_100000749019_100010176784 [0,1,0,1,0,0|2,0,0]=4 24520 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)F 11a_100000749019_100000690930 [0,1,0,1,0,0|2,0,0]=4 24521 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)F 1626a_100000749019_100000690930 [0,1,0,1,0,0|2,0,0]=4 24522 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)F 240690a_100000749019_100000690930 [0,1,0,1,0,0|2,0,0]=4 24523 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)F 527a_100000749019_100000690930 [0,1,0,1,0,0|2,0,0]=4 24524 B16R2.80751 O=C(NC1CCC1)c2cccc(c2I)O 527a_100000749019_100010084636 [0,1,0,1,0,0|2,0,0]=4 24525 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)Br 240690a_100000749019_100000752940 [0,1,0,1,0,0|1,0,0]=3 24526 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)Br 527a_100000749019_100000752940 [0,1,0,1,0,0|1,0,0]=3 24527 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)Cl 240690a_100000749019_100000742801 [0,1,0,1,0,0|1,0,0]=3 24528 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)Cl 527a_100000749019_100000742801 [0,1,0,1,0,0|1,0,0]=3 24529 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)F 240690a_100000749019_100011217230 [0,1,0,1,0,0|1,0,0]=3 24530 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)F 527a_100000749019_100011217230 [0,1,0,1,0,0|1,0,0]=3 24531 B16R2.80751 O=C(NC1CCC1)c2cccc(c2O)O 527a_100000749019_100000690420 [0,1,0,1,0,0|1,0,0]=3 24532 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)Br 240690a_100016991112_100000752940 [0,1,0,1,0,0|2,0,0]=4 24533 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)Br 527a_100016991112_100000752940 [0,1,0,1,0,0|2,0,0]=4 24534 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)Cl 240690a_100016991112_100000742801 [0,1,0,1,0,0|2,0,0]=4 24535 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)Cl 527a_100016991112_100000742801 [0,1,0,1,0,0|2,0,0]=4 24536 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)F 240690a_100016991112_100011217230 [0,1,0,1,0,0|2,0,0]=4 24537 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)F 527a_100016991112_100011217230 [0,1,0,1,0,0|2,0,0]=4 24538 B16R2.80751 O=C(NC1COC1)c2cccc(c2O)O 527a_100016991112_100000690420 [0,1,0,1,0,0|2,0,0]=4 24539 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)Br 240690a_100016994217_100000752940 [0,1,0,1,0,0|2,0,0]=4 24540 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)Br 527a_100016994217_100000752940 [0,1,0,1,0,0|2,0,0]=4 24541 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)Cl 240690a_100016994217_100000742801 [0,1,0,1,0,0|2,0,0]=4 24542 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)Cl 527a_100016994217_100000742801 [0,1,0,1,0,0|2,0,0]=4 24543 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)F 240690a_100016994217_100011217230 [0,1,0,1,0,0|2,0,0]=4 24544 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)F 527a_100016994217_100011217230 [0,1,0,1,0,0|2,0,0]=4 24545 B16R2.80751 O=C(NC1CSC1)c2cccc(c2O)O 527a_100016994217_100000690420 [0,1,0,1,0,0|2,0,0]=4 24546 B16R2.12165 CCCSC1Oc2ccc(cc2C1=O)Br 62a_100000210303_100011071988 [0,1,0,1,0,0|2,0,0]=4 24547 B16R2.12615 Cc1ccc(c(c1)C2=CCCCCC2)O 271570a_200009888920_100000765521 [0,1,0,1,0,0|2,0,0]=4 24548 B16R2.12615 Nc1ccc(c(c1)C2=CCCCCC2)O 271570a_200009888920_100011534360 [0,1,0,1,0,0|2,0,0]=4 24549 B16R2.12615 Oc1ccc(c(c1)C2=CCCCCC2)O 271570a_200009888920_100009813629 [0,1,0,1,0,0|2,0,0]=4 24550 B16R2.12615 Oc1ccc(cc1C2=CCCCCC2)Br 271570a_200009888920_100012355227 [0,1,0,1,0,0|2,0,0]=4 24551 B16R2.12615 Oc1ccc(cc1C2=CCCCCC2)Cl 271570a_200009888920_100011356953 [0,1,0,1,0,0|2,0,0]=4 24552 B16R2.12615 Oc1ccc(cc1C2=CCCCCC2)F 271570a_200009888920_100000211999 [0,1,0,1,0,0|2,0,0]=4 24553 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CC2)Br 1458a_100000689033_100000694398 [0,1,0,1,0,0|2,0,0]=4 24554 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CC2)C 1458a_100000195421_100000694398 [0,1,0,1,0,0|2,0,0]=4 24555 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CC2)Cl 1458a_100011290873_100000694398 [0,1,0,1,0,0|2,0,0]=4 24556 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CC2)F 1458a_100000749327_100000694398 [0,1,0,1,0,0|2,0,0]=4 24557 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CC2)I 1458a_100000057929_100000694398 [0,1,0,1,0,0|2,0,0]=4 24558 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CC2)O 1458a_100000229998_100000694398 [0,1,0,1,0,0|1,0,0]=3 24559 B16R2.26185 Cc1ccc(c(c1)C(=O)CCC2CO2)O 1458a_100000229998_100000732470 [0,1,0,1,0,0|2,0,0]=4 24560 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Br 11a_100000735609_100000689033 [0,1,0,1,0,0|2,0,0]=4 24561 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Br 1626a_100000735609_100000689033 [0,1,0,1,0,0|2,0,0]=4 24562 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Br 240690a_100000735609_100000689033 [0,1,0,1,0,0|2,0,0]=4 24563 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Br 527a_100000735609_100000689033 [0,1,0,1,0,0|2,0,0]=4 24564 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)C 11a_100000735609_100000195421 [0,1,0,1,0,0|2,0,0]=4 24565 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)C 1626a_100000735609_100000195421 [0,1,0,1,0,0|2,0,0]=4 24566 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)C 240690a_100000735609_100000195421 [0,1,0,1,0,0|2,0,0]=4 24567 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)C 527a_100000735609_100000195421 [0,1,0,1,0,0|2,0,0]=4 24568 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Cl 11a_100000735609_100011290873 [0,1,0,1,0,0|2,0,0]=4 24569 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Cl 1626a_100000735609_100011290873 [0,1,0,1,0,0|2,0,0]=4 24570 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Cl 240690a_100000735609_100011290873 [0,1,0,1,0,0|2,0,0]=4 24571 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)Cl 527a_100000735609_100011290873 [0,1,0,1,0,0|2,0,0]=4 24572 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)F 11a_100000735609_100000749327 [0,1,0,1,0,0|2,0,0]=4 24573 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)F 1626a_100000735609_100000749327 [0,1,0,1,0,0|2,0,0]=4 24574 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)F 240690a_100000735609_100000749327 [0,1,0,1,0,0|2,0,0]=4 24575 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)F 527a_100000735609_100000749327 [0,1,0,1,0,0|2,0,0]=4 24576 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)I 11a_100000735609_100000057929 [0,1,0,1,0,0|2,0,0]=4 24577 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)I 1626a_100000735609_100000057929 [0,1,0,1,0,0|2,0,0]=4 24578 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)I 240690a_100000735609_100000057929 [0,1,0,1,0,0|2,0,0]=4 24579 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)I 527a_100000735609_100000057929 [0,1,0,1,0,0|2,0,0]=4 24580 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)O 240690a_100000735609_100000229998 [0,1,0,1,0,0|1,0,0]=3 24581 B16R2.26185 Cc1ccc(c(c1)C(=O)NCC2CC2)O 527a_100000735609_100000229998 [0,1,0,1,0,0|1,0,0]=3 24582 B16R2.26185 Cc1ccc(c(c1)C(=O)NNC2CC2)O 22a_100000701032_100000229998 [0,1,0,1,0,0|2,0,0]=4 24583 B16R2.26185 Cc1ccc(cc1C(=O)CCC2CC2)Br 1458a_100000759961_100000694398 [0,1,0,1,0,0|2,0,0]=4 24584 B16R2.26185 Cc1ccc(cc1C(=O)CCC2CC2)Cl 1458a_100000692595_100000694398 [0,1,0,1,0,0|2,0,0]=4 24585 B16R2.26185 Cc1ccc(cc1C(=O)CCC2CC2)F 1458a_100000240043_100000694398 [0,1,0,1,0,0|2,0,0]=4 24586 B16R2.26185 Cc1ccc(cc1C(=O)CCC2CC2)I 1458a_100000688012_100000694398 [0,1,0,1,0,0|2,0,0]=4 24587 B16R2.26185 Cc1ccc(cc1C(=O)CCC2CC2)O 1458a_100000687834_100000694398 [0,1,0,1,0,0|2,0,0]=4 24588 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Br 11a_100000735609_100000759961 [0,1,0,1,0,0|2,0,0]=4 24589 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Br 1626a_100000735609_100000759961 [0,1,0,1,0,0|2,0,0]=4 24590 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Br 240690a_100000735609_100000759961 [0,1,0,1,0,0|2,0,0]=4 24591 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Br 527a_100000735609_100000759961 [0,1,0,1,0,0|2,0,0]=4 24592 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Cl 11a_100000735609_100000692595 [0,1,0,1,0,0|2,0,0]=4 24593 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Cl 1626a_100000735609_100000692595 [0,1,0,1,0,0|2,0,0]=4 24594 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Cl 240690a_100000735609_100000692595 [0,1,0,1,0,0|2,0,0]=4 24595 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)Cl 527a_100000735609_100000692595 [0,1,0,1,0,0|2,0,0]=4 24596 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)F 11a_100000735609_100000240043 [0,1,0,1,0,0|2,0,0]=4 24597 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)F 1626a_100000735609_100000240043 [0,1,0,1,0,0|2,0,0]=4 24598 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)F 240690a_100000735609_100000240043 [0,1,0,1,0,0|2,0,0]=4 24599 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)F 527a_100000735609_100000240043 [0,1,0,1,0,0|2,0,0]=4 24600 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)I 11a_100000735609_100000688012 [0,1,0,1,0,0|2,0,0]=4 24601 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)I 1626a_100000735609_100000688012 [0,1,0,1,0,0|2,0,0]=4 24602 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)I 240690a_100000735609_100000688012 [0,1,0,1,0,0|2,0,0]=4 24603 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)I 527a_100000735609_100000688012 [0,1,0,1,0,0|2,0,0]=4 24604 B16R2.26185 Cc1ccc(cc1C(=O)NCC2CC2)O 240690a_100000735609_100000687834 [0,1,0,1,0,0|2,0,0]=4 24605 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Br)Br 1458a_100000690610_100000694398 [0,1,0,1,0,0|2,0,0]=4 24606 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Br)Cl 1458a_100000736951_100000694398 [0,1,0,1,0,0|2,0,0]=4 24607 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Br)F 1458a_100000212315_100000694398 [0,1,0,1,0,0|2,0,0]=4 24608 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Br)I 1458a_100000698340_100000694398 [0,1,0,1,0,0|2,0,0]=4 24609 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Br)O 1458a_100012352043_100000694398 [0,1,0,1,0,0|2,0,0]=4 24610 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Cl)Br 1458a_100000211212_100000694398 [0,1,0,1,0,0|2,0,0]=4 24611 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Cl)Cl 1458a_100000210642_100000694398 [0,1,0,1,0,0|2,0,0]=4 24612 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Cl)F 1458a_100011219680_100000694398 [0,1,0,1,0,0|2,0,0]=4 24613 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Cl)I 1458a_100000688013_100000694398 [0,1,0,1,0,0|2,0,0]=4 24614 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2Cl)O 1458a_100000719527_100000694398 [0,1,0,1,0,0|2,0,0]=4 24615 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2F)Br 1458a_100000212322_100000694398 [0,1,0,1,0,0|2,0,0]=4 24616 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2F)Cl 1458a_100000214954_100000694398 [0,1,0,1,0,0|2,0,0]=4 24617 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2F)F 1458a_100000198512_100000694398 [0,1,0,1,0,0|2,0,0]=4 24618 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2F)I 1458a_100000688014_100000694398 [0,1,0,1,0,0|2,0,0]=4 24619 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2F)O 1458a_100000037260_100000694398 [0,1,0,1,0,0|2,0,0]=4 24620 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2I)Br 1458a_100000183945_100000694398 [0,1,0,1,0,0|2,0,0]=4 24621 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2I)Cl 1458a_100000739379_100000694398 [0,1,0,1,0,0|2,0,0]=4 24622 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2I)F 1458a_100000748905_100000694398 [0,1,0,1,0,0|2,0,0]=4 24623 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2I)I 1458a_100000750460_100000694398 [0,1,0,1,0,0|2,0,0]=4 24624 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2I)O 1458a_200009995701_100000694398 [0,1,0,1,0,0|2,0,0]=4 24625 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2O)Br 1458a_100000212140_100000694398 [0,1,0,1,0,0|1,0,0]=3 24626 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2O)Cl 1458a_100000212143_100000694398 [0,1,0,1,0,0|1,0,0]=3 24627 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2O)F 1458a_100000742286_100000694398 [0,1,0,1,0,0|1,0,0]=3 24628 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2O)I 1458a_100000212111_100000694398 [0,1,0,1,0,0|1,0,0]=3 24629 B16R2.26185 O=C(CCC1CC1)c2cc(ccc2O)O 1458a_100000758025_100000694398 [0,1,0,1,0,0|1,0,0]=3 24630 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)Br 1458a_100000212140_100000732470 [0,1,0,1,0,0|2,0,0]=4 24631 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)Cl 1458a_100000212143_100000732470 [0,1,0,1,0,0|2,0,0]=4 24632 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)F 1458a_100000742286_100000732470 [0,1,0,1,0,0|2,0,0]=4 24633 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)I 1458a_100000212111_100000732470 [0,1,0,1,0,0|2,0,0]=4 24634 B16R2.26185 O=C(CCC1CO1)c2cc(ccc2O)O 1458a_100000758025_100000732470 [0,1,0,1,0,0|2,0,0]=4 24635 B16R2.26185 O=C(CNC1CC1)c2cc(ccc2O)Br 34a_100000212008_200009828000 [0,1,0,1,0,0|2,0,0]=4 24636 B16R2.26185 O=C(CNC1CC1)c2cc(ccc2O)F 34a_100000212008_100009814381 [0,1,0,1,0,0|2,0,0]=4 24637 B16R2.26185 O=C(CNC1CC1)c2cc(ccc2O)O 34a_100000212008_100009814097 [0,1,0,1,0,0|2,0,0]=4 24638 B16R2.26185 O=C(CSC1CC1)c2cc(ccc2O)Br 62a_200009828000_100000211595 [0,1,0,1,0,0|2,0,0]=4 24639 B16R2.26185 O=C(CSC1CC1)c2cc(ccc2O)Cl 62a_200009816716_100000211595 [0,1,0,1,0,0|2,0,0]=4 24640 B16R2.26185 O=C(CSC1CC1)c2cc(ccc2O)F 62a_100009814381_100000211595 [0,1,0,1,0,0|2,0,0]=4 24641 B16R2.26185 O=C(CSC1CC1)c2cc(ccc2O)O 62a_100009814097_100000211595 [0,1,0,1,0,0|2,0,0]=4 24642 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Br 11a_100000735609_100000690610 [0,1,0,1,0,0|2,0,0]=4 24643 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Br 1626a_100000735609_100000690610 [0,1,0,1,0,0|2,0,0]=4 24644 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Br 240690a_100000735609_100000690610 [0,1,0,1,0,0|2,0,0]=4 24645 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Br 527a_100000735609_100000690610 [0,1,0,1,0,0|2,0,0]=4 24646 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Cl 11a_100000735609_100000736951 [0,1,0,1,0,0|2,0,0]=4 24647 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Cl 1626a_100000735609_100000736951 [0,1,0,1,0,0|2,0,0]=4 24648 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Cl 240690a_100000735609_100000736951 [0,1,0,1,0,0|2,0,0]=4 24649 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)Cl 527a_100000735609_100000736951 [0,1,0,1,0,0|2,0,0]=4 24650 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)F 11a_100000735609_100000212315 [0,1,0,1,0,0|2,0,0]=4 24651 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)F 1626a_100000735609_100000212315 [0,1,0,1,0,0|2,0,0]=4 24652 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)F 240690a_100000735609_100000212315 [0,1,0,1,0,0|2,0,0]=4 24653 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)F 527a_100000735609_100000212315 [0,1,0,1,0,0|2,0,0]=4 24654 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)I 11a_100000735609_100000698340 [0,1,0,1,0,0|2,0,0]=4 24655 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)I 1626a_100000735609_100000698340 [0,1,0,1,0,0|2,0,0]=4 24656 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)I 240690a_100000735609_100000698340 [0,1,0,1,0,0|2,0,0]=4 24657 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)I 527a_100000735609_100000698340 [0,1,0,1,0,0|2,0,0]=4 24658 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)O 240690a_100000735609_100012352043 [0,1,0,1,0,0|2,0,0]=4 24659 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Br)O 527a_100000735609_100012352043 [0,1,0,1,0,0|2,0,0]=4 24660 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Br 11a_100000735609_100000211212 [0,1,0,1,0,0|2,0,0]=4 24661 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Br 1626a_100000735609_100000211212 [0,1,0,1,0,0|2,0,0]=4 24662 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Br 240690a_100000735609_100000211212 [0,1,0,1,0,0|2,0,0]=4 24663 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Br 527a_100000735609_100000211212 [0,1,0,1,0,0|2,0,0]=4 24664 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Cl 11a_100000735609_100000210642 [0,1,0,1,0,0|2,0,0]=4 24665 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Cl 1626a_100000735609_100000210642 [0,1,0,1,0,0|2,0,0]=4 24666 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Cl 240690a_100000735609_100000210642 [0,1,0,1,0,0|2,0,0]=4 24667 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)Cl 527a_100000735609_100000210642 [0,1,0,1,0,0|2,0,0]=4 24668 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)F 11a_100000735609_100011219680 [0,1,0,1,0,0|2,0,0]=4 24669 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)F 1626a_100000735609_100011219680 [0,1,0,1,0,0|2,0,0]=4 24670 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)F 240690a_100000735609_100011219680 [0,1,0,1,0,0|2,0,0]=4 24671 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)F 527a_100000735609_100011219680 [0,1,0,1,0,0|2,0,0]=4 24672 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)I 11a_100000735609_100000688013 [0,1,0,1,0,0|2,0,0]=4 24673 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)I 1626a_100000735609_100000688013 [0,1,0,1,0,0|2,0,0]=4 24674 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)I 240690a_100000735609_100000688013 [0,1,0,1,0,0|2,0,0]=4 24675 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)I 527a_100000735609_100000688013 [0,1,0,1,0,0|2,0,0]=4 24676 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)O 240690a_100000735609_100000719527 [0,1,0,1,0,0|2,0,0]=4 24677 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2Cl)O 527a_100000735609_100000719527 [0,1,0,1,0,0|2,0,0]=4 24678 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Br 11a_100000735609_100000212322 [0,1,0,1,0,0|2,0,0]=4 24679 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Br 1626a_100000735609_100000212322 [0,1,0,1,0,0|2,0,0]=4 24680 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Br 240690a_100000735609_100000212322 [0,1,0,1,0,0|2,0,0]=4 24681 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Br 527a_100000735609_100000212322 [0,1,0,1,0,0|2,0,0]=4 24682 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Cl 11a_100000735609_100000214954 [0,1,0,1,0,0|2,0,0]=4 24683 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Cl 1626a_100000735609_100000214954 [0,1,0,1,0,0|2,0,0]=4 24684 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Cl 240690a_100000735609_100000214954 [0,1,0,1,0,0|2,0,0]=4 24685 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)Cl 527a_100000735609_100000214954 [0,1,0,1,0,0|2,0,0]=4 24686 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)F 11a_100000735609_100000198512 [0,1,0,1,0,0|2,0,0]=4 24687 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)F 1626a_100000735609_100000198512 [0,1,0,1,0,0|2,0,0]=4 24688 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)F 240690a_100000735609_100000198512 [0,1,0,1,0,0|2,0,0]=4 24689 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)F 527a_100000735609_100000198512 [0,1,0,1,0,0|2,0,0]=4 24690 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)I 11a_100000735609_100000688014 [0,1,0,1,0,0|2,0,0]=4 24691 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)I 1626a_100000735609_100000688014 [0,1,0,1,0,0|2,0,0]=4 24692 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)I 240690a_100000735609_100000688014 [0,1,0,1,0,0|2,0,0]=4 24693 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)I 527a_100000735609_100000688014 [0,1,0,1,0,0|2,0,0]=4 24694 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)O 240690a_100000735609_100000037260 [0,1,0,1,0,0|2,0,0]=4 24695 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2F)O 527a_100000735609_100000037260 [0,1,0,1,0,0|2,0,0]=4 24696 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Br 11a_100000735609_100000183945 [0,1,0,1,0,0|2,0,0]=4 24697 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Br 1626a_100000735609_100000183945 [0,1,0,1,0,0|2,0,0]=4 24698 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Br 240690a_100000735609_100000183945 [0,1,0,1,0,0|2,0,0]=4 24699 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Cl 11a_100000735609_100000739379 [0,1,0,1,0,0|2,0,0]=4 24700 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Cl 1626a_100000735609_100000739379 [0,1,0,1,0,0|2,0,0]=4 24701 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Cl 240690a_100000735609_100000739379 [0,1,0,1,0,0|2,0,0]=4 24702 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)Cl 527a_100000735609_100000739379 [0,1,0,1,0,0|2,0,0]=4 24703 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)F 11a_100000735609_100000748905 [0,1,0,1,0,0|2,0,0]=4 24704 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)F 1626a_100000735609_100000748905 [0,1,0,1,0,0|2,0,0]=4 24705 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)F 240690a_100000735609_100000748905 [0,1,0,1,0,0|2,0,0]=4 24706 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)F 527a_100000735609_100000748905 [0,1,0,1,0,0|2,0,0]=4 24707 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)I 11a_100000735609_100000750460 [0,1,0,1,0,0|2,0,0]=4 24708 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)I 1626a_100000735609_100000750460 [0,1,0,1,0,0|2,0,0]=4 24709 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)I 240690a_100000735609_100000750460 [0,1,0,1,0,0|2,0,0]=4 24710 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)I 527a_100000735609_100000750460 [0,1,0,1,0,0|2,0,0]=4 24711 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)O 1626a_100000735609_200009995701 [0,1,0,1,0,0|2,0,0]=4 24712 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)O 240690a_100000735609_200009995701 [0,1,0,1,0,0|2,0,0]=4 24713 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2I)O 527a_100000735609_200009995701 [0,1,0,1,0,0|2,0,0]=4 24714 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Br 1626a_100000735609_100000212140 [0,1,0,1,0,0|1,0,0]=3 24715 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Br 240690a_100000735609_100000212140 [0,1,0,1,0,0|1,0,0]=3 24716 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Br 527a_100000735609_100000212140 [0,1,0,1,0,0|1,0,0]=3 24717 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Cl 11a_100000735609_100000212143 [0,1,0,1,0,0|1,0,0]=3 24718 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Cl 1626a_100000735609_100000212143 [0,1,0,1,0,0|1,0,0]=3 24719 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Cl 240690a_100000735609_100000212143 [0,1,0,1,0,0|1,0,0]=3 24720 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)Cl 527a_100000735609_100000212143 [0,1,0,1,0,0|1,0,0]=3 24721 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)F 240690a_100000735609_100000742286 [0,1,0,1,0,0|1,0,0]=3 24722 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)F 527a_100000735609_100000742286 [0,1,0,1,0,0|1,0,0]=3 24723 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)I 240690a_100000735609_100000212111 [0,1,0,1,0,0|1,0,0]=3 24724 B16R2.26185 O=C(NCC1CC1)c2cc(ccc2O)I 527a_100000735609_100000212111 [0,1,0,1,0,0|1,0,0]=3 24725 B16R2.26185 O=C(NNC1CC1)c2cc(ccc2O)Br 22a_100000701032_100000212140 [0,1,0,1,0,0|2,0,0]=4 24726 B16R2.26185 O=C(NNC1CC1)c2cc(ccc2O)Cl 22a_100000701032_100000212143 [0,1,0,1,0,0|2,0,0]=4 24727 B16R2.26185 O=C(NNC1CC1)c2cc(ccc2O)F 22a_100000701032_100000742286 [0,1,0,1,0,0|2,0,0]=4 24728 B16R2.26185 O=C(NNC1CC1)c2cc(ccc2O)I 22a_100000701032_100000212111 [0,1,0,1,0,0|2,0,0]=4 24729 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCCC2)Br 1458a_100000689033_100000179811 [0,1,0,1,0,0|2,0,0]=4 24730 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCCC2)C 1458a_100000195421_100000179811 [0,1,0,1,0,0|2,0,0]=4 24731 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCCC2)Cl 1458a_100011290873_100000179811 [0,1,0,1,0,0|2,0,0]=4 24732 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCCC2)F 1458a_100000749327_100000179811 [0,1,0,1,0,0|2,0,0]=4 24733 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCCC2)I 1458a_100000057929_100000179811 [0,1,0,1,0,0|2,0,0]=4 24734 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCCC2)O 1458a_100000229998_100000179811 [0,1,0,1,0,0|1,0,0]=3 24735 B16R2.26186 Cc1ccc(c(c1)C(=O)C2CCOC2)O 1458a_100000229998_100000690089 [0,1,0,1,0,0|2,0,0]=4 24736 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)Br 240690a_100000188435_100000689033 [0,1,0,1,0,0|2,0,0]=4 24737 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)Br 527a_100000188435_100000689033 [0,1,0,1,0,0|2,0,0]=4 24738 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)C 240690a_100000188435_100000195421 [0,1,0,1,0,0|2,0,0]=4 24739 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)C 527a_100000188435_100000195421 [0,1,0,1,0,0|2,0,0]=4 24740 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)Cl 240690a_100000188435_100011290873 [0,1,0,1,0,0|2,0,0]=4 24741 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)Cl 527a_100000188435_100011290873 [0,1,0,1,0,0|2,0,0]=4 24742 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)F 240690a_100000188435_100000749327 [0,1,0,1,0,0|2,0,0]=4 24743 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)F 527a_100000188435_100000749327 [0,1,0,1,0,0|2,0,0]=4 24744 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)I 240690a_100000188435_100000057929 [0,1,0,1,0,0|2,0,0]=4 24745 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)I 527a_100000188435_100000057929 [0,1,0,1,0,0|2,0,0]=4 24746 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)O 240690a_100000188435_100000229998 [0,1,0,1,0,0|1,0,0]=3 24747 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCCC2)O 527a_100000188435_100000229998 [0,1,0,1,0,0|1,0,0]=3 24748 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCSC2)O 240690a_100011215254_100000229998 [0,1,0,1,0,0|2,0,0]=4 24749 B16R2.26186 Cc1ccc(c(c1)C(=O)N2CCSC2)O 527a_100011215254_100000229998 [0,1,0,1,0,0|2,0,0]=4 24750 B16R2.26186 Cc1ccc(cc1C(=O)C2CCCC2)Br 1458a_100000759961_100000179811 [0,1,0,1,0,0|2,0,0]=4 24751 B16R2.26186 Cc1ccc(cc1C(=O)C2CCCC2)Cl 1458a_100000692595_100000179811 [0,1,0,1,0,0|2,0,0]=4 24752 B16R2.26186 Cc1ccc(cc1C(=O)C2CCCC2)F 1458a_100000240043_100000179811 [0,1,0,1,0,0|2,0,0]=4 24753 B16R2.26186 Cc1ccc(cc1C(=O)C2CCCC2)I 1458a_100000688012_100000179811 [0,1,0,1,0,0|2,0,0]=4 24754 B16R2.26186 Cc1ccc(cc1C(=O)C2CCCC2)O 1458a_100000687834_100000179811 [0,1,0,1,0,0|2,0,0]=4 24755 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)Br 240690a_100000188435_100000759961 [0,1,0,1,0,0|2,0,0]=4 24756 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)Br 527a_100000188435_100000759961 [0,1,0,1,0,0|2,0,0]=4 24757 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)Cl 240690a_100000188435_100000692595 [0,1,0,1,0,0|2,0,0]=4 24758 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)Cl 527a_100000188435_100000692595 [0,1,0,1,0,0|2,0,0]=4 24759 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)F 240690a_100000188435_100000240043 [0,1,0,1,0,0|2,0,0]=4 24760 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)F 527a_100000188435_100000240043 [0,1,0,1,0,0|2,0,0]=4 24761 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)I 240690a_100000188435_100000688012 [0,1,0,1,0,0|2,0,0]=4 24762 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)I 527a_100000188435_100000688012 [0,1,0,1,0,0|2,0,0]=4 24763 B16R2.26186 Cc1ccc(cc1C(=O)N2CCCC2)O 240690a_100000188435_100000687834 [0,1,0,1,0,0|2,0,0]=4 24764 B16R2.26186 O=C(c1cc(ccc1Br)Br)C2CCCC2 1458a_100000690610_100000179811 [0,1,0,1,0,0|2,0,0]=4 24765 B16R2.26186 O=C(c1cc(ccc1Br)Br)N2CCCC2 240690a_100000188435_100000690610 [0,1,0,1,0,0|2,0,0]=4 24766 B16R2.26186 O=C(c1cc(ccc1Br)Br)N2CCCC2 527a_100000188435_100000690610 [0,1,0,1,0,0|2,0,0]=4 24767 B16R2.26186 O=C(c1cc(ccc1Br)Cl)C2CCCC2 1458a_100000736951_100000179811 [0,1,0,1,0,0|2,0,0]=4 24768 B16R2.26186 O=C(c1cc(ccc1Br)Cl)N2CCCC2 240690a_100000188435_100000736951 [0,1,0,1,0,0|2,0,0]=4 24769 B16R2.26186 O=C(c1cc(ccc1Br)Cl)N2CCCC2 527a_100000188435_100000736951 [0,1,0,1,0,0|2,0,0]=4 24770 B16R2.26186 O=C(c1cc(ccc1Br)F)C2CCCC2 1458a_100000212315_100000179811 [0,1,0,1,0,0|2,0,0]=4 24771 B16R2.26186 O=C(c1cc(ccc1Br)F)N2CCCC2 240690a_100000188435_100000212315 [0,1,0,1,0,0|2,0,0]=4 24772 B16R2.26186 O=C(c1cc(ccc1Br)F)N2CCCC2 527a_100000188435_100000212315 [0,1,0,1,0,0|2,0,0]=4 24773 B16R2.26186 O=C(c1cc(ccc1Br)I)C2CCCC2 1458a_100000698340_100000179811 [0,1,0,1,0,0|2,0,0]=4 24774 B16R2.26186 O=C(c1cc(ccc1Br)I)N2CCCC2 240690a_100000188435_100000698340 [0,1,0,1,0,0|2,0,0]=4 24775 B16R2.26186 O=C(c1cc(ccc1Br)I)N2CCCC2 527a_100000188435_100000698340 [0,1,0,1,0,0|2,0,0]=4 24776 B16R2.26186 O=C(c1cc(ccc1Br)O)C2CCCC2 1458a_100012352043_100000179811 [0,1,0,1,0,0|2,0,0]=4 24777 B16R2.26186 O=C(c1cc(ccc1Br)O)N2CCCC2 240690a_100000188435_100012352043 [0,1,0,1,0,0|2,0,0]=4 24778 B16R2.26186 O=C(c1cc(ccc1Br)O)N2CCCC2 527a_100000188435_100012352043 [0,1,0,1,0,0|2,0,0]=4 24779 B16R2.26186 O=C(c1cc(ccc1Cl)Br)C2CCCC2 1458a_100000211212_100000179811 [0,1,0,1,0,0|2,0,0]=4 24780 B16R2.26186 O=C(c1cc(ccc1Cl)Br)N2CCCC2 240690a_100000188435_100000211212 [0,1,0,1,0,0|2,0,0]=4 24781 B16R2.26186 O=C(c1cc(ccc1Cl)Br)N2CCCC2 527a_100000188435_100000211212 [0,1,0,1,0,0|2,0,0]=4 24782 B16R2.26186 O=C(c1cc(ccc1Cl)Cl)C2CCCC2 1458a_100000210642_100000179811 [0,1,0,1,0,0|2,0,0]=4 24783 B16R2.26186 O=C(c1cc(ccc1Cl)Cl)N2CCCC2 240690a_100000188435_100000210642 [0,1,0,1,0,0|2,0,0]=4 24784 B16R2.26186 O=C(c1cc(ccc1Cl)Cl)N2CCCC2 527a_100000188435_100000210642 [0,1,0,1,0,0|2,0,0]=4 24785 B16R2.26186 O=C(c1cc(ccc1Cl)F)C2CCCC2 1458a_100011219680_100000179811 [0,1,0,1,0,0|2,0,0]=4 24786 B16R2.26186 O=C(c1cc(ccc1Cl)F)N2CCCC2 240690a_100000188435_100011219680 [0,1,0,1,0,0|2,0,0]=4 24787 B16R2.26186 O=C(c1cc(ccc1Cl)F)N2CCCC2 527a_100000188435_100011219680 [0,1,0,1,0,0|2,0,0]=4 24788 B16R2.26186 O=C(c1cc(ccc1Cl)I)C2CCCC2 1458a_100000688013_100000179811 [0,1,0,1,0,0|2,0,0]=4 24789 B16R2.26186 O=C(c1cc(ccc1Cl)I)N2CCCC2 240690a_100000188435_100000688013 [0,1,0,1,0,0|2,0,0]=4 24790 B16R2.26186 O=C(c1cc(ccc1Cl)I)N2CCCC2 527a_100000188435_100000688013 [0,1,0,1,0,0|2,0,0]=4 24791 B16R2.26186 O=C(c1cc(ccc1Cl)O)C2CCCC2 1458a_100000719527_100000179811 [0,1,0,1,0,0|2,0,0]=4 24792 B16R2.26186 O=C(c1cc(ccc1Cl)O)N2CCCC2 240690a_100000188435_100000719527 [0,1,0,1,0,0|2,0,0]=4 24793 B16R2.26186 O=C(c1cc(ccc1Cl)O)N2CCCC2 527a_100000188435_100000719527 [0,1,0,1,0,0|2,0,0]=4 24794 B16R2.26186 O=C(c1cc(ccc1F)Br)C2CCCC2 1458a_100000212322_100000179811 [0,1,0,1,0,0|2,0,0]=4 24795 B16R2.26186 O=C(c1cc(ccc1F)Br)N2CCCC2 240690a_100000188435_100000212322 [0,1,0,1,0,0|2,0,0]=4 24796 B16R2.26186 O=C(c1cc(ccc1F)Br)N2CCCC2 527a_100000188435_100000212322 [0,1,0,1,0,0|2,0,0]=4 24797 B16R2.26186 O=C(c1cc(ccc1F)Cl)C2CCCC2 1458a_100000214954_100000179811 [0,1,0,1,0,0|2,0,0]=4 24798 B16R2.26186 O=C(c1cc(ccc1F)Cl)N2CCCC2 240690a_100000188435_100000214954 [0,1,0,1,0,0|2,0,0]=4 24799 B16R2.26186 O=C(c1cc(ccc1F)Cl)N2CCCC2 527a_100000188435_100000214954 [0,1,0,1,0,0|2,0,0]=4 24800 B16R2.26186 O=C(c1cc(ccc1F)F)C2CCCC2 1458a_100000198512_100000179811 [0,1,0,1,0,0|2,0,0]=4 24801 B16R2.26186 O=C(c1cc(ccc1F)F)N2CCCC2 240690a_100000188435_100000198512 [0,1,0,1,0,0|2,0,0]=4 24802 B16R2.26186 O=C(c1cc(ccc1F)F)N2CCCC2 527a_100000188435_100000198512 [0,1,0,1,0,0|2,0,0]=4 24803 B16R2.26186 O=C(c1cc(ccc1F)I)C2CCCC2 1458a_100000688014_100000179811 [0,1,0,1,0,0|2,0,0]=4 24804 B16R2.26186 O=C(c1cc(ccc1F)I)N2CCCC2 240690a_100000188435_100000688014 [0,1,0,1,0,0|2,0,0]=4 24805 B16R2.26186 O=C(c1cc(ccc1F)I)N2CCCC2 527a_100000188435_100000688014 [0,1,0,1,0,0|2,0,0]=4 24806 B16R2.26186 O=C(c1cc(ccc1F)O)C2CCCC2 1458a_100000037260_100000179811 [0,1,0,1,0,0|2,0,0]=4 24807 B16R2.26186 O=C(c1cc(ccc1F)O)N2CCCC2 240690a_100000188435_100000037260 [0,1,0,1,0,0|2,0,0]=4 24808 B16R2.26186 O=C(c1cc(ccc1F)O)N2CCCC2 527a_100000188435_100000037260 [0,1,0,1,0,0|2,0,0]=4 24809 B16R2.26186 O=C(c1cc(ccc1I)Br)C2CCCC2 1458a_100000183945_100000179811 [0,1,0,1,0,0|2,0,0]=4 24810 B16R2.26186 O=C(c1cc(ccc1I)Br)N2CCCC2 240690a_100000188435_100000183945 [0,1,0,1,0,0|2,0,0]=4 24811 B16R2.26186 O=C(c1cc(ccc1I)Cl)C2CCCC2 1458a_100000739379_100000179811 [0,1,0,1,0,0|2,0,0]=4 24812 B16R2.26186 O=C(c1cc(ccc1I)Cl)N2CCCC2 240690a_100000188435_100000739379 [0,1,0,1,0,0|2,0,0]=4 24813 B16R2.26186 O=C(c1cc(ccc1I)Cl)N2CCCC2 527a_100000188435_100000739379 [0,1,0,1,0,0|2,0,0]=4 24814 B16R2.26186 O=C(c1cc(ccc1I)F)C2CCCC2 1458a_100000748905_100000179811 [0,1,0,1,0,0|2,0,0]=4 24815 B16R2.26186 O=C(c1cc(ccc1I)F)N2CCCC2 240690a_100000188435_100000748905 [0,1,0,1,0,0|2,0,0]=4 24816 B16R2.26186 O=C(c1cc(ccc1I)F)N2CCCC2 527a_100000188435_100000748905 [0,1,0,1,0,0|2,0,0]=4 24817 B16R2.26186 O=C(c1cc(ccc1I)I)C2CCCC2 1458a_100000750460_100000179811 [0,1,0,1,0,0|2,0,0]=4 24818 B16R2.26186 O=C(c1cc(ccc1I)I)N2CCCC2 240690a_100000188435_100000750460 [0,1,0,1,0,0|2,0,0]=4 24819 B16R2.26186 O=C(c1cc(ccc1I)I)N2CCCC2 527a_100000188435_100000750460 [0,1,0,1,0,0|2,0,0]=4 24820 B16R2.26186 O=C(c1cc(ccc1I)O)C2CCCC2 1458a_200009995701_100000179811 [0,1,0,1,0,0|2,0,0]=4 24821 B16R2.26186 O=C(c1cc(ccc1I)O)N2CCCC2 240690a_100000188435_200009995701 [0,1,0,1,0,0|2,0,0]=4 24822 B16R2.26186 O=C(c1cc(ccc1I)O)N2CCCC2 527a_100000188435_200009995701 [0,1,0,1,0,0|2,0,0]=4 24823 B16R2.26186 O=C(c1cc(ccc1O)Br)C2CCCC2 1458a_100000212140_100000179811 [0,1,0,1,0,0|1,0,0]=3 24824 B16R2.26186 O=C(c1cc(ccc1O)Br)C2CCOC2 1458a_100000212140_100000690089 [0,1,0,1,0,0|2,0,0]=4 24825 B16R2.26186 O=C(c1cc(ccc1O)Br)N2CCCC2 240690a_100000188435_100000212140 [0,1,0,1,0,0|1,0,0]=3 24826 B16R2.26186 O=C(c1cc(ccc1O)Br)N2CCCC2 527a_100000188435_100000212140 [0,1,0,1,0,0|1,0,0]=3 24827 B16R2.26186 O=C(c1cc(ccc1O)Br)N2CCSC2 240690a_100011215254_100000212140 [0,1,0,1,0,0|2,0,0]=4 24828 B16R2.26186 O=C(c1cc(ccc1O)Br)N2CCSC2 527a_100011215254_100000212140 [0,1,0,1,0,0|2,0,0]=4 24829 B16R2.26186 O=C(c1cc(ccc1O)Cl)C2CCCC2 1458a_100000212143_100000179811 [0,1,0,1,0,0|1,0,0]=3 24830 B16R2.26186 O=C(c1cc(ccc1O)Cl)C2CCOC2 1458a_100000212143_100000690089 [0,1,0,1,0,0|2,0,0]=4 24831 B16R2.26186 O=C(c1cc(ccc1O)Cl)N2CCCC2 240690a_100000188435_100000212143 [0,1,0,1,0,0|1,0,0]=3 24832 B16R2.26186 O=C(c1cc(ccc1O)Cl)N2CCCC2 527a_100000188435_100000212143 [0,1,0,1,0,0|1,0,0]=3 24833 B16R2.26186 O=C(c1cc(ccc1O)Cl)N2CCSC2 11a_100011215254_100000212143 [0,1,0,1,0,0|2,0,0]=4 24834 B16R2.26186 O=C(c1cc(ccc1O)Cl)N2CCSC2 240690a_100011215254_100000212143 [0,1,0,1,0,0|2,0,0]=4 24835 B16R2.26186 O=C(c1cc(ccc1O)Cl)N2CCSC2 527a_100011215254_100000212143 [0,1,0,1,0,0|2,0,0]=4 24836 B16R2.26186 O=C(c1cc(ccc1O)F)C2CCCC2 1458a_100000742286_100000179811 [0,1,0,1,0,0|1,0,0]=3 24837 B16R2.26186 O=C(c1cc(ccc1O)F)C2CCOC2 1458a_100000742286_100000690089 [0,1,0,1,0,0|2,0,0]=4 24838 B16R2.26186 O=C(c1cc(ccc1O)F)N2CCCC2 240690a_100000188435_100000742286 [0,1,0,1,0,0|1,0,0]=3 24839 B16R2.26186 O=C(c1cc(ccc1O)F)N2CCCC2 527a_100000188435_100000742286 [0,1,0,1,0,0|1,0,0]=3 24840 B16R2.26186 O=C(c1cc(ccc1O)F)N2CCSC2 240690a_100011215254_100000742286 [0,1,0,1,0,0|2,0,0]=4 24841 B16R2.26186 O=C(c1cc(ccc1O)F)N2CCSC2 527a_100011215254_100000742286 [0,1,0,1,0,0|2,0,0]=4 24842 B16R2.26186 O=C(c1cc(ccc1O)I)C2CCCC2 1458a_100000212111_100000179811 [0,1,0,1,0,0|1,0,0]=3 24843 B16R2.26186 O=C(c1cc(ccc1O)I)C2CCOC2 1458a_100000212111_100000690089 [0,1,0,1,0,0|2,0,0]=4 24844 B16R2.26186 O=C(c1cc(ccc1O)I)N2CCCC2 240690a_100000188435_100000212111 [0,1,0,1,0,0|1,0,0]=3 24845 B16R2.26186 O=C(c1cc(ccc1O)I)N2CCCC2 527a_100000188435_100000212111 [0,1,0,1,0,0|1,0,0]=3 24846 B16R2.26186 O=C(c1cc(ccc1O)I)N2CCSC2 240690a_100011215254_100000212111 [0,1,0,1,0,0|2,0,0]=4 24847 B16R2.26186 O=C(c1cc(ccc1O)I)N2CCSC2 527a_100011215254_100000212111 [0,1,0,1,0,0|2,0,0]=4 24848 B16R2.26186 O=C(c1cc(ccc1O)O)C2CCCC2 1458a_100000758025_100000179811 [0,1,0,1,0,0|1,0,0]=3 24849 B16R2.26186 O=C(c1cc(ccc1O)O)C2CCOC2 1458a_100000758025_100000690089 [0,1,0,1,0,0|2,0,0]=4 24850 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCC2)Br 1458a_100000689033_100000763275 [0,1,0,1,0,0|2,0,0]=4 24851 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCC2)C 1458a_100000195421_100000763275 [0,1,0,1,0,0|2,0,0]=4 24852 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCC2)Cl 1458a_100011290873_100000763275 [0,1,0,1,0,0|2,0,0]=4 24853 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCC2)F 1458a_100000749327_100000763275 [0,1,0,1,0,0|2,0,0]=4 24854 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCC2)I 1458a_100000057929_100000763275 [0,1,0,1,0,0|2,0,0]=4 24855 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCC2)O 1458a_100000229998_100000763275 [0,1,0,1,0,0|1,0,0]=3 24856 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2CCO2)O 1458a_100000229998_100000103362 [0,1,0,1,0,0|2,0,0]=4 24857 B16R2.26193 Cc1ccc(c(c1)C(=O)CC2COC2)O 1458a_100000229998_100010264016 [0,1,0,1,0,0|2,0,0]=4 24858 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Br 11a_100000749019_100000689033 [0,1,0,1,0,0|2,0,0]=4 24859 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Br 1626a_100000749019_100000689033 [0,1,0,1,0,0|2,0,0]=4 24860 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Br 240690a_100000749019_100000689033 [0,1,0,1,0,0|2,0,0]=4 24861 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Br 527a_100000749019_100000689033 [0,1,0,1,0,0|2,0,0]=4 24862 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)C 11a_100000749019_100000195421 [0,1,0,1,0,0|2,0,0]=4 24863 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)C 1626a_100000749019_100000195421 [0,1,0,1,0,0|2,0,0]=4 24864 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)C 240690a_100000749019_100000195421 [0,1,0,1,0,0|2,0,0]=4 24865 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)C 527a_100000749019_100000195421 [0,1,0,1,0,0|2,0,0]=4 24866 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Cl 11a_100000749019_100011290873 [0,1,0,1,0,0|2,0,0]=4 24867 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Cl 1626a_100000749019_100011290873 [0,1,0,1,0,0|2,0,0]=4 24868 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Cl 240690a_100000749019_100011290873 [0,1,0,1,0,0|2,0,0]=4 24869 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)Cl 527a_100000749019_100011290873 [0,1,0,1,0,0|2,0,0]=4 24870 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)F 11a_100000749019_100000749327 [0,1,0,1,0,0|2,0,0]=4 24871 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)F 1626a_100000749019_100000749327 [0,1,0,1,0,0|2,0,0]=4 24872 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)F 240690a_100000749019_100000749327 [0,1,0,1,0,0|2,0,0]=4 24873 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)F 527a_100000749019_100000749327 [0,1,0,1,0,0|2,0,0]=4 24874 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)I 11a_100000749019_100000057929 [0,1,0,1,0,0|2,0,0]=4 24875 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)I 1626a_100000749019_100000057929 [0,1,0,1,0,0|2,0,0]=4 24876 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)I 240690a_100000749019_100000057929 [0,1,0,1,0,0|2,0,0]=4 24877 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)I 527a_100000749019_100000057929 [0,1,0,1,0,0|2,0,0]=4 24878 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)O 240690a_100000749019_100000229998 [0,1,0,1,0,0|1,0,0]=3 24879 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CCC2)O 527a_100000749019_100000229998 [0,1,0,1,0,0|1,0,0]=3 24880 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2COC2)O 240690a_100016991112_100000229998 [0,1,0,1,0,0|2,0,0]=4 24881 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2COC2)O 527a_100016991112_100000229998 [0,1,0,1,0,0|2,0,0]=4 24882 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CSC2)O 240690a_100016994217_100000229998 [0,1,0,1,0,0|2,0,0]=4 24883 B16R2.26193 Cc1ccc(c(c1)C(=O)NC2CSC2)O 527a_100016994217_100000229998 [0,1,0,1,0,0|2,0,0]=4 24884 B16R2.26193 Cc1ccc(cc1C(=O)CC2CCC2)Br 1458a_100000759961_100000763275 [0,1,0,1,0,0|2,0,0]=4 24885 B16R2.26193 Cc1ccc(cc1C(=O)CC2CCC2)Cl 1458a_100000692595_100000763275 [0,1,0,1,0,0|2,0,0]=4 24886 B16R2.26193 Cc1ccc(cc1C(=O)CC2CCC2)F 1458a_100000240043_100000763275 [0,1,0,1,0,0|2,0,0]=4 24887 B16R2.26193 Cc1ccc(cc1C(=O)CC2CCC2)I 1458a_100000688012_100000763275 [0,1,0,1,0,0|2,0,0]=4 24888 B16R2.26193 Cc1ccc(cc1C(=O)CC2CCC2)O 1458a_100000687834_100000763275 [0,1,0,1,0,0|2,0,0]=4 24889 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Br 11a_100000749019_100000759961 [0,1,0,1,0,0|2,0,0]=4 24890 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Br 1626a_100000749019_100000759961 [0,1,0,1,0,0|2,0,0]=4 24891 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Br 240690a_100000749019_100000759961 [0,1,0,1,0,0|2,0,0]=4 24892 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Br 527a_100000749019_100000759961 [0,1,0,1,0,0|2,0,0]=4 24893 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Cl 11a_100000749019_100000692595 [0,1,0,1,0,0|2,0,0]=4 24894 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Cl 1626a_100000749019_100000692595 [0,1,0,1,0,0|2,0,0]=4 24895 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Cl 240690a_100000749019_100000692595 [0,1,0,1,0,0|2,0,0]=4 24896 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)Cl 527a_100000749019_100000692595 [0,1,0,1,0,0|2,0,0]=4 24897 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)F 11a_100000749019_100000240043 [0,1,0,1,0,0|2,0,0]=4 24898 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)F 1626a_100000749019_100000240043 [0,1,0,1,0,0|2,0,0]=4 24899 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)F 240690a_100000749019_100000240043 [0,1,0,1,0,0|2,0,0]=4 24900 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)F 527a_100000749019_100000240043 [0,1,0,1,0,0|2,0,0]=4 24901 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)I 11a_100000749019_100000688012 [0,1,0,1,0,0|2,0,0]=4 24902 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)I 1626a_100000749019_100000688012 [0,1,0,1,0,0|2,0,0]=4 24903 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)I 240690a_100000749019_100000688012 [0,1,0,1,0,0|2,0,0]=4 24904 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)I 527a_100000749019_100000688012 [0,1,0,1,0,0|2,0,0]=4 24905 B16R2.26193 Cc1ccc(cc1C(=O)NC2CCC2)O 240690a_100000749019_100000687834 [0,1,0,1,0,0|2,0,0]=4 24906 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Br)Br 1458a_100000690610_100000763275 [0,1,0,1,0,0|2,0,0]=4 24907 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Br)Cl 1458a_100000736951_100000763275 [0,1,0,1,0,0|2,0,0]=4 24908 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Br)F 1458a_100000212315_100000763275 [0,1,0,1,0,0|2,0,0]=4 24909 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Br)I 1458a_100000698340_100000763275 [0,1,0,1,0,0|2,0,0]=4 24910 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Br)O 1458a_100012352043_100000763275 [0,1,0,1,0,0|2,0,0]=4 24911 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Cl)Br 1458a_100000211212_100000763275 [0,1,0,1,0,0|2,0,0]=4 24912 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Cl)Cl 1458a_100000210642_100000763275 [0,1,0,1,0,0|2,0,0]=4 24913 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Cl)F 1458a_100011219680_100000763275 [0,1,0,1,0,0|2,0,0]=4 24914 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Cl)I 1458a_100000688013_100000763275 [0,1,0,1,0,0|2,0,0]=4 24915 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2Cl)O 1458a_100000719527_100000763275 [0,1,0,1,0,0|2,0,0]=4 24916 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2F)Br 1458a_100000212322_100000763275 [0,1,0,1,0,0|2,0,0]=4 24917 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2F)Cl 1458a_100000214954_100000763275 [0,1,0,1,0,0|2,0,0]=4 24918 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2F)F 1458a_100000198512_100000763275 [0,1,0,1,0,0|2,0,0]=4 24919 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2F)I 1458a_100000688014_100000763275 [0,1,0,1,0,0|2,0,0]=4 24920 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2F)O 1458a_100000037260_100000763275 [0,1,0,1,0,0|2,0,0]=4 24921 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2I)Br 1458a_100000183945_100000763275 [0,1,0,1,0,0|2,0,0]=4 24922 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2I)Cl 1458a_100000739379_100000763275 [0,1,0,1,0,0|2,0,0]=4 24923 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2I)F 1458a_100000748905_100000763275 [0,1,0,1,0,0|2,0,0]=4 24924 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2I)I 1458a_100000750460_100000763275 [0,1,0,1,0,0|2,0,0]=4 24925 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2I)O 1458a_200009995701_100000763275 [0,1,0,1,0,0|2,0,0]=4 24926 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2O)Br 1458a_100000212140_100000763275 [0,1,0,1,0,0|1,0,0]=3 24927 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2O)Cl 1458a_100000212143_100000763275 [0,1,0,1,0,0|1,0,0]=3 24928 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2O)F 1458a_100000742286_100000763275 [0,1,0,1,0,0|1,0,0]=3 24929 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2O)I 1458a_100000212111_100000763275 [0,1,0,1,0,0|1,0,0]=3 24930 B16R2.26193 O=C(CC1CCC1)c2cc(ccc2O)O 1458a_100000758025_100000763275 [0,1,0,1,0,0|1,0,0]=3 24931 B16R2.26193 O=C(CC1CCO1)c2cc(ccc2O)Br 1458a_100000212140_100000103362 [0,1,0,1,0,0|2,0,0]=4 24932 B16R2.26193 O=C(CC1CCO1)c2cc(ccc2O)Cl 1458a_100000212143_100000103362 [0,1,0,1,0,0|2,0,0]=4 24933 B16R2.26193 O=C(CC1CCO1)c2cc(ccc2O)F 1458a_100000742286_100000103362 [0,1,0,1,0,0|2,0,0]=4 24934 B16R2.26193 O=C(CC1CCO1)c2cc(ccc2O)I 1458a_100000212111_100000103362 [0,1,0,1,0,0|2,0,0]=4 24935 B16R2.26193 O=C(CC1CCO1)c2cc(ccc2O)O 1458a_100000758025_100000103362 [0,1,0,1,0,0|2,0,0]=4 24936 B16R2.26193 O=C(CC1COC1)c2cc(ccc2O)Br 1458a_100000212140_100010264016 [0,1,0,1,0,0|2,0,0]=4 24937 B16R2.26193 O=C(CC1COC1)c2cc(ccc2O)Cl 1458a_100000212143_100010264016 [0,1,0,1,0,0|2,0,0]=4 24938 B16R2.26193 O=C(CC1COC1)c2cc(ccc2O)F 1458a_100000742286_100010264016 [0,1,0,1,0,0|2,0,0]=4 24939 B16R2.26193 O=C(CC1COC1)c2cc(ccc2O)I 1458a_100000212111_100010264016 [0,1,0,1,0,0|2,0,0]=4 24940 B16R2.26193 O=C(CC1COC1)c2cc(ccc2O)O 1458a_100000758025_100010264016 [0,1,0,1,0,0|2,0,0]=4 24941 B16R2.26193 O=C(CN1CCC1)c2cc(ccc2O)Br 269982a_100000754969_200009828000 [0,1,0,1,0,0|2,0,0]=4 24942 B16R2.26193 O=C(CN1CCC1)c2cc(ccc2O)Cl 269982a_100000754969_200009816716 [0,1,0,1,0,0|2,0,0]=4 24943 B16R2.26193 O=C(CN1CCC1)c2cc(ccc2O)F 269982a_100000754969_100009814381 [0,1,0,1,0,0|2,0,0]=4 24944 B16R2.26193 O=C(CN1CCC1)c2cc(ccc2O)O 269982a_100000754969_100009814097 [0,1,0,1,0,0|2,0,0]=4 24945 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Br 11a_100000749019_100000690610 [0,1,0,1,0,0|2,0,0]=4 24946 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Br 1626a_100000749019_100000690610 [0,1,0,1,0,0|2,0,0]=4 24947 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Br 240690a_100000749019_100000690610 [0,1,0,1,0,0|2,0,0]=4 24948 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Br 527a_100000749019_100000690610 [0,1,0,1,0,0|2,0,0]=4 24949 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Cl 11a_100000749019_100000736951 [0,1,0,1,0,0|2,0,0]=4 24950 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Cl 1626a_100000749019_100000736951 [0,1,0,1,0,0|2,0,0]=4 24951 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Cl 240690a_100000749019_100000736951 [0,1,0,1,0,0|2,0,0]=4 24952 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)Cl 527a_100000749019_100000736951 [0,1,0,1,0,0|2,0,0]=4 24953 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)F 11a_100000749019_100000212315 [0,1,0,1,0,0|2,0,0]=4 24954 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)F 1626a_100000749019_100000212315 [0,1,0,1,0,0|2,0,0]=4 24955 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)F 240690a_100000749019_100000212315 [0,1,0,1,0,0|2,0,0]=4 24956 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)F 527a_100000749019_100000212315 [0,1,0,1,0,0|2,0,0]=4 24957 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)I 11a_100000749019_100000698340 [0,1,0,1,0,0|2,0,0]=4 24958 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)I 1626a_100000749019_100000698340 [0,1,0,1,0,0|2,0,0]=4 24959 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)I 240690a_100000749019_100000698340 [0,1,0,1,0,0|2,0,0]=4 24960 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)I 527a_100000749019_100000698340 [0,1,0,1,0,0|2,0,0]=4 24961 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)O 240690a_100000749019_100012352043 [0,1,0,1,0,0|2,0,0]=4 24962 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Br)O 527a_100000749019_100012352043 [0,1,0,1,0,0|2,0,0]=4 24963 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Br 11a_100000749019_100000211212 [0,1,0,1,0,0|2,0,0]=4 24964 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Br 1626a_100000749019_100000211212 [0,1,0,1,0,0|2,0,0]=4 24965 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Br 240690a_100000749019_100000211212 [0,1,0,1,0,0|2,0,0]=4 24966 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Br 527a_100000749019_100000211212 [0,1,0,1,0,0|2,0,0]=4 24967 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Cl 11a_100000749019_100000210642 [0,1,0,1,0,0|2,0,0]=4 24968 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Cl 1626a_100000749019_100000210642 [0,1,0,1,0,0|2,0,0]=4 24969 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Cl 240690a_100000749019_100000210642 [0,1,0,1,0,0|2,0,0]=4 24970 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)Cl 527a_100000749019_100000210642 [0,1,0,1,0,0|2,0,0]=4 24971 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)F 11a_100000749019_100011219680 [0,1,0,1,0,0|2,0,0]=4 24972 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)F 1626a_100000749019_100011219680 [0,1,0,1,0,0|2,0,0]=4 24973 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)F 240690a_100000749019_100011219680 [0,1,0,1,0,0|2,0,0]=4 24974 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)F 527a_100000749019_100011219680 [0,1,0,1,0,0|2,0,0]=4 24975 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)I 11a_100000749019_100000688013 [0,1,0,1,0,0|2,0,0]=4 24976 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)I 1626a_100000749019_100000688013 [0,1,0,1,0,0|2,0,0]=4 24977 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)I 240690a_100000749019_100000688013 [0,1,0,1,0,0|2,0,0]=4 24978 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)I 527a_100000749019_100000688013 [0,1,0,1,0,0|2,0,0]=4 24979 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)O 240690a_100000749019_100000719527 [0,1,0,1,0,0|2,0,0]=4 24980 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2Cl)O 527a_100000749019_100000719527 [0,1,0,1,0,0|2,0,0]=4 24981 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Br 11a_100000749019_100000212322 [0,1,0,1,0,0|2,0,0]=4 24982 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Br 1626a_100000749019_100000212322 [0,1,0,1,0,0|2,0,0]=4 24983 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Br 240690a_100000749019_100000212322 [0,1,0,1,0,0|2,0,0]=4 24984 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Br 527a_100000749019_100000212322 [0,1,0,1,0,0|2,0,0]=4 24985 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Cl 11a_100000749019_100000214954 [0,1,0,1,0,0|2,0,0]=4 24986 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Cl 1626a_100000749019_100000214954 [0,1,0,1,0,0|2,0,0]=4 24987 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Cl 240690a_100000749019_100000214954 [0,1,0,1,0,0|2,0,0]=4 24988 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)Cl 527a_100000749019_100000214954 [0,1,0,1,0,0|2,0,0]=4 24989 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)F 11a_100000749019_100000198512 [0,1,0,1,0,0|2,0,0]=4 24990 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)F 1626a_100000749019_100000198512 [0,1,0,1,0,0|2,0,0]=4 24991 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)F 240690a_100000749019_100000198512 [0,1,0,1,0,0|2,0,0]=4 24992 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)F 527a_100000749019_100000198512 [0,1,0,1,0,0|2,0,0]=4 24993 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)I 11a_100000749019_100000688014 [0,1,0,1,0,0|2,0,0]=4 24994 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)I 1626a_100000749019_100000688014 [0,1,0,1,0,0|2,0,0]=4 24995 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)I 240690a_100000749019_100000688014 [0,1,0,1,0,0|2,0,0]=4 24996 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)I 527a_100000749019_100000688014 [0,1,0,1,0,0|2,0,0]=4 24997 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)O 240690a_100000749019_100000037260 [0,1,0,1,0,0|2,0,0]=4 24998 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2F)O 527a_100000749019_100000037260 [0,1,0,1,0,0|2,0,0]=4 24999 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Br 11a_100000749019_100000183945 [0,1,0,1,0,0|2,0,0]=4 25000 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Br 1626a_100000749019_100000183945 [0,1,0,1,0,0|2,0,0]=4 25001 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Br 240690a_100000749019_100000183945 [0,1,0,1,0,0|2,0,0]=4 25002 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Cl 11a_100000749019_100000739379 [0,1,0,1,0,0|2,0,0]=4 25003 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Cl 1626a_100000749019_100000739379 [0,1,0,1,0,0|2,0,0]=4 25004 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Cl 240690a_100000749019_100000739379 [0,1,0,1,0,0|2,0,0]=4 25005 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)Cl 527a_100000749019_100000739379 [0,1,0,1,0,0|2,0,0]=4 25006 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)F 11a_100000749019_100000748905 [0,1,0,1,0,0|2,0,0]=4 25007 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)F 1626a_100000749019_100000748905 [0,1,0,1,0,0|2,0,0]=4 25008 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)F 240690a_100000749019_100000748905 [0,1,0,1,0,0|2,0,0]=4 25009 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)F 527a_100000749019_100000748905 [0,1,0,1,0,0|2,0,0]=4 25010 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)I 11a_100000749019_100000750460 [0,1,0,1,0,0|2,0,0]=4 25011 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)I 1626a_100000749019_100000750460 [0,1,0,1,0,0|2,0,0]=4 25012 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)I 240690a_100000749019_100000750460 [0,1,0,1,0,0|2,0,0]=4 25013 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)I 527a_100000749019_100000750460 [0,1,0,1,0,0|2,0,0]=4 25014 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)O 1626a_100000749019_200009995701 [0,1,0,1,0,0|2,0,0]=4 25015 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)O 240690a_100000749019_200009995701 [0,1,0,1,0,0|2,0,0]=4 25016 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2I)O 527a_100000749019_200009995701 [0,1,0,1,0,0|2,0,0]=4 25017 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Br 1626a_100000749019_100000212140 [0,1,0,1,0,0|1,0,0]=3 25018 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Br 240690a_100000749019_100000212140 [0,1,0,1,0,0|1,0,0]=3 25019 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Br 527a_100000749019_100000212140 [0,1,0,1,0,0|1,0,0]=3 25020 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Cl 11a_100000749019_100000212143 [0,1,0,1,0,0|1,0,0]=3 25021 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Cl 1626a_100000749019_100000212143 [0,1,0,1,0,0|1,0,0]=3 25022 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Cl 240690a_100000749019_100000212143 [0,1,0,1,0,0|1,0,0]=3 25023 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)Cl 527a_100000749019_100000212143 [0,1,0,1,0,0|1,0,0]=3 25024 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)F 240690a_100000749019_100000742286 [0,1,0,1,0,0|1,0,0]=3 25025 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)F 527a_100000749019_100000742286 [0,1,0,1,0,0|1,0,0]=3 25026 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)I 240690a_100000749019_100000212111 [0,1,0,1,0,0|1,0,0]=3 25027 B16R2.26193 O=C(NC1CCC1)c2cc(ccc2O)I 527a_100000749019_100000212111 [0,1,0,1,0,0|1,0,0]=3 25028 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Br 1626a_100016991112_100000212140 [0,1,0,1,0,0|2,0,0]=4 25029 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Br 240690a_100016991112_100000212140 [0,1,0,1,0,0|2,0,0]=4 25030 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Br 527a_100016991112_100000212140 [0,1,0,1,0,0|2,0,0]=4 25031 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Cl 11a_100016991112_100000212143 [0,1,0,1,0,0|2,0,0]=4 25032 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Cl 1626a_100016991112_100000212143 [0,1,0,1,0,0|2,0,0]=4 25033 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Cl 240690a_100016991112_100000212143 [0,1,0,1,0,0|2,0,0]=4 25034 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)Cl 527a_100016991112_100000212143 [0,1,0,1,0,0|2,0,0]=4 25035 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)F 240690a_100016991112_100000742286 [0,1,0,1,0,0|2,0,0]=4 25036 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)F 527a_100016991112_100000742286 [0,1,0,1,0,0|2,0,0]=4 25037 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)I 240690a_100016991112_100000212111 [0,1,0,1,0,0|2,0,0]=4 25038 B16R2.26193 O=C(NC1COC1)c2cc(ccc2O)I 527a_100016991112_100000212111 [0,1,0,1,0,0|2,0,0]=4 25039 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Br 1626a_100016994217_100000212140 [0,1,0,1,0,0|2,0,0]=4 25040 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Br 240690a_100016994217_100000212140 [0,1,0,1,0,0|2,0,0]=4 25041 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Br 527a_100016994217_100000212140 [0,1,0,1,0,0|2,0,0]=4 25042 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Cl 11a_100016994217_100000212143 [0,1,0,1,0,0|2,0,0]=4 25043 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Cl 1626a_100016994217_100000212143 [0,1,0,1,0,0|2,0,0]=4 25044 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Cl 240690a_100016994217_100000212143 [0,1,0,1,0,0|2,0,0]=4 25045 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)Cl 527a_100016994217_100000212143 [0,1,0,1,0,0|2,0,0]=4 25046 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)F 240690a_100016994217_100000742286 [0,1,0,1,0,0|2,0,0]=4 25047 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)F 527a_100016994217_100000742286 [0,1,0,1,0,0|2,0,0]=4 25048 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)I 240690a_100016994217_100000212111 [0,1,0,1,0,0|2,0,0]=4 25049 B16R2.26193 O=C(NC1CSC1)c2cc(ccc2O)I 527a_100016994217_100000212111 [0,1,0,1,0,0|2,0,0]=4 25050 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)Br 11a_100000755817_100000690610 [0,1,0,1,0,0|2,0,0]=4 25051 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)Br 240690a_100000755817_100000690610 [0,1,0,1,0,0|2,0,0]=4 25052 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)Br 527a_100000755817_100000690610 [0,1,0,1,0,0|2,0,0]=4 25053 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)Cl 11a_100000755817_100000736951 [0,1,0,1,0,0|2,0,0]=4 25054 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)Cl 240690a_100000755817_100000736951 [0,1,0,1,0,0|2,0,0]=4 25055 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)Cl 527a_100000755817_100000736951 [0,1,0,1,0,0|2,0,0]=4 25056 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)F 11a_100000755817_100000212315 [0,1,0,1,0,0|2,0,0]=4 25057 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)F 240690a_100000755817_100000212315 [0,1,0,1,0,0|2,0,0]=4 25058 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)F 527a_100000755817_100000212315 [0,1,0,1,0,0|2,0,0]=4 25059 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)I 11a_100000755817_100000698340 [0,1,0,1,0,0|2,0,0]=4 25060 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)I 240690a_100000755817_100000698340 [0,1,0,1,0,0|2,0,0]=4 25061 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)I 527a_100000755817_100000698340 [0,1,0,1,0,0|2,0,0]=4 25062 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)O 240690a_100000755817_100012352043 [0,1,0,1,0,0|2,0,0]=4 25063 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Br)O 527a_100000755817_100012352043 [0,1,0,1,0,0|2,0,0]=4 25064 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)Br 11a_100000755817_100000211212 [0,1,0,1,0,0|2,0,0]=4 25065 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)Br 240690a_100000755817_100000211212 [0,1,0,1,0,0|2,0,0]=4 25066 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)Br 527a_100000755817_100000211212 [0,1,0,1,0,0|2,0,0]=4 25067 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)Cl 11a_100000755817_100000210642 [0,1,0,1,0,0|2,0,0]=4 25068 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)Cl 240690a_100000755817_100000210642 [0,1,0,1,0,0|2,0,0]=4 25069 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)Cl 527a_100000755817_100000210642 [0,1,0,1,0,0|2,0,0]=4 25070 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)F 11a_100000755817_100011219680 [0,1,0,1,0,0|2,0,0]=4 25071 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)F 240690a_100000755817_100011219680 [0,1,0,1,0,0|2,0,0]=4 25072 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)F 527a_100000755817_100011219680 [0,1,0,1,0,0|2,0,0]=4 25073 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)I 11a_100000755817_100000688013 [0,1,0,1,0,0|2,0,0]=4 25074 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)I 240690a_100000755817_100000688013 [0,1,0,1,0,0|2,0,0]=4 25075 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)I 527a_100000755817_100000688013 [0,1,0,1,0,0|2,0,0]=4 25076 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)O 240690a_100000755817_100000719527 [0,1,0,1,0,0|2,0,0]=4 25077 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2Cl)O 527a_100000755817_100000719527 [0,1,0,1,0,0|2,0,0]=4 25078 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)Br 11a_100000755817_100000212322 [0,1,0,1,0,0|2,0,0]=4 25079 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)Br 240690a_100000755817_100000212322 [0,1,0,1,0,0|2,0,0]=4 25080 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)Br 527a_100000755817_100000212322 [0,1,0,1,0,0|2,0,0]=4 25081 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)Cl 11a_100000755817_100000214954 [0,1,0,1,0,0|2,0,0]=4 25082 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)Cl 240690a_100000755817_100000214954 [0,1,0,1,0,0|2,0,0]=4 25083 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)Cl 527a_100000755817_100000214954 [0,1,0,1,0,0|2,0,0]=4 25084 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)F 11a_100000755817_100000198512 [0,1,0,1,0,0|2,0,0]=4 25085 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)F 240690a_100000755817_100000198512 [0,1,0,1,0,0|2,0,0]=4 25086 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)F 527a_100000755817_100000198512 [0,1,0,1,0,0|2,0,0]=4 25087 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)I 11a_100000755817_100000688014 [0,1,0,1,0,0|2,0,0]=4 25088 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)I 240690a_100000755817_100000688014 [0,1,0,1,0,0|2,0,0]=4 25089 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)I 527a_100000755817_100000688014 [0,1,0,1,0,0|2,0,0]=4 25090 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)O 240690a_100000755817_100000037260 [0,1,0,1,0,0|2,0,0]=4 25091 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2F)O 527a_100000755817_100000037260 [0,1,0,1,0,0|2,0,0]=4 25092 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)Br 11a_100000755817_100000183945 [0,1,0,1,0,0|2,0,0]=4 25093 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)Br 240690a_100000755817_100000183945 [0,1,0,1,0,0|2,0,0]=4 25094 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)Cl 11a_100000755817_100000739379 [0,1,0,1,0,0|2,0,0]=4 25095 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)Cl 240690a_100000755817_100000739379 [0,1,0,1,0,0|2,0,0]=4 25096 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)Cl 527a_100000755817_100000739379 [0,1,0,1,0,0|2,0,0]=4 25097 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)F 11a_100000755817_100000748905 [0,1,0,1,0,0|2,0,0]=4 25098 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)F 240690a_100000755817_100000748905 [0,1,0,1,0,0|2,0,0]=4 25099 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)F 527a_100000755817_100000748905 [0,1,0,1,0,0|2,0,0]=4 25100 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)I 11a_100000755817_100000750460 [0,1,0,1,0,0|2,0,0]=4 25101 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)I 240690a_100000755817_100000750460 [0,1,0,1,0,0|2,0,0]=4 25102 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)I 527a_100000755817_100000750460 [0,1,0,1,0,0|2,0,0]=4 25103 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)O 240690a_100000755817_200009995701 [0,1,0,1,0,0|2,0,0]=4 25104 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2I)O 527a_100000755817_200009995701 [0,1,0,1,0,0|2,0,0]=4 25105 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)Br 240690a_100000755817_100000212140 [0,1,0,1,0,0|1,0,0]=3 25106 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)Br 527a_100000755817_100000212140 [0,1,0,1,0,0|1,0,0]=3 25107 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)Cl 11a_100000755817_100000212143 [0,1,0,1,0,0|1,0,0]=3 25108 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)Cl 240690a_100000755817_100000212143 [0,1,0,1,0,0|1,0,0]=3 25109 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)Cl 527a_100000755817_100000212143 [0,1,0,1,0,0|1,0,0]=3 25110 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)F 240690a_100000755817_100000742286 [0,1,0,1,0,0|1,0,0]=3 25111 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)F 527a_100000755817_100000742286 [0,1,0,1,0,0|1,0,0]=3 25112 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)I 240690a_100000755817_100000212111 [0,1,0,1,0,0|1,0,0]=3 25113 B16R2.138124 CC1CCN1C(=O)c2cc(ccc2O)I 527a_100000755817_100000212111 [0,1,0,1,0,0|1,0,0]=3 25114 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)Br 11a_100000755817_100000689033 [0,1,0,1,0,0|2,0,0]=4 25115 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)Br 240690a_100000755817_100000689033 [0,1,0,1,0,0|2,0,0]=4 25116 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)Br 527a_100000755817_100000689033 [0,1,0,1,0,0|2,0,0]=4 25117 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)C 11a_100000755817_100000195421 [0,1,0,1,0,0|2,0,0]=4 25118 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)C 240690a_100000755817_100000195421 [0,1,0,1,0,0|2,0,0]=4 25119 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)C 527a_100000755817_100000195421 [0,1,0,1,0,0|2,0,0]=4 25120 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)Cl 11a_100000755817_100011290873 [0,1,0,1,0,0|2,0,0]=4 25121 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)Cl 240690a_100000755817_100011290873 [0,1,0,1,0,0|2,0,0]=4 25122 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)Cl 527a_100000755817_100011290873 [0,1,0,1,0,0|2,0,0]=4 25123 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)F 11a_100000755817_100000749327 [0,1,0,1,0,0|2,0,0]=4 25124 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)F 240690a_100000755817_100000749327 [0,1,0,1,0,0|2,0,0]=4 25125 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)F 527a_100000755817_100000749327 [0,1,0,1,0,0|2,0,0]=4 25126 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)I 11a_100000755817_100000057929 [0,1,0,1,0,0|2,0,0]=4 25127 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)I 240690a_100000755817_100000057929 [0,1,0,1,0,0|2,0,0]=4 25128 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)I 527a_100000755817_100000057929 [0,1,0,1,0,0|2,0,0]=4 25129 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)O 240690a_100000755817_100000229998 [0,1,0,1,0,0|1,0,0]=3 25130 B16R2.138124 Cc1ccc(c(c1)C(=O)N2CCC2C)O 527a_100000755817_100000229998 [0,1,0,1,0,0|1,0,0]=3 25131 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)Br 11a_100000755817_100000759961 [0,1,0,1,0,0|2,0,0]=4 25132 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)Br 240690a_100000755817_100000759961 [0,1,0,1,0,0|2,0,0]=4 25133 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)Br 527a_100000755817_100000759961 [0,1,0,1,0,0|2,0,0]=4 25134 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)Cl 11a_100000755817_100000692595 [0,1,0,1,0,0|2,0,0]=4 25135 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)Cl 240690a_100000755817_100000692595 [0,1,0,1,0,0|2,0,0]=4 25136 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)Cl 527a_100000755817_100000692595 [0,1,0,1,0,0|2,0,0]=4 25137 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)F 11a_100000755817_100000240043 [0,1,0,1,0,0|2,0,0]=4 25138 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)F 240690a_100000755817_100000240043 [0,1,0,1,0,0|2,0,0]=4 25139 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)F 527a_100000755817_100000240043 [0,1,0,1,0,0|2,0,0]=4 25140 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)I 11a_100000755817_100000688012 [0,1,0,1,0,0|2,0,0]=4 25141 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)I 240690a_100000755817_100000688012 [0,1,0,1,0,0|2,0,0]=4 25142 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)I 527a_100000755817_100000688012 [0,1,0,1,0,0|2,0,0]=4 25143 B16R2.138124 Cc1ccc(cc1C(=O)N2CCC2C)O 240690a_100000755817_100000687834 [0,1,0,1,0,0|2,0,0]=4 25144 B16R2.138165 Cc1ccc(c(c1)C(=O)N[C@@H]2C[C@@H]2F)O 240690a_100015190264_100000229998 [0,1,0,1,0,0|2,0,0]=4 25145 B16R2.138165 Cc1ccc(c(c1)C(=O)N[C@@H]2C[C@@H]2F)O 527a_100015190264_100000229998 [0,1,0,1,0,0|2,0,0]=4 25146 B16R2.138165 Cc1ccc(c(c1)C(=O)N[C@@H]2C[C@H]2F)O 240690a_100025746932_100000229998 [0,1,0,1,0,0|2,0,0]=4 25147 B16R2.138165 Cc1ccc(c(c1)C(=O)N[C@@H]2C[C@H]2F)O 527a_100025746932_100000229998 [0,1,0,1,0,0|2,0,0]=4 25148 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)Br 240690a_100015190264_100000212140 [0,1,0,1,0,0|2,0,0]=4 25149 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)Br 527a_100015190264_100000212140 [0,1,0,1,0,0|2,0,0]=4 25150 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)Cl 240690a_100015190264_100000212143 [0,1,0,1,0,0|2,0,0]=4 25151 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)Cl 527a_100015190264_100000212143 [0,1,0,1,0,0|2,0,0]=4 25152 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)F 240690a_100015190264_100000742286 [0,1,0,1,0,0|2,0,0]=4 25153 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)F 527a_100015190264_100000742286 [0,1,0,1,0,0|2,0,0]=4 25154 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)I 240690a_100015190264_100000212111 [0,1,0,1,0,0|2,0,0]=4 25155 B16R2.138165 O=C(N[C@@H]1C[C@@H]1F)c2cc(ccc2O)I 527a_100015190264_100000212111 [0,1,0,1,0,0|2,0,0]=4 25156 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Br 1626a_100025746932_100000212140 [0,1,0,1,0,0|2,0,0]=4 25157 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Br 240690a_100025746932_100000212140 [0,1,0,1,0,0|2,0,0]=4 25158 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Br 527a_100025746932_100000212140 [0,1,0,1,0,0|2,0,0]=4 25159 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Cl 11a_100025746932_100000212143 [0,1,0,1,0,0|2,0,0]=4 25160 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Cl 1626a_100025746932_100000212143 [0,1,0,1,0,0|2,0,0]=4 25161 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Cl 240690a_100025746932_100000212143 [0,1,0,1,0,0|2,0,0]=4 25162 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)Cl 527a_100025746932_100000212143 [0,1,0,1,0,0|2,0,0]=4 25163 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)F 240690a_100025746932_100000742286 [0,1,0,1,0,0|2,0,0]=4 25164 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)F 527a_100025746932_100000742286 [0,1,0,1,0,0|2,0,0]=4 25165 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)I 240690a_100025746932_100000212111 [0,1,0,1,0,0|2,0,0]=4 25166 B16R2.138165 O=C(N[C@@H]1C[C@H]1F)c2cc(ccc2O)I 527a_100025746932_100000212111 [0,1,0,1,0,0|2,0,0]=4 25167 B16R2.2450 C#Cc1ccccc1C(=O)C2CCCC2 1458a_100011243808_100000179811 [0,1,0,1,0,0|2,0,0]=4 25168 B16R2.2450 C#Cc1ccccc1C(=O)N2CCCC2 527a_100000188435_100011243808 [0,1,0,1,0,0|2,0,0]=4 25169 B16R2.2450 C=Cc1ccccc1C(=O)C2CCCC2 1458a_100011830265_100000179811 [0,1,0,1,0,0|2,0,0]=4 25170 B16R2.2450 C=Cc1ccccc1C(=O)N2CCCC2 271570a_100011290941_200000153373 [0,1,0,1,0,0|2,0,0]=4 25171 B16R2.2450 CCc1ccccc1C(=O)C2CCCC2 1458a_100000689120_100000179811 [0,1,0,1,0,0|2,0,0]=4 25172 B16R2.2450 CCc1ccccc1C(=O)N2CCCC2 240690a_100000188435_100000689120 [0,1,0,1,0,0|2,0,0]=4 25173 B16R2.2450 CCc1ccccc1C(=O)N2CCCC2 527a_100000188435_100000689120 [0,1,0,1,0,0|2,0,0]=4 25174 B16R2.2450 CNc1ccccc1C(=O)N2CCCC2 27a_100102657272_200000153373 [0,1,0,1,0,0|2,0,0]=4 25175 B16R2.2450 CNc1ccccc1C(=O)N2CCCC2 7a_100000180280_200000210301 [0,1,0,1,0,0|2,0,0]=4 25176 B16R2.2450 COc1ccccc1C(=O)C2CCCC2 1458a_100000185835_100000179811 [0,1,0,1,0,0|1,0,0]=3 25177 B16R2.2450 COc1ccccc1C(=O)C2CCOC2 1458a_100000185835_100000690089 [0,1,0,1,0,0|2,0,0]=4 25178 B16R2.2450 COc1ccccc1C(=O)N2CCCC2 240690a_100000188435_100000185835 [0,1,0,1,0,0|1,0,0]=3 25179 B16R2.2450 COc1ccccc1C(=O)N2CCCC2 527a_100000188435_100000185835 [0,1,0,1,0,0|1,0,0]=3 25180 B16R2.2450 COc1ccccc1C(=O)N2CCCC2 7a_200000191493_200000210301 [0,1,0,1,0,0|1,0,0]=3 25181 B16R2.2450 COc1ccccc1C(=O)N2CCSC2 11a_100011215254_100000185835 [0,1,0,1,0,0|2,0,0]=4 25182 B16R2.2450 COc1ccccc1C(=O)N2CCSC2 240690a_100011215254_100000185835 [0,1,0,1,0,0|2,0,0]=4 25183 B16R2.2450 COc1ccccc1C(=O)N2CCSC2 527a_100011215254_100000185835 [0,1,0,1,0,0|2,0,0]=4 25184 B16R2.2450 CSc1ccccc1C(=O)C2CCCC2 1458a_100000183967_100000179811 [0,1,0,1,0,0|1,1,0]=4 25185 B16R2.2450 CSc1ccccc1C(=O)N2CCCC2 240690a_100000188435_100000183967 [0,1,0,1,0,0|1,1,0]=4 25186 B16R2.2450 CSc1ccccc1C(=O)N2CCCC2 527a_100000188435_100000183967 [0,1,0,1,0,0|1,1,0]=4 25187 B16R2.2450 CSc1ccccc1C(=O)N2CCCC2 62a_200000153373_200000210301 [0,1,0,1,0,0|1,1,0]=4 25188 B16R2.2450 CSc1ccccc1C(=O)N2CCCC2 62a_200000210301_200000153373 [0,1,0,1,0,0|1,1,0]=4 25189 B16R2.2450 N#Cc1ccccc1C(=O)C2CCCC2 1458a_100000742908_100000179811 [0,1,0,1,0,0|2,0,0]=4 25190 B16R2.2450 N#Cc1ccccc1C(=O)N2CCCC2 527a_100000188435_100000742908 [0,1,0,1,0,0|2,0,0]=4 25191 B16R2.2450 O=C(c1ccccc1CO)C2CCCC2 1458a_100011301526_100000179811 [0,1,0,1,0,0|1,0,0]=3 25192 B16R2.2450 O=C(c1ccccc1CO)C2CCOC2 1458a_100011301526_100000690089 [0,1,0,1,0,0|2,0,0]=4 25193 B16R2.2450 O=Ic1ccccc1C(=O)C2CCCC2 1458a_100000032414_100000179811 [0,1,0,1,0,0|1,0,1]=4 25194 B16R2.2450 O=Ic1ccccc1C(=O)N2CCCC2 240690a_100000188435_100000032414 [0,1,0,1,0,0|1,0,1]=4 25195 B16R2.2450 O=Ic1ccccc1C(=O)N2CCCC2 527a_100000188435_100000032414 [0,1,0,1,0,0|1,0,1]=4 25196 B16R2.2450 [13CH3]Nc1ccccc1C(=O)N2CCCC2 7a_100000180280_200025704644 [0,1,0,1,0,0|2,0,0]=4 25197 B16R2.2450 [13CH3]Oc1ccccc1C(=O)N2CCCC2 7a_200000191493_200025704644 [0,1,0,1,0,0|1,0,0]=3 25198 B16R2.2450 [13CH3]Sc1ccccc1C(=O)N2CCCC2 62a_200000153373_200025704644 [0,1,0,1,0,0|1,1,0]=4 25199 B16R2.2450 [13CH3]Sc1ccccc1C(=O)N2CCCC2 62a_200025704644_200000153373 [0,1,0,1,0,0|1,1,0]=4 25200 B16R2.2942 CCCCc1c[nH]c2ccccc2c1=O 271570a_100020621405_100012339567 [0,1,0,1,0,0|2,0,0]=4 25201 B16R2.2942 CCCCc1coc2ccccc2c1=O 271570a_100020621405_100009813851 [0,1,0,1,0,0|1,0,0]=3 25202 B16R2.2942 CCCSc1coc2ccccc2c1=O 62a_100000210303_100009813851 [0,1,0,1,0,0|2,0,0]=4 25203 B16R2.2942 CCNCc1coc2ccccc2c1=O 270004a_100015525214_100000195500 [0,1,0,1,0,0|2,0,0]=4 25204 B16R2.7809 C#Cc1ccccc1C(=O)N2CCC2C 527a_100000755817_100011243808 [0,1,0,1,0,0|2,0,0]=4 25205 B16R2.7809 CC1CCN1C(=O)c2ccccc2C#N 11a_100000755817_100000742908 [0,1,0,1,0,0|2,0,0]=4 25206 B16R2.7809 CC1CCN1C(=O)c2ccccc2C#N 527a_100000755817_100000742908 [0,1,0,1,0,0|2,0,0]=4 25207 B16R2.7809 CC1CCN1C(=O)c2ccccc2I=O 240690a_100000755817_100000032414 [0,1,0,1,0,0|1,0,1]=4 25208 B16R2.7809 CC1CCN1C(=O)c2ccccc2I=O 527a_100000755817_100000032414 [0,1,0,1,0,0|1,0,1]=4 25209 B16R2.7809 CCc1ccccc1C(=O)N2CCC2C 11a_100000755817_100000689120 [0,1,0,1,0,0|2,0,0]=4 25210 B16R2.7809 CCc1ccccc1C(=O)N2CCC2C 240690a_100000755817_100000689120 [0,1,0,1,0,0|2,0,0]=4 25211 B16R2.7809 CCc1ccccc1C(=O)N2CCC2C 527a_100000755817_100000689120 [0,1,0,1,0,0|2,0,0]=4 25212 B16R2.7809 COc1ccccc1C(=O)N2CCC2C 11a_100000755817_100000185835 [0,1,0,1,0,0|1,0,0]=3 25213 B16R2.7809 COc1ccccc1C(=O)N2CCC2C 240690a_100000755817_100000185835 [0,1,0,1,0,0|1,0,0]=3 25214 B16R2.7809 COc1ccccc1C(=O)N2CCC2C 527a_100000755817_100000185835 [0,1,0,1,0,0|1,0,0]=3 25215 B16R2.7809 CSc1ccccc1C(=O)N2CCC2C 11a_100000755817_100000183967 [0,1,0,1,0,0|1,1,0]=4 25216 B16R2.7809 CSc1ccccc1C(=O)N2CCC2C 240690a_100000755817_100000183967 [0,1,0,1,0,0|1,1,0]=4 25217 B16R2.7809 CSc1ccccc1C(=O)N2CCC2C 527a_100000755817_100000183967 [0,1,0,1,0,0|1,1,0]=4 25218 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000185835 [0,1,0,1,0,0|2,0,0]=4 25219 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000185835 [0,1,0,1,0,0|2,0,0]=4 25220 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000185835 [0,1,0,1,0,0|2,0,0]=4 25221 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000185835 [0,1,0,1,0,0|2,0,0]=4 25222 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000185835 [0,1,0,1,0,0|2,0,0]=4 25223 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000185835 [0,1,0,1,0,0|2,0,0]=4 25224 B16R2.7890 COc1ccccc1C2=CCCCCC2 271570a_200009888920_100000174000 [0,1,0,1,0,0|2,0,0]=4 25225 B16R2.7890 OCc1ccccc1C2=CCCCCC2 271570a_200009888920_100000187465 [0,1,0,1,0,0|2,0,0]=4 25226 B16R2.36540 C#Cc1ccccc1C(=O)CCC2CC2 1458a_100011243808_100000694398 [0,1,0,1,0,0|2,0,0]=4 25227 B16R2.36540 C#Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100011243808 [0,1,0,1,0,0|2,0,0]=4 25228 B16R2.36540 C=Cc1ccccc1C(=O)CCC2CC2 1458a_100011830265_100000694398 [0,1,0,1,0,0|2,0,0]=4 25229 B16R2.36540 C=Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100011830265 [0,1,0,1,0,0|2,0,0]=4 25230 B16R2.36540 CCc1ccccc1C(=O)CCC2CC2 1458a_100000689120_100000694398 [0,1,0,1,0,0|2,0,0]=4 25231 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000689120 [0,1,0,1,0,0|2,0,0]=4 25232 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000689120 [0,1,0,1,0,0|2,0,0]=4 25233 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000689120 [0,1,0,1,0,0|2,0,0]=4 25234 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000689120 [0,1,0,1,0,0|2,0,0]=4 25235 B16R2.36540 COc1ccccc1C(=O)CCC2CC2 1458a_100000185835_100000694398 [0,1,0,1,0,0|1,0,0]=3 25236 B16R2.36540 COc1ccccc1C(=O)CCC2CO2 1458a_100000185835_100000732470 [0,1,0,1,0,0|2,0,0]=4 25237 B16R2.36540 COc1ccccc1C(=O)CNC2CC2 34a_100000212008_100000195505 [0,1,0,1,0,0|2,0,0]=4 25238 B16R2.36540 COc1ccccc1C(=O)CSC2CC2 62a_100000195505_100000211595 [0,1,0,1,0,0|2,0,0]=4 25239 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000185835 [0,1,0,1,0,0|1,0,0]=3 25240 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000185835 [0,1,0,1,0,0|1,0,0]=3 25241 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000185835 [0,1,0,1,0,0|1,0,0]=3 25242 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000185835 [0,1,0,1,0,0|1,0,0]=3 25243 B16R2.36540 COc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000185835 [0,1,0,1,0,0|2,0,0]=4 25244 B16R2.36540 COc1ccccc1C(C)OCC2CC2 7a_100000742714_100000742324 [0,1,0,1,0,0|1,0,1]=4 25245 B16R2.36540 CSc1ccccc1C(=O)CCC2CC2 1458a_100000183967_100000694398 [0,1,0,1,0,0|1,1,0]=4 25246 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000183967 [0,1,0,1,0,0|1,1,0]=4 25247 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000183967 [0,1,0,1,0,0|1,1,0]=4 25248 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000183967 [0,1,0,1,0,0|1,1,0]=4 25249 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000183967 [0,1,0,1,0,0|1,1,0]=4 25250 B16R2.36540 N#Cc1ccccc1C(=O)CCC2CC2 1458a_100000742908_100000694398 [0,1,0,1,0,0|2,0,0]=4 25251 B16R2.36540 N#Cc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000742908 [0,1,0,1,0,0|2,0,0]=4 25252 B16R2.36540 N#Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000742908 [0,1,0,1,0,0|2,0,0]=4 25253 B16R2.36540 N#Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000742908 [0,1,0,1,0,0|2,0,0]=4 25254 B16R2.36540 O=C(CCC1CC1)c2ccccc2CO 1458a_100011301526_100000694398 [0,1,0,1,0,0|1,0,0]=3 25255 B16R2.36540 O=C(CCC1CO1)c2ccccc2CO 1458a_100011301526_100000732470 [0,1,0,1,0,0|2,0,0]=4 25256 B16R2.36540 O=Ic1ccccc1C(=O)CCC2CC2 1458a_100000032414_100000694398 [0,1,0,1,0,0|1,0,1]=4 25257 B16R2.36540 O=Ic1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000032414 [0,1,0,1,0,0|1,0,1]=4 25258 B16R2.36540 O=Ic1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000032414 [0,1,0,1,0,0|1,0,1]=4 25259 B16R2.36540 O=Ic1ccccc1C(=O)NCC2CC2 527a_100000735609_100000032414 [0,1,0,1,0,0|1,0,1]=4 25260 B16R2.50359 CCCCOC1CCOc2c1cccc2 7a_100000708930_100000210211 [0,1,0,1,0,0|1,0,1]=4 25261 B16R2.50359 CCCCOC1COCc2c1cccc2 34a_100012179175_100000210210 [0,1,0,1,0,0|1,0,1]=4 25262 B16R2.50359 CCCCOc1cccc2c1cccc2 34a_100000210388_100000210210 [0,1,0,1,0,0|2,0,0]=4 25263 B16R2.50359 CCCCOc1cccc2c1cccc2 7a_100000210388_100000210211 [0,1,0,1,0,0|2,0,0]=4 25264 B16R2.50359 CCCCOc1cncc2c1cccc2 34a_100000066178_100000210210 [0,1,0,1,0,0|2,0,0]=4 25265 B16R2.50359 CCCCOc1cncc2c1cccc2 7a_100000066178_100000210211 [0,1,0,1,0,0|2,0,0]=4 25266 B16R2.50359 CCCCOc1nccc2c1cccc2 34a_102531767632_100000210210 [0,1,0,1,0,0|2,0,0]=4 25267 B16R2.59303 C#Cc1ccccc1C(=O)CC2CCC2 1458a_100011243808_100000763275 [0,1,0,1,0,0|2,0,0]=4 25268 B16R2.59303 C#Cc1ccccc1C(=O)NC2CCC2 527a_100000749019_100011243808 [0,1,0,1,0,0|2,0,0]=4 25269 B16R2.59303 C=Cc1ccccc1C(=O)CC2CCC2 1458a_100011830265_100000763275 [0,1,0,1,0,0|2,0,0]=4 25270 B16R2.59303 C=Cc1ccccc1C(=O)NC2CCC2 1626a_100000749019_100011830265 [0,1,0,1,0,0|2,0,0]=4 25271 B16R2.59303 CCc1ccccc1C(=O)CC2CCC2 1458a_100000689120_100000763275 [0,1,0,1,0,0|2,0,0]=4 25272 B16R2.59303 CCc1ccccc1C(=O)NC2CCC2 11a_100000749019_100000689120 [0,1,0,1,0,0|2,0,0]=4 25273 B16R2.59303 CCc1ccccc1C(=O)NC2CCC2 1626a_100000749019_100000689120 [0,1,0,1,0,0|2,0,0]=4 25274 B16R2.59303 CCc1ccccc1C(=O)NC2CCC2 240690a_100000749019_100000689120 [0,1,0,1,0,0|2,0,0]=4 25275 B16R2.59303 CCc1ccccc1C(=O)NC2CCC2 527a_100000749019_100000689120 [0,1,0,1,0,0|2,0,0]=4 25276 B16R2.59303 COc1ccccc1C(=O)CC2CCC2 1458a_100000185835_100000763275 [0,1,0,1,0,0|1,0,0]=3 25277 B16R2.59303 COc1ccccc1C(=O)CC2CCO2 1458a_100000185835_100000103362 [0,1,0,1,0,0|2,0,0]=4 25278 B16R2.59303 COc1ccccc1C(=O)CC2COC2 1458a_100000185835_100010264016 [0,1,0,1,0,0|2,0,0]=4 25279 B16R2.59303 COc1ccccc1C(=O)CN2CCC2 269982a_100000754969_100000195505 [0,1,0,1,0,0|2,0,0]=4 25280 B16R2.59303 COc1ccccc1C(=O)NC2CCC2 11a_100000749019_100000185835 [0,1,0,1,0,0|1,0,0]=3 25281 B16R2.59303 COc1ccccc1C(=O)NC2CCC2 1626a_100000749019_100000185835 [0,1,0,1,0,0|1,0,0]=3 25282 B16R2.59303 COc1ccccc1C(=O)NC2CCC2 240690a_100000749019_100000185835 [0,1,0,1,0,0|1,0,0]=3 25283 B16R2.59303 COc1ccccc1C(=O)NC2CCC2 527a_100000749019_100000185835 [0,1,0,1,0,0|1,0,0]=3 25284 B16R2.59303 COc1ccccc1C(=O)NC2COC2 11a_100016991112_100000185835 [0,1,0,1,0,0|2,0,0]=4 25285 B16R2.59303 COc1ccccc1C(=O)NC2COC2 1626a_100016991112_100000185835 [0,1,0,1,0,0|2,0,0]=4 25286 B16R2.59303 COc1ccccc1C(=O)NC2COC2 240690a_100016991112_100000185835 [0,1,0,1,0,0|2,0,0]=4 25287 B16R2.59303 COc1ccccc1C(=O)NC2COC2 527a_100016991112_100000185835 [0,1,0,1,0,0|2,0,0]=4 25288 B16R2.59303 COc1ccccc1C(=O)NC2CSC2 11a_100016994217_100000185835 [0,1,0,1,0,0|2,0,0]=4 25289 B16R2.59303 COc1ccccc1C(=O)NC2CSC2 1626a_100016994217_100000185835 [0,1,0,1,0,0|2,0,0]=4 25290 B16R2.59303 COc1ccccc1C(=O)NC2CSC2 240690a_100016994217_100000185835 [0,1,0,1,0,0|2,0,0]=4 25291 B16R2.59303 COc1ccccc1C(=O)NC2CSC2 527a_100016994217_100000185835 [0,1,0,1,0,0|2,0,0]=4 25292 B16R2.59303 CSc1ccccc1C(=O)CC2CCC2 1458a_100000183967_100000763275 [0,1,0,1,0,0|1,1,0]=4 25293 B16R2.59303 CSc1ccccc1C(=O)NC2CCC2 11a_100000749019_100000183967 [0,1,0,1,0,0|1,1,0]=4 25294 B16R2.59303 CSc1ccccc1C(=O)NC2CCC2 1626a_100000749019_100000183967 [0,1,0,1,0,0|1,1,0]=4 25295 B16R2.59303 CSc1ccccc1C(=O)NC2CCC2 240690a_100000749019_100000183967 [0,1,0,1,0,0|1,1,0]=4 25296 B16R2.59303 CSc1ccccc1C(=O)NC2CCC2 527a_100000749019_100000183967 [0,1,0,1,0,0|1,1,0]=4 25297 B16R2.59303 N#Cc1ccccc1C(=O)CC2CCC2 1458a_100000742908_100000763275 [0,1,0,1,0,0|2,0,0]=4 25298 B16R2.59303 N#Cc1ccccc1C(=O)NC2CCC2 11a_100000749019_100000742908 [0,1,0,1,0,0|2,0,0]=4 25299 B16R2.59303 N#Cc1ccccc1C(=O)NC2CCC2 1626a_100000749019_100000742908 [0,1,0,1,0,0|2,0,0]=4 25300 B16R2.59303 N#Cc1ccccc1C(=O)NC2CCC2 527a_100000749019_100000742908 [0,1,0,1,0,0|2,0,0]=4 25301 B16R2.59303 O=C(CC1CCC1)c2ccccc2CO 1458a_100011301526_100000763275 [0,1,0,1,0,0|1,0,0]=3 25302 B16R2.59303 O=C(CC1CCO1)c2ccccc2CO 1458a_100011301526_100000103362 [0,1,0,1,0,0|2,0,0]=4 25303 B16R2.59303 O=C(CC1COC1)c2ccccc2CO 1458a_100011301526_100010264016 [0,1,0,1,0,0|2,0,0]=4 25304 B16R2.59303 O=Ic1ccccc1C(=O)CC2CCC2 1458a_100000032414_100000763275 [0,1,0,1,0,0|1,0,1]=4 25305 B16R2.59303 O=Ic1ccccc1C(=O)NC2CCC2 1626a_100000749019_100000032414 [0,1,0,1,0,0|1,0,1]=4 25306 B16R2.59303 O=Ic1ccccc1C(=O)NC2CCC2 240690a_100000749019_100000032414 [0,1,0,1,0,0|1,0,1]=4 25307 B16R2.59303 O=Ic1ccccc1C(=O)NC2CCC2 527a_100000749019_100000032414 [0,1,0,1,0,0|1,0,1]=4 25308 B16R2.319 Cc1cc(ccc1C(=O)C2CCCC2)Br 1458a_100000741311_100000179811 [0,1,0,1,0,0|2,0,0]=4 25309 B16R2.319 Cc1cc(ccc1C(=O)C2CCCC2)Cl 1458a_100000688705_100000179811 [0,1,0,1,0,0|2,0,0]=4 25310 B16R2.319 Cc1cc(ccc1C(=O)C2CCCC2)F 1458a_100000686989_100000179811 [0,1,0,1,0,0|2,0,0]=4 25311 B16R2.319 Cc1cc(ccc1C(=O)C2CCCC2)I 1458a_100010189873_100000179811 [0,1,0,1,0,0|2,0,0]=4 25312 B16R2.319 Cc1cc(ccc1C(=O)C2CCCC2)O 1458a_100000692822_100000179811 [0,1,0,1,0,0|2,0,0]=4 25313 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)Br 240690a_100000188435_100000741311 [0,1,0,1,0,0|2,0,0]=4 25314 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)Br 527a_100000188435_100000741311 [0,1,0,1,0,0|2,0,0]=4 25315 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)Cl 240690a_100000188435_100000688705 [0,1,0,1,0,0|2,0,0]=4 25316 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)Cl 527a_100000188435_100000688705 [0,1,0,1,0,0|2,0,0]=4 25317 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)F 240690a_100000188435_100000686989 [0,1,0,1,0,0|2,0,0]=4 25318 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)F 527a_100000188435_100000686989 [0,1,0,1,0,0|2,0,0]=4 25319 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)I 240690a_100000188435_100010189873 [0,1,0,1,0,0|2,0,0]=4 25320 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)I 527a_100000188435_100010189873 [0,1,0,1,0,0|2,0,0]=4 25321 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)O 240690a_100000188435_100000692822 [0,1,0,1,0,0|2,0,0]=4 25322 B16R2.319 Cc1cc(ccc1C(=O)N2CCCC2)O 527a_100000188435_100000692822 [0,1,0,1,0,0|2,0,0]=4 25323 B16R2.319 Cc1ccc(c(c1)Br)C(=O)C2CCCC2 1458a_100000685072_100000179811 [0,1,0,1,0,0|2,0,0]=4 25324 B16R2.319 Cc1ccc(c(c1)Br)C(=O)N2CCCC2 240690a_100000188435_100000685072 [0,1,0,1,0,0|2,0,0]=4 25325 B16R2.319 Cc1ccc(c(c1)Br)C(=O)N2CCCC2 527a_100000188435_100000685072 [0,1,0,1,0,0|2,0,0]=4 25326 B16R2.319 Cc1ccc(c(c1)C)C(=O)C2CCCC2 1458a_100000211164_100000179811 [0,1,0,1,0,0|2,0,0]=4 25327 B16R2.319 Cc1ccc(c(c1)C)C(=O)N2CCCC2 240690a_100000188435_100000211164 [0,1,0,1,0,0|2,0,0]=4 25328 B16R2.319 Cc1ccc(c(c1)C)C(=O)N2CCCC2 527a_100000188435_100000211164 [0,1,0,1,0,0|2,0,0]=4 25329 B16R2.319 Cc1ccc(c(c1)Cl)C(=O)C2CCCC2 1458a_100000766932_100000179811 [0,1,0,1,0,0|2,0,0]=4 25330 B16R2.319 Cc1ccc(c(c1)Cl)C(=O)N2CCCC2 240690a_100000188435_100000766932 [0,1,0,1,0,0|2,0,0]=4 25331 B16R2.319 Cc1ccc(c(c1)Cl)C(=O)N2CCCC2 527a_100000188435_100000766932 [0,1,0,1,0,0|2,0,0]=4 25332 B16R2.319 Cc1ccc(c(c1)F)C(=O)C2CCCC2 1458a_100000766033_100000179811 [0,1,0,1,0,0|2,0,0]=4 25333 B16R2.319 Cc1ccc(c(c1)F)C(=O)N2CCCC2 240690a_100000188435_100000766033 [0,1,0,1,0,0|2,0,0]=4 25334 B16R2.319 Cc1ccc(c(c1)F)C(=O)N2CCCC2 527a_100000188435_100000766033 [0,1,0,1,0,0|2,0,0]=4 25335 B16R2.319 Cc1ccc(c(c1)I)C(=O)C2CCCC2 1458a_100009999607_100000179811 [0,1,0,1,0,0|2,0,0]=4 25336 B16R2.319 Cc1ccc(c(c1)I)C(=O)N2CCCC2 240690a_100000188435_100009999607 [0,1,0,1,0,0|2,0,0]=4 25337 B16R2.319 Cc1ccc(c(c1)I)C(=O)N2CCCC2 527a_100000188435_100009999607 [0,1,0,1,0,0|2,0,0]=4 25338 B16R2.319 Cc1ccc(c(c1)O)C(=O)C2CCCC2 1458a_100000212137_100000179811 [0,1,0,1,0,0|1,0,0]=3 25339 B16R2.319 Cc1ccc(c(c1)O)C(=O)C2CCOC2 1458a_100000212137_100000690089 [0,1,0,1,0,0|2,0,0]=4 25340 B16R2.319 Cc1ccc(c(c1)O)C(=O)N2CCCC2 240690a_100000188435_100000212137 [0,1,0,1,0,0|1,0,0]=3 25341 B16R2.319 Cc1ccc(c(c1)O)C(=O)N2CCCC2 527a_100000188435_100000212137 [0,1,0,1,0,0|1,0,0]=3 25342 B16R2.319 Cc1ccc(c(c1)O)C(=O)N2CCSC2 240690a_100011215254_100000212137 [0,1,0,1,0,0|2,0,0]=4 25343 B16R2.319 Cc1ccc(c(c1)O)C(=O)N2CCSC2 527a_100011215254_100000212137 [0,1,0,1,0,0|2,0,0]=4 25344 B16R2.319 O=C(c1ccc(cc1Br)Br)C2CCCC2 1458a_100000762965_100000179811 [0,1,0,1,0,0|2,0,0]=4 25345 B16R2.319 O=C(c1ccc(cc1Br)Br)N2CCCC2 240690a_100000188435_100000762965 [0,1,0,1,0,0|2,0,0]=4 25346 B16R2.319 O=C(c1ccc(cc1Br)Br)N2CCCC2 527a_100000188435_100000762965 [0,1,0,1,0,0|2,0,0]=4 25347 B16R2.319 O=C(c1ccc(cc1Br)Cl)C2CCCC2 1458a_100000766353_100000179811 [0,1,0,1,0,0|2,0,0]=4 25348 B16R2.319 O=C(c1ccc(cc1Br)Cl)N2CCCC2 240690a_100000188435_100000766353 [0,1,0,1,0,0|2,0,0]=4 25349 B16R2.319 O=C(c1ccc(cc1Br)Cl)N2CCCC2 527a_100000188435_100000766353 [0,1,0,1,0,0|2,0,0]=4 25350 B16R2.319 O=C(c1ccc(cc1Br)F)C2CCCC2 1458a_100000212304_100000179811 [0,1,0,1,0,0|2,0,0]=4 25351 B16R2.319 O=C(c1ccc(cc1Br)F)N2CCCC2 240690a_100000188435_100000212304 [0,1,0,1,0,0|2,0,0]=4 25352 B16R2.319 O=C(c1ccc(cc1Br)F)N2CCCC2 527a_100000188435_100000212304 [0,1,0,1,0,0|2,0,0]=4 25353 B16R2.319 O=C(c1ccc(cc1Br)I)C2CCCC2 1458a_100012360512_100000179811 [0,1,0,1,0,0|2,0,0]=4 25354 B16R2.319 O=C(c1ccc(cc1Br)I)N2CCCC2 240690a_100000188435_100012360512 [0,1,0,1,0,0|2,0,0]=4 25355 B16R2.319 O=C(c1ccc(cc1Br)I)N2CCCC2 527a_100000188435_100012360512 [0,1,0,1,0,0|2,0,0]=4 25356 B16R2.319 O=C(c1ccc(cc1Br)O)C2CCCC2 1458a_100012344906_100000179811 [0,1,0,1,0,0|2,0,0]=4 25357 B16R2.319 O=C(c1ccc(cc1Br)O)N2CCCC2 240690a_100000188435_100012344906 [0,1,0,1,0,0|2,0,0]=4 25358 B16R2.319 O=C(c1ccc(cc1Br)O)N2CCCC2 527a_100000188435_100012344906 [0,1,0,1,0,0|2,0,0]=4 25359 B16R2.319 O=C(c1ccc(cc1Cl)Br)C2CCCC2 1458a_100000741628_100000179811 [0,1,0,1,0,0|2,0,0]=4 25360 B16R2.319 O=C(c1ccc(cc1Cl)Br)N2CCCC2 240690a_100000188435_100000741628 [0,1,0,1,0,0|2,0,0]=4 25361 B16R2.319 O=C(c1ccc(cc1Cl)Br)N2CCCC2 527a_100000188435_100000741628 [0,1,0,1,0,0|2,0,0]=4 25362 B16R2.319 O=C(c1ccc(cc1Cl)Cl)C2CCCC2 1458a_100000185840_100000179811 [0,1,0,1,0,0|2,0,0]=4 25363 B16R2.319 O=C(c1ccc(cc1Cl)Cl)N2CCCC2 240690a_100000188435_100000185840 [0,1,0,1,0,0|2,0,0]=4 25364 B16R2.319 O=C(c1ccc(cc1Cl)Cl)N2CCCC2 527a_100000188435_100000185840 [0,1,0,1,0,0|2,0,0]=4 25365 B16R2.319 O=C(c1ccc(cc1Cl)F)C2CCCC2 1458a_100000211397_100000179811 [0,1,0,1,0,0|2,0,0]=4 25366 B16R2.319 O=C(c1ccc(cc1Cl)F)N2CCCC2 240690a_100000188435_100000211397 [0,1,0,1,0,0|2,0,0]=4 25367 B16R2.319 O=C(c1ccc(cc1Cl)F)N2CCCC2 527a_100000188435_100000211397 [0,1,0,1,0,0|2,0,0]=4 25368 B16R2.319 O=C(c1ccc(cc1Cl)I)C2CCCC2 1458a_100000751301_100000179811 [0,1,0,1,0,0|2,0,0]=4 25369 B16R2.319 O=C(c1ccc(cc1Cl)I)N2CCCC2 240690a_100000188435_100000751301 [0,1,0,1,0,0|2,0,0]=4 25370 B16R2.319 O=C(c1ccc(cc1Cl)I)N2CCCC2 527a_100000188435_100000751301 [0,1,0,1,0,0|2,0,0]=4 25371 B16R2.319 O=C(c1ccc(cc1Cl)O)C2CCCC2 1458a_100000702456_100000179811 [0,1,0,1,0,0|2,0,0]=4 25372 B16R2.319 O=C(c1ccc(cc1Cl)O)N2CCCC2 240690a_100000188435_100000702456 [0,1,0,1,0,0|2,0,0]=4 25373 B16R2.319 O=C(c1ccc(cc1Cl)O)N2CCCC2 527a_100000188435_100000702456 [0,1,0,1,0,0|2,0,0]=4 25374 B16R2.319 O=C(c1ccc(cc1F)Br)C2CCCC2 1458a_100000214689_100000179811 [0,1,0,1,0,0|2,0,0]=4 25375 B16R2.319 O=C(c1ccc(cc1F)Br)N2CCCC2 240690a_100000188435_100000214689 [0,1,0,1,0,0|2,0,0]=4 25376 B16R2.319 O=C(c1ccc(cc1F)Br)N2CCCC2 527a_100000188435_100000214689 [0,1,0,1,0,0|2,0,0]=4 25377 B16R2.319 O=C(c1ccc(cc1F)Cl)C2CCCC2 1458a_100000212326_100000179811 [0,1,0,1,0,0|2,0,0]=4 25378 B16R2.319 O=C(c1ccc(cc1F)Cl)N2CCCC2 240690a_100000188435_100000212326 [0,1,0,1,0,0|2,0,0]=4 25379 B16R2.319 O=C(c1ccc(cc1F)Cl)N2CCCC2 527a_100000188435_100000212326 [0,1,0,1,0,0|2,0,0]=4 25380 B16R2.319 O=C(c1ccc(cc1F)F)C2CCCC2 1458a_100000211022_100000179811 [0,1,0,1,0,0|2,0,0]=4 25381 B16R2.319 O=C(c1ccc(cc1F)F)N2CCCC2 240690a_100000188435_100000211022 [0,1,0,1,0,0|2,0,0]=4 25382 B16R2.319 O=C(c1ccc(cc1F)F)N2CCCC2 527a_100000188435_100000211022 [0,1,0,1,0,0|2,0,0]=4 25383 B16R2.319 O=C(c1ccc(cc1F)I)C2CCCC2 1458a_100000037189_100000179811 [0,1,0,1,0,0|2,0,0]=4 25384 B16R2.319 O=C(c1ccc(cc1F)I)N2CCCC2 240690a_100000188435_100000037189 [0,1,0,1,0,0|2,0,0]=4 25385 B16R2.319 O=C(c1ccc(cc1F)I)N2CCCC2 527a_100000188435_100000037189 [0,1,0,1,0,0|2,0,0]=4 25386 B16R2.319 O=C(c1ccc(cc1F)O)C2CCCC2 1458a_100000689029_100000179811 [0,1,0,1,0,0|2,0,0]=4 25387 B16R2.319 O=C(c1ccc(cc1F)O)N2CCCC2 240690a_100000188435_100000689029 [0,1,0,1,0,0|2,0,0]=4 25388 B16R2.319 O=C(c1ccc(cc1F)O)N2CCCC2 527a_100000188435_100000689029 [0,1,0,1,0,0|2,0,0]=4 25389 B16R2.319 O=C(c1ccc(cc1I)Br)C2CCCC2 1458a_100000751167_100000179811 [0,1,0,1,0,0|2,0,0]=4 25390 B16R2.319 O=C(c1ccc(cc1I)Br)N2CCCC2 240690a_100000188435_100000751167 [0,1,0,1,0,0|2,0,0]=4 25391 B16R2.319 O=C(c1ccc(cc1I)Br)N2CCCC2 527a_100000188435_100000751167 [0,1,0,1,0,0|2,0,0]=4 25392 B16R2.319 O=C(c1ccc(cc1I)Cl)C2CCCC2 1458a_100000739380_100000179811 [0,1,0,1,0,0|2,0,0]=4 25393 B16R2.319 O=C(c1ccc(cc1I)Cl)N2CCCC2 240690a_100000188435_100000739380 [0,1,0,1,0,0|2,0,0]=4 25394 B16R2.319 O=C(c1ccc(cc1I)Cl)N2CCCC2 527a_100000188435_100000739380 [0,1,0,1,0,0|2,0,0]=4 25395 B16R2.319 O=C(c1ccc(cc1I)F)C2CCCC2 1458a_100000739341_100000179811 [0,1,0,1,0,0|2,0,0]=4 25396 B16R2.319 O=C(c1ccc(cc1I)F)N2CCCC2 240690a_100000188435_100000739341 [0,1,0,1,0,0|2,0,0]=4 25397 B16R2.319 O=C(c1ccc(cc1I)F)N2CCCC2 527a_100000188435_100000739341 [0,1,0,1,0,0|2,0,0]=4 25398 B16R2.319 O=C(c1ccc(cc1O)Br)C2CCCC2 1458a_100000744433_100000179811 [0,1,0,1,0,0|1,0,0]=3 25399 B16R2.319 O=C(c1ccc(cc1O)Br)C2CCOC2 1458a_100000744433_100000690089 [0,1,0,1,0,0|2,0,0]=4 25400 B16R2.319 O=C(c1ccc(cc1O)Br)N2CCCC2 240690a_100000188435_100000744433 [0,1,0,1,0,0|1,0,0]=3 25401 B16R2.319 O=C(c1ccc(cc1O)Br)N2CCCC2 527a_100000188435_100000744433 [0,1,0,1,0,0|1,0,0]=3 25402 B16R2.319 O=C(c1ccc(cc1O)Br)N2CCSC2 240690a_100011215254_100000744433 [0,1,0,1,0,0|2,0,0]=4 25403 B16R2.319 O=C(c1ccc(cc1O)Br)N2CCSC2 527a_100011215254_100000744433 [0,1,0,1,0,0|2,0,0]=4 25404 B16R2.319 O=C(c1ccc(cc1O)Cl)C2CCCC2 1458a_100000188622_100000179811 [0,1,0,1,0,0|1,0,0]=3 25405 B16R2.319 O=C(c1ccc(cc1O)Cl)C2CCOC2 1458a_100000188622_100000690089 [0,1,0,1,0,0|2,0,0]=4 25406 B16R2.319 O=C(c1ccc(cc1O)Cl)N2CCCC2 240690a_100000188435_100000188622 [0,1,0,1,0,0|1,0,0]=3 25407 B16R2.319 O=C(c1ccc(cc1O)Cl)N2CCCC2 527a_100000188435_100000188622 [0,1,0,1,0,0|1,0,0]=3 25408 B16R2.319 O=C(c1ccc(cc1O)Cl)N2CCSC2 11a_100011215254_100000188622 [0,1,0,1,0,0|2,0,0]=4 25409 B16R2.319 O=C(c1ccc(cc1O)Cl)N2CCSC2 240690a_100011215254_100000188622 [0,1,0,1,0,0|2,0,0]=4 25410 B16R2.319 O=C(c1ccc(cc1O)Cl)N2CCSC2 527a_100011215254_100000188622 [0,1,0,1,0,0|2,0,0]=4 25411 B16R2.319 O=C(c1ccc(cc1O)F)C2CCCC2 1458a_100000746061_100000179811 [0,1,0,1,0,0|1,0,0]=3 25412 B16R2.319 O=C(c1ccc(cc1O)F)C2CCOC2 1458a_100000746061_100000690089 [0,1,0,1,0,0|2,0,0]=4 25413 B16R2.319 O=C(c1ccc(cc1O)F)N2CCCC2 240690a_100000188435_100000746061 [0,1,0,1,0,0|1,0,0]=3 25414 B16R2.319 O=C(c1ccc(cc1O)F)N2CCCC2 527a_100000188435_100000746061 [0,1,0,1,0,0|1,0,0]=3 25415 B16R2.319 O=C(c1ccc(cc1O)F)N2CCSC2 240690a_100011215254_100000746061 [0,1,0,1,0,0|2,0,0]=4 25416 B16R2.319 O=C(c1ccc(cc1O)F)N2CCSC2 527a_100011215254_100000746061 [0,1,0,1,0,0|2,0,0]=4 25417 B16R2.319 O=C(c1ccc(cc1O)I)C2CCCC2 1458a_100000091984_100000179811 [0,1,0,1,0,0|1,0,0]=3 25418 B16R2.319 O=C(c1ccc(cc1O)I)C2CCOC2 1458a_100000091984_100000690089 [0,1,0,1,0,0|2,0,0]=4 25419 B16R2.319 O=C(c1ccc(cc1O)I)N2CCCC2 240690a_100000188435_100000091984 [0,1,0,1,0,0|1,0,0]=3 25420 B16R2.319 O=C(c1ccc(cc1O)I)N2CCCC2 527a_100000188435_100000091984 [0,1,0,1,0,0|1,0,0]=3 25421 B16R2.319 O=C(c1ccc(cc1O)I)N2CCSC2 240690a_100011215254_100000091984 [0,1,0,1,0,0|2,0,0]=4 25422 B16R2.319 O=C(c1ccc(cc1O)I)N2CCSC2 527a_100011215254_100000091984 [0,1,0,1,0,0|2,0,0]=4 25423 B16R2.319 O=C(c1ccc(cc1O)O)C2CCCC2 1458a_100000212172_100000179811 [0,1,0,1,0,0|1,0,0]=3 25424 B16R2.319 O=C(c1ccc(cc1O)O)C2CCOC2 1458a_100000212172_100000690089 [0,1,0,1,0,0|2,0,0]=4 25425 B16R2.12629 Cc1ccc(c(c1)O)C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212137 [0,1,0,1,0,0|2,0,0]=4 25426 B16R2.12629 Cc1ccc(c(c1)O)C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212137 [0,1,0,1,0,0|2,0,0]=4 25427 B16R2.12629 Cc1ccc(c(c1)O)C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000212137 [0,1,0,1,0,0|2,0,0]=4 25428 B16R2.12629 Cc1ccc(c(c1)O)C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212137 [0,1,0,1,0,0|2,0,0]=4 25429 B16R2.12629 Cc1ccc(c(c1)O)C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000212137 [0,1,0,1,0,0|2,0,0]=4 25430 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)Br 240690a_100015190264_100000744433 [0,1,0,1,0,0|2,0,0]=4 25431 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)Br 527a_100015190264_100000744433 [0,1,0,1,0,0|2,0,0]=4 25432 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)Cl 240690a_100015190264_100000188622 [0,1,0,1,0,0|2,0,0]=4 25433 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)Cl 527a_100015190264_100000188622 [0,1,0,1,0,0|2,0,0]=4 25434 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)F 240690a_100015190264_100000746061 [0,1,0,1,0,0|2,0,0]=4 25435 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)F 527a_100015190264_100000746061 [0,1,0,1,0,0|2,0,0]=4 25436 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)I 240690a_100015190264_100000091984 [0,1,0,1,0,0|2,0,0]=4 25437 B16R2.12629 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2O)I 527a_100015190264_100000091984 [0,1,0,1,0,0|2,0,0]=4 25438 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)Br 240690a_100025746932_100000744433 [0,1,0,1,0,0|2,0,0]=4 25439 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)Br 527a_100025746932_100000744433 [0,1,0,1,0,0|2,0,0]=4 25440 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)Cl 11a_100025746932_100000188622 [0,1,0,1,0,0|2,0,0]=4 25441 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)Cl 240690a_100025746932_100000188622 [0,1,0,1,0,0|2,0,0]=4 25442 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)Cl 527a_100025746932_100000188622 [0,1,0,1,0,0|2,0,0]=4 25443 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)F 240690a_100025746932_100000746061 [0,1,0,1,0,0|2,0,0]=4 25444 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)F 527a_100025746932_100000746061 [0,1,0,1,0,0|2,0,0]=4 25445 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)I 240690a_100025746932_100000091984 [0,1,0,1,0,0|2,0,0]=4 25446 B16R2.12629 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2O)I 527a_100025746932_100000091984 [0,1,0,1,0,0|2,0,0]=4 25447 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)Br 11a_100000755817_100000762965 [0,1,0,1,0,0|2,0,0]=4 25448 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)Br 240690a_100000755817_100000762965 [0,1,0,1,0,0|2,0,0]=4 25449 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)Br 527a_100000755817_100000762965 [0,1,0,1,0,0|2,0,0]=4 25450 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)Cl 11a_100000755817_100000766353 [0,1,0,1,0,0|2,0,0]=4 25451 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)Cl 240690a_100000755817_100000766353 [0,1,0,1,0,0|2,0,0]=4 25452 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)Cl 527a_100000755817_100000766353 [0,1,0,1,0,0|2,0,0]=4 25453 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)F 11a_100000755817_100000212304 [0,1,0,1,0,0|2,0,0]=4 25454 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)F 240690a_100000755817_100000212304 [0,1,0,1,0,0|2,0,0]=4 25455 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)F 527a_100000755817_100000212304 [0,1,0,1,0,0|2,0,0]=4 25456 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)I 11a_100000755817_100012360512 [0,1,0,1,0,0|2,0,0]=4 25457 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)I 240690a_100000755817_100012360512 [0,1,0,1,0,0|2,0,0]=4 25458 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)I 527a_100000755817_100012360512 [0,1,0,1,0,0|2,0,0]=4 25459 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)O 240690a_100000755817_100012344906 [0,1,0,1,0,0|2,0,0]=4 25460 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Br)O 527a_100000755817_100012344906 [0,1,0,1,0,0|2,0,0]=4 25461 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)Br 11a_100000755817_100000741628 [0,1,0,1,0,0|2,0,0]=4 25462 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)Br 240690a_100000755817_100000741628 [0,1,0,1,0,0|2,0,0]=4 25463 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)Br 527a_100000755817_100000741628 [0,1,0,1,0,0|2,0,0]=4 25464 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)Cl 11a_100000755817_100000185840 [0,1,0,1,0,0|2,0,0]=4 25465 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)Cl 240690a_100000755817_100000185840 [0,1,0,1,0,0|2,0,0]=4 25466 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)Cl 527a_100000755817_100000185840 [0,1,0,1,0,0|2,0,0]=4 25467 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)F 11a_100000755817_100000211397 [0,1,0,1,0,0|2,0,0]=4 25468 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)F 240690a_100000755817_100000211397 [0,1,0,1,0,0|2,0,0]=4 25469 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)F 527a_100000755817_100000211397 [0,1,0,1,0,0|2,0,0]=4 25470 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)I 11a_100000755817_100000751301 [0,1,0,1,0,0|2,0,0]=4 25471 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)I 240690a_100000755817_100000751301 [0,1,0,1,0,0|2,0,0]=4 25472 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)I 527a_100000755817_100000751301 [0,1,0,1,0,0|2,0,0]=4 25473 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)O 240690a_100000755817_100000702456 [0,1,0,1,0,0|2,0,0]=4 25474 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2Cl)O 527a_100000755817_100000702456 [0,1,0,1,0,0|2,0,0]=4 25475 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)Br 11a_100000755817_100000214689 [0,1,0,1,0,0|2,0,0]=4 25476 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)Br 240690a_100000755817_100000214689 [0,1,0,1,0,0|2,0,0]=4 25477 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)Br 527a_100000755817_100000214689 [0,1,0,1,0,0|2,0,0]=4 25478 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)Cl 11a_100000755817_100000212326 [0,1,0,1,0,0|2,0,0]=4 25479 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)Cl 240690a_100000755817_100000212326 [0,1,0,1,0,0|2,0,0]=4 25480 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)Cl 527a_100000755817_100000212326 [0,1,0,1,0,0|2,0,0]=4 25481 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)F 11a_100000755817_100000211022 [0,1,0,1,0,0|2,0,0]=4 25482 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)F 240690a_100000755817_100000211022 [0,1,0,1,0,0|2,0,0]=4 25483 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)F 527a_100000755817_100000211022 [0,1,0,1,0,0|2,0,0]=4 25484 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)I 11a_100000755817_100000037189 [0,1,0,1,0,0|2,0,0]=4 25485 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)I 240690a_100000755817_100000037189 [0,1,0,1,0,0|2,0,0]=4 25486 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)I 527a_100000755817_100000037189 [0,1,0,1,0,0|2,0,0]=4 25487 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)O 240690a_100000755817_100000689029 [0,1,0,1,0,0|2,0,0]=4 25488 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2F)O 527a_100000755817_100000689029 [0,1,0,1,0,0|2,0,0]=4 25489 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)Br 11a_100000755817_100000751167 [0,1,0,1,0,0|2,0,0]=4 25490 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)Br 240690a_100000755817_100000751167 [0,1,0,1,0,0|2,0,0]=4 25491 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)Br 527a_100000755817_100000751167 [0,1,0,1,0,0|2,0,0]=4 25492 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)Cl 11a_100000755817_100000739380 [0,1,0,1,0,0|2,0,0]=4 25493 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)Cl 240690a_100000755817_100000739380 [0,1,0,1,0,0|2,0,0]=4 25494 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)Cl 527a_100000755817_100000739380 [0,1,0,1,0,0|2,0,0]=4 25495 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)F 11a_100000755817_100000739341 [0,1,0,1,0,0|2,0,0]=4 25496 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)F 240690a_100000755817_100000739341 [0,1,0,1,0,0|2,0,0]=4 25497 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2I)F 527a_100000755817_100000739341 [0,1,0,1,0,0|2,0,0]=4 25498 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)Br 240690a_100000755817_100000744433 [0,1,0,1,0,0|1,0,0]=3 25499 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)Br 527a_100000755817_100000744433 [0,1,0,1,0,0|1,0,0]=3 25500 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)Cl 11a_100000755817_100000188622 [0,1,0,1,0,0|1,0,0]=3 25501 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)Cl 240690a_100000755817_100000188622 [0,1,0,1,0,0|1,0,0]=3 25502 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)Cl 527a_100000755817_100000188622 [0,1,0,1,0,0|1,0,0]=3 25503 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)F 240690a_100000755817_100000746061 [0,1,0,1,0,0|1,0,0]=3 25504 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)F 527a_100000755817_100000746061 [0,1,0,1,0,0|1,0,0]=3 25505 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)I 240690a_100000755817_100000091984 [0,1,0,1,0,0|1,0,0]=3 25506 B16R2.26210 CC1CCN1C(=O)c2ccc(cc2O)I 527a_100000755817_100000091984 [0,1,0,1,0,0|1,0,0]=3 25507 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)Br 11a_100000755817_100000741311 [0,1,0,1,0,0|2,0,0]=4 25508 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)Br 240690a_100000755817_100000741311 [0,1,0,1,0,0|2,0,0]=4 25509 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)Br 527a_100000755817_100000741311 [0,1,0,1,0,0|2,0,0]=4 25510 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)Cl 11a_100000755817_100000688705 [0,1,0,1,0,0|2,0,0]=4 25511 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)Cl 240690a_100000755817_100000688705 [0,1,0,1,0,0|2,0,0]=4 25512 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)Cl 527a_100000755817_100000688705 [0,1,0,1,0,0|2,0,0]=4 25513 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)F 11a_100000755817_100000686989 [0,1,0,1,0,0|2,0,0]=4 25514 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)F 240690a_100000755817_100000686989 [0,1,0,1,0,0|2,0,0]=4 25515 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)F 527a_100000755817_100000686989 [0,1,0,1,0,0|2,0,0]=4 25516 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)I 11a_100000755817_100010189873 [0,1,0,1,0,0|2,0,0]=4 25517 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)I 240690a_100000755817_100010189873 [0,1,0,1,0,0|2,0,0]=4 25518 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)I 527a_100000755817_100010189873 [0,1,0,1,0,0|2,0,0]=4 25519 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)O 240690a_100000755817_100000692822 [0,1,0,1,0,0|2,0,0]=4 25520 B16R2.26210 Cc1cc(ccc1C(=O)N2CCC2C)O 527a_100000755817_100000692822 [0,1,0,1,0,0|2,0,0]=4 25521 B16R2.26210 Cc1ccc(c(c1)Br)C(=O)N2CCC2C 11a_100000755817_100000685072 [0,1,0,1,0,0|2,0,0]=4 25522 B16R2.26210 Cc1ccc(c(c1)Br)C(=O)N2CCC2C 240690a_100000755817_100000685072 [0,1,0,1,0,0|2,0,0]=4 25523 B16R2.26210 Cc1ccc(c(c1)Br)C(=O)N2CCC2C 527a_100000755817_100000685072 [0,1,0,1,0,0|2,0,0]=4 25524 B16R2.26210 Cc1ccc(c(c1)C)C(=O)N2CCC2C 11a_100000755817_100000211164 [0,1,0,1,0,0|2,0,0]=4 25525 B16R2.26210 Cc1ccc(c(c1)C)C(=O)N2CCC2C 240690a_100000755817_100000211164 [0,1,0,1,0,0|2,0,0]=4 25526 B16R2.26210 Cc1ccc(c(c1)C)C(=O)N2CCC2C 527a_100000755817_100000211164 [0,1,0,1,0,0|2,0,0]=4 25527 B16R2.26210 Cc1ccc(c(c1)Cl)C(=O)N2CCC2C 11a_100000755817_100000766932 [0,1,0,1,0,0|2,0,0]=4 25528 B16R2.26210 Cc1ccc(c(c1)Cl)C(=O)N2CCC2C 240690a_100000755817_100000766932 [0,1,0,1,0,0|2,0,0]=4 25529 B16R2.26210 Cc1ccc(c(c1)Cl)C(=O)N2CCC2C 527a_100000755817_100000766932 [0,1,0,1,0,0|2,0,0]=4 25530 B16R2.26210 Cc1ccc(c(c1)F)C(=O)N2CCC2C 11a_100000755817_100000766033 [0,1,0,1,0,0|2,0,0]=4 25531 B16R2.26210 Cc1ccc(c(c1)F)C(=O)N2CCC2C 240690a_100000755817_100000766033 [0,1,0,1,0,0|2,0,0]=4 25532 B16R2.26210 Cc1ccc(c(c1)F)C(=O)N2CCC2C 527a_100000755817_100000766033 [0,1,0,1,0,0|2,0,0]=4 25533 B16R2.26210 Cc1ccc(c(c1)I)C(=O)N2CCC2C 11a_100000755817_100009999607 [0,1,0,1,0,0|2,0,0]=4 25534 B16R2.26210 Cc1ccc(c(c1)I)C(=O)N2CCC2C 240690a_100000755817_100009999607 [0,1,0,1,0,0|2,0,0]=4 25535 B16R2.26210 Cc1ccc(c(c1)I)C(=O)N2CCC2C 527a_100000755817_100009999607 [0,1,0,1,0,0|2,0,0]=4 25536 B16R2.26210 Cc1ccc(c(c1)O)C(=O)N2CCC2C 240690a_100000755817_100000212137 [0,1,0,1,0,0|1,0,0]=3 25537 B16R2.26210 Cc1ccc(c(c1)O)C(=O)N2CCC2C 527a_100000755817_100000212137 [0,1,0,1,0,0|1,0,0]=3 25538 B16R2.84500 Cc1cc(ccc1C(=O)CC2CCC2)Br 1458a_100000741311_100000763275 [0,1,0,1,0,0|2,0,0]=4 25539 B16R2.84500 Cc1cc(ccc1C(=O)CC2CCC2)Cl 1458a_100000688705_100000763275 [0,1,0,1,0,0|2,0,0]=4 25540 B16R2.84500 Cc1cc(ccc1C(=O)CC2CCC2)F 1458a_100000686989_100000763275 [0,1,0,1,0,0|2,0,0]=4 25541 B16R2.84500 Cc1cc(ccc1C(=O)CC2CCC2)I 1458a_100010189873_100000763275 [0,1,0,1,0,0|2,0,0]=4 25542 B16R2.84500 Cc1cc(ccc1C(=O)CC2CCC2)O 1458a_100000692822_100000763275 [0,1,0,1,0,0|2,0,0]=4 25543 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Br 11a_100000749019_100000741311 [0,1,0,1,0,0|2,0,0]=4 25544 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Br 1626a_100000749019_100000741311 [0,1,0,1,0,0|2,0,0]=4 25545 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Br 240690a_100000749019_100000741311 [0,1,0,1,0,0|2,0,0]=4 25546 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Br 527a_100000749019_100000741311 [0,1,0,1,0,0|2,0,0]=4 25547 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Cl 11a_100000749019_100000688705 [0,1,0,1,0,0|2,0,0]=4 25548 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Cl 1626a_100000749019_100000688705 [0,1,0,1,0,0|2,0,0]=4 25549 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Cl 240690a_100000749019_100000688705 [0,1,0,1,0,0|2,0,0]=4 25550 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)Cl 527a_100000749019_100000688705 [0,1,0,1,0,0|2,0,0]=4 25551 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)F 11a_100000749019_100000686989 [0,1,0,1,0,0|2,0,0]=4 25552 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)F 1626a_100000749019_100000686989 [0,1,0,1,0,0|2,0,0]=4 25553 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)F 240690a_100000749019_100000686989 [0,1,0,1,0,0|2,0,0]=4 25554 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)F 527a_100000749019_100000686989 [0,1,0,1,0,0|2,0,0]=4 25555 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)I 11a_100000749019_100010189873 [0,1,0,1,0,0|2,0,0]=4 25556 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)I 1626a_100000749019_100010189873 [0,1,0,1,0,0|2,0,0]=4 25557 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)I 240690a_100000749019_100010189873 [0,1,0,1,0,0|2,0,0]=4 25558 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)I 527a_100000749019_100010189873 [0,1,0,1,0,0|2,0,0]=4 25559 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)O 240690a_100000749019_100000692822 [0,1,0,1,0,0|2,0,0]=4 25560 B16R2.84500 Cc1cc(ccc1C(=O)NC2CCC2)O 527a_100000749019_100000692822 [0,1,0,1,0,0|2,0,0]=4 25561 B16R2.84500 Cc1ccc(c(c1)Br)C(=O)CC2CCC2 1458a_100000685072_100000763275 [0,1,0,1,0,0|2,0,0]=4 25562 B16R2.84500 Cc1ccc(c(c1)Br)C(=O)NC2CCC2 11a_100000749019_100000685072 [0,1,0,1,0,0|2,0,0]=4 25563 B16R2.84500 Cc1ccc(c(c1)Br)C(=O)NC2CCC2 1626a_100000749019_100000685072 [0,1,0,1,0,0|2,0,0]=4 25564 B16R2.84500 Cc1ccc(c(c1)Br)C(=O)NC2CCC2 240690a_100000749019_100000685072 [0,1,0,1,0,0|2,0,0]=4 25565 B16R2.84500 Cc1ccc(c(c1)Br)C(=O)NC2CCC2 527a_100000749019_100000685072 [0,1,0,1,0,0|2,0,0]=4 25566 B16R2.84500 Cc1ccc(c(c1)C)C(=O)CC2CCC2 1458a_100000211164_100000763275 [0,1,0,1,0,0|2,0,0]=4 25567 B16R2.84500 Cc1ccc(c(c1)C)C(=O)NC2CCC2 11a_100000749019_100000211164 [0,1,0,1,0,0|2,0,0]=4 25568 B16R2.84500 Cc1ccc(c(c1)C)C(=O)NC2CCC2 1626a_100000749019_100000211164 [0,1,0,1,0,0|2,0,0]=4 25569 B16R2.84500 Cc1ccc(c(c1)C)C(=O)NC2CCC2 240690a_100000749019_100000211164 [0,1,0,1,0,0|2,0,0]=4 25570 B16R2.84500 Cc1ccc(c(c1)C)C(=O)NC2CCC2 527a_100000749019_100000211164 [0,1,0,1,0,0|2,0,0]=4 25571 B16R2.84500 Cc1ccc(c(c1)Cl)C(=O)CC2CCC2 1458a_100000766932_100000763275 [0,1,0,1,0,0|2,0,0]=4 25572 B16R2.84500 Cc1ccc(c(c1)Cl)C(=O)NC2CCC2 11a_100000749019_100000766932 [0,1,0,1,0,0|2,0,0]=4 25573 B16R2.84500 Cc1ccc(c(c1)Cl)C(=O)NC2CCC2 1626a_100000749019_100000766932 [0,1,0,1,0,0|2,0,0]=4 25574 B16R2.84500 Cc1ccc(c(c1)Cl)C(=O)NC2CCC2 240690a_100000749019_100000766932 [0,1,0,1,0,0|2,0,0]=4 25575 B16R2.84500 Cc1ccc(c(c1)Cl)C(=O)NC2CCC2 527a_100000749019_100000766932 [0,1,0,1,0,0|2,0,0]=4 25576 B16R2.84500 Cc1ccc(c(c1)F)C(=O)CC2CCC2 1458a_100000766033_100000763275 [0,1,0,1,0,0|2,0,0]=4 25577 B16R2.84500 Cc1ccc(c(c1)F)C(=O)NC2CCC2 11a_100000749019_100000766033 [0,1,0,1,0,0|2,0,0]=4 25578 B16R2.84500 Cc1ccc(c(c1)F)C(=O)NC2CCC2 1626a_100000749019_100000766033 [0,1,0,1,0,0|2,0,0]=4 25579 B16R2.84500 Cc1ccc(c(c1)F)C(=O)NC2CCC2 240690a_100000749019_100000766033 [0,1,0,1,0,0|2,0,0]=4 25580 B16R2.84500 Cc1ccc(c(c1)F)C(=O)NC2CCC2 527a_100000749019_100000766033 [0,1,0,1,0,0|2,0,0]=4 25581 B16R2.84500 Cc1ccc(c(c1)I)C(=O)CC2CCC2 1458a_100009999607_100000763275 [0,1,0,1,0,0|2,0,0]=4 25582 B16R2.84500 Cc1ccc(c(c1)I)C(=O)NC2CCC2 11a_100000749019_100009999607 [0,1,0,1,0,0|2,0,0]=4 25583 B16R2.84500 Cc1ccc(c(c1)I)C(=O)NC2CCC2 1626a_100000749019_100009999607 [0,1,0,1,0,0|2,0,0]=4 25584 B16R2.84500 Cc1ccc(c(c1)I)C(=O)NC2CCC2 240690a_100000749019_100009999607 [0,1,0,1,0,0|2,0,0]=4 25585 B16R2.84500 Cc1ccc(c(c1)I)C(=O)NC2CCC2 527a_100000749019_100009999607 [0,1,0,1,0,0|2,0,0]=4 25586 B16R2.84500 Cc1ccc(c(c1)O)C(=O)CC2CCC2 1458a_100000212137_100000763275 [0,1,0,1,0,0|1,0,0]=3 25587 B16R2.84500 Cc1ccc(c(c1)O)C(=O)CC2CCO2 1458a_100000212137_100000103362 [0,1,0,1,0,0|2,0,0]=4 25588 B16R2.84500 Cc1ccc(c(c1)O)C(=O)CC2COC2 1458a_100000212137_100010264016 [0,1,0,1,0,0|2,0,0]=4 25589 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2CCC2 1626a_100000749019_100000212137 [0,1,0,1,0,0|1,0,0]=3 25590 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2CCC2 240690a_100000749019_100000212137 [0,1,0,1,0,0|1,0,0]=3 25591 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2CCC2 527a_100000749019_100000212137 [0,1,0,1,0,0|1,0,0]=3 25592 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2COC2 1626a_100016991112_100000212137 [0,1,0,1,0,0|2,0,0]=4 25593 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2COC2 240690a_100016991112_100000212137 [0,1,0,1,0,0|2,0,0]=4 25594 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2COC2 527a_100016991112_100000212137 [0,1,0,1,0,0|2,0,0]=4 25595 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2CSC2 1626a_100016994217_100000212137 [0,1,0,1,0,0|2,0,0]=4 25596 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2CSC2 240690a_100016994217_100000212137 [0,1,0,1,0,0|2,0,0]=4 25597 B16R2.84500 Cc1ccc(c(c1)O)C(=O)NC2CSC2 527a_100016994217_100000212137 [0,1,0,1,0,0|2,0,0]=4 25598 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Br)Br 1458a_100000762965_100000763275 [0,1,0,1,0,0|2,0,0]=4 25599 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Br)Cl 1458a_100000766353_100000763275 [0,1,0,1,0,0|2,0,0]=4 25600 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Br)F 1458a_100000212304_100000763275 [0,1,0,1,0,0|2,0,0]=4 25601 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Br)I 1458a_100012360512_100000763275 [0,1,0,1,0,0|2,0,0]=4 25602 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Br)O 1458a_100012344906_100000763275 [0,1,0,1,0,0|2,0,0]=4 25603 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Cl)Br 1458a_100000741628_100000763275 [0,1,0,1,0,0|2,0,0]=4 25604 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Cl)Cl 1458a_100000185840_100000763275 [0,1,0,1,0,0|2,0,0]=4 25605 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Cl)F 1458a_100000211397_100000763275 [0,1,0,1,0,0|2,0,0]=4 25606 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Cl)I 1458a_100000751301_100000763275 [0,1,0,1,0,0|2,0,0]=4 25607 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2Cl)O 1458a_100000702456_100000763275 [0,1,0,1,0,0|2,0,0]=4 25608 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2F)Br 1458a_100000214689_100000763275 [0,1,0,1,0,0|2,0,0]=4 25609 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2F)Cl 1458a_100000212326_100000763275 [0,1,0,1,0,0|2,0,0]=4 25610 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2F)F 1458a_100000211022_100000763275 [0,1,0,1,0,0|2,0,0]=4 25611 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2F)I 1458a_100000037189_100000763275 [0,1,0,1,0,0|2,0,0]=4 25612 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2F)O 1458a_100000689029_100000763275 [0,1,0,1,0,0|2,0,0]=4 25613 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2I)Br 1458a_100000751167_100000763275 [0,1,0,1,0,0|2,0,0]=4 25614 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2I)Cl 1458a_100000739380_100000763275 [0,1,0,1,0,0|2,0,0]=4 25615 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2I)F 1458a_100000739341_100000763275 [0,1,0,1,0,0|2,0,0]=4 25616 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2O)Br 1458a_100000744433_100000763275 [0,1,0,1,0,0|1,0,0]=3 25617 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2O)Cl 1458a_100000188622_100000763275 [0,1,0,1,0,0|1,0,0]=3 25618 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2O)F 1458a_100000746061_100000763275 [0,1,0,1,0,0|1,0,0]=3 25619 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2O)I 1458a_100000091984_100000763275 [0,1,0,1,0,0|1,0,0]=3 25620 B16R2.84500 O=C(CC1CCC1)c2ccc(cc2O)O 1458a_100000212172_100000763275 [0,1,0,1,0,0|1,0,0]=3 25621 B16R2.84500 O=C(CC1CCO1)c2ccc(cc2O)Br 1458a_100000744433_100000103362 [0,1,0,1,0,0|2,0,0]=4 25622 B16R2.84500 O=C(CC1CCO1)c2ccc(cc2O)Cl 1458a_100000188622_100000103362 [0,1,0,1,0,0|2,0,0]=4 25623 B16R2.84500 O=C(CC1CCO1)c2ccc(cc2O)F 1458a_100000746061_100000103362 [0,1,0,1,0,0|2,0,0]=4 25624 B16R2.84500 O=C(CC1CCO1)c2ccc(cc2O)I 1458a_100000091984_100000103362 [0,1,0,1,0,0|2,0,0]=4 25625 B16R2.84500 O=C(CC1CCO1)c2ccc(cc2O)O 1458a_100000212172_100000103362 [0,1,0,1,0,0|2,0,0]=4 25626 B16R2.84500 O=C(CC1COC1)c2ccc(cc2O)Br 1458a_100000744433_100010264016 [0,1,0,1,0,0|2,0,0]=4 25627 B16R2.84500 O=C(CC1COC1)c2ccc(cc2O)Cl 1458a_100000188622_100010264016 [0,1,0,1,0,0|2,0,0]=4 25628 B16R2.84500 O=C(CC1COC1)c2ccc(cc2O)F 1458a_100000746061_100010264016 [0,1,0,1,0,0|2,0,0]=4 25629 B16R2.84500 O=C(CC1COC1)c2ccc(cc2O)I 1458a_100000091984_100010264016 [0,1,0,1,0,0|2,0,0]=4 25630 B16R2.84500 O=C(CC1COC1)c2ccc(cc2O)O 1458a_100000212172_100010264016 [0,1,0,1,0,0|2,0,0]=4 25631 B16R2.84500 O=C(CN1CCC1)c2ccc(cc2O)F 269982a_100000754969_100009817053 [0,1,0,1,0,0|2,0,0]=4 25632 B16R2.84500 O=C(CN1CCC1)c2ccc(cc2O)O 269982a_100000754969_100009814262 [0,1,0,1,0,0|2,0,0]=4 25633 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Br 11a_100000749019_100000762965 [0,1,0,1,0,0|2,0,0]=4 25634 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Br 1626a_100000749019_100000762965 [0,1,0,1,0,0|2,0,0]=4 25635 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Br 240690a_100000749019_100000762965 [0,1,0,1,0,0|2,0,0]=4 25636 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Br 527a_100000749019_100000762965 [0,1,0,1,0,0|2,0,0]=4 25637 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Cl 11a_100000749019_100000766353 [0,1,0,1,0,0|2,0,0]=4 25638 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Cl 1626a_100000749019_100000766353 [0,1,0,1,0,0|2,0,0]=4 25639 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Cl 240690a_100000749019_100000766353 [0,1,0,1,0,0|2,0,0]=4 25640 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)Cl 527a_100000749019_100000766353 [0,1,0,1,0,0|2,0,0]=4 25641 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)F 11a_100000749019_100000212304 [0,1,0,1,0,0|2,0,0]=4 25642 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)F 1626a_100000749019_100000212304 [0,1,0,1,0,0|2,0,0]=4 25643 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)F 240690a_100000749019_100000212304 [0,1,0,1,0,0|2,0,0]=4 25644 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)F 527a_100000749019_100000212304 [0,1,0,1,0,0|2,0,0]=4 25645 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)I 11a_100000749019_100012360512 [0,1,0,1,0,0|2,0,0]=4 25646 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)I 1626a_100000749019_100012360512 [0,1,0,1,0,0|2,0,0]=4 25647 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)I 240690a_100000749019_100012360512 [0,1,0,1,0,0|2,0,0]=4 25648 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)I 527a_100000749019_100012360512 [0,1,0,1,0,0|2,0,0]=4 25649 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)O 240690a_100000749019_100012344906 [0,1,0,1,0,0|2,0,0]=4 25650 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Br)O 527a_100000749019_100012344906 [0,1,0,1,0,0|2,0,0]=4 25651 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Br 11a_100000749019_100000741628 [0,1,0,1,0,0|2,0,0]=4 25652 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Br 1626a_100000749019_100000741628 [0,1,0,1,0,0|2,0,0]=4 25653 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Br 240690a_100000749019_100000741628 [0,1,0,1,0,0|2,0,0]=4 25654 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Br 527a_100000749019_100000741628 [0,1,0,1,0,0|2,0,0]=4 25655 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Cl 11a_100000749019_100000185840 [0,1,0,1,0,0|2,0,0]=4 25656 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Cl 1626a_100000749019_100000185840 [0,1,0,1,0,0|2,0,0]=4 25657 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Cl 240690a_100000749019_100000185840 [0,1,0,1,0,0|2,0,0]=4 25658 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)Cl 527a_100000749019_100000185840 [0,1,0,1,0,0|2,0,0]=4 25659 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)F 11a_100000749019_100000211397 [0,1,0,1,0,0|2,0,0]=4 25660 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)F 1626a_100000749019_100000211397 [0,1,0,1,0,0|2,0,0]=4 25661 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)F 240690a_100000749019_100000211397 [0,1,0,1,0,0|2,0,0]=4 25662 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)F 527a_100000749019_100000211397 [0,1,0,1,0,0|2,0,0]=4 25663 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)I 11a_100000749019_100000751301 [0,1,0,1,0,0|2,0,0]=4 25664 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)I 1626a_100000749019_100000751301 [0,1,0,1,0,0|2,0,0]=4 25665 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)I 240690a_100000749019_100000751301 [0,1,0,1,0,0|2,0,0]=4 25666 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)I 527a_100000749019_100000751301 [0,1,0,1,0,0|2,0,0]=4 25667 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)O 240690a_100000749019_100000702456 [0,1,0,1,0,0|2,0,0]=4 25668 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2Cl)O 527a_100000749019_100000702456 [0,1,0,1,0,0|2,0,0]=4 25669 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Br 11a_100000749019_100000214689 [0,1,0,1,0,0|2,0,0]=4 25670 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Br 1626a_100000749019_100000214689 [0,1,0,1,0,0|2,0,0]=4 25671 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Br 240690a_100000749019_100000214689 [0,1,0,1,0,0|2,0,0]=4 25672 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Br 527a_100000749019_100000214689 [0,1,0,1,0,0|2,0,0]=4 25673 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Cl 11a_100000749019_100000212326 [0,1,0,1,0,0|2,0,0]=4 25674 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Cl 1626a_100000749019_100000212326 [0,1,0,1,0,0|2,0,0]=4 25675 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Cl 240690a_100000749019_100000212326 [0,1,0,1,0,0|2,0,0]=4 25676 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)Cl 527a_100000749019_100000212326 [0,1,0,1,0,0|2,0,0]=4 25677 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)F 11a_100000749019_100000211022 [0,1,0,1,0,0|2,0,0]=4 25678 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)F 1626a_100000749019_100000211022 [0,1,0,1,0,0|2,0,0]=4 25679 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)F 240690a_100000749019_100000211022 [0,1,0,1,0,0|2,0,0]=4 25680 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)F 527a_100000749019_100000211022 [0,1,0,1,0,0|2,0,0]=4 25681 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)I 11a_100000749019_100000037189 [0,1,0,1,0,0|2,0,0]=4 25682 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)I 1626a_100000749019_100000037189 [0,1,0,1,0,0|2,0,0]=4 25683 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)I 240690a_100000749019_100000037189 [0,1,0,1,0,0|2,0,0]=4 25684 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)I 527a_100000749019_100000037189 [0,1,0,1,0,0|2,0,0]=4 25685 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)O 240690a_100000749019_100000689029 [0,1,0,1,0,0|2,0,0]=4 25686 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2F)O 527a_100000749019_100000689029 [0,1,0,1,0,0|2,0,0]=4 25687 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Br 11a_100000749019_100000751167 [0,1,0,1,0,0|2,0,0]=4 25688 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Br 1626a_100000749019_100000751167 [0,1,0,1,0,0|2,0,0]=4 25689 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Br 240690a_100000749019_100000751167 [0,1,0,1,0,0|2,0,0]=4 25690 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Br 527a_100000749019_100000751167 [0,1,0,1,0,0|2,0,0]=4 25691 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Cl 11a_100000749019_100000739380 [0,1,0,1,0,0|2,0,0]=4 25692 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Cl 1626a_100000749019_100000739380 [0,1,0,1,0,0|2,0,0]=4 25693 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Cl 240690a_100000749019_100000739380 [0,1,0,1,0,0|2,0,0]=4 25694 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)Cl 527a_100000749019_100000739380 [0,1,0,1,0,0|2,0,0]=4 25695 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)F 11a_100000749019_100000739341 [0,1,0,1,0,0|2,0,0]=4 25696 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)F 1626a_100000749019_100000739341 [0,1,0,1,0,0|2,0,0]=4 25697 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)F 240690a_100000749019_100000739341 [0,1,0,1,0,0|2,0,0]=4 25698 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2I)F 527a_100000749019_100000739341 [0,1,0,1,0,0|2,0,0]=4 25699 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)Br 240690a_100000749019_100000744433 [0,1,0,1,0,0|1,0,0]=3 25700 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)Br 527a_100000749019_100000744433 [0,1,0,1,0,0|1,0,0]=3 25701 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)Cl 11a_100000749019_100000188622 [0,1,0,1,0,0|1,0,0]=3 25702 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)Cl 240690a_100000749019_100000188622 [0,1,0,1,0,0|1,0,0]=3 25703 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)Cl 527a_100000749019_100000188622 [0,1,0,1,0,0|1,0,0]=3 25704 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)F 240690a_100000749019_100000746061 [0,1,0,1,0,0|1,0,0]=3 25705 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)F 527a_100000749019_100000746061 [0,1,0,1,0,0|1,0,0]=3 25706 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)I 240690a_100000749019_100000091984 [0,1,0,1,0,0|1,0,0]=3 25707 B16R2.84500 O=C(NC1CCC1)c2ccc(cc2O)I 527a_100000749019_100000091984 [0,1,0,1,0,0|1,0,0]=3 25708 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)Br 240690a_100016991112_100000744433 [0,1,0,1,0,0|2,0,0]=4 25709 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)Br 527a_100016991112_100000744433 [0,1,0,1,0,0|2,0,0]=4 25710 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)Cl 11a_100016991112_100000188622 [0,1,0,1,0,0|2,0,0]=4 25711 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)Cl 240690a_100016991112_100000188622 [0,1,0,1,0,0|2,0,0]=4 25712 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)Cl 527a_100016991112_100000188622 [0,1,0,1,0,0|2,0,0]=4 25713 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)F 240690a_100016991112_100000746061 [0,1,0,1,0,0|2,0,0]=4 25714 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)F 527a_100016991112_100000746061 [0,1,0,1,0,0|2,0,0]=4 25715 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)I 240690a_100016991112_100000091984 [0,1,0,1,0,0|2,0,0]=4 25716 B16R2.84500 O=C(NC1COC1)c2ccc(cc2O)I 527a_100016991112_100000091984 [0,1,0,1,0,0|2,0,0]=4 25717 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)Br 240690a_100016994217_100000744433 [0,1,0,1,0,0|2,0,0]=4 25718 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)Br 527a_100016994217_100000744433 [0,1,0,1,0,0|2,0,0]=4 25719 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)Cl 11a_100016994217_100000188622 [0,1,0,1,0,0|2,0,0]=4 25720 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)Cl 240690a_100016994217_100000188622 [0,1,0,1,0,0|2,0,0]=4 25721 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)Cl 527a_100016994217_100000188622 [0,1,0,1,0,0|2,0,0]=4 25722 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)F 240690a_100016994217_100000746061 [0,1,0,1,0,0|2,0,0]=4 25723 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)F 527a_100016994217_100000746061 [0,1,0,1,0,0|2,0,0]=4 25724 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)I 240690a_100016994217_100000091984 [0,1,0,1,0,0|2,0,0]=4 25725 B16R2.84500 O=C(NC1CSC1)c2ccc(cc2O)I 527a_100016994217_100000091984 [0,1,0,1,0,0|2,0,0]=4 25726 B16R2.138103 Cc1ccc(c(c1)O)C2=CCCCCC2 271570a_200009888920_100012002257 [0,1,0,1,0,0|2,0,0]=4 25727 B16R2.138103 Oc1cc(ccc1C2=CCCCCC2)Br 271570a_200009888920_100012344904 [0,1,0,1,0,0|2,0,0]=4 25728 B16R2.138103 Oc1cc(ccc1C2=CCCCCC2)Cl 271570a_200009888920_100000050036 [0,1,0,1,0,0|2,0,0]=4 25729 B16R2.138103 Oc1cc(ccc1C2=CCCCCC2)F 271570a_200009888920_100000690578 [0,1,0,1,0,0|2,0,0]=4 25730 B16R2.138103 Oc1ccc(c(c1)O)C2=CCCCCC2 271570a_200009888920_100009813921 [0,1,0,1,0,0|2,0,0]=4 25731 B16R2.138118 Cc1cc(ccc1C(=O)CCC2CC2)Br 1458a_100000741311_100000694398 [0,1,0,1,0,0|2,0,0]=4 25732 B16R2.138118 Cc1cc(ccc1C(=O)CCC2CC2)Cl 1458a_100000688705_100000694398 [0,1,0,1,0,0|2,0,0]=4 25733 B16R2.138118 Cc1cc(ccc1C(=O)CCC2CC2)F 1458a_100000686989_100000694398 [0,1,0,1,0,0|2,0,0]=4 25734 B16R2.138118 Cc1cc(ccc1C(=O)CCC2CC2)I 1458a_100010189873_100000694398 [0,1,0,1,0,0|2,0,0]=4 25735 B16R2.138118 Cc1cc(ccc1C(=O)CCC2CC2)O 1458a_100000692822_100000694398 [0,1,0,1,0,0|2,0,0]=4 25736 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Br 11a_100000735609_100000741311 [0,1,0,1,0,0|2,0,0]=4 25737 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Br 1626a_100000735609_100000741311 [0,1,0,1,0,0|2,0,0]=4 25738 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Br 240690a_100000735609_100000741311 [0,1,0,1,0,0|2,0,0]=4 25739 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Br 527a_100000735609_100000741311 [0,1,0,1,0,0|2,0,0]=4 25740 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Cl 11a_100000735609_100000688705 [0,1,0,1,0,0|2,0,0]=4 25741 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Cl 1626a_100000735609_100000688705 [0,1,0,1,0,0|2,0,0]=4 25742 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Cl 240690a_100000735609_100000688705 [0,1,0,1,0,0|2,0,0]=4 25743 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)Cl 527a_100000735609_100000688705 [0,1,0,1,0,0|2,0,0]=4 25744 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)F 11a_100000735609_100000686989 [0,1,0,1,0,0|2,0,0]=4 25745 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)F 1626a_100000735609_100000686989 [0,1,0,1,0,0|2,0,0]=4 25746 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)F 240690a_100000735609_100000686989 [0,1,0,1,0,0|2,0,0]=4 25747 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)F 527a_100000735609_100000686989 [0,1,0,1,0,0|2,0,0]=4 25748 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)I 11a_100000735609_100010189873 [0,1,0,1,0,0|2,0,0]=4 25749 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)I 1626a_100000735609_100010189873 [0,1,0,1,0,0|2,0,0]=4 25750 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)I 240690a_100000735609_100010189873 [0,1,0,1,0,0|2,0,0]=4 25751 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)I 527a_100000735609_100010189873 [0,1,0,1,0,0|2,0,0]=4 25752 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)O 240690a_100000735609_100000692822 [0,1,0,1,0,0|2,0,0]=4 25753 B16R2.138118 Cc1cc(ccc1C(=O)NCC2CC2)O 527a_100000735609_100000692822 [0,1,0,1,0,0|2,0,0]=4 25754 B16R2.138118 Cc1ccc(c(c1)Br)C(=O)CCC2CC2 1458a_100000685072_100000694398 [0,1,0,1,0,0|2,0,0]=4 25755 B16R2.138118 Cc1ccc(c(c1)Br)C(=O)NCC2CC2 11a_100000735609_100000685072 [0,1,0,1,0,0|2,0,0]=4 25756 B16R2.138118 Cc1ccc(c(c1)Br)C(=O)NCC2CC2 1626a_100000735609_100000685072 [0,1,0,1,0,0|2,0,0]=4 25757 B16R2.138118 Cc1ccc(c(c1)Br)C(=O)NCC2CC2 240690a_100000735609_100000685072 [0,1,0,1,0,0|2,0,0]=4 25758 B16R2.138118 Cc1ccc(c(c1)Br)C(=O)NCC2CC2 527a_100000735609_100000685072 [0,1,0,1,0,0|2,0,0]=4 25759 B16R2.138118 Cc1ccc(c(c1)C)C(=O)CCC2CC2 1458a_100000211164_100000694398 [0,1,0,1,0,0|2,0,0]=4 25760 B16R2.138118 Cc1ccc(c(c1)C)C(=O)NCC2CC2 11a_100000735609_100000211164 [0,1,0,1,0,0|2,0,0]=4 25761 B16R2.138118 Cc1ccc(c(c1)C)C(=O)NCC2CC2 1626a_100000735609_100000211164 [0,1,0,1,0,0|2,0,0]=4 25762 B16R2.138118 Cc1ccc(c(c1)C)C(=O)NCC2CC2 240690a_100000735609_100000211164 [0,1,0,1,0,0|2,0,0]=4 25763 B16R2.138118 Cc1ccc(c(c1)C)C(=O)NCC2CC2 527a_100000735609_100000211164 [0,1,0,1,0,0|2,0,0]=4 25764 B16R2.138118 Cc1ccc(c(c1)Cl)C(=O)CCC2CC2 1458a_100000766932_100000694398 [0,1,0,1,0,0|2,0,0]=4 25765 B16R2.138118 Cc1ccc(c(c1)Cl)C(=O)NCC2CC2 11a_100000735609_100000766932 [0,1,0,1,0,0|2,0,0]=4 25766 B16R2.138118 Cc1ccc(c(c1)Cl)C(=O)NCC2CC2 1626a_100000735609_100000766932 [0,1,0,1,0,0|2,0,0]=4 25767 B16R2.138118 Cc1ccc(c(c1)Cl)C(=O)NCC2CC2 240690a_100000735609_100000766932 [0,1,0,1,0,0|2,0,0]=4 25768 B16R2.138118 Cc1ccc(c(c1)Cl)C(=O)NCC2CC2 527a_100000735609_100000766932 [0,1,0,1,0,0|2,0,0]=4 25769 B16R2.138118 Cc1ccc(c(c1)F)C(=O)CCC2CC2 1458a_100000766033_100000694398 [0,1,0,1,0,0|2,0,0]=4 25770 B16R2.138118 Cc1ccc(c(c1)F)C(=O)NCC2CC2 11a_100000735609_100000766033 [0,1,0,1,0,0|2,0,0]=4 25771 B16R2.138118 Cc1ccc(c(c1)F)C(=O)NCC2CC2 1626a_100000735609_100000766033 [0,1,0,1,0,0|2,0,0]=4 25772 B16R2.138118 Cc1ccc(c(c1)F)C(=O)NCC2CC2 240690a_100000735609_100000766033 [0,1,0,1,0,0|2,0,0]=4 25773 B16R2.138118 Cc1ccc(c(c1)F)C(=O)NCC2CC2 527a_100000735609_100000766033 [0,1,0,1,0,0|2,0,0]=4 25774 B16R2.138118 Cc1ccc(c(c1)I)C(=O)CCC2CC2 1458a_100009999607_100000694398 [0,1,0,1,0,0|2,0,0]=4 25775 B16R2.138118 Cc1ccc(c(c1)I)C(=O)NCC2CC2 11a_100000735609_100009999607 [0,1,0,1,0,0|2,0,0]=4 25776 B16R2.138118 Cc1ccc(c(c1)I)C(=O)NCC2CC2 1626a_100000735609_100009999607 [0,1,0,1,0,0|2,0,0]=4 25777 B16R2.138118 Cc1ccc(c(c1)I)C(=O)NCC2CC2 240690a_100000735609_100009999607 [0,1,0,1,0,0|2,0,0]=4 25778 B16R2.138118 Cc1ccc(c(c1)I)C(=O)NCC2CC2 527a_100000735609_100009999607 [0,1,0,1,0,0|2,0,0]=4 25779 B16R2.138118 Cc1ccc(c(c1)O)C(=O)CCC2CC2 1458a_100000212137_100000694398 [0,1,0,1,0,0|1,0,0]=3 25780 B16R2.138118 Cc1ccc(c(c1)O)C(=O)CCC2CO2 1458a_100000212137_100000732470 [0,1,0,1,0,0|2,0,0]=4 25781 B16R2.138118 Cc1ccc(c(c1)O)C(=O)NCC2CC2 1626a_100000735609_100000212137 [0,1,0,1,0,0|1,0,0]=3 25782 B16R2.138118 Cc1ccc(c(c1)O)C(=O)NCC2CC2 240690a_100000735609_100000212137 [0,1,0,1,0,0|1,0,0]=3 25783 B16R2.138118 Cc1ccc(c(c1)O)C(=O)NCC2CC2 527a_100000735609_100000212137 [0,1,0,1,0,0|1,0,0]=3 25784 B16R2.138118 Cc1ccc(c(c1)O)C(=O)NNC2CC2 22a_100000701032_100000212137 [0,1,0,1,0,0|2,0,0]=4 25785 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Br)Br 1458a_100000762965_100000694398 [0,1,0,1,0,0|2,0,0]=4 25786 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Br)Cl 1458a_100000766353_100000694398 [0,1,0,1,0,0|2,0,0]=4 25787 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Br)F 1458a_100000212304_100000694398 [0,1,0,1,0,0|2,0,0]=4 25788 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Br)I 1458a_100012360512_100000694398 [0,1,0,1,0,0|2,0,0]=4 25789 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Br)O 1458a_100012344906_100000694398 [0,1,0,1,0,0|2,0,0]=4 25790 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Cl)Br 1458a_100000741628_100000694398 [0,1,0,1,0,0|2,0,0]=4 25791 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Cl)Cl 1458a_100000185840_100000694398 [0,1,0,1,0,0|2,0,0]=4 25792 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Cl)F 1458a_100000211397_100000694398 [0,1,0,1,0,0|2,0,0]=4 25793 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Cl)I 1458a_100000751301_100000694398 [0,1,0,1,0,0|2,0,0]=4 25794 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2Cl)O 1458a_100000702456_100000694398 [0,1,0,1,0,0|2,0,0]=4 25795 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2F)Br 1458a_100000214689_100000694398 [0,1,0,1,0,0|2,0,0]=4 25796 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2F)Cl 1458a_100000212326_100000694398 [0,1,0,1,0,0|2,0,0]=4 25797 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2F)F 1458a_100000211022_100000694398 [0,1,0,1,0,0|2,0,0]=4 25798 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2F)I 1458a_100000037189_100000694398 [0,1,0,1,0,0|2,0,0]=4 25799 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2F)O 1458a_100000689029_100000694398 [0,1,0,1,0,0|2,0,0]=4 25800 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2I)Br 1458a_100000751167_100000694398 [0,1,0,1,0,0|2,0,0]=4 25801 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2I)Cl 1458a_100000739380_100000694398 [0,1,0,1,0,0|2,0,0]=4 25802 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2I)F 1458a_100000739341_100000694398 [0,1,0,1,0,0|2,0,0]=4 25803 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2O)Br 1458a_100000744433_100000694398 [0,1,0,1,0,0|1,0,0]=3 25804 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2O)Cl 1458a_100000188622_100000694398 [0,1,0,1,0,0|1,0,0]=3 25805 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2O)F 1458a_100000746061_100000694398 [0,1,0,1,0,0|1,0,0]=3 25806 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2O)I 1458a_100000091984_100000694398 [0,1,0,1,0,0|1,0,0]=3 25807 B16R2.138118 O=C(CCC1CC1)c2ccc(cc2O)O 1458a_100000212172_100000694398 [0,1,0,1,0,0|1,0,0]=3 25808 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)Br 1458a_100000744433_100000732470 [0,1,0,1,0,0|2,0,0]=4 25809 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)Cl 1458a_100000188622_100000732470 [0,1,0,1,0,0|2,0,0]=4 25810 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)F 1458a_100000746061_100000732470 [0,1,0,1,0,0|2,0,0]=4 25811 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)I 1458a_100000091984_100000732470 [0,1,0,1,0,0|2,0,0]=4 25812 B16R2.138118 O=C(CCC1CO1)c2ccc(cc2O)O 1458a_100000212172_100000732470 [0,1,0,1,0,0|2,0,0]=4 25813 B16R2.138118 O=C(CNC1CC1)c2ccc(cc2O)F 34a_100000212008_100009817053 [0,1,0,1,0,0|2,0,0]=4 25814 B16R2.138118 O=C(CNC1CC1)c2ccc(cc2O)O 34a_100000212008_100009814262 [0,1,0,1,0,0|2,0,0]=4 25815 B16R2.138118 O=C(CSC1CC1)c2ccc(cc2O)F 62a_100009817053_100000211595 [0,1,0,1,0,0|2,0,0]=4 25816 B16R2.138118 O=C(CSC1CC1)c2ccc(cc2O)O 62a_100009814262_100000211595 [0,1,0,1,0,0|2,0,0]=4 25817 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Br 11a_100000735609_100000762965 [0,1,0,1,0,0|2,0,0]=4 25818 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Br 1626a_100000735609_100000762965 [0,1,0,1,0,0|2,0,0]=4 25819 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Br 240690a_100000735609_100000762965 [0,1,0,1,0,0|2,0,0]=4 25820 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Br 527a_100000735609_100000762965 [0,1,0,1,0,0|2,0,0]=4 25821 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Cl 11a_100000735609_100000766353 [0,1,0,1,0,0|2,0,0]=4 25822 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Cl 1626a_100000735609_100000766353 [0,1,0,1,0,0|2,0,0]=4 25823 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Cl 240690a_100000735609_100000766353 [0,1,0,1,0,0|2,0,0]=4 25824 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)Cl 527a_100000735609_100000766353 [0,1,0,1,0,0|2,0,0]=4 25825 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)F 11a_100000735609_100000212304 [0,1,0,1,0,0|2,0,0]=4 25826 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)F 1626a_100000735609_100000212304 [0,1,0,1,0,0|2,0,0]=4 25827 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)F 240690a_100000735609_100000212304 [0,1,0,1,0,0|2,0,0]=4 25828 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)F 527a_100000735609_100000212304 [0,1,0,1,0,0|2,0,0]=4 25829 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)I 11a_100000735609_100012360512 [0,1,0,1,0,0|2,0,0]=4 25830 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)I 1626a_100000735609_100012360512 [0,1,0,1,0,0|2,0,0]=4 25831 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)I 240690a_100000735609_100012360512 [0,1,0,1,0,0|2,0,0]=4 25832 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)I 527a_100000735609_100012360512 [0,1,0,1,0,0|2,0,0]=4 25833 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)O 240690a_100000735609_100012344906 [0,1,0,1,0,0|2,0,0]=4 25834 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Br)O 527a_100000735609_100012344906 [0,1,0,1,0,0|2,0,0]=4 25835 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Br 11a_100000735609_100000741628 [0,1,0,1,0,0|2,0,0]=4 25836 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Br 1626a_100000735609_100000741628 [0,1,0,1,0,0|2,0,0]=4 25837 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Br 240690a_100000735609_100000741628 [0,1,0,1,0,0|2,0,0]=4 25838 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Br 527a_100000735609_100000741628 [0,1,0,1,0,0|2,0,0]=4 25839 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Cl 11a_100000735609_100000185840 [0,1,0,1,0,0|2,0,0]=4 25840 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Cl 1626a_100000735609_100000185840 [0,1,0,1,0,0|2,0,0]=4 25841 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Cl 240690a_100000735609_100000185840 [0,1,0,1,0,0|2,0,0]=4 25842 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)Cl 527a_100000735609_100000185840 [0,1,0,1,0,0|2,0,0]=4 25843 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)F 11a_100000735609_100000211397 [0,1,0,1,0,0|2,0,0]=4 25844 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)F 1626a_100000735609_100000211397 [0,1,0,1,0,0|2,0,0]=4 25845 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)F 240690a_100000735609_100000211397 [0,1,0,1,0,0|2,0,0]=4 25846 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)F 527a_100000735609_100000211397 [0,1,0,1,0,0|2,0,0]=4 25847 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)I 11a_100000735609_100000751301 [0,1,0,1,0,0|2,0,0]=4 25848 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)I 1626a_100000735609_100000751301 [0,1,0,1,0,0|2,0,0]=4 25849 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)I 240690a_100000735609_100000751301 [0,1,0,1,0,0|2,0,0]=4 25850 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)I 527a_100000735609_100000751301 [0,1,0,1,0,0|2,0,0]=4 25851 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)O 240690a_100000735609_100000702456 [0,1,0,1,0,0|2,0,0]=4 25852 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2Cl)O 527a_100000735609_100000702456 [0,1,0,1,0,0|2,0,0]=4 25853 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Br 11a_100000735609_100000214689 [0,1,0,1,0,0|2,0,0]=4 25854 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Br 1626a_100000735609_100000214689 [0,1,0,1,0,0|2,0,0]=4 25855 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Br 240690a_100000735609_100000214689 [0,1,0,1,0,0|2,0,0]=4 25856 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Br 527a_100000735609_100000214689 [0,1,0,1,0,0|2,0,0]=4 25857 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Cl 11a_100000735609_100000212326 [0,1,0,1,0,0|2,0,0]=4 25858 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Cl 1626a_100000735609_100000212326 [0,1,0,1,0,0|2,0,0]=4 25859 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Cl 240690a_100000735609_100000212326 [0,1,0,1,0,0|2,0,0]=4 25860 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)Cl 527a_100000735609_100000212326 [0,1,0,1,0,0|2,0,0]=4 25861 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)F 11a_100000735609_100000211022 [0,1,0,1,0,0|2,0,0]=4 25862 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)F 1626a_100000735609_100000211022 [0,1,0,1,0,0|2,0,0]=4 25863 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)F 240690a_100000735609_100000211022 [0,1,0,1,0,0|2,0,0]=4 25864 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)F 527a_100000735609_100000211022 [0,1,0,1,0,0|2,0,0]=4 25865 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)I 11a_100000735609_100000037189 [0,1,0,1,0,0|2,0,0]=4 25866 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)I 1626a_100000735609_100000037189 [0,1,0,1,0,0|2,0,0]=4 25867 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)I 240690a_100000735609_100000037189 [0,1,0,1,0,0|2,0,0]=4 25868 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)I 527a_100000735609_100000037189 [0,1,0,1,0,0|2,0,0]=4 25869 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)O 240690a_100000735609_100000689029 [0,1,0,1,0,0|2,0,0]=4 25870 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2F)O 527a_100000735609_100000689029 [0,1,0,1,0,0|2,0,0]=4 25871 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Br 11a_100000735609_100000751167 [0,1,0,1,0,0|2,0,0]=4 25872 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Br 1626a_100000735609_100000751167 [0,1,0,1,0,0|2,0,0]=4 25873 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Br 240690a_100000735609_100000751167 [0,1,0,1,0,0|2,0,0]=4 25874 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Br 527a_100000735609_100000751167 [0,1,0,1,0,0|2,0,0]=4 25875 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Cl 11a_100000735609_100000739380 [0,1,0,1,0,0|2,0,0]=4 25876 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Cl 1626a_100000735609_100000739380 [0,1,0,1,0,0|2,0,0]=4 25877 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Cl 240690a_100000735609_100000739380 [0,1,0,1,0,0|2,0,0]=4 25878 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)Cl 527a_100000735609_100000739380 [0,1,0,1,0,0|2,0,0]=4 25879 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)F 11a_100000735609_100000739341 [0,1,0,1,0,0|2,0,0]=4 25880 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)F 1626a_100000735609_100000739341 [0,1,0,1,0,0|2,0,0]=4 25881 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)F 240690a_100000735609_100000739341 [0,1,0,1,0,0|2,0,0]=4 25882 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2I)F 527a_100000735609_100000739341 [0,1,0,1,0,0|2,0,0]=4 25883 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)Br 240690a_100000735609_100000744433 [0,1,0,1,0,0|1,0,0]=3 25884 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)Br 527a_100000735609_100000744433 [0,1,0,1,0,0|1,0,0]=3 25885 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)Cl 11a_100000735609_100000188622 [0,1,0,1,0,0|1,0,0]=3 25886 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)Cl 240690a_100000735609_100000188622 [0,1,0,1,0,0|1,0,0]=3 25887 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)Cl 527a_100000735609_100000188622 [0,1,0,1,0,0|1,0,0]=3 25888 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)F 240690a_100000735609_100000746061 [0,1,0,1,0,0|1,0,0]=3 25889 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)F 527a_100000735609_100000746061 [0,1,0,1,0,0|1,0,0]=3 25890 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)I 240690a_100000735609_100000091984 [0,1,0,1,0,0|1,0,0]=3 25891 B16R2.138118 O=C(NCC1CC1)c2ccc(cc2O)I 527a_100000735609_100000091984 [0,1,0,1,0,0|1,0,0]=3 25892 B16R2.138118 O=C(NNC1CC1)c2ccc(cc2O)Br 22a_100000701032_100000744433 [0,1,0,1,0,0|2,0,0]=4 25893 B16R2.138118 O=C(NNC1CC1)c2ccc(cc2O)Cl 22a_100000701032_100000188622 [0,1,0,1,0,0|2,0,0]=4 25894 B16R2.138118 O=C(NNC1CC1)c2ccc(cc2O)F 22a_100000701032_100000746061 [0,1,0,1,0,0|2,0,0]=4 25895 B16R2.138118 O=C(NNC1CC1)c2ccc(cc2O)I 22a_100000701032_100000091984 [0,1,0,1,0,0|2,0,0]=4 25896 B16R2.138118 O=C(NNC1CC1)c2ccc(cc2O)O 22a_100000701032_100000212172 [0,1,0,1,0,0|2,0,0]=4 25897 B16R2.47 CCC1CC=C(CC1)c2ccccc2O 271570a_200010144120_100000739446 [0,1,0,1,0,0|2,0,0]=4 25898 B16R2.546 CCCc1nc(no1)c2ccccc2O 270196a_100000211048_100000211992 [0,1,0,1,0,0|1,0,1]=4 25899 B16R2.546 CCCc1noc(n1)c2ccccc2O 270196a_100011193412_100015234032 [0,1,0,1,0,0|1,0,1]=4 25900 B16R2.6335 CCCCSc1c(oc2c1cccc2)C 62a_100000210211_200010236113 [0,1,0,1,0,0|1,1,0]=4 25901 B16R2.205532 CCCCOc1noc2c1c(ccc2)F 34a_100009888067_100000210210 [0,1,0,1,0,0|1,0,0]=3 25902 B16R2.205532 COCCOc1noc2c1c(ccc2)F 34a_100009888067_100011201679 [0,1,0,1,0,0|2,0,0]=4 25903 B16R2.205532 CSCCOc1noc2c1c(ccc2)F 34a_100009888067_100000212216 [0,1,0,1,0,0|2,0,0]=4 25904 B16R2.205532 FCCCOc1noc2c1c(ccc2)F 34a_100009888067_100011934791 [0,1,0,1,0,0|2,0,0]=4 25905 B16R2.205532 OCCCOc1noc2c1c(ccc2)F 34a_100009888067_100000230001 [0,1,0,1,0,0|2,0,0]=4 25906 B16R2.5 CCCC(C)Oc1csc2c1cccc2 34a_100000077758_100000766640 [0,1,0,1,0,0|1,1,0]=4 25907 B16R2.5 CCCC(C)Oc1csc2c1cccc2 7a_100000077758_100000766640 [0,1,0,1,0,0|1,1,0]=4 25908 B16R2.5 CCCC(C)Sc1coc2c1cccc2 62a_100000766640_100009812202 [0,1,0,1,0,0|1,1,0]=4 25909 B16R2.5 CCCC(C)Sc1noc2c1cccc2 62a_100000766640_200000703156 [0,1,0,1,0,0|1,1,0]=4 25910 B16R2.5 CCCC(C)Sc1noc2c1cccc2 62a_200000703156_100000766640 [0,1,0,1,0,0|1,1,0]=4 25911 B16R2.2965 Cc1ccccc1C(=O)CC2CCCC2 1458a_100000212026_100000740388 [0,1,0,1,0,0|2,0,0]=4 25912 B16R2.2965 Cc1ccccc1C(=O)CC2CCCO2 1458a_100000212026_100000203698 [0,1,0,1,0,0|2,0,0]=4 25913 B16R2.2965 Cc1ccccc1C(=O)CC2CCOC2 1458a_100000212026_100000702531 [0,1,0,1,0,0|2,0,0]=4 25914 B16R2.2965 Cc1ccccc1C(=O)CN2CCCC2 2230a_100000188435_100000741374 [0,1,0,1,0,0|2,0,0]=4 25915 B16R2.2965 Cc1ccccc1C(=O)CN2CCCC2 269982a_100000188435_100000741374 [0,1,0,1,0,0|2,0,0]=4 25916 B16R2.2965 Cc1ccccc1C(=O)NC2CCCC2 11a_100000211070_100000212026 [0,1,0,1,0,0|2,0,0]=4 25917 B16R2.2965 Cc1ccccc1C(=O)NC2CCCC2 1626a_100000211070_100000212026 [0,1,0,1,0,0|2,0,0]=4 25918 B16R2.2965 Cc1ccccc1C(=O)NC2CCCC2 240690a_100000211070_100000212026 [0,1,0,1,0,0|2,0,0]=4 25919 B16R2.2965 Cc1ccccc1C(=O)NC2CCCC2 527a_100000211070_100000212026 [0,1,0,1,0,0|2,0,0]=4 25920 B16R2.2965 Cc1ccccc1C(=O)N[C@@H]2CCOC2 240690a_200015188469_100000212026 [0,1,0,1,0,0|2,0,0]=4 25921 B16R2.2965 Cc1ccccc1C(=O)N[C@@H]2CCOC2 527a_200015188469_100000212026 [0,1,0,1,0,0|2,0,0]=4 25922 B16R2.2965 Cc1ccccc1C(=O)N[C@H]2CCOC2 11a_100015188467_100000212026 [0,1,0,1,0,0|2,0,0]=4 25923 B16R2.2965 Cc1ccccc1C(=O)N[C@H]2CCOC2 1626a_100015188467_100000212026 [0,1,0,1,0,0|2,0,0]=4 25924 B16R2.2965 Cc1ccccc1C(=O)N[C@H]2CCOC2 240690a_100015188467_100000212026 [0,1,0,1,0,0|2,0,0]=4 25925 B16R2.2965 Cc1ccccc1C(=O)N[C@H]2CCOC2 527a_100015188467_100000212026 [0,1,0,1,0,0|2,0,0]=4 25926 B16R2.2965 O=C(CC1CCCC1)c2ccccc2Br 1458a_100000188424_100000740388 [0,1,0,1,0,0|2,0,0]=4 25927 B16R2.2965 O=C(CC1CCCC1)c2ccccc2Cl 1458a_100000185844_100000740388 [0,1,0,1,0,0|2,0,0]=4 25928 B16R2.2965 O=C(CC1CCCC1)c2ccccc2F 1458a_100000188656_100000740388 [0,1,0,1,0,0|2,0,0]=4 25929 B16R2.2965 O=C(CC1CCCC1)c2ccccc2I 1458a_100000187884_100000740388 [0,1,0,1,0,0|2,0,0]=4 25930 B16R2.2965 O=C(CC1CCCC1)c2ccccc2O 1458a_100015234032_100000740388 [0,1,0,1,0,0|1,0,0]=3 25931 B16R2.2965 O=C(CC1CCCC1)c2ccccc2[O-] 1458a_100009911694_100000740388 [0,1,0,1,0,0|1,0,1]=4 25932 B16R2.2965 O=C(CC1CCCO1)c2ccccc2Br 1458a_100000188424_100000203698 [0,1,0,1,0,0|2,0,0]=4 25933 B16R2.2965 O=C(CC1CCCO1)c2ccccc2Cl 1458a_100000185844_100000203698 [0,1,0,1,0,0|2,0,0]=4 25934 B16R2.2965 O=C(CC1CCCO1)c2ccccc2F 1458a_100000188656_100000203698 [0,1,0,1,0,0|2,0,0]=4 25935 B16R2.2965 O=C(CC1CCCO1)c2ccccc2I 1458a_100000187884_100000203698 [0,1,0,1,0,0|2,0,0]=4 25936 B16R2.2965 O=C(CC1CCCO1)c2ccccc2O 1458a_100015234032_100000203698 [0,1,0,1,0,0|1,0,0]=3 25937 B16R2.2965 O=C(CC1CCCO1)c2ccccc2[O-] 1458a_100009911694_100000203698 [0,1,0,1,0,0|1,0,1]=4 25938 B16R2.2965 O=C(CC1CCOC1)c2ccccc2Br 1458a_100000188424_100000702531 [0,1,0,1,0,0|2,0,0]=4 25939 B16R2.2965 O=C(CC1CCOC1)c2ccccc2Cl 1458a_100000185844_100000702531 [0,1,0,1,0,0|2,0,0]=4 25940 B16R2.2965 O=C(CC1CCOC1)c2ccccc2F 1458a_100000188656_100000702531 [0,1,0,1,0,0|2,0,0]=4 25941 B16R2.2965 O=C(CC1CCOC1)c2ccccc2I 1458a_100000187884_100000702531 [0,1,0,1,0,0|2,0,0]=4 25942 B16R2.2965 O=C(CC1CCOC1)c2ccccc2O 1458a_100015234032_100000702531 [0,1,0,1,0,0|1,0,0]=3 25943 B16R2.2965 O=C(CC1CCOC1)c2ccccc2[O-] 1458a_100009911694_100000702531 [0,1,0,1,0,0|1,0,1]=4 25944 B16R2.2965 O=C(CC1OCCO1)c2ccccc2O 1458a_100015234032_100000755774 [0,1,0,1,0,0|2,0,0]=4 25945 B16R2.2965 O=C(CN1CCCC1)c2ccccc2Br 269982a_100000188435_100000199116 [0,1,0,1,0,0|2,0,0]=4 25946 B16R2.2965 O=C(CN1CCCC1)c2ccccc2Cl 269982a_100000188435_100000211432 [0,1,0,1,0,0|2,0,0]=4 25947 B16R2.2965 O=C(CN1CCCC1)c2ccccc2F 269982a_100000188435_100000204681 [0,1,0,1,0,0|2,0,0]=4 25948 B16R2.2965 O=C(CN1CCCC1)c2ccccc2O 269982a_100000188435_100000188908 [0,1,0,1,0,0|1,0,0]=3 25949 B16R2.2965 O=C(CN1CCSC1)c2ccccc2O 269982a_100011215254_100000188908 [0,1,0,1,0,0|2,0,0]=4 25950 B16R2.2965 O=C(NC1CC=CC1)c2ccccc2O 240690a_100015188752_100015234032 [0,1,0,1,0,0|1,0,1]=4 25951 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Br 11a_100000211070_100000188424 [0,1,0,1,0,0|2,0,0]=4 25952 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Br 1626a_100000211070_100000188424 [0,1,0,1,0,0|2,0,0]=4 25953 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Br 240690a_100000211070_100000188424 [0,1,0,1,0,0|2,0,0]=4 25954 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Br 527a_100000211070_100000188424 [0,1,0,1,0,0|2,0,0]=4 25955 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Cl 11a_100000211070_100000185844 [0,1,0,1,0,0|2,0,0]=4 25956 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Cl 1626a_100000211070_100000185844 [0,1,0,1,0,0|2,0,0]=4 25957 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Cl 240690a_100000211070_100000185844 [0,1,0,1,0,0|2,0,0]=4 25958 B16R2.2965 O=C(NC1CCCC1)c2ccccc2Cl 527a_100000211070_100000185844 [0,1,0,1,0,0|2,0,0]=4 25959 B16R2.2965 O=C(NC1CCCC1)c2ccccc2F 11a_100000211070_100000188656 [0,1,0,1,0,0|2,0,0]=4 25960 B16R2.2965 O=C(NC1CCCC1)c2ccccc2F 1626a_100000211070_100000188656 [0,1,0,1,0,0|2,0,0]=4 25961 B16R2.2965 O=C(NC1CCCC1)c2ccccc2F 240690a_100000211070_100000188656 [0,1,0,1,0,0|2,0,0]=4 25962 B16R2.2965 O=C(NC1CCCC1)c2ccccc2F 527a_100000211070_100000188656 [0,1,0,1,0,0|2,0,0]=4 25963 B16R2.2965 O=C(NC1CCCC1)c2ccccc2I 11a_100000211070_100000187884 [0,1,0,1,0,0|2,0,0]=4 25964 B16R2.2965 O=C(NC1CCCC1)c2ccccc2I 1626a_100000211070_100000187884 [0,1,0,1,0,0|2,0,0]=4 25965 B16R2.2965 O=C(NC1CCCC1)c2ccccc2I 240690a_100000211070_100000187884 [0,1,0,1,0,0|2,0,0]=4 25966 B16R2.2965 O=C(NC1CCCC1)c2ccccc2I 527a_100000211070_100000187884 [0,1,0,1,0,0|2,0,0]=4 25967 B16R2.2965 O=C(NC1CCCC1)c2ccccc2O 240690a_100000211070_100015234032 [0,1,0,1,0,0|1,0,0]=3 25968 B16R2.2965 O=C(NC1CCCC1)c2ccccc2O 271570a_203496583355_200000155805 [0,1,0,1,0,0|1,0,0]=3 25969 B16R2.2965 O=C(NC1CCCC1)c2ccccc2[O-] 1626a_100000211070_100009911694 [0,1,0,1,0,0|1,0,1]=4 25970 B16R2.2965 O=C(NC1CCCC1)c2ccccc2[O-] 240690a_100000211070_100009911694 [0,1,0,1,0,0|1,0,1]=4 25971 B16R2.2965 O=C(NC1CCCC1)c2ccccc2[O-] 527a_100000211070_100009911694 [0,1,0,1,0,0|1,0,1]=4 25972 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2Br 240690a_200015188469_100000188424 [0,1,0,1,0,0|2,0,0]=4 25973 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2Br 527a_200015188469_100000188424 [0,1,0,1,0,0|2,0,0]=4 25974 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2Cl 240690a_200015188469_100000185844 [0,1,0,1,0,0|2,0,0]=4 25975 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2Cl 527a_200015188469_100000185844 [0,1,0,1,0,0|2,0,0]=4 25976 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2F 240690a_200015188469_100000188656 [0,1,0,1,0,0|2,0,0]=4 25977 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2F 527a_200015188469_100000188656 [0,1,0,1,0,0|2,0,0]=4 25978 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2I 240690a_200015188469_100000187884 [0,1,0,1,0,0|2,0,0]=4 25979 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2I 527a_200015188469_100000187884 [0,1,0,1,0,0|2,0,0]=4 25980 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2O 240690a_200015188469_100015234032 [0,1,0,1,0,0|1,0,0]=3 25981 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2[O-] 240690a_200015188469_100009911694 [0,1,0,1,0,0|1,0,1]=4 25982 B16R2.2965 O=C(N[C@@H]1CCOC1)c2ccccc2[O-] 527a_200015188469_100009911694 [0,1,0,1,0,0|1,0,1]=4 25983 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Br 11a_100015188467_100000188424 [0,1,0,1,0,0|2,0,0]=4 25984 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Br 1626a_100015188467_100000188424 [0,1,0,1,0,0|2,0,0]=4 25985 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Br 240690a_100015188467_100000188424 [0,1,0,1,0,0|2,0,0]=4 25986 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Br 527a_100015188467_100000188424 [0,1,0,1,0,0|2,0,0]=4 25987 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Cl 11a_100015188467_100000185844 [0,1,0,1,0,0|2,0,0]=4 25988 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Cl 1626a_100015188467_100000185844 [0,1,0,1,0,0|2,0,0]=4 25989 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Cl 240690a_100015188467_100000185844 [0,1,0,1,0,0|2,0,0]=4 25990 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2Cl 527a_100015188467_100000185844 [0,1,0,1,0,0|2,0,0]=4 25991 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2F 11a_100015188467_100000188656 [0,1,0,1,0,0|2,0,0]=4 25992 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2F 1626a_100015188467_100000188656 [0,1,0,1,0,0|2,0,0]=4 25993 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2F 240690a_100015188467_100000188656 [0,1,0,1,0,0|2,0,0]=4 25994 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2F 527a_100015188467_100000188656 [0,1,0,1,0,0|2,0,0]=4 25995 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2I 11a_100015188467_100000187884 [0,1,0,1,0,0|2,0,0]=4 25996 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2I 1626a_100015188467_100000187884 [0,1,0,1,0,0|2,0,0]=4 25997 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2I 240690a_100015188467_100000187884 [0,1,0,1,0,0|2,0,0]=4 25998 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2I 527a_100015188467_100000187884 [0,1,0,1,0,0|2,0,0]=4 25999 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2O 240690a_100015188467_100015234032 [0,1,0,1,0,0|1,0,0]=3 26000 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2[O-] 1626a_100015188467_100009911694 [0,1,0,1,0,0|1,0,1]=4 26001 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2[O-] 240690a_100015188467_100009911694 [0,1,0,1,0,0|1,0,1]=4 26002 B16R2.2965 O=C(N[C@H]1CCOC1)c2ccccc2[O-] 527a_100015188467_100009911694 [0,1,0,1,0,0|1,0,1]=4 26003 B16R2.12487 CC1CN(C1)CC(=O)c2ccccc2O 269982a_100000702820_100000188908 [0,1,0,1,0,0|2,0,0]=4 26004 B16R2.12487 CN1CC(C1)NC(=O)c2ccccc2O 240690a_100015196640_100015234032 [0,1,0,1,0,0|2,0,0]=4 26005 B16R2.12487 Cc1ccccc1C(=O)NC2CC(C2)F 11a_100016993743_100000212026 [0,1,0,1,0,0|2,0,0]=4 26006 B16R2.12487 Cc1ccccc1C(=O)NC2CC(C2)F 1626a_100016993743_100000212026 [0,1,0,1,0,0|2,0,0]=4 26007 B16R2.12487 Cc1ccccc1C(=O)NC2CC(C2)F 240690a_100016993743_100000212026 [0,1,0,1,0,0|2,0,0]=4 26008 B16R2.12487 Cc1ccccc1C(=O)NC2CC(C2)F 527a_100016993743_100000212026 [0,1,0,1,0,0|2,0,0]=4 26009 B16R2.12487 Cc1ccccc1C(=O)N[C@H]2C[C@@H](C2)O 11a_100020629032_100000212026 [0,1,0,1,0,0|2,0,0]=4 26010 B16R2.12487 Cc1ccccc1C(=O)N[C@H]2C[C@@H](C2)O 1626a_100020629032_100000212026 [0,1,0,1,0,0|2,0,0]=4 26011 B16R2.12487 Cc1ccccc1C(=O)N[C@H]2C[C@@H](C2)O 240690a_100020629032_100000212026 [0,1,0,1,0,0|2,0,0]=4 26012 B16R2.12487 Cc1ccccc1C(=O)N[C@H]2C[C@@H](C2)O 527a_100020629032_100000212026 [0,1,0,1,0,0|2,0,0]=4 26013 B16R2.12487 O=C(CN1CC(C1)F)c2ccccc2O 269982a_100000690557_100000188908 [0,1,0,1,0,0|2,0,0]=4 26014 B16R2.12487 O=C(CN1CC(C1)O)c2ccccc2O 269982a_100000749847_100000188908 [0,1,0,1,0,0|2,0,0]=4 26015 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Br 11a_100016993743_100000188424 [0,1,0,1,0,0|2,0,0]=4 26016 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Br 1626a_100016993743_100000188424 [0,1,0,1,0,0|2,0,0]=4 26017 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Br 240690a_100016993743_100000188424 [0,1,0,1,0,0|2,0,0]=4 26018 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Br 527a_100016993743_100000188424 [0,1,0,1,0,0|2,0,0]=4 26019 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Cl 11a_100016993743_100000185844 [0,1,0,1,0,0|2,0,0]=4 26020 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Cl 1626a_100016993743_100000185844 [0,1,0,1,0,0|2,0,0]=4 26021 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Cl 240690a_100016993743_100000185844 [0,1,0,1,0,0|2,0,0]=4 26022 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2Cl 527a_100016993743_100000185844 [0,1,0,1,0,0|2,0,0]=4 26023 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2F 11a_100016993743_100000188656 [0,1,0,1,0,0|2,0,0]=4 26024 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2F 1626a_100016993743_100000188656 [0,1,0,1,0,0|2,0,0]=4 26025 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2F 240690a_100016993743_100000188656 [0,1,0,1,0,0|2,0,0]=4 26026 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2F 527a_100016993743_100000188656 [0,1,0,1,0,0|2,0,0]=4 26027 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2I 11a_100016993743_100000187884 [0,1,0,1,0,0|2,0,0]=4 26028 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2I 1626a_100016993743_100000187884 [0,1,0,1,0,0|2,0,0]=4 26029 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2I 240690a_100016993743_100000187884 [0,1,0,1,0,0|2,0,0]=4 26030 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2I 527a_100016993743_100000187884 [0,1,0,1,0,0|2,0,0]=4 26031 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2O 240690a_100016993743_100015234032 [0,1,0,1,0,0|1,0,0]=3 26032 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2[O-] 1626a_100016993743_100009911694 [0,1,0,1,0,0|1,0,1]=4 26033 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2[O-] 240690a_100016993743_100009911694 [0,1,0,1,0,0|1,0,1]=4 26034 B16R2.12487 O=C(NC1CC(C1)F)c2ccccc2[O-] 527a_100016993743_100009911694 [0,1,0,1,0,0|1,0,1]=4 26035 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Br 11a_100020629032_100000188424 [0,1,0,1,0,0|2,0,0]=4 26036 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Br 1626a_100020629032_100000188424 [0,1,0,1,0,0|2,0,0]=4 26037 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Br 240690a_100020629032_100000188424 [0,1,0,1,0,0|2,0,0]=4 26038 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Br 527a_100020629032_100000188424 [0,1,0,1,0,0|2,0,0]=4 26039 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Cl 11a_100020629032_100000185844 [0,1,0,1,0,0|2,0,0]=4 26040 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Cl 1626a_100020629032_100000185844 [0,1,0,1,0,0|2,0,0]=4 26041 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Cl 240690a_100020629032_100000185844 [0,1,0,1,0,0|2,0,0]=4 26042 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2Cl 527a_100020629032_100000185844 [0,1,0,1,0,0|2,0,0]=4 26043 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2F 11a_100020629032_100000188656 [0,1,0,1,0,0|2,0,0]=4 26044 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2F 1626a_100020629032_100000188656 [0,1,0,1,0,0|2,0,0]=4 26045 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2F 240690a_100020629032_100000188656 [0,1,0,1,0,0|2,0,0]=4 26046 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2F 527a_100020629032_100000188656 [0,1,0,1,0,0|2,0,0]=4 26047 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2I 11a_100020629032_100000187884 [0,1,0,1,0,0|2,0,0]=4 26048 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2I 1626a_100020629032_100000187884 [0,1,0,1,0,0|2,0,0]=4 26049 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2I 240690a_100020629032_100000187884 [0,1,0,1,0,0|2,0,0]=4 26050 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2I 527a_100020629032_100000187884 [0,1,0,1,0,0|2,0,0]=4 26051 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2O 240690a_100020629032_100015234032 [0,1,0,1,0,0|1,0,0]=3 26052 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2[O-] 1626a_100020629032_100009911694 [0,1,0,1,0,0|1,0,1]=4 26053 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2[O-] 240690a_100020629032_100009911694 [0,1,0,1,0,0|1,0,1]=4 26054 B16R2.12487 O=C(N[C@H]1C[C@@H](C1)O)c2ccccc2[O-] 527a_100020629032_100009911694 [0,1,0,1,0,0|1,0,1]=4 26055 B16R2.12487 O=C1CC(C1)CC(=O)c2ccccc2O 1458a_100015234032_100009874392 [0,1,0,1,0,0|1,0,1]=4 26056 B16R2.14671 CC(NC(=O)c1ccccc1Br)C2CC2 11a_100000700016_100000188424 [0,1,0,1,0,0|2,0,0]=4 26057 B16R2.14671 CC(NC(=O)c1ccccc1Br)C2CC2 1626a_100000700016_100000188424 [0,1,0,1,0,0|2,0,0]=4 26058 B16R2.14671 CC(NC(=O)c1ccccc1Br)C2CC2 240690a_100000700016_100000188424 [0,1,0,1,0,0|2,0,0]=4 26059 B16R2.14671 CC(NC(=O)c1ccccc1Br)C2CC2 527a_100000700016_100000188424 [0,1,0,1,0,0|2,0,0]=4 26060 B16R2.14671 CC(NC(=O)c1ccccc1Cl)C2CC2 11a_100000700016_100000185844 [0,1,0,1,0,0|2,0,0]=4 26061 B16R2.14671 CC(NC(=O)c1ccccc1Cl)C2CC2 1626a_100000700016_100000185844 [0,1,0,1,0,0|2,0,0]=4 26062 B16R2.14671 CC(NC(=O)c1ccccc1Cl)C2CC2 240690a_100000700016_100000185844 [0,1,0,1,0,0|2,0,0]=4 26063 B16R2.14671 CC(NC(=O)c1ccccc1Cl)C2CC2 527a_100000700016_100000185844 [0,1,0,1,0,0|2,0,0]=4 26064 B16R2.14671 CC(NC(=O)c1ccccc1F)C2CC2 11a_100000700016_100000188656 [0,1,0,1,0,0|2,0,0]=4 26065 B16R2.14671 CC(NC(=O)c1ccccc1F)C2CC2 1626a_100000700016_100000188656 [0,1,0,1,0,0|2,0,0]=4 26066 B16R2.14671 CC(NC(=O)c1ccccc1F)C2CC2 240690a_100000700016_100000188656 [0,1,0,1,0,0|2,0,0]=4 26067 B16R2.14671 CC(NC(=O)c1ccccc1F)C2CC2 527a_100000700016_100000188656 [0,1,0,1,0,0|2,0,0]=4 26068 B16R2.14671 CC(NC(=O)c1ccccc1I)C2CC2 11a_100000700016_100000187884 [0,1,0,1,0,0|2,0,0]=4 26069 B16R2.14671 CC(NC(=O)c1ccccc1I)C2CC2 1626a_100000700016_100000187884 [0,1,0,1,0,0|2,0,0]=4 26070 B16R2.14671 CC(NC(=O)c1ccccc1I)C2CC2 240690a_100000700016_100000187884 [0,1,0,1,0,0|2,0,0]=4 26071 B16R2.14671 CC(NC(=O)c1ccccc1I)C2CC2 527a_100000700016_100000187884 [0,1,0,1,0,0|2,0,0]=4 26072 B16R2.14671 CC(NC(=O)c1ccccc1O)C2CC2 240690a_100000700016_100015234032 [0,1,0,1,0,0|1,0,0]=3 26073 B16R2.14671 CC(NC(=O)c1ccccc1[O-])C2CC2 1626a_100000700016_100009911694 [0,1,0,1,0,0|1,0,1]=4 26074 B16R2.14671 CC(NC(=O)c1ccccc1[O-])C2CC2 240690a_100000700016_100009911694 [0,1,0,1,0,0|1,0,1]=4 26075 B16R2.14671 CC(NC(=O)c1ccccc1[O-])C2CC2 527a_100000700016_100009911694 [0,1,0,1,0,0|1,0,1]=4 26076 B16R2.14671 CN(CC(=O)c1ccccc1O)C2CC2 269982a_100000226674_100000188908 [0,1,0,1,0,0|2,0,0]=4 26077 B16R2.14671 Cc1ccccc1C(=O)NC(C)C2CC2 11a_100000700016_100000212026 [0,1,0,1,0,0|2,0,0]=4 26078 B16R2.14671 Cc1ccccc1C(=O)NC(C)C2CC2 1626a_100000700016_100000212026 [0,1,0,1,0,0|2,0,0]=4 26079 B16R2.14671 Cc1ccccc1C(=O)NC(C)C2CC2 240690a_100000700016_100000212026 [0,1,0,1,0,0|2,0,0]=4 26080 B16R2.14671 Cc1ccccc1C(=O)NC(C)C2CC2 527a_100000700016_100000212026 [0,1,0,1,0,0|2,0,0]=4 26081 B16R2.14671 O=C(CC(=O)C1CC1)c2ccccc2O 1458a_100000210395_100000188908 [0,1,0,1,0,0|1,0,1]=4 26082 B16R2.14671 O=C(CC(=O)C1CC1)c2ccccc2O 1458a_100015234032_100000746382 [0,1,0,1,0,0|1,0,1]=4 26083 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Br 11a_200011216479_100000188424 [0,1,0,1,0,0|2,0,0]=4 26084 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Br 1626a_200011216479_100000188424 [0,1,0,1,0,0|2,0,0]=4 26085 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Br 240690a_200011216479_100000188424 [0,1,0,1,0,0|2,0,0]=4 26086 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Br 527a_200011216479_100000188424 [0,1,0,1,0,0|2,0,0]=4 26087 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Cl 11a_200011216479_100000185844 [0,1,0,1,0,0|2,0,0]=4 26088 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Cl 1626a_200011216479_100000185844 [0,1,0,1,0,0|2,0,0]=4 26089 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Cl 240690a_200011216479_100000185844 [0,1,0,1,0,0|2,0,0]=4 26090 B16R2.22598 CC1SCCN1C(=O)c2ccccc2Cl 527a_200011216479_100000185844 [0,1,0,1,0,0|2,0,0]=4 26091 B16R2.22598 CC1SCCN1C(=O)c2ccccc2F 11a_200011216479_100000188656 [0,1,0,1,0,0|2,0,0]=4 26092 B16R2.22598 CC1SCCN1C(=O)c2ccccc2F 1626a_200011216479_100000188656 [0,1,0,1,0,0|2,0,0]=4 26093 B16R2.22598 CC1SCCN1C(=O)c2ccccc2F 240690a_200011216479_100000188656 [0,1,0,1,0,0|2,0,0]=4 26094 B16R2.22598 CC1SCCN1C(=O)c2ccccc2F 527a_200011216479_100000188656 [0,1,0,1,0,0|2,0,0]=4 26095 B16R2.22598 CC1SCCN1C(=O)c2ccccc2I 11a_200011216479_100000187884 [0,1,0,1,0,0|2,0,0]=4 26096 B16R2.22598 CC1SCCN1C(=O)c2ccccc2I 1626a_200011216479_100000187884 [0,1,0,1,0,0|2,0,0]=4 26097 B16R2.22598 CC1SCCN1C(=O)c2ccccc2I 240690a_200011216479_100000187884 [0,1,0,1,0,0|2,0,0]=4 26098 B16R2.22598 CC1SCCN1C(=O)c2ccccc2I 527a_200011216479_100000187884 [0,1,0,1,0,0|2,0,0]=4 26099 B16R2.22598 CC1SCCN1C(=O)c2ccccc2O 240690a_200011216479_100015234032 [0,1,0,1,0,0|1,0,0]=3 26100 B16R2.22598 CC1SCCN1C(=O)c2ccccc2[O-] 1626a_200011216479_100009911694 [0,1,0,1,0,0|1,0,1]=4 26101 B16R2.22598 CC1SCCN1C(=O)c2ccccc2[O-] 240690a_200011216479_100009911694 [0,1,0,1,0,0|1,0,1]=4 26102 B16R2.22598 CC1SCCN1C(=O)c2ccccc2[O-] 527a_200011216479_100009911694 [0,1,0,1,0,0|1,0,1]=4 26103 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2Br 11a_100015189458_100000188424 [0,1,0,1,0,0|2,0,0]=4 26104 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2Br 240690a_100015189458_100000188424 [0,1,0,1,0,0|2,0,0]=4 26105 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2Br 527a_100015189458_100000188424 [0,1,0,1,0,0|2,0,0]=4 26106 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2Cl 11a_100015189458_100000185844 [0,1,0,1,0,0|2,0,0]=4 26107 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2Cl 240690a_100015189458_100000185844 [0,1,0,1,0,0|2,0,0]=4 26108 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2Cl 527a_100015189458_100000185844 [0,1,0,1,0,0|2,0,0]=4 26109 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2F 11a_100015189458_100000188656 [0,1,0,1,0,0|2,0,0]=4 26110 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2F 240690a_100015189458_100000188656 [0,1,0,1,0,0|2,0,0]=4 26111 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2F 527a_100015189458_100000188656 [0,1,0,1,0,0|2,0,0]=4 26112 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2I 11a_100015189458_100000187884 [0,1,0,1,0,0|2,0,0]=4 26113 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2I 240690a_100015189458_100000187884 [0,1,0,1,0,0|2,0,0]=4 26114 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2I 527a_100015189458_100000187884 [0,1,0,1,0,0|2,0,0]=4 26115 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2O 240690a_100015189458_100015234032 [0,1,0,1,0,0|1,0,0]=3 26116 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2[O-] 240690a_100015189458_100009911694 [0,1,0,1,0,0|1,0,1]=4 26117 B16R2.22598 C[C@@H]1CCCN1C(=O)c2ccccc2[O-] 527a_100015189458_100009911694 [0,1,0,1,0,0|1,0,1]=4 26118 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2Br 240690a_100020605311_100000188424 [0,1,0,1,0,0|2,0,0]=4 26119 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2Br 527a_100020605311_100000188424 [0,1,0,1,0,0|2,0,0]=4 26120 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2Cl 240690a_100020605311_100000185844 [0,1,0,1,0,0|2,0,0]=4 26121 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2Cl 527a_100020605311_100000185844 [0,1,0,1,0,0|2,0,0]=4 26122 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2F 240690a_100020605311_100000188656 [0,1,0,1,0,0|2,0,0]=4 26123 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2F 527a_100020605311_100000188656 [0,1,0,1,0,0|2,0,0]=4 26124 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2I 240690a_100020605311_100000187884 [0,1,0,1,0,0|2,0,0]=4 26125 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2I 527a_100020605311_100000187884 [0,1,0,1,0,0|2,0,0]=4 26126 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2O 240690a_100020605311_100015234032 [0,1,0,1,0,0|1,0,0]=3 26127 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2[O-] 240690a_100020605311_100009911694 [0,1,0,1,0,0|1,0,1]=4 26128 B16R2.22598 C[C@H]1CCCN1C(=O)c2ccccc2[O-] 527a_100020605311_100009911694 [0,1,0,1,0,0|1,0,1]=4 26129 B16R2.22598 Cc1ccccc1C(=O)N2CCC[C@@H]2C 240690a_100020605311_100000212026 [0,1,0,1,0,0|2,0,0]=4 26130 B16R2.22598 Cc1ccccc1C(=O)N2CCC[C@@H]2C 527a_100020605311_100000212026 [0,1,0,1,0,0|2,0,0]=4 26131 B16R2.22598 Cc1ccccc1C(=O)N2CCC[C@H]2C 11a_100015189458_100000212026 [0,1,0,1,0,0|2,0,0]=4 26132 B16R2.22598 Cc1ccccc1C(=O)N2CCC[C@H]2C 240690a_100015189458_100000212026 [0,1,0,1,0,0|2,0,0]=4 26133 B16R2.22598 Cc1ccccc1C(=O)N2CCC[C@H]2C 527a_100015189458_100000212026 [0,1,0,1,0,0|2,0,0]=4 26134 B16R2.22598 Cc1ccccc1C(=O)N2CCSC2C 11a_200011216479_100000212026 [0,1,0,1,0,0|2,0,0]=4 26135 B16R2.22598 Cc1ccccc1C(=O)N2CCSC2C 1626a_200011216479_100000212026 [0,1,0,1,0,0|2,0,0]=4 26136 B16R2.22598 Cc1ccccc1C(=O)N2CCSC2C 240690a_200011216479_100000212026 [0,1,0,1,0,0|2,0,0]=4 26137 B16R2.22598 Cc1ccccc1C(=O)N2CCSC2C 527a_200011216479_100000212026 [0,1,0,1,0,0|2,0,0]=4 26138 B16R2.22598 O=C1CCCC1C(=O)c2ccccc2O 1458a_100015234032_100000211823 [0,1,0,1,0,0|1,0,1]=4 26139 B16R2.84056 CC1(CCC1)CC(=O)c2ccccc2Br 1458a_100000188424_100000726658 [0,1,0,1,0,0|2,0,0]=4 26140 B16R2.84056 CC1(CCC1)CC(=O)c2ccccc2Cl 1458a_100000185844_100000726658 [0,1,0,1,0,0|2,0,0]=4 26141 B16R2.84056 CC1(CCC1)CC(=O)c2ccccc2F 1458a_100000188656_100000726658 [0,1,0,1,0,0|2,0,0]=4 26142 B16R2.84056 CC1(CCC1)CC(=O)c2ccccc2I 1458a_100000187884_100000726658 [0,1,0,1,0,0|2,0,0]=4 26143 B16R2.84056 CC1(CCC1)CC(=O)c2ccccc2O 1458a_100015234032_100000726658 [0,1,0,1,0,0|1,0,0]=3 26144 B16R2.84056 CC1(CCC1)CC(=O)c2ccccc2[O-] 1458a_100009911694_100000726658 [0,1,0,1,0,0|1,0,1]=4 26145 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Br 11a_100000692455_100000188424 [0,1,0,1,0,0|2,0,0]=4 26146 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Br 1626a_100000692455_100000188424 [0,1,0,1,0,0|2,0,0]=4 26147 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Br 240690a_100000692455_100000188424 [0,1,0,1,0,0|2,0,0]=4 26148 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Br 527a_100000692455_100000188424 [0,1,0,1,0,0|2,0,0]=4 26149 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Cl 11a_100000692455_100000185844 [0,1,0,1,0,0|2,0,0]=4 26150 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Cl 1626a_100000692455_100000185844 [0,1,0,1,0,0|2,0,0]=4 26151 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Cl 240690a_100000692455_100000185844 [0,1,0,1,0,0|2,0,0]=4 26152 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2Cl 527a_100000692455_100000185844 [0,1,0,1,0,0|2,0,0]=4 26153 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2F 11a_100000692455_100000188656 [0,1,0,1,0,0|2,0,0]=4 26154 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2F 1626a_100000692455_100000188656 [0,1,0,1,0,0|2,0,0]=4 26155 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2F 240690a_100000692455_100000188656 [0,1,0,1,0,0|2,0,0]=4 26156 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2F 527a_100000692455_100000188656 [0,1,0,1,0,0|2,0,0]=4 26157 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2I 11a_100000692455_100000187884 [0,1,0,1,0,0|2,0,0]=4 26158 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2I 1626a_100000692455_100000187884 [0,1,0,1,0,0|2,0,0]=4 26159 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2I 240690a_100000692455_100000187884 [0,1,0,1,0,0|2,0,0]=4 26160 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2I 527a_100000692455_100000187884 [0,1,0,1,0,0|2,0,0]=4 26161 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2O 240690a_100000692455_100015234032 [0,1,0,1,0,0|1,0,0]=3 26162 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2[O-] 1626a_100000692455_100009911694 [0,1,0,1,0,0|1,0,1]=4 26163 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2[O-] 240690a_100000692455_100009911694 [0,1,0,1,0,0|1,0,1]=4 26164 B16R2.84056 CC1(CCC1)NC(=O)c2ccccc2[O-] 527a_100000692455_100009911694 [0,1,0,1,0,0|1,0,1]=4 26165 B16R2.84056 CC1(COC1)CC(=O)c2ccccc2O 1458a_100015234032_100000066812 [0,1,0,1,0,0|2,0,0]=4 26166 B16R2.84056 Cc1ccccc1C(=O)CC2(CCC2)C 1458a_100000212026_100000726658 [0,1,0,1,0,0|2,0,0]=4 26167 B16R2.84056 Cc1ccccc1C(=O)NC2(CCC2)C 11a_100000692455_100000212026 [0,1,0,1,0,0|2,0,0]=4 26168 B16R2.84056 Cc1ccccc1C(=O)NC2(CCC2)C 1626a_100000692455_100000212026 [0,1,0,1,0,0|2,0,0]=4 26169 B16R2.84056 Cc1ccccc1C(=O)NC2(CCC2)C 240690a_100000692455_100000212026 [0,1,0,1,0,0|2,0,0]=4 26170 B16R2.84056 Cc1ccccc1C(=O)NC2(CCC2)C 527a_100000692455_100000212026 [0,1,0,1,0,0|2,0,0]=4 26171 B16R2.6 BrCCCOCc1noc2c1cccc2 34a_100011217188_100009813815 [0,1,0,1,0,0|2,0,0]=4 26172 B16R2.6 CCCCC=Cc1coc2c1cccc2 271570a_100016275911_100009812202 [0,1,0,1,0,0|2,0,0]=4 26173 B16R2.6 CCCCCOc1csc2c1cccc2 34a_100000077758_100000718602 [0,1,0,1,0,0|1,1,0]=4 26174 B16R2.6 CCCCCOc1csc2c1cccc2 7a_100000077758_100000210326 [0,1,0,1,0,0|1,1,0]=4 26175 B16R2.6 CCCCCSc1coc2c1cccc2 62a_100000210326_100009812202 [0,1,0,1,0,0|1,1,0]=4 26176 B16R2.6 CCCCCSc1noc2c1cccc2 62a_100000210326_200000703156 [0,1,0,1,0,0|1,1,0]=4 26177 B16R2.6 CCCCCSc1noc2c1cccc2 62a_200000703156_100000210326 [0,1,0,1,0,0|1,1,0]=4 26178 B16R2.6 CCCCNCc1coc2c1cccc2 207a_100000102301_100000688544 [0,1,0,1,0,0|2,0,0]=4 26179 B16R2.6 CCCCNCc1coc2c1cccc2 270004a_100000102301_100000688544 [0,1,0,1,0,0|2,0,0]=4 26180 B16R2.6 CCCCNCc1noc2c1cccc2 7a_106832991798_100009813815 [0,1,0,1,0,0|2,0,0]=4 26181 B16R2.6 CCCCNN=C1COc2c1cccc2 4a_100025702795_100000185568 [0,1,0,1,0,0|2,0,0]=4 26182 B16R2.6 CCCCOCc1csc2c1cccc2 34a_100000210227_200000742921 [0,1,0,1,0,0|1,1,0]=4 26183 B16R2.6 CCCCOCc1csc2c1cccc2 34a_100011219454_100000210210 [0,1,0,1,0,0|1,1,0]=4 26184 B16R2.6 CCCCOCc1noc2c1cccc2 34a_100000210227_100009813815 [0,1,0,1,0,0|1,0,0]=3 26185 B16R2.6 CCCCOCc1noc2c1cccc2 7a_100000210227_100009813815 [0,1,0,1,0,0|1,0,0]=3 26186 B16R2.6 CCCCSCc1noc2c1cccc2 62a_100000210211_100009813815 [0,1,0,1,0,0|1,1,0]=4 26187 B16R2.6 CCCCSCc1noc2c1cccc2 62a_100009813815_100000210210 [0,1,0,1,0,0|1,1,0]=4 26188 B16R2.6 CCCNCCc1coc2c1cccc2 2230a_100011934666_100000210303 [0,1,0,1,0,0|2,0,0]=4 26189 B16R2.6 CCCNCCc1coc2c1cccc2 34a_100011934666_100000210303 [0,1,0,1,0,0|2,0,0]=4 26190 B16R2.6 CCOCCOc1csc2c1cccc2 34a_100000077758_100000210147 [0,1,0,1,0,0|1,1,0]=4 26191 B16R2.6 CCOCCOc1csc2c1cccc2 7a_100000077758_100011215890 [0,1,0,1,0,0|1,1,0]=4 26192 B16R2.6 CCOCCSc1coc2c1cccc2 62a_100000210147_100009812202 [0,1,0,1,0,0|1,1,0]=4 26193 B16R2.6 CCOCCSc1noc2c1cccc2 62a_100000210147_200000703156 [0,1,0,1,0,0|1,1,0]=4 26194 B16R2.6 CCOCCSc1noc2c1cccc2 62a_200000703156_100011215890 [0,1,0,1,0,0|1,1,0]=4 26195 B16R2.6 CCSCCOc1csc2c1cccc2 34a_100000077758_100000757381 [0,1,0,1,0,0|1,1,0]=4 26196 B16R2.6 CCSCCOc1csc2c1cccc2 7a_100000077758_100000757381 [0,1,0,1,0,0|1,1,0]=4 26197 B16R2.6 CCSCCSc1coc2c1cccc2 62a_100000757381_100009812202 [0,1,0,1,0,0|1,1,0]=4 26198 B16R2.6 CCSCCSc1noc2c1cccc2 62a_100000757381_200000703156 [0,1,0,1,0,0|1,1,0]=4 26199 B16R2.6 CCSCCSc1noc2c1cccc2 62a_200000703156_100000757381 [0,1,0,1,0,0|1,1,0]=4 26200 B16R2.6 COCCCOc1csc2c1cccc2 34a_100000077758_100000740836 [0,1,0,1,0,0|1,1,0]=4 26201 B16R2.6 COCCCOc1csc2c1cccc2 7a_100000077758_100000740836 [0,1,0,1,0,0|1,1,0]=4 26202 B16R2.6 COCCCSc1coc2c1cccc2 62a_100000709357_100009812202 [0,1,0,1,0,0|1,1,0]=4 26203 B16R2.6 COCCCSc1noc2c1cccc2 62a_100000709357_200000703156 [0,1,0,1,0,0|1,1,0]=4 26204 B16R2.6 COCCCSc1noc2c1cccc2 62a_200000703156_100000709357 [0,1,0,1,0,0|1,1,0]=4 26205 B16R2.6 COCCOCc1noc2c1cccc2 34a_100000210237_100009813815 [0,1,0,1,0,0|2,0,0]=4 26206 B16R2.6 CSCCOCc1noc2c1cccc2 34a_100000230434_100009813815 [0,1,0,1,0,0|2,0,0]=4 26207 B16R2.6 CSCCOCc1noc2c1cccc2 7a_100000230434_100009813815 [0,1,0,1,0,0|2,0,0]=4 26208 B16R2.6 ClCCCOCc1noc2c1cccc2 34a_100000230001_100009813815 [0,1,0,1,0,0|2,0,0]=4 26209 B16R2.6 FCCCCOc1csc2c1cccc2 34a_100000077758_100000729493 [0,1,0,1,0,0|1,1,0]=4 26210 B16R2.6 FCCCCOc1csc2c1cccc2 7a_100000077758_100000729493 [0,1,0,1,0,0|1,1,0]=4 26211 B16R2.6 FCCCCSc1coc2c1cccc2 62a_100000729493_100009812202 [0,1,0,1,0,0|1,1,0]=4 26212 B16R2.6 FCCCCSc1noc2c1cccc2 62a_100000729493_200000703156 [0,1,0,1,0,0|1,1,0]=4 26213 B16R2.6 FCCCCSc1noc2c1cccc2 62a_200000703156_100000729493 [0,1,0,1,0,0|1,1,0]=4 26214 B16R2.6 FCCCOCc1noc2c1cccc2 34a_100000759539_100009813815 [0,1,0,1,0,0|2,0,0]=4 26215 B16R2.6 NCCCOCc1noc2c1cccc2 34a_100000182051_100009813815 [0,1,0,1,0,0|2,0,0]=4 26216 B16R2.6 OCCCCOc1csc2c1cccc2 34a_100000077758_100011216708 [0,1,0,1,0,0|1,1,0]=4 26217 B16R2.6 OCCCCOc1csc2c1cccc2 7a_100000077758_100000210776 [0,1,0,1,0,0|1,1,0]=4 26218 B16R2.6 OCCCCSc1coc2c1cccc2 62a_100000210776_100009812202 [0,1,0,1,0,0|1,1,0]=4 26219 B16R2.6 OCCCCSc1noc2c1cccc2 62a_100000210776_200000703156 [0,1,0,1,0,0|1,1,0]=4 26220 B16R2.6 OCCCCSc1noc2c1cccc2 62a_200000703156_100000210776 [0,1,0,1,0,0|1,1,0]=4 26221 B16R2.1054 CCCCc1cc(=O)c2ccccc2[nH]1 271570a_100020621405_100000090176 [0,1,0,1,0,0|2,0,0]=4 26222 B16R2.2272 CCCCSC1Cc2ccccc2C1=O 62a_100000210211_100011218503 [0,1,0,1,0,0|1,1,0]=4 26223 B16R2.2272 CCCCSC1Cc2ccccc2C1=O 62a_100011218503_100000210210 [0,1,0,1,0,0|1,1,0]=4 26224 B16R2.2272 CCCNCc1oc2ccccc2c1C 207a_100020643023_100000077534 [0,1,0,1,0,0|2,0,0]=4 26225 B16R2.2272 CCCNCc1oc2ccccc2c1C 2230a_100153394726_100000210303 [0,1,0,1,0,0|2,0,0]=4 26226 B16R2.2272 CCCNCc1oc2ccccc2c1C 270004a_100020643023_100000077534 [0,1,0,1,0,0|2,0,0]=4 26227 B16R2.2272 CCCNCc1oc2ccccc2c1C 34a_100153394726_100000210303 [0,1,0,1,0,0|2,0,0]=4 26228 B16R2.3896 Cc1ccccc1C(=O)C2CCCCC2 1458a_100000212026_100000210327 [0,1,0,1,0,0|2,0,0]=4 26229 B16R2.3896 Cc1ccccc1C(=O)C2CCCOC2 1458a_100000212026_100000693364 [0,1,0,1,0,0|2,0,0]=4 26230 B16R2.3896 Cc1ccccc1C(=O)C2CCOCC2 1458a_100000212026_100011324220 [0,1,0,1,0,0|2,0,0]=4 26231 B16R2.3896 Cc1ccccc1C(=O)N2CCCOC2 11a_100000131196_100000212026 [0,1,0,1,0,0|2,0,0]=4 26232 B16R2.3896 Cc1ccccc1C(=O)N2CCCOC2 240690a_100000131196_100000212026 [0,1,0,1,0,0|2,0,0]=4 26233 B16R2.3896 Cc1ccccc1C(=O)N2CCOCC2 11a_100015191051_100000212026 [0,1,0,1,0,0|2,0,0]=4 26234 B16R2.3896 Cc1ccccc1C(=O)N2CCOCC2 1626a_100015191051_100000212026 [0,1,0,1,0,0|2,0,0]=4 26235 B16R2.3896 Cc1ccccc1C(=O)N2CCOCC2 240690a_100015191051_100000212026 [0,1,0,1,0,0|2,0,0]=4 26236 B16R2.3896 Cc1ccccc1C(=O)N2CCOCC2 527a_100015191051_100000212026 [0,1,0,1,0,0|2,0,0]=4 26237 B16R2.3896 Cc1ccccc1C(=O)N2CCSCC2 11a_100000737611_100000212026 [0,1,0,1,0,0|2,0,0]=4 26238 B16R2.3896 Cc1ccccc1C(=O)N2CCSCC2 240690a_100000737611_100000212026 [0,1,0,1,0,0|2,0,0]=4 26239 B16R2.3896 Cc1ccccc1C(=O)N2CCSCC2 527a_100000737611_100000212026 [0,1,0,1,0,0|2,0,0]=4 26240 B16R2.3896 O=C(c1ccccc1Br)C2CCCCC2 1458a_100000188424_100000210327 [0,1,0,1,0,0|2,0,0]=4 26241 B16R2.3896 O=C(c1ccccc1Br)C2CCCOC2 1458a_100000188424_100000693364 [0,1,0,1,0,0|2,0,0]=4 26242 B16R2.3896 O=C(c1ccccc1Br)C2CCOCC2 1458a_100000188424_100011324220 [0,1,0,1,0,0|2,0,0]=4 26243 B16R2.3896 O=C(c1ccccc1Br)N2CCCOC2 11a_100000131196_100000188424 [0,1,0,1,0,0|2,0,0]=4 26244 B16R2.3896 O=C(c1ccccc1Br)N2CCCOC2 240690a_100000131196_100000188424 [0,1,0,1,0,0|2,0,0]=4 26245 B16R2.3896 O=C(c1ccccc1Br)N2CCOCC2 11a_100015191051_100000188424 [0,1,0,1,0,0|2,0,0]=4 26246 B16R2.3896 O=C(c1ccccc1Br)N2CCOCC2 1626a_100015191051_100000188424 [0,1,0,1,0,0|2,0,0]=4 26247 B16R2.3896 O=C(c1ccccc1Br)N2CCOCC2 240690a_100015191051_100000188424 [0,1,0,1,0,0|2,0,0]=4 26248 B16R2.3896 O=C(c1ccccc1Br)N2CCOCC2 527a_100015191051_100000188424 [0,1,0,1,0,0|2,0,0]=4 26249 B16R2.3896 O=C(c1ccccc1Br)N2CCSCC2 11a_100000737611_100000188424 [0,1,0,1,0,0|2,0,0]=4 26250 B16R2.3896 O=C(c1ccccc1Br)N2CCSCC2 240690a_100000737611_100000188424 [0,1,0,1,0,0|2,0,0]=4 26251 B16R2.3896 O=C(c1ccccc1Br)N2CCSCC2 527a_100000737611_100000188424 [0,1,0,1,0,0|2,0,0]=4 26252 B16R2.3896 O=C(c1ccccc1Cl)C2CCCCC2 1458a_100000185844_100000210327 [0,1,0,1,0,0|2,0,0]=4 26253 B16R2.3896 O=C(c1ccccc1Cl)C2CCCOC2 1458a_100000185844_100000693364 [0,1,0,1,0,0|2,0,0]=4 26254 B16R2.3896 O=C(c1ccccc1Cl)C2CCOCC2 1458a_100000185844_100011324220 [0,1,0,1,0,0|2,0,0]=4 26255 B16R2.3896 O=C(c1ccccc1Cl)N2CCCOC2 11a_100000131196_100000185844 [0,1,0,1,0,0|2,0,0]=4 26256 B16R2.3896 O=C(c1ccccc1Cl)N2CCCOC2 240690a_100000131196_100000185844 [0,1,0,1,0,0|2,0,0]=4 26257 B16R2.3896 O=C(c1ccccc1Cl)N2CCOCC2 11a_100015191051_100000185844 [0,1,0,1,0,0|2,0,0]=4 26258 B16R2.3896 O=C(c1ccccc1Cl)N2CCOCC2 1626a_100015191051_100000185844 [0,1,0,1,0,0|2,0,0]=4 26259 B16R2.3896 O=C(c1ccccc1Cl)N2CCOCC2 240690a_100015191051_100000185844 [0,1,0,1,0,0|2,0,0]=4 26260 B16R2.3896 O=C(c1ccccc1Cl)N2CCOCC2 527a_100015191051_100000185844 [0,1,0,1,0,0|2,0,0]=4 26261 B16R2.3896 O=C(c1ccccc1Cl)N2CCSCC2 11a_100000737611_100000185844 [0,1,0,1,0,0|2,0,0]=4 26262 B16R2.3896 O=C(c1ccccc1Cl)N2CCSCC2 240690a_100000737611_100000185844 [0,1,0,1,0,0|2,0,0]=4 26263 B16R2.3896 O=C(c1ccccc1Cl)N2CCSCC2 527a_100000737611_100000185844 [0,1,0,1,0,0|2,0,0]=4 26264 B16R2.3896 O=C(c1ccccc1F)C2CCCCC2 1458a_100000188656_100000210327 [0,1,0,1,0,0|2,0,0]=4 26265 B16R2.3896 O=C(c1ccccc1F)C2CCCOC2 1458a_100000188656_100000693364 [0,1,0,1,0,0|2,0,0]=4 26266 B16R2.3896 O=C(c1ccccc1F)C2CCOCC2 1458a_100000188656_100011324220 [0,1,0,1,0,0|2,0,0]=4 26267 B16R2.3896 O=C(c1ccccc1F)N2CCCOC2 11a_100000131196_100000188656 [0,1,0,1,0,0|2,0,0]=4 26268 B16R2.3896 O=C(c1ccccc1F)N2CCCOC2 240690a_100000131196_100000188656 [0,1,0,1,0,0|2,0,0]=4 26269 B16R2.3896 O=C(c1ccccc1F)N2CCOCC2 11a_100015191051_100000188656 [0,1,0,1,0,0|2,0,0]=4 26270 B16R2.3896 O=C(c1ccccc1F)N2CCOCC2 1626a_100015191051_100000188656 [0,1,0,1,0,0|2,0,0]=4 26271 B16R2.3896 O=C(c1ccccc1F)N2CCOCC2 240690a_100015191051_100000188656 [0,1,0,1,0,0|2,0,0]=4 26272 B16R2.3896 O=C(c1ccccc1F)N2CCOCC2 527a_100015191051_100000188656 [0,1,0,1,0,0|2,0,0]=4 26273 B16R2.3896 O=C(c1ccccc1F)N2CCSCC2 11a_100000737611_100000188656 [0,1,0,1,0,0|2,0,0]=4 26274 B16R2.3896 O=C(c1ccccc1F)N2CCSCC2 240690a_100000737611_100000188656 [0,1,0,1,0,0|2,0,0]=4 26275 B16R2.3896 O=C(c1ccccc1F)N2CCSCC2 527a_100000737611_100000188656 [0,1,0,1,0,0|2,0,0]=4 26276 B16R2.3896 O=C(c1ccccc1I)C2CCCCC2 1458a_100000187884_100000210327 [0,1,0,1,0,0|2,0,0]=4 26277 B16R2.3896 O=C(c1ccccc1I)C2CCCOC2 1458a_100000187884_100000693364 [0,1,0,1,0,0|2,0,0]=4 26278 B16R2.3896 O=C(c1ccccc1I)C2CCOCC2 1458a_100000187884_100011324220 [0,1,0,1,0,0|2,0,0]=4 26279 B16R2.3896 O=C(c1ccccc1I)N2CCCOC2 11a_100000131196_100000187884 [0,1,0,1,0,0|2,0,0]=4 26280 B16R2.3896 O=C(c1ccccc1I)N2CCCOC2 240690a_100000131196_100000187884 [0,1,0,1,0,0|2,0,0]=4 26281 B16R2.3896 O=C(c1ccccc1I)N2CCOCC2 11a_100015191051_100000187884 [0,1,0,1,0,0|2,0,0]=4 26282 B16R2.3896 O=C(c1ccccc1I)N2CCOCC2 1626a_100015191051_100000187884 [0,1,0,1,0,0|2,0,0]=4 26283 B16R2.3896 O=C(c1ccccc1I)N2CCOCC2 240690a_100015191051_100000187884 [0,1,0,1,0,0|2,0,0]=4 26284 B16R2.3896 O=C(c1ccccc1I)N2CCOCC2 527a_100015191051_100000187884 [0,1,0,1,0,0|2,0,0]=4 26285 B16R2.3896 O=C(c1ccccc1I)N2CCSCC2 11a_100000737611_100000187884 [0,1,0,1,0,0|2,0,0]=4 26286 B16R2.3896 O=C(c1ccccc1I)N2CCSCC2 240690a_100000737611_100000187884 [0,1,0,1,0,0|2,0,0]=4 26287 B16R2.3896 O=C(c1ccccc1I)N2CCSCC2 527a_100000737611_100000187884 [0,1,0,1,0,0|2,0,0]=4 26288 B16R2.3896 O=C(c1ccccc1O)C2C=CCCC2 1458a_100015234032_100000751183 [0,1,0,1,0,0|1,0,1]=4 26289 B16R2.3896 O=C(c1ccccc1O)C2CCCCC2 1458a_100015234032_100000210327 [0,1,0,1,0,0|1,0,0]=3 26290 B16R2.3896 O=C(c1ccccc1O)C2CCCOC2 1458a_100015234032_100000693364 [0,1,0,1,0,0|1,0,0]=3 26291 B16R2.3896 O=C(c1ccccc1O)C2CCOCC2 1458a_100015234032_100011324220 [0,1,0,1,0,0|1,0,0]=3 26292 B16R2.3896 O=C(c1ccccc1O)N2CC=CCC2 240690a_100000698166_100015234032 [0,1,0,1,0,0|1,0,1]=4 26293 B16R2.3896 O=C(c1ccccc1O)N2CCCCC2 271570a_203496583355_200000152729 [0,1,0,1,0,0|1,0,0]=3 26294 B16R2.3896 O=C(c1ccccc1O)N2CCCOC2 240690a_100000131196_100015234032 [0,1,0,1,0,0|1,0,0]=3 26295 B16R2.3896 O=C(c1ccccc1O)N2CCOCC2 240690a_100015191051_100015234032 [0,1,0,1,0,0|1,0,0]=3 26296 B16R2.3896 O=C(c1ccccc1O)N2CCOCC2 271570a_203496583355_200000154153 [0,1,0,1,0,0|1,0,0]=3 26297 B16R2.3896 O=C(c1ccccc1O)N2CCSCC2 240690a_100000737611_100015234032 [0,1,0,1,0,0|1,0,0]=3 26298 B16R2.3896 O=C(c1ccccc1[O-])C2CCCCC2 1458a_100009911694_100000210327 [0,1,0,1,0,0|1,0,1]=4 26299 B16R2.3896 O=C(c1ccccc1[O-])C2CCCOC2 1458a_100009911694_100000693364 [0,1,0,1,0,0|1,0,1]=4 26300 B16R2.3896 O=C(c1ccccc1[O-])C2CCOCC2 1458a_100009911694_100011324220 [0,1,0,1,0,0|1,0,1]=4 26301 B16R2.3896 O=C(c1ccccc1[O-])N2CCCOC2 240690a_100000131196_100009911694 [0,1,0,1,0,0|1,0,1]=4 26302 B16R2.3896 O=C(c1ccccc1[O-])N2CCOCC2 1626a_100015191051_100009911694 [0,1,0,1,0,0|1,0,1]=4 26303 B16R2.3896 O=C(c1ccccc1[O-])N2CCOCC2 240690a_100015191051_100009911694 [0,1,0,1,0,0|1,0,1]=4 26304 B16R2.3896 O=C(c1ccccc1[O-])N2CCOCC2 527a_100015191051_100009911694 [0,1,0,1,0,0|1,0,1]=4 26305 B16R2.3896 O=C(c1ccccc1[O-])N2CCSCC2 240690a_100000737611_100009911694 [0,1,0,1,0,0|1,0,1]=4 26306 B16R2.3896 O=C(c1ccccc1[O-])N2CCSCC2 527a_100000737611_100009911694 [0,1,0,1,0,0|1,0,1]=4 26307 B16R2.3896 O=C(c1cccnc1O)N2CCCCC2 271570a_203496583355_100000157701 [0,1,0,1,0,0|2,0,0]=4 26308 B16R2.12486 CC1CCN1CC(=O)c2ccccc2Br 269982a_100000755817_100000199116 [0,1,0,1,0,0|2,0,0]=4 26309 B16R2.12486 CC1CCN1CC(=O)c2ccccc2Br 34a_100000755817_100000199116 [0,1,0,1,0,0|2,0,0]=4 26310 B16R2.12486 CC1CCN1CC(=O)c2ccccc2Cl 269982a_100000755817_100000211432 [0,1,0,1,0,0|2,0,0]=4 26311 B16R2.12486 CC1CCN1CC(=O)c2ccccc2Cl 34a_100000755817_100000211432 [0,1,0,1,0,0|2,0,0]=4 26312 B16R2.12486 CC1CCN1CC(=O)c2ccccc2F 269982a_100000755817_100000204681 [0,1,0,1,0,0|2,0,0]=4 26313 B16R2.12486 CC1CCN1CC(=O)c2ccccc2F 34a_100000755817_100000204681 [0,1,0,1,0,0|2,0,0]=4 26314 B16R2.12486 CC1CCN1CC(=O)c2ccccc2O 269982a_100000755817_100000188908 [0,1,0,1,0,0|1,0,0]=3 26315 B16R2.12486 Cc1ccccc1C(=O)CN2CCC2C 269982a_100000755817_100000741374 [0,1,0,1,0,0|2,0,0]=4 26316 B16R2.12486 Cc1ccccc1C(=O)CN2CCC2C 34a_100000755817_100000741374 [0,1,0,1,0,0|2,0,0]=4 26317 B16R2.22604 CC(=NNCC1CC1)c2ccccc2O 4a_100000736359_100000188907 [0,1,0,1,0,0|2,0,0]=4 26318 B16R2.22604 Cc1ccccc1C(=O)CCCC2CO2 1458a_100000212026_100000733510 [0,1,0,1,0,0|2,0,0]=4 26319 B16R2.22604 Cc1ccccc1C(=O)CNCC2CC2 2230a_100000735609_100000741374 [0,1,0,1,0,0|2,0,0]=4 26320 B16R2.22604 Cc1ccccc1C(=O)CNCC2CC2 34a_100000735609_100000741374 [0,1,0,1,0,0|2,0,0]=4 26321 B16R2.22604 Cc1ccccc1C(=O)COCC2CC2 34a_100000211283_100000741374 [0,1,0,1,0,0|1,0,0]=3 26322 B16R2.22604 Cc1ccccc1C(=O)COC[C@@H]2CO2 34a_100000757423_100000741374 [0,1,0,1,0,0|2,0,0]=4 26323 B16R2.22604 Cc1ccccc1C(=O)CSCC2CC2 62a_100000741374_100000742324 [0,1,0,1,0,0|1,1,0]=4 26324 B16R2.22604 Cc1ccccc1C(=O)CSCC2CC2 62a_100000756562_100000741374 [0,1,0,1,0,0|1,1,0]=4 26325 B16R2.22604 Cc1ccccc1C(=O)NCCC2CC2 1626a_100000764129_100000212026 [0,1,0,1,0,0|2,0,0]=4 26326 B16R2.22604 Cc1ccccc1C(=O)NCCC2CC2 240690a_100000764129_100000212026 [0,1,0,1,0,0|2,0,0]=4 26327 B16R2.22604 Cc1ccccc1C(=O)NCCC2CC2 527a_100000764129_100000212026 [0,1,0,1,0,0|2,0,0]=4 26328 B16R2.22604 Cc1ccccc1C(=O)NNCC2CC2 22a_100000736359_100000212026 [0,1,0,1,0,0|2,0,0]=4 26329 B16R2.22604 O=C(CC#CC1CC1)c2ccccc2O 1458a_100015234032_100009895102 [0,1,0,1,0,0|1,0,1]=4 26330 B16R2.22604 O=C(CCCC1CO1)c2ccccc2Br 1458a_100000188424_100000733510 [0,1,0,1,0,0|2,0,0]=4 26331 B16R2.22604 O=C(CCCC1CO1)c2ccccc2Cl 1458a_100000185844_100000733510 [0,1,0,1,0,0|2,0,0]=4 26332 B16R2.22604 O=C(CCCC1CO1)c2ccccc2F 1458a_100000188656_100000733510 [0,1,0,1,0,0|2,0,0]=4 26333 B16R2.22604 O=C(CCCC1CO1)c2ccccc2I 1458a_100000187884_100000733510 [0,1,0,1,0,0|2,0,0]=4 26334 B16R2.22604 O=C(CCCC1CO1)c2ccccc2O 1458a_100015234032_100000733510 [0,1,0,1,0,0|1,0,0]=3 26335 B16R2.22604 O=C(CCCC1CO1)c2ccccc2[O-] 1458a_100009911694_100000733510 [0,1,0,1,0,0|1,0,1]=4 26336 B16R2.22604 O=C(CCSC1CC1)c2ccccc2F 62a_100000086012_100000211595 [0,1,0,1,0,0|2,0,0]=4 26337 B16R2.22604 O=C(CNCC1CC1)c2ccccc2Br 34a_100000735609_100000199116 [0,1,0,1,0,0|2,0,0]=4 26338 B16R2.22604 O=C(CNCC1CC1)c2ccccc2Cl 34a_100000735609_100000211432 [0,1,0,1,0,0|2,0,0]=4 26339 B16R2.22604 O=C(CNCC1CC1)c2ccccc2F 34a_100000735609_100000204681 [0,1,0,1,0,0|2,0,0]=4 26340 B16R2.22604 O=C(COCC1CC1)c2ccccc2Br 34a_100000211283_100000199116 [0,1,0,1,0,0|1,0,0]=3 26341 B16R2.22604 O=C(COCC1CC1)c2ccccc2Cl 34a_100000211283_100000211432 [0,1,0,1,0,0|1,0,0]=3 26342 B16R2.22604 O=C(COCC1CC1)c2ccccc2F 34a_100000211283_100000204681 [0,1,0,1,0,0|1,0,0]=3 26343 B16R2.22604 O=C(COC[C@@H]1CO1)c2ccccc2Br 34a_100000757423_100000199116 [0,1,0,1,0,0|2,0,0]=4 26344 B16R2.22604 O=C(COC[C@@H]1CO1)c2ccccc2Cl 34a_100000757423_100000211432 [0,1,0,1,0,0|2,0,0]=4 26345 B16R2.22604 O=C(COC[C@@H]1CO1)c2ccccc2F 34a_100000757423_100000204681 [0,1,0,1,0,0|2,0,0]=4 26346 B16R2.22604 O=C(CSCC1CC1)c2ccccc2Br 62a_100000199116_100000742324 [0,1,0,1,0,0|1,1,0]=4 26347 B16R2.22604 O=C(CSCC1CC1)c2ccccc2Cl 62a_100000211432_100000742324 [0,1,0,1,0,0|1,1,0]=4 26348 B16R2.22604 O=C(CSCC1CC1)c2ccccc2Cl 62a_100000756562_100000211432 [0,1,0,1,0,0|1,1,0]=4 26349 B16R2.22604 O=C(CSCC1CC1)c2ccccc2F 62a_100000204681_100000742324 [0,1,0,1,0,0|1,1,0]=4 26350 B16R2.22604 O=C(CSCC1CC1)c2ccccc2F 62a_100000756562_100000204681 [0,1,0,1,0,0|1,1,0]=4 26351 B16R2.22604 O=C(CSCC1CC1)c2ccccc2O 62a_100000188908_100000742324 [0,1,0,1,0,0|0,1,0]=3 26352 B16R2.22604 O=C(CSCC1CC1)c2ccccc2O 62a_100000756562_100000188908 [0,1,0,1,0,0|0,1,0]=3 26353 B16R2.22604 O=C(CSCC1CO1)c2ccccc2O 62a_100000188908_102125554688 [0,1,0,1,0,0|1,1,0]=4 26354 B16R2.22604 O=C(CSCC1CO1)c2ccccc2O 62a_102125554688_100000188908 [0,1,0,1,0,0|1,1,0]=4 26355 B16R2.22604 O=C(CSCC1CS1)c2ccccc2O 62a_100000031435_100000188908 [0,1,0,1,0,0|1,1,0]=4 26356 B16R2.22604 O=C(CSCC1CS1)c2ccccc2O 62a_100000188908_100000031435 [0,1,0,1,0,0|1,1,0]=4 26357 B16R2.22604 O=C(CSC[C@@H]1CO1)c2ccccc2O 62a_100000188908_100000745022 [0,1,0,1,0,0|1,1,0]=4 26358 B16R2.22604 O=C(CSC[C@@H]1CO1)c2ccccc2O 62a_100000745022_100000188908 [0,1,0,1,0,0|1,1,0]=4 26359 B16R2.22604 O=C(NCCC1CC1)c2ccccc2Br 1626a_100000764129_100000188424 [0,1,0,1,0,0|2,0,0]=4 26360 B16R2.22604 O=C(NCCC1CC1)c2ccccc2Br 240690a_100000764129_100000188424 [0,1,0,1,0,0|2,0,0]=4 26361 B16R2.22604 O=C(NCCC1CC1)c2ccccc2Br 527a_100000764129_100000188424 [0,1,0,1,0,0|2,0,0]=4 26362 B16R2.22604 O=C(NCCC1CC1)c2ccccc2Cl 1626a_100000764129_100000185844 [0,1,0,1,0,0|2,0,0]=4 26363 B16R2.22604 O=C(NCCC1CC1)c2ccccc2Cl 240690a_100000764129_100000185844 [0,1,0,1,0,0|2,0,0]=4 26364 B16R2.22604 O=C(NCCC1CC1)c2ccccc2Cl 527a_100000764129_100000185844 [0,1,0,1,0,0|2,0,0]=4 26365 B16R2.22604 O=C(NCCC1CC1)c2ccccc2F 1626a_100000764129_100000188656 [0,1,0,1,0,0|2,0,0]=4 26366 B16R2.22604 O=C(NCCC1CC1)c2ccccc2F 240690a_100000764129_100000188656 [0,1,0,1,0,0|2,0,0]=4 26367 B16R2.22604 O=C(NCCC1CC1)c2ccccc2F 527a_100000764129_100000188656 [0,1,0,1,0,0|2,0,0]=4 26368 B16R2.22604 O=C(NCCC1CC1)c2ccccc2I 1626a_100000764129_100000187884 [0,1,0,1,0,0|2,0,0]=4 26369 B16R2.22604 O=C(NCCC1CC1)c2ccccc2I 240690a_100000764129_100000187884 [0,1,0,1,0,0|2,0,0]=4 26370 B16R2.22604 O=C(NCCC1CC1)c2ccccc2I 527a_100000764129_100000187884 [0,1,0,1,0,0|2,0,0]=4 26371 B16R2.22604 O=C(NCCC1CC1)c2ccccc2O 240690a_100000764129_100015234032 [0,1,0,1,0,0|1,0,0]=3 26372 B16R2.22604 O=C(NCCC1CC1)c2ccccc2[O-] 1626a_100000764129_100009911694 [0,1,0,1,0,0|1,0,1]=4 26373 B16R2.22604 O=C(NCCC1CC1)c2ccccc2[O-] 240690a_100000764129_100009911694 [0,1,0,1,0,0|1,0,1]=4 26374 B16R2.22604 O=C(NCCC1CC1)c2ccccc2[O-] 527a_100000764129_100009911694 [0,1,0,1,0,0|1,0,1]=4 26375 B16R2.22604 O=C(NNCC1CC1)c2ccccc2Br 22a_100000736359_100000188424 [0,1,0,1,0,0|2,0,0]=4 26376 B16R2.22604 O=C(NNCC1CC1)c2ccccc2Cl 22a_100000736359_100000185844 [0,1,0,1,0,0|2,0,0]=4 26377 B16R2.22604 O=C(NNCC1CC1)c2ccccc2F 22a_100000736359_100000188656 [0,1,0,1,0,0|2,0,0]=4 26378 B16R2.22604 O=C(NNCC1CC1)c2ccccc2I 22a_100000736359_100000187884 [0,1,0,1,0,0|2,0,0]=4 26379 B16R2.22604 O=C(NNCC1CC1)c2ccccc2O 22a_100000736359_100015234032 [0,1,0,1,0,0|1,0,0]=3 26380 B16R2.22604 O=C(NNCC1CC1)c2ccccc2[O-] 22a_100000736359_100009911694 [0,1,0,1,0,0|1,0,1]=4 26381 B16R2.95971 CC(=NNC1CCC1)c2ccccc2O 4a_100000736358_100000188907 [0,1,0,1,0,0|2,0,0]=4 26382 B16R2.95971 Cc1ccccc1C(=O)CNC2CCC2 2230a_100000749019_100000741374 [0,1,0,1,0,0|2,0,0]=4 26383 B16R2.95971 Cc1ccccc1C(=O)CNC2CCC2 34a_100000749019_100000741374 [0,1,0,1,0,0|2,0,0]=4 26384 B16R2.95971 Cc1ccccc1C(=O)COC2CCC2 34a_100000748187_100000741374 [0,1,0,1,0,0|1,0,0]=3 26385 B16R2.95971 Cc1ccccc1C(=O)COC2CSC2 7a_100000072292_100000741374 [0,1,0,1,0,0|2,0,0]=4 26386 B16R2.95971 Cc1ccccc1C(=O)CSC2CCC2 62a_100000741374_100000749161 [0,1,0,1,0,0|1,1,0]=4 26387 B16R2.95971 Cc1ccccc1C(=O)NCC2CCC2 11a_100000738700_100000212026 [0,1,0,1,0,0|2,0,0]=4 26388 B16R2.95971 Cc1ccccc1C(=O)NCC2CCC2 1626a_100000738700_100000212026 [0,1,0,1,0,0|2,0,0]=4 26389 B16R2.95971 Cc1ccccc1C(=O)NCC2CCC2 240690a_100000738700_100000212026 [0,1,0,1,0,0|2,0,0]=4 26390 B16R2.95971 Cc1ccccc1C(=O)NCC2CCC2 527a_100000738700_100000212026 [0,1,0,1,0,0|2,0,0]=4 26391 B16R2.95971 Cc1ccccc1C(=O)NCC2COC2 11a_100015281925_100000212026 [0,1,0,1,0,0|2,0,0]=4 26392 B16R2.95971 Cc1ccccc1C(=O)NCC2COC2 1626a_100015281925_100000212026 [0,1,0,1,0,0|2,0,0]=4 26393 B16R2.95971 Cc1ccccc1C(=O)NCC2COC2 240690a_100015281925_100000212026 [0,1,0,1,0,0|2,0,0]=4 26394 B16R2.95971 Cc1ccccc1C(=O)NCC2COC2 527a_100015281925_100000212026 [0,1,0,1,0,0|2,0,0]=4 26395 B16R2.95971 Cc1ccccc1C(=O)NC[C@@H]2CCO2 11a_100020831831_100000212026 [0,1,0,1,0,0|2,0,0]=4 26396 B16R2.95971 Cc1ccccc1C(=O)NC[C@@H]2CCO2 1626a_100020831831_100000212026 [0,1,0,1,0,0|2,0,0]=4 26397 B16R2.95971 Cc1ccccc1C(=O)NC[C@@H]2CCO2 240690a_100020831831_100000212026 [0,1,0,1,0,0|2,0,0]=4 26398 B16R2.95971 Cc1ccccc1C(=O)NC[C@@H]2CCO2 527a_100020831831_100000212026 [0,1,0,1,0,0|2,0,0]=4 26399 B16R2.95971 Cc1ccccc1C(=O)NNC2CCC2 22a_100000736358_100000212026 [0,1,0,1,0,0|2,0,0]=4 26400 B16R2.95971 O=C(CCN1CCC1)c2ccccc2F 269982a_100000754969_100000086012 [0,1,0,1,0,0|2,0,0]=4 26401 B16R2.95971 O=C(CCN1CCC1)c2ccccc2O 269982a_100000754969_100009873196 [0,1,0,1,0,0|1,0,0]=3 26402 B16R2.95971 O=C(CNC1CCC1)c2ccccc2Br 34a_100000749019_100000199116 [0,1,0,1,0,0|2,0,0]=4 26403 B16R2.95971 O=C(CNC1CCC1)c2ccccc2Cl 34a_100000749019_100000211432 [0,1,0,1,0,0|2,0,0]=4 26404 B16R2.95971 O=C(CNC1CCC1)c2ccccc2F 34a_100000749019_100000204681 [0,1,0,1,0,0|2,0,0]=4 26405 B16R2.95971 O=C(COC1CCC1)c2ccccc2Br 34a_100000748187_100000199116 [0,1,0,1,0,0|1,0,0]=3 26406 B16R2.95971 O=C(COC1CCC1)c2ccccc2Cl 34a_100000748187_100000211432 [0,1,0,1,0,0|1,0,0]=3 26407 B16R2.95971 O=C(COC1CCC1)c2ccccc2F 34a_100000748187_100000204681 [0,1,0,1,0,0|1,0,0]=3 26408 B16R2.95971 O=C(COC1CSC1)c2ccccc2F 7a_100000072292_100000204681 [0,1,0,1,0,0|2,0,0]=4 26409 B16R2.95971 O=C(COC1CSC1)c2ccccc2O 7a_100000072292_100000188908 [0,1,0,1,0,0|1,0,0]=3 26410 B16R2.95971 O=C(CSC1CCC1)c2ccccc2Br 62a_100000199116_100000749161 [0,1,0,1,0,0|1,1,0]=4 26411 B16R2.95971 O=C(CSC1CCC1)c2ccccc2Cl 62a_100000211432_100000749161 [0,1,0,1,0,0|1,1,0]=4 26412 B16R2.95971 O=C(CSC1CCC1)c2ccccc2F 62a_100000204681_100000749161 [0,1,0,1,0,0|1,1,0]=4 26413 B16R2.95971 O=C(CSC1CCC1)c2ccccc2O 62a_100000188908_100000749161 [0,1,0,1,0,0|0,1,0]=3 26414 B16R2.95971 O=C(CSC1COC1)c2ccccc2O 62a_100000188908_100009818527 [0,1,0,1,0,0|1,1,0]=4 26415 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Br 11a_100000738700_100000188424 [0,1,0,1,0,0|2,0,0]=4 26416 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Br 1626a_100000738700_100000188424 [0,1,0,1,0,0|2,0,0]=4 26417 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Br 240690a_100000738700_100000188424 [0,1,0,1,0,0|2,0,0]=4 26418 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Br 527a_100000738700_100000188424 [0,1,0,1,0,0|2,0,0]=4 26419 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Cl 11a_100000738700_100000185844 [0,1,0,1,0,0|2,0,0]=4 26420 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Cl 1626a_100000738700_100000185844 [0,1,0,1,0,0|2,0,0]=4 26421 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Cl 240690a_100000738700_100000185844 [0,1,0,1,0,0|2,0,0]=4 26422 B16R2.95971 O=C(NCC1CCC1)c2ccccc2Cl 527a_100000738700_100000185844 [0,1,0,1,0,0|2,0,0]=4 26423 B16R2.95971 O=C(NCC1CCC1)c2ccccc2F 11a_100000738700_100000188656 [0,1,0,1,0,0|2,0,0]=4 26424 B16R2.95971 O=C(NCC1CCC1)c2ccccc2F 1626a_100000738700_100000188656 [0,1,0,1,0,0|2,0,0]=4 26425 B16R2.95971 O=C(NCC1CCC1)c2ccccc2F 240690a_100000738700_100000188656 [0,1,0,1,0,0|2,0,0]=4 26426 B16R2.95971 O=C(NCC1CCC1)c2ccccc2F 527a_100000738700_100000188656 [0,1,0,1,0,0|2,0,0]=4 26427 B16R2.95971 O=C(NCC1CCC1)c2ccccc2I 11a_100000738700_100000187884 [0,1,0,1,0,0|2,0,0]=4 26428 B16R2.95971 O=C(NCC1CCC1)c2ccccc2I 1626a_100000738700_100000187884 [0,1,0,1,0,0|2,0,0]=4 26429 B16R2.95971 O=C(NCC1CCC1)c2ccccc2I 240690a_100000738700_100000187884 [0,1,0,1,0,0|2,0,0]=4 26430 B16R2.95971 O=C(NCC1CCC1)c2ccccc2I 527a_100000738700_100000187884 [0,1,0,1,0,0|2,0,0]=4 26431 B16R2.95971 O=C(NCC1CCC1)c2ccccc2O 240690a_100000738700_100015234032 [0,1,0,1,0,0|1,0,0]=3 26432 B16R2.95971 O=C(NCC1CCC1)c2ccccc2[O-] 1626a_100000738700_100009911694 [0,1,0,1,0,0|1,0,1]=4 26433 B16R2.95971 O=C(NCC1CCC1)c2ccccc2[O-] 240690a_100000738700_100009911694 [0,1,0,1,0,0|1,0,1]=4 26434 B16R2.95971 O=C(NCC1CCC1)c2ccccc2[O-] 527a_100000738700_100009911694 [0,1,0,1,0,0|1,0,1]=4 26435 B16R2.95971 O=C(NCC1COC1)c2ccccc2Br 11a_100015281925_100000188424 [0,1,0,1,0,0|2,0,0]=4 26436 B16R2.95971 O=C(NCC1COC1)c2ccccc2Br 1626a_100015281925_100000188424 [0,1,0,1,0,0|2,0,0]=4 26437 B16R2.95971 O=C(NCC1COC1)c2ccccc2Br 240690a_100015281925_100000188424 [0,1,0,1,0,0|2,0,0]=4 26438 B16R2.95971 O=C(NCC1COC1)c2ccccc2Br 527a_100015281925_100000188424 [0,1,0,1,0,0|2,0,0]=4 26439 B16R2.95971 O=C(NCC1COC1)c2ccccc2Cl 11a_100015281925_100000185844 [0,1,0,1,0,0|2,0,0]=4 26440 B16R2.95971 O=C(NCC1COC1)c2ccccc2Cl 1626a_100015281925_100000185844 [0,1,0,1,0,0|2,0,0]=4 26441 B16R2.95971 O=C(NCC1COC1)c2ccccc2Cl 240690a_100015281925_100000185844 [0,1,0,1,0,0|2,0,0]=4 26442 B16R2.95971 O=C(NCC1COC1)c2ccccc2Cl 527a_100015281925_100000185844 [0,1,0,1,0,0|2,0,0]=4 26443 B16R2.95971 O=C(NCC1COC1)c2ccccc2F 11a_100015281925_100000188656 [0,1,0,1,0,0|2,0,0]=4 26444 B16R2.95971 O=C(NCC1COC1)c2ccccc2F 1626a_100015281925_100000188656 [0,1,0,1,0,0|2,0,0]=4 26445 B16R2.95971 O=C(NCC1COC1)c2ccccc2F 240690a_100015281925_100000188656 [0,1,0,1,0,0|2,0,0]=4 26446 B16R2.95971 O=C(NCC1COC1)c2ccccc2F 527a_100015281925_100000188656 [0,1,0,1,0,0|2,0,0]=4 26447 B16R2.95971 O=C(NCC1COC1)c2ccccc2I 11a_100015281925_100000187884 [0,1,0,1,0,0|2,0,0]=4 26448 B16R2.95971 O=C(NCC1COC1)c2ccccc2I 1626a_100015281925_100000187884 [0,1,0,1,0,0|2,0,0]=4 26449 B16R2.95971 O=C(NCC1COC1)c2ccccc2I 240690a_100015281925_100000187884 [0,1,0,1,0,0|2,0,0]=4 26450 B16R2.95971 O=C(NCC1COC1)c2ccccc2I 527a_100015281925_100000187884 [0,1,0,1,0,0|2,0,0]=4 26451 B16R2.95971 O=C(NCC1COC1)c2ccccc2O 240690a_100015281925_100015234032 [0,1,0,1,0,0|1,0,0]=3 26452 B16R2.95971 O=C(NCC1COC1)c2ccccc2[O-] 1626a_100015281925_100009911694 [0,1,0,1,0,0|1,0,1]=4 26453 B16R2.95971 O=C(NCC1COC1)c2ccccc2[O-] 240690a_100015281925_100009911694 [0,1,0,1,0,0|1,0,1]=4 26454 B16R2.95971 O=C(NCC1COC1)c2ccccc2[O-] 527a_100015281925_100009911694 [0,1,0,1,0,0|1,0,1]=4 26455 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Br 11a_100020831831_100000188424 [0,1,0,1,0,0|2,0,0]=4 26456 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Br 1626a_100020831831_100000188424 [0,1,0,1,0,0|2,0,0]=4 26457 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Br 240690a_100020831831_100000188424 [0,1,0,1,0,0|2,0,0]=4 26458 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Br 527a_100020831831_100000188424 [0,1,0,1,0,0|2,0,0]=4 26459 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Cl 11a_100020831831_100000185844 [0,1,0,1,0,0|2,0,0]=4 26460 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Cl 1626a_100020831831_100000185844 [0,1,0,1,0,0|2,0,0]=4 26461 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Cl 240690a_100020831831_100000185844 [0,1,0,1,0,0|2,0,0]=4 26462 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2Cl 527a_100020831831_100000185844 [0,1,0,1,0,0|2,0,0]=4 26463 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2F 11a_100020831831_100000188656 [0,1,0,1,0,0|2,0,0]=4 26464 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2F 1626a_100020831831_100000188656 [0,1,0,1,0,0|2,0,0]=4 26465 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2F 240690a_100020831831_100000188656 [0,1,0,1,0,0|2,0,0]=4 26466 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2F 527a_100020831831_100000188656 [0,1,0,1,0,0|2,0,0]=4 26467 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2I 11a_100020831831_100000187884 [0,1,0,1,0,0|2,0,0]=4 26468 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2I 1626a_100020831831_100000187884 [0,1,0,1,0,0|2,0,0]=4 26469 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2I 240690a_100020831831_100000187884 [0,1,0,1,0,0|2,0,0]=4 26470 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2I 527a_100020831831_100000187884 [0,1,0,1,0,0|2,0,0]=4 26471 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2O 240690a_100020831831_100015234032 [0,1,0,1,0,0|1,0,0]=3 26472 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2[O-] 1626a_100020831831_100009911694 [0,1,0,1,0,0|1,0,1]=4 26473 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2[O-] 240690a_100020831831_100009911694 [0,1,0,1,0,0|1,0,1]=4 26474 B16R2.95971 O=C(NC[C@@H]1CCO1)c2ccccc2[O-] 527a_100020831831_100009911694 [0,1,0,1,0,0|1,0,1]=4 26475 B16R2.95971 O=C(NNC1CCC1)c2ccccc2Br 22a_100000736358_100000188424 [0,1,0,1,0,0|2,0,0]=4 26476 B16R2.95971 O=C(NNC1CCC1)c2ccccc2Cl 22a_100000736358_100000185844 [0,1,0,1,0,0|2,0,0]=4 26477 B16R2.95971 O=C(NNC1CCC1)c2ccccc2F 22a_100000736358_100000188656 [0,1,0,1,0,0|2,0,0]=4 26478 B16R2.95971 O=C(NNC1CCC1)c2ccccc2I 22a_100000736358_100000187884 [0,1,0,1,0,0|2,0,0]=4 26479 B16R2.95971 O=C(NNC1CCC1)c2ccccc2O 22a_100000736358_100015234032 [0,1,0,1,0,0|1,0,0]=3 26480 B16R2.95971 O=C(NNC1CCC1)c2ccccc2[O-] 22a_100000736358_100009911694 [0,1,0,1,0,0|1,0,1]=4 26481 B16R2.95971 O=C(NNC1COC1)c2ccccc2O 22a_100015188821_100015234032 [0,1,0,1,0,0|2,0,0]=4 26482 B16R2.2962 O=S(=O)(c1ccccc1O)N2CCCC2 271570a_203496583355_200000164901 [0,1,0,1,0,0|2,0,0]=4 26483 B16R2.14 CCC(C)COc1csc2c1cccc2 34a_100000077758_100000748023 [0,1,0,1,0,0|1,1,0]=4 26484 B16R2.14 CCC(C)COc1csc2c1cccc2 7a_100000077758_100000748023 [0,1,0,1,0,0|1,1,0]=4 26485 B16R2.14 CCC(C)CSc1coc2c1cccc2 62a_100000748023_100009812202 [0,1,0,1,0,0|1,1,0]=4 26486 B16R2.14 CCC(C)CSc1noc2c1cccc2 62a_100000748023_200000703156 [0,1,0,1,0,0|1,1,0]=4 26487 B16R2.14 CCC(C)CSc1noc2c1cccc2 62a_200000703156_100000748023 [0,1,0,1,0,0|1,1,0]=4 26488 B16R2.14 CCC(O)COc1csc2c1cccc2 34a_100000077758_100011218378 [0,1,0,1,0,0|1,1,0]=4 26489 B16R2.14 CCC(O)COc1csc2c1cccc2 7a_100000077758_100011218378 [0,1,0,1,0,0|1,1,0]=4 26490 B16R2.14 CCC(O)CSc1coc2c1cccc2 62a_100011218378_100009812202 [0,1,0,1,0,0|1,1,0]=4 26491 B16R2.14 CCC(O)CSc1noc2c1cccc2 62a_100011218378_200000703156 [0,1,0,1,0,0|1,1,0]=4 26492 B16R2.14 CCC(O)CSc1noc2c1cccc2 62a_200000703156_100011218378 [0,1,0,1,0,0|1,1,0]=4 26493 B16R2.14 CC[C@H](C)COc1csc2c1cccc2 34a_100000077758_100009816398 [0,1,0,1,0,0|1,1,0]=4 26494 B16R2.14 CC[C@H](C)COc1csc2c1cccc2 7a_100000077758_100009816398 [0,1,0,1,0,0|1,1,0]=4 26495 B16R2.14 CC[C@H](C)CSc1coc2c1cccc2 62a_100009816398_100009812202 [0,1,0,1,0,0|1,1,0]=4 26496 B16R2.14 CC[C@H](C)CSc1noc2c1cccc2 62a_100009816398_200000703156 [0,1,0,1,0,0|1,1,0]=4 26497 B16R2.14 CC[C@H](C)CSc1noc2c1cccc2 62a_200000703156_100009816398 [0,1,0,1,0,0|1,1,0]=4 26498 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2Br 11a_100016987628_100000188424 [0,1,0,1,0,0|2,0,0]=4 26499 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2Br 240690a_100016987628_100000188424 [0,1,0,1,0,0|2,0,0]=4 26500 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2Br 527a_100016987628_100000188424 [0,1,0,1,0,0|2,0,0]=4 26501 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2Cl 11a_100016987628_100000185844 [0,1,0,1,0,0|2,0,0]=4 26502 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2Cl 240690a_100016987628_100000185844 [0,1,0,1,0,0|2,0,0]=4 26503 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2Cl 527a_100016987628_100000185844 [0,1,0,1,0,0|2,0,0]=4 26504 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2F 11a_100016987628_100000188656 [0,1,0,1,0,0|2,0,0]=4 26505 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2F 240690a_100016987628_100000188656 [0,1,0,1,0,0|2,0,0]=4 26506 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2F 527a_100016987628_100000188656 [0,1,0,1,0,0|2,0,0]=4 26507 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2I 11a_100016987628_100000187884 [0,1,0,1,0,0|2,0,0]=4 26508 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2I 240690a_100016987628_100000187884 [0,1,0,1,0,0|2,0,0]=4 26509 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2I 527a_100016987628_100000187884 [0,1,0,1,0,0|2,0,0]=4 26510 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2O 240690a_100016987628_100015234032 [0,1,0,1,0,0|1,0,0]=3 26511 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2[O-] 240690a_100016987628_100009911694 [0,1,0,1,0,0|1,0,1]=4 26512 B16R2.11440 C[C@@H]1CCN(C1)C(=O)c2ccccc2[O-] 527a_100016987628_100009911694 [0,1,0,1,0,0|1,0,1]=4 26513 B16R2.11440 Cc1ccccc1C(=O)N2CCC(C2)O 240690a_100011215560_100000212026 [0,1,0,1,0,0|2,0,0]=4 26514 B16R2.11440 Cc1ccccc1C(=O)N2CCC(C2)O 527a_100011215560_100000212026 [0,1,0,1,0,0|2,0,0]=4 26515 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@@H](C2)F 11a_100015203821_100000212026 [0,1,0,1,0,0|2,0,0]=4 26516 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@@H](C2)F 1626a_100015203821_100000212026 [0,1,0,1,0,0|2,0,0]=4 26517 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@@H](C2)F 240690a_100015203821_100000212026 [0,1,0,1,0,0|2,0,0]=4 26518 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@@H](C2)F 527a_100015203821_100000212026 [0,1,0,1,0,0|2,0,0]=4 26519 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@H](C2)C 11a_100016987628_100000212026 [0,1,0,1,0,0|2,0,0]=4 26520 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@H](C2)C 240690a_100016987628_100000212026 [0,1,0,1,0,0|2,0,0]=4 26521 B16R2.11440 Cc1ccccc1C(=O)N2CC[C@H](C2)C 527a_100016987628_100000212026 [0,1,0,1,0,0|2,0,0]=4 26522 B16R2.11440 O=C(c1ccccc1Br)N2CCC(C2)O 240690a_100011215560_100000188424 [0,1,0,1,0,0|2,0,0]=4 26523 B16R2.11440 O=C(c1ccccc1Br)N2CCC(C2)O 527a_100011215560_100000188424 [0,1,0,1,0,0|2,0,0]=4 26524 B16R2.11440 O=C(c1ccccc1Br)N2CC[C@@H](C2)F 11a_100015203821_100000188424 [0,1,0,1,0,0|2,0,0]=4 26525 B16R2.11440 O=C(c1ccccc1Br)N2CC[C@@H](C2)F 1626a_100015203821_100000188424 [0,1,0,1,0,0|2,0,0]=4 26526 B16R2.11440 O=C(c1ccccc1Br)N2CC[C@@H](C2)F 240690a_100015203821_100000188424 [0,1,0,1,0,0|2,0,0]=4 26527 B16R2.11440 O=C(c1ccccc1Br)N2CC[C@@H](C2)F 527a_100015203821_100000188424 [0,1,0,1,0,0|2,0,0]=4 26528 B16R2.11440 O=C(c1ccccc1Cl)N2CCC(C2)O 240690a_100011215560_100000185844 [0,1,0,1,0,0|2,0,0]=4 26529 B16R2.11440 O=C(c1ccccc1Cl)N2CCC(C2)O 527a_100011215560_100000185844 [0,1,0,1,0,0|2,0,0]=4 26530 B16R2.11440 O=C(c1ccccc1Cl)N2CC[C@@H](C2)F 11a_100015203821_100000185844 [0,1,0,1,0,0|2,0,0]=4 26531 B16R2.11440 O=C(c1ccccc1Cl)N2CC[C@@H](C2)F 1626a_100015203821_100000185844 [0,1,0,1,0,0|2,0,0]=4 26532 B16R2.11440 O=C(c1ccccc1Cl)N2CC[C@@H](C2)F 240690a_100015203821_100000185844 [0,1,0,1,0,0|2,0,0]=4 26533 B16R2.11440 O=C(c1ccccc1Cl)N2CC[C@@H](C2)F 527a_100015203821_100000185844 [0,1,0,1,0,0|2,0,0]=4 26534 B16R2.11440 O=C(c1ccccc1F)N2CCC(C2)O 240690a_100011215560_100000188656 [0,1,0,1,0,0|2,0,0]=4 26535 B16R2.11440 O=C(c1ccccc1F)N2CCC(C2)O 527a_100011215560_100000188656 [0,1,0,1,0,0|2,0,0]=4 26536 B16R2.11440 O=C(c1ccccc1F)N2CC[C@@H](C2)F 11a_100015203821_100000188656 [0,1,0,1,0,0|2,0,0]=4 26537 B16R2.11440 O=C(c1ccccc1F)N2CC[C@@H](C2)F 1626a_100015203821_100000188656 [0,1,0,1,0,0|2,0,0]=4 26538 B16R2.11440 O=C(c1ccccc1F)N2CC[C@@H](C2)F 240690a_100015203821_100000188656 [0,1,0,1,0,0|2,0,0]=4 26539 B16R2.11440 O=C(c1ccccc1F)N2CC[C@@H](C2)F 527a_100015203821_100000188656 [0,1,0,1,0,0|2,0,0]=4 26540 B16R2.11440 O=C(c1ccccc1I)N2CCC(C2)O 240690a_100011215560_100000187884 [0,1,0,1,0,0|2,0,0]=4 26541 B16R2.11440 O=C(c1ccccc1I)N2CCC(C2)O 527a_100011215560_100000187884 [0,1,0,1,0,0|2,0,0]=4 26542 B16R2.11440 O=C(c1ccccc1I)N2CC[C@@H](C2)F 11a_100015203821_100000187884 [0,1,0,1,0,0|2,0,0]=4 26543 B16R2.11440 O=C(c1ccccc1I)N2CC[C@@H](C2)F 1626a_100015203821_100000187884 [0,1,0,1,0,0|2,0,0]=4 26544 B16R2.11440 O=C(c1ccccc1I)N2CC[C@@H](C2)F 240690a_100015203821_100000187884 [0,1,0,1,0,0|2,0,0]=4 26545 B16R2.11440 O=C(c1ccccc1I)N2CC[C@@H](C2)F 527a_100015203821_100000187884 [0,1,0,1,0,0|2,0,0]=4 26546 B16R2.11440 O=C(c1ccccc1O)N2CCC(C2)O 240690a_100011215560_100015234032 [0,1,0,1,0,0|1,0,0]=3 26547 B16R2.11440 O=C(c1ccccc1O)N2CC[C@@H](C2)F 240690a_100015203821_100015234032 [0,1,0,1,0,0|1,0,0]=3 26548 B16R2.11440 O=C(c1ccccc1[O-])N2CCC(C2)O 240690a_100011215560_100009911694 [0,1,0,1,0,0|1,0,1]=4 26549 B16R2.11440 O=C(c1ccccc1[O-])N2CCC(C2)O 527a_100011215560_100009911694 [0,1,0,1,0,0|1,0,1]=4 26550 B16R2.11440 O=C(c1ccccc1[O-])N2CC[C@@H](C2)F 1626a_100015203821_100009911694 [0,1,0,1,0,0|1,0,1]=4 26551 B16R2.11440 O=C(c1ccccc1[O-])N2CC[C@@H](C2)F 240690a_100015203821_100009911694 [0,1,0,1,0,0|1,0,1]=4 26552 B16R2.11440 O=C(c1ccccc1[O-])N2CC[C@@H](C2)F 527a_100015203821_100009911694 [0,1,0,1,0,0|1,0,1]=4 26553 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Br 11a_100000766693_100000188424 [0,1,0,1,0,0|2,0,0]=4 26554 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Br 1626a_100000766693_100000188424 [0,1,0,1,0,0|2,0,0]=4 26555 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Br 240690a_100000766693_100000188424 [0,1,0,1,0,0|2,0,0]=4 26556 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Br 527a_100000766693_100000188424 [0,1,0,1,0,0|2,0,0]=4 26557 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Cl 11a_100000766693_100000185844 [0,1,0,1,0,0|2,0,0]=4 26558 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Cl 1626a_100000766693_100000185844 [0,1,0,1,0,0|2,0,0]=4 26559 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Cl 240690a_100000766693_100000185844 [0,1,0,1,0,0|2,0,0]=4 26560 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2Cl 527a_100000766693_100000185844 [0,1,0,1,0,0|2,0,0]=4 26561 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2F 11a_100000766693_100000188656 [0,1,0,1,0,0|2,0,0]=4 26562 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2F 1626a_100000766693_100000188656 [0,1,0,1,0,0|2,0,0]=4 26563 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2F 240690a_100000766693_100000188656 [0,1,0,1,0,0|2,0,0]=4 26564 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2F 527a_100000766693_100000188656 [0,1,0,1,0,0|2,0,0]=4 26565 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2I 11a_100000766693_100000187884 [0,1,0,1,0,0|2,0,0]=4 26566 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2I 1626a_100000766693_100000187884 [0,1,0,1,0,0|2,0,0]=4 26567 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2I 240690a_100000766693_100000187884 [0,1,0,1,0,0|2,0,0]=4 26568 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2I 527a_100000766693_100000187884 [0,1,0,1,0,0|2,0,0]=4 26569 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2O 240690a_100000766693_100015234032 [0,1,0,1,0,0|1,0,0]=3 26570 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2[O-] 1626a_100000766693_100009911694 [0,1,0,1,0,0|1,0,1]=4 26571 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2[O-] 240690a_100000766693_100009911694 [0,1,0,1,0,0|1,0,1]=4 26572 B16R2.12488 CC1(CC1)CNC(=O)c2ccccc2[O-] 527a_100000766693_100009911694 [0,1,0,1,0,0|1,0,1]=4 26573 B16R2.12488 CC1(CC1)OCC(=O)c2ccccc2O 7a_100011725673_100000188908 [0,1,0,1,0,0|2,0,0]=4 26574 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)C 11a_100000766693_100000212026 [0,1,0,1,0,0|2,0,0]=4 26575 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)C 1626a_100000766693_100000212026 [0,1,0,1,0,0|2,0,0]=4 26576 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)C 240690a_100000766693_100000212026 [0,1,0,1,0,0|2,0,0]=4 26577 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)C 527a_100000766693_100000212026 [0,1,0,1,0,0|2,0,0]=4 26578 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)O 11a_100011936951_100000212026 [0,1,0,1,0,0|2,0,0]=4 26579 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)O 240690a_100011936951_100000212026 [0,1,0,1,0,0|2,0,0]=4 26580 B16R2.12488 Cc1ccccc1C(=O)NCC2(CC2)O 527a_100011936951_100000212026 [0,1,0,1,0,0|2,0,0]=4 26581 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2Br 11a_100011936951_100000188424 [0,1,0,1,0,0|2,0,0]=4 26582 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2Br 240690a_100011936951_100000188424 [0,1,0,1,0,0|2,0,0]=4 26583 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2Br 527a_100011936951_100000188424 [0,1,0,1,0,0|2,0,0]=4 26584 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2Cl 11a_100011936951_100000185844 [0,1,0,1,0,0|2,0,0]=4 26585 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2Cl 240690a_100011936951_100000185844 [0,1,0,1,0,0|2,0,0]=4 26586 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2Cl 527a_100011936951_100000185844 [0,1,0,1,0,0|2,0,0]=4 26587 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2F 11a_100011936951_100000188656 [0,1,0,1,0,0|2,0,0]=4 26588 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2F 240690a_100011936951_100000188656 [0,1,0,1,0,0|2,0,0]=4 26589 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2F 527a_100011936951_100000188656 [0,1,0,1,0,0|2,0,0]=4 26590 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2I 11a_100011936951_100000187884 [0,1,0,1,0,0|2,0,0]=4 26591 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2I 240690a_100011936951_100000187884 [0,1,0,1,0,0|2,0,0]=4 26592 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2I 527a_100011936951_100000187884 [0,1,0,1,0,0|2,0,0]=4 26593 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2O 240690a_100011936951_100015234032 [0,1,0,1,0,0|1,0,0]=3 26594 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2[O-] 240690a_100011936951_100009911694 [0,1,0,1,0,0|1,0,1]=4 26595 B16R2.12488 O=C(NCC1(CC1)O)c2ccccc2[O-] 527a_100011936951_100009911694 [0,1,0,1,0,0|1,0,1]=4 26596 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Br 11a_100015205115_100000188424 [0,1,0,1,0,0|2,0,0]=4 26597 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Br 1626a_100015205115_100000188424 [0,1,0,1,0,0|2,0,0]=4 26598 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Br 240690a_100015205115_100000188424 [0,1,0,1,0,0|2,0,0]=4 26599 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Br 527a_100015205115_100000188424 [0,1,0,1,0,0|2,0,0]=4 26600 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2C 11a_100015205115_100000212026 [0,1,0,1,0,0|2,0,0]=4 26601 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2C 1626a_100015205115_100000212026 [0,1,0,1,0,0|2,0,0]=4 26602 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2C 240690a_100015205115_100000212026 [0,1,0,1,0,0|2,0,0]=4 26603 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2C 527a_100015205115_100000212026 [0,1,0,1,0,0|2,0,0]=4 26604 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Cl 11a_100015205115_100000185844 [0,1,0,1,0,0|2,0,0]=4 26605 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Cl 1626a_100015205115_100000185844 [0,1,0,1,0,0|2,0,0]=4 26606 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Cl 240690a_100015205115_100000185844 [0,1,0,1,0,0|2,0,0]=4 26607 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2Cl 527a_100015205115_100000185844 [0,1,0,1,0,0|2,0,0]=4 26608 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2F 11a_100015205115_100000188656 [0,1,0,1,0,0|2,0,0]=4 26609 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2F 1626a_100015205115_100000188656 [0,1,0,1,0,0|2,0,0]=4 26610 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2F 240690a_100015205115_100000188656 [0,1,0,1,0,0|2,0,0]=4 26611 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2F 527a_100015205115_100000188656 [0,1,0,1,0,0|2,0,0]=4 26612 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2I 11a_100015205115_100000187884 [0,1,0,1,0,0|2,0,0]=4 26613 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2I 1626a_100015205115_100000187884 [0,1,0,1,0,0|2,0,0]=4 26614 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2I 240690a_100015205115_100000187884 [0,1,0,1,0,0|2,0,0]=4 26615 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2I 527a_100015205115_100000187884 [0,1,0,1,0,0|2,0,0]=4 26616 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2O 240690a_100015205115_100015234032 [0,1,0,1,0,0|1,0,0]=3 26617 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2[O-] 1626a_100015205115_100009911694 [0,1,0,1,0,0|1,0,1]=4 26618 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2[O-] 240690a_100015205115_100009911694 [0,1,0,1,0,0|1,0,1]=4 26619 B16R2.40888 CCC1CN(C1)C(=O)c2ccccc2[O-] 527a_100015205115_100009911694 [0,1,0,1,0,0|1,0,1]=4 26620 B16R2.40888 COC1CN(C1)C(=O)c2ccccc2O 240690a_100000755009_100015234032 [0,1,0,1,0,0|2,0,0]=4 26621 B16R2.40888 CSC1CN(C1)C(=O)c2ccccc2O 240690a_100016990038_100015234032 [0,1,0,1,0,0|2,0,0]=4 26622 B16R2.40888 O=C(c1ccccc1O)N2CC(C2)CF 240690a_100010363649_100015234032 [0,1,0,1,0,0|2,0,0]=4 26623 B16R2.40888 O=C(c1ccccc1O)N2CC(C2)CO 240690a_100016987283_100015234032 [0,1,0,1,0,0|2,0,0]=4 26624 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2Br)O 11a_206633788156_100000188424 [0,1,0,1,0,0|2,0,0]=4 26625 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2Br)O 240690a_206633788156_100000188424 [0,1,0,1,0,0|2,0,0]=4 26626 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2Br)O 527a_206633788156_100000188424 [0,1,0,1,0,0|2,0,0]=4 26627 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2Cl)O 11a_206633788156_100000185844 [0,1,0,1,0,0|2,0,0]=4 26628 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2Cl)O 240690a_206633788156_100000185844 [0,1,0,1,0,0|2,0,0]=4 26629 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2Cl)O 527a_206633788156_100000185844 [0,1,0,1,0,0|2,0,0]=4 26630 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2F)O 11a_206633788156_100000188656 [0,1,0,1,0,0|2,0,0]=4 26631 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2F)O 240690a_206633788156_100000188656 [0,1,0,1,0,0|2,0,0]=4 26632 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2F)O 527a_206633788156_100000188656 [0,1,0,1,0,0|2,0,0]=4 26633 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2I)O 11a_206633788156_100000187884 [0,1,0,1,0,0|2,0,0]=4 26634 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2I)O 240690a_206633788156_100000187884 [0,1,0,1,0,0|2,0,0]=4 26635 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2I)O 527a_206633788156_100000187884 [0,1,0,1,0,0|2,0,0]=4 26636 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2O)O 240690a_206633788156_100015234032 [0,1,0,1,0,0|1,0,0]=3 26637 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2[O-])O 240690a_206633788156_100009911694 [0,1,0,1,0,0|1,0,1]=4 26638 B16R2.83938 C[C@H]1[C@H](CN1C(=O)c2ccccc2[O-])O 527a_206633788156_100009911694 [0,1,0,1,0,0|1,0,1]=4 26639 B16R2.83938 Cc1ccccc1C(=O)N2C[C@@H]([C@@H]2C)O 11a_206633788156_100000212026 [0,1,0,1,0,0|2,0,0]=4 26640 B16R2.83938 Cc1ccccc1C(=O)N2C[C@@H]([C@@H]2C)O 240690a_206633788156_100000212026 [0,1,0,1,0,0|2,0,0]=4 26641 B16R2.83938 Cc1ccccc1C(=O)N2C[C@@H]([C@@H]2C)O 527a_206633788156_100000212026 [0,1,0,1,0,0|2,0,0]=4 26642 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Br 11a_100000741881_100000188424 [0,1,0,1,0,0|2,0,0]=4 26643 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Br 1626a_100000741881_100000188424 [0,1,0,1,0,0|2,0,0]=4 26644 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Br 240690a_100000741881_100000188424 [0,1,0,1,0,0|2,0,0]=4 26645 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Br 527a_100000741881_100000188424 [0,1,0,1,0,0|2,0,0]=4 26646 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Cl 11a_100000741881_100000185844 [0,1,0,1,0,0|2,0,0]=4 26647 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Cl 1626a_100000741881_100000185844 [0,1,0,1,0,0|2,0,0]=4 26648 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Cl 240690a_100000741881_100000185844 [0,1,0,1,0,0|2,0,0]=4 26649 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2Cl 527a_100000741881_100000185844 [0,1,0,1,0,0|2,0,0]=4 26650 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2F 11a_100000741881_100000188656 [0,1,0,1,0,0|2,0,0]=4 26651 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2F 1626a_100000741881_100000188656 [0,1,0,1,0,0|2,0,0]=4 26652 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2F 240690a_100000741881_100000188656 [0,1,0,1,0,0|2,0,0]=4 26653 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2F 527a_100000741881_100000188656 [0,1,0,1,0,0|2,0,0]=4 26654 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2I 11a_100000741881_100000187884 [0,1,0,1,0,0|2,0,0]=4 26655 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2I 1626a_100000741881_100000187884 [0,1,0,1,0,0|2,0,0]=4 26656 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2I 240690a_100000741881_100000187884 [0,1,0,1,0,0|2,0,0]=4 26657 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2I 527a_100000741881_100000187884 [0,1,0,1,0,0|2,0,0]=4 26658 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2O 240690a_100000741881_100015234032 [0,1,0,1,0,0|1,0,0]=3 26659 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2[O-] 1626a_100000741881_100009911694 [0,1,0,1,0,0|1,0,1]=4 26660 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2[O-] 240690a_100000741881_100009911694 [0,1,0,1,0,0|1,0,1]=4 26661 B16R2.12439 CN(CC1CC1)C(=O)c2ccccc2[O-] 527a_100000741881_100009911694 [0,1,0,1,0,0|1,0,1]=4 26662 B16R2.12439 Cc1ccccc1C(=O)N(C)CC2CC2 11a_100000741881_100000212026 [0,1,0,1,0,0|2,0,0]=4 26663 B16R2.12439 Cc1ccccc1C(=O)N(C)CC2CC2 1626a_100000741881_100000212026 [0,1,0,1,0,0|2,0,0]=4 26664 B16R2.12439 Cc1ccccc1C(=O)N(C)CC2CC2 240690a_100000741881_100000212026 [0,1,0,1,0,0|2,0,0]=4 26665 B16R2.12439 Cc1ccccc1C(=O)N(C)CC2CC2 527a_100000741881_100000212026 [0,1,0,1,0,0|2,0,0]=4 26666 B16R2.83999 CN(C(=O)c1ccccc1Br)C2CCC2 11a_100000758072_100000188424 [0,1,0,1,0,0|2,0,0]=4 26667 B16R2.83999 CN(C(=O)c1ccccc1Br)C2CCC2 1626a_100000758072_100000188424 [0,1,0,1,0,0|2,0,0]=4 26668 B16R2.83999 CN(C(=O)c1ccccc1Br)C2CCC2 240690a_100000758072_100000188424 [0,1,0,1,0,0|2,0,0]=4 26669 B16R2.83999 CN(C(=O)c1ccccc1Br)C2CCC2 527a_100000758072_100000188424 [0,1,0,1,0,0|2,0,0]=4 26670 B16R2.83999 CN(C(=O)c1ccccc1Cl)C2CCC2 11a_100000758072_100000185844 [0,1,0,1,0,0|2,0,0]=4 26671 B16R2.83999 CN(C(=O)c1ccccc1Cl)C2CCC2 1626a_100000758072_100000185844 [0,1,0,1,0,0|2,0,0]=4 26672 B16R2.83999 CN(C(=O)c1ccccc1Cl)C2CCC2 240690a_100000758072_100000185844 [0,1,0,1,0,0|2,0,0]=4 26673 B16R2.83999 CN(C(=O)c1ccccc1Cl)C2CCC2 527a_100000758072_100000185844 [0,1,0,1,0,0|2,0,0]=4 26674 B16R2.83999 CN(C(=O)c1ccccc1F)C2CCC2 11a_100000758072_100000188656 [0,1,0,1,0,0|2,0,0]=4 26675 B16R2.83999 CN(C(=O)c1ccccc1F)C2CCC2 1626a_100000758072_100000188656 [0,1,0,1,0,0|2,0,0]=4 26676 B16R2.83999 CN(C(=O)c1ccccc1F)C2CCC2 240690a_100000758072_100000188656 [0,1,0,1,0,0|2,0,0]=4 26677 B16R2.83999 CN(C(=O)c1ccccc1F)C2CCC2 527a_100000758072_100000188656 [0,1,0,1,0,0|2,0,0]=4 26678 B16R2.83999 CN(C(=O)c1ccccc1I)C2CCC2 11a_100000758072_100000187884 [0,1,0,1,0,0|2,0,0]=4 26679 B16R2.83999 CN(C(=O)c1ccccc1I)C2CCC2 1626a_100000758072_100000187884 [0,1,0,1,0,0|2,0,0]=4 26680 B16R2.83999 CN(C(=O)c1ccccc1I)C2CCC2 240690a_100000758072_100000187884 [0,1,0,1,0,0|2,0,0]=4 26681 B16R2.83999 CN(C(=O)c1ccccc1I)C2CCC2 527a_100000758072_100000187884 [0,1,0,1,0,0|2,0,0]=4 26682 B16R2.83999 CN(C(=O)c1ccccc1O)C2CCC2 240690a_100000758072_100015234032 [0,1,0,1,0,0|1,0,0]=3 26683 B16R2.83999 CN(C(=O)c1ccccc1O)C2COC2 240690a_100102693430_100015234032 [0,1,0,1,0,0|2,0,0]=4 26684 B16R2.83999 CN(C(=O)c1ccccc1[O-])C2CCC2 1626a_100000758072_100009911694 [0,1,0,1,0,0|1,0,1]=4 26685 B16R2.83999 CN(C(=O)c1ccccc1[O-])C2CCC2 240690a_100000758072_100009911694 [0,1,0,1,0,0|1,0,1]=4 26686 B16R2.83999 CN(C(=O)c1ccccc1[O-])C2CCC2 527a_100000758072_100009911694 [0,1,0,1,0,0|1,0,1]=4 26687 B16R2.83999 Cc1ccccc1C(=O)N(C)C2CCC2 11a_100000758072_100000212026 [0,1,0,1,0,0|2,0,0]=4 26688 B16R2.83999 Cc1ccccc1C(=O)N(C)C2CCC2 1626a_100000758072_100000212026 [0,1,0,1,0,0|2,0,0]=4 26689 B16R2.83999 Cc1ccccc1C(=O)N(C)C2CCC2 240690a_100000758072_100000212026 [0,1,0,1,0,0|2,0,0]=4 26690 B16R2.83999 Cc1ccccc1C(=O)N(C)C2CCC2 527a_100000758072_100000212026 [0,1,0,1,0,0|2,0,0]=4 26691 B16R2.36 CC(C)CCOc1csc2c1cccc2 34a_100000077758_100000210312 [0,1,0,1,0,0|1,1,0]=4 26692 B16R2.36 CC(C)CCOc1csc2c1cccc2 7a_100000077758_100000210626 [0,1,0,1,0,0|1,1,0]=4 26693 B16R2.36 CC(C)CCSc1coc2c1cccc2 62a_100000210312_100009812202 [0,1,0,1,0,0|1,1,0]=4 26694 B16R2.36 CC(C)CCSc1noc2c1cccc2 62a_100000210312_200000703156 [0,1,0,1,0,0|1,1,0]=4 26695 B16R2.36 CC(C)CCSc1noc2c1cccc2 62a_200000703156_100000210312 [0,1,0,1,0,0|1,1,0]=4 26696 B16R2.36 CC(O)CCOc1csc2c1cccc2 34a_100000077758_100012276601 [0,1,0,1,0,0|1,1,0]=4 26697 B16R2.36 CC(O)CCOc1csc2c1cccc2 7a_100000077758_100012276601 [0,1,0,1,0,0|1,1,0]=4 26698 B16R2.36 CC(O)CCSc1coc2c1cccc2 62a_100012276601_100009812202 [0,1,0,1,0,0|1,1,0]=4 26699 B16R2.36 CC(O)CCSc1noc2c1cccc2 62a_100012276601_200000703156 [0,1,0,1,0,0|1,1,0]=4 26700 B16R2.36 CC(O)CCSc1noc2c1cccc2 62a_200000703156_100012276601 [0,1,0,1,0,0|1,1,0]=4 26701 B16R2.3270 CC(C)[C@@H]1COC(=N1)c2ccccc2O 271570a_203496583355_100015289593 [0,1,0,1,0,0|1,0,0]=3 26702 B16R2.84058 O=C(CC1CC1(F)F)c2ccccc2O 1458a_100015234032_100009817841 [0,1,0,1,0,0|2,0,0]=4 26703 B16R2.84058 O=C(NC1CC1(F)F)c2ccccc2O 240690a_100020610826_100015234032 [0,1,0,1,0,0|2,0,0]=4 26704 B16R2.25683 Cc1cccc(c1C(=O)CCC2CC2)Br 1458a_100000701904_100000694398 [0,1,0,1,0,0|2,0,0]=4 26705 B16R2.25683 Cc1cccc(c1C(=O)CCC2CC2)C 1458a_100000758298_100000694398 [0,1,0,1,0,0|2,0,0]=4 26706 B16R2.25683 Cc1cccc(c1C(=O)CCC2CC2)Cl 1458a_100000692601_100000694398 [0,1,0,1,0,0|2,0,0]=4 26707 B16R2.25683 Cc1cccc(c1C(=O)CCC2CC2)F 1458a_100000762013_100000694398 [0,1,0,1,0,0|2,0,0]=4 26708 B16R2.25683 Cc1cccc(c1C(=O)CCC2CC2)I 1458a_100000688020_100000694398 [0,1,0,1,0,0|2,0,0]=4 26709 B16R2.25683 Cc1cccc(c1C(=O)CCC2CC2)O 1458a_100011934116_100000694398 [0,1,0,1,0,0|1,0,0]=3 26710 B16R2.25683 Cc1cccc(c1C(=O)CCC2CO2)O 1458a_100011934116_100000732470 [0,1,0,1,0,0|2,0,0]=4 26711 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Br 11a_100000735609_100000701904 [0,1,0,1,0,0|2,0,0]=4 26712 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Br 1626a_100000735609_100000701904 [0,1,0,1,0,0|2,0,0]=4 26713 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Br 240690a_100000735609_100000701904 [0,1,0,1,0,0|2,0,0]=4 26714 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Br 527a_100000735609_100000701904 [0,1,0,1,0,0|2,0,0]=4 26715 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)C 11a_100000735609_100000758298 [0,1,0,1,0,0|2,0,0]=4 26716 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)C 1626a_100000735609_100000758298 [0,1,0,1,0,0|2,0,0]=4 26717 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)C 240690a_100000735609_100000758298 [0,1,0,1,0,0|2,0,0]=4 26718 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Cl 11a_100000735609_100000692601 [0,1,0,1,0,0|2,0,0]=4 26719 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Cl 1626a_100000735609_100000692601 [0,1,0,1,0,0|2,0,0]=4 26720 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)Cl 240690a_100000735609_100000692601 [0,1,0,1,0,0|2,0,0]=4 26721 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)F 11a_100000735609_100000762013 [0,1,0,1,0,0|2,0,0]=4 26722 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)F 1626a_100000735609_100000762013 [0,1,0,1,0,0|2,0,0]=4 26723 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)F 240690a_100000735609_100000762013 [0,1,0,1,0,0|2,0,0]=4 26724 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)F 527a_100000735609_100000762013 [0,1,0,1,0,0|2,0,0]=4 26725 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)I 11a_100000735609_100000688020 [0,1,0,1,0,0|2,0,0]=4 26726 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)I 1626a_100000735609_100000688020 [0,1,0,1,0,0|2,0,0]=4 26727 B16R2.25683 Cc1cccc(c1C(=O)NCC2CC2)I 240690a_100000735609_100000688020 [0,1,0,1,0,0|2,0,0]=4 26728 B16R2.25683 Cc1cccc(c1C(=O)NNC2CC2)O 22a_100000701032_100011934116 [0,1,0,1,0,0|2,0,0]=4 26729 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Br)Br 1458a_100000690891_100000694398 [0,1,0,1,0,0|2,0,0]=4 26730 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Br)Cl 1458a_100011253703_100000694398 [0,1,0,1,0,0|2,0,0]=4 26731 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Br)F 1458a_100000752694_100000694398 [0,1,0,1,0,0|2,0,0]=4 26732 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Br)O 1458a_100011935254_100000694398 [0,1,0,1,0,0|1,0,0]=3 26733 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Cl)Cl 1458a_100000210656_100000694398 [0,1,0,1,0,0|2,0,0]=4 26734 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Cl)F 1458a_100000210369_100000694398 [0,1,0,1,0,0|2,0,0]=4 26735 B16R2.25683 O=C(CCC1CC1)c2c(cccc2Cl)O 1458a_100000745519_100000694398 [0,1,0,1,0,0|1,0,0]=3 26736 B16R2.25683 O=C(CCC1CC1)c2c(cccc2F)F 1458a_100000210804_100000694398 [0,1,0,1,0,0|2,0,0]=4 26737 B16R2.25683 O=C(CCC1CC1)c2c(cccc2F)O 1458a_100000763259_100000694398 [0,1,0,1,0,0|1,0,0]=3 26738 B16R2.25683 O=C(CCC1CC1)c2c(cccc2I)Br 1458a_100010232521_100000694398 [0,1,0,1,0,0|2,0,0]=4 26739 B16R2.25683 O=C(CCC1CC1)c2c(cccc2I)Cl 1458a_100000702859_100000694398 [0,1,0,1,0,0|2,0,0]=4 26740 B16R2.25683 O=C(CCC1CC1)c2c(cccc2I)F 1458a_100000023732_100000694398 [0,1,0,1,0,0|2,0,0]=4 26741 B16R2.25683 O=C(CCC1CC1)c2c(cccc2O)O 1458a_100000755285_100000694398 [0,1,0,1,0,0|1,0,0]=3 26742 B16R2.25683 O=C(CCC1CO1)c2c(cccc2Br)O 1458a_100011935254_100000732470 [0,1,0,1,0,0|2,0,0]=4 26743 B16R2.25683 O=C(CCC1CO1)c2c(cccc2Cl)O 1458a_100000745519_100000732470 [0,1,0,1,0,0|2,0,0]=4 26744 B16R2.25683 O=C(CCC1CO1)c2c(cccc2F)O 1458a_100000763259_100000732470 [0,1,0,1,0,0|2,0,0]=4 26745 B16R2.25683 O=C(CCC1CO1)c2c(cccc2O)O 1458a_100000755285_100000732470 [0,1,0,1,0,0|2,0,0]=4 26746 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Br 11a_100000735609_100000690891 [0,1,0,1,0,0|2,0,0]=4 26747 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Br 1626a_100000735609_100000690891 [0,1,0,1,0,0|2,0,0]=4 26748 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Br 240690a_100000735609_100000690891 [0,1,0,1,0,0|2,0,0]=4 26749 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Br 527a_100000735609_100000690891 [0,1,0,1,0,0|2,0,0]=4 26750 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Cl 11a_100000735609_100011253703 [0,1,0,1,0,0|2,0,0]=4 26751 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Cl 1626a_100000735609_100011253703 [0,1,0,1,0,0|2,0,0]=4 26752 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Cl 240690a_100000735609_100011253703 [0,1,0,1,0,0|2,0,0]=4 26753 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)Cl 527a_100000735609_100011253703 [0,1,0,1,0,0|2,0,0]=4 26754 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)F 11a_100000735609_100000752694 [0,1,0,1,0,0|2,0,0]=4 26755 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)F 1626a_100000735609_100000752694 [0,1,0,1,0,0|2,0,0]=4 26756 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)F 240690a_100000735609_100000752694 [0,1,0,1,0,0|2,0,0]=4 26757 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)F 527a_100000735609_100000752694 [0,1,0,1,0,0|2,0,0]=4 26758 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)O 240690a_100000735609_100011935254 [0,1,0,1,0,0|1,0,0]=3 26759 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Br)O 527a_100000735609_100011935254 [0,1,0,1,0,0|1,0,0]=3 26760 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)Cl 11a_100000735609_100000210656 [0,1,0,1,0,0|2,0,0]=4 26761 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)Cl 1626a_100000735609_100000210656 [0,1,0,1,0,0|2,0,0]=4 26762 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)Cl 240690a_100000735609_100000210656 [0,1,0,1,0,0|2,0,0]=4 26763 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)F 11a_100000735609_100000210369 [0,1,0,1,0,0|2,0,0]=4 26764 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)F 1626a_100000735609_100000210369 [0,1,0,1,0,0|2,0,0]=4 26765 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)F 240690a_100000735609_100000210369 [0,1,0,1,0,0|2,0,0]=4 26766 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)F 527a_100000735609_100000210369 [0,1,0,1,0,0|2,0,0]=4 26767 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)O 240690a_100000735609_100000745519 [0,1,0,1,0,0|1,0,0]=3 26768 B16R2.25683 O=C(NCC1CC1)c2c(cccc2Cl)O 527a_100000735609_100000745519 [0,1,0,1,0,0|1,0,0]=3 26769 B16R2.25683 O=C(NCC1CC1)c2c(cccc2F)F 11a_100000735609_100000210804 [0,1,0,1,0,0|2,0,0]=4 26770 B16R2.25683 O=C(NCC1CC1)c2c(cccc2F)F 1626a_100000735609_100000210804 [0,1,0,1,0,0|2,0,0]=4 26771 B16R2.25683 O=C(NCC1CC1)c2c(cccc2F)F 240690a_100000735609_100000210804 [0,1,0,1,0,0|2,0,0]=4 26772 B16R2.25683 O=C(NCC1CC1)c2c(cccc2F)F 527a_100000735609_100000210804 [0,1,0,1,0,0|2,0,0]=4 26773 B16R2.25683 O=C(NCC1CC1)c2c(cccc2F)O 527a_100000735609_100000763259 [0,1,0,1,0,0|1,0,0]=3 26774 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Br 11a_100000735609_100010232521 [0,1,0,1,0,0|2,0,0]=4 26775 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Br 1626a_100000735609_100010232521 [0,1,0,1,0,0|2,0,0]=4 26776 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Br 240690a_100000735609_100010232521 [0,1,0,1,0,0|2,0,0]=4 26777 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Br 527a_100000735609_100010232521 [0,1,0,1,0,0|2,0,0]=4 26778 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Cl 11a_100000735609_100000702859 [0,1,0,1,0,0|2,0,0]=4 26779 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Cl 1626a_100000735609_100000702859 [0,1,0,1,0,0|2,0,0]=4 26780 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Cl 240690a_100000735609_100000702859 [0,1,0,1,0,0|2,0,0]=4 26781 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)Cl 527a_100000735609_100000702859 [0,1,0,1,0,0|2,0,0]=4 26782 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)F 11a_100000735609_100000023732 [0,1,0,1,0,0|2,0,0]=4 26783 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)F 1626a_100000735609_100000023732 [0,1,0,1,0,0|2,0,0]=4 26784 B16R2.25683 O=C(NCC1CC1)c2c(cccc2I)F 240690a_100000735609_100000023732 [0,1,0,1,0,0|2,0,0]=4 26785 B16R2.25683 O=C(NCC1CC1)c2c(cccc2O)O 527a_100000735609_100000755285 [0,1,0,1,0,0|1,0,0]=3 26786 B16R2.25683 O=C(NNC1CC1)c2c(cccc2Br)O 22a_100000701032_100011935254 [0,1,0,1,0,0|2,0,0]=4 26787 B16R2.25683 O=C(NNC1CC1)c2c(cccc2Cl)O 22a_100000701032_100000745519 [0,1,0,1,0,0|2,0,0]=4 26788 B16R2.25683 O=C(NNC1CC1)c2c(cccc2F)O 22a_100000701032_100000763259 [0,1,0,1,0,0|2,0,0]=4 26789 B16R2.25684 Cc1cccc(c1C(=O)C2CCCC2)Br 1458a_100000701904_100000179811 [0,1,0,1,0,0|2,0,0]=4 26790 B16R2.25684 Cc1cccc(c1C(=O)C2CCCC2)C 1458a_100000758298_100000179811 [0,1,0,1,0,0|2,0,0]=4 26791 B16R2.25684 Cc1cccc(c1C(=O)C2CCCC2)Cl 1458a_100000692601_100000179811 [0,1,0,1,0,0|2,0,0]=4 26792 B16R2.25684 Cc1cccc(c1C(=O)C2CCCC2)F 1458a_100000762013_100000179811 [0,1,0,1,0,0|2,0,0]=4 26793 B16R2.25684 Cc1cccc(c1C(=O)C2CCCC2)I 1458a_100000688020_100000179811 [0,1,0,1,0,0|2,0,0]=4 26794 B16R2.25684 Cc1cccc(c1C(=O)C2CCCC2)O 1458a_100011934116_100000179811 [0,1,0,1,0,0|1,0,0]=3 26795 B16R2.25684 Cc1cccc(c1C(=O)C2CCOC2)O 1458a_100011934116_100000690089 [0,1,0,1,0,0|2,0,0]=4 26796 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)Br 240690a_100000188435_100000701904 [0,1,0,1,0,0|2,0,0]=4 26797 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)Br 527a_100000188435_100000701904 [0,1,0,1,0,0|2,0,0]=4 26798 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)C 240690a_100000188435_100000758298 [0,1,0,1,0,0|2,0,0]=4 26799 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)Cl 240690a_100000188435_100000692601 [0,1,0,1,0,0|2,0,0]=4 26800 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)F 240690a_100000188435_100000762013 [0,1,0,1,0,0|2,0,0]=4 26801 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)F 527a_100000188435_100000762013 [0,1,0,1,0,0|2,0,0]=4 26802 B16R2.25684 Cc1cccc(c1C(=O)N2CCCC2)I 240690a_100000188435_100000688020 [0,1,0,1,0,0|2,0,0]=4 26803 B16R2.25684 O=C(c1c(cccc1Br)Br)C2CCCC2 1458a_100000690891_100000179811 [0,1,0,1,0,0|2,0,0]=4 26804 B16R2.25684 O=C(c1c(cccc1Br)Br)N2CCCC2 240690a_100000188435_100000690891 [0,1,0,1,0,0|2,0,0]=4 26805 B16R2.25684 O=C(c1c(cccc1Br)Br)N2CCCC2 527a_100000188435_100000690891 [0,1,0,1,0,0|2,0,0]=4 26806 B16R2.25684 O=C(c1c(cccc1Br)Cl)C2CCCC2 1458a_100011253703_100000179811 [0,1,0,1,0,0|2,0,0]=4 26807 B16R2.25684 O=C(c1c(cccc1Br)Cl)N2CCCC2 240690a_100000188435_100011253703 [0,1,0,1,0,0|2,0,0]=4 26808 B16R2.25684 O=C(c1c(cccc1Br)Cl)N2CCCC2 527a_100000188435_100011253703 [0,1,0,1,0,0|2,0,0]=4 26809 B16R2.25684 O=C(c1c(cccc1Br)F)C2CCCC2 1458a_100000752694_100000179811 [0,1,0,1,0,0|2,0,0]=4 26810 B16R2.25684 O=C(c1c(cccc1Br)F)N2CCCC2 240690a_100000188435_100000752694 [0,1,0,1,0,0|2,0,0]=4 26811 B16R2.25684 O=C(c1c(cccc1Br)F)N2CCCC2 527a_100000188435_100000752694 [0,1,0,1,0,0|2,0,0]=4 26812 B16R2.25684 O=C(c1c(cccc1Br)O)C2CCCC2 1458a_100011935254_100000179811 [0,1,0,1,0,0|1,0,0]=3 26813 B16R2.25684 O=C(c1c(cccc1Br)O)C2CCOC2 1458a_100011935254_100000690089 [0,1,0,1,0,0|2,0,0]=4 26814 B16R2.25684 O=C(c1c(cccc1Br)O)N2CCCC2 240690a_100000188435_100011935254 [0,1,0,1,0,0|1,0,0]=3 26815 B16R2.25684 O=C(c1c(cccc1Br)O)N2CCCC2 527a_100000188435_100011935254 [0,1,0,1,0,0|1,0,0]=3 26816 B16R2.25684 O=C(c1c(cccc1Br)O)N2CCSC2 240690a_100011215254_100011935254 [0,1,0,1,0,0|2,0,0]=4 26817 B16R2.25684 O=C(c1c(cccc1Br)O)N2CCSC2 527a_100011215254_100011935254 [0,1,0,1,0,0|2,0,0]=4 26818 B16R2.25684 O=C(c1c(cccc1Cl)Cl)C2CCCC2 1458a_100000210656_100000179811 [0,1,0,1,0,0|2,0,0]=4 26819 B16R2.25684 O=C(c1c(cccc1Cl)Cl)N2CCCC2 240690a_100000188435_100000210656 [0,1,0,1,0,0|2,0,0]=4 26820 B16R2.25684 O=C(c1c(cccc1Cl)F)C2CCCC2 1458a_100000210369_100000179811 [0,1,0,1,0,0|2,0,0]=4 26821 B16R2.25684 O=C(c1c(cccc1Cl)F)N2CCCC2 240690a_100000188435_100000210369 [0,1,0,1,0,0|2,0,0]=4 26822 B16R2.25684 O=C(c1c(cccc1Cl)F)N2CCCC2 527a_100000188435_100000210369 [0,1,0,1,0,0|2,0,0]=4 26823 B16R2.25684 O=C(c1c(cccc1Cl)O)C2CCCC2 1458a_100000745519_100000179811 [0,1,0,1,0,0|1,0,0]=3 26824 B16R2.25684 O=C(c1c(cccc1Cl)O)C2CCOC2 1458a_100000745519_100000690089 [0,1,0,1,0,0|2,0,0]=4 26825 B16R2.25684 O=C(c1c(cccc1Cl)O)N2CCCC2 240690a_100000188435_100000745519 [0,1,0,1,0,0|1,0,0]=3 26826 B16R2.25684 O=C(c1c(cccc1Cl)O)N2CCCC2 527a_100000188435_100000745519 [0,1,0,1,0,0|1,0,0]=3 26827 B16R2.25684 O=C(c1c(cccc1Cl)O)N2CCSC2 240690a_100011215254_100000745519 [0,1,0,1,0,0|2,0,0]=4 26828 B16R2.25684 O=C(c1c(cccc1Cl)O)N2CCSC2 527a_100011215254_100000745519 [0,1,0,1,0,0|2,0,0]=4 26829 B16R2.25684 O=C(c1c(cccc1F)F)C2CCCC2 1458a_100000210804_100000179811 [0,1,0,1,0,0|2,0,0]=4 26830 B16R2.25684 O=C(c1c(cccc1F)F)N2CCCC2 240690a_100000188435_100000210804 [0,1,0,1,0,0|2,0,0]=4 26831 B16R2.25684 O=C(c1c(cccc1F)F)N2CCCC2 527a_100000188435_100000210804 [0,1,0,1,0,0|2,0,0]=4 26832 B16R2.25684 O=C(c1c(cccc1F)O)C2CCCC2 1458a_100000763259_100000179811 [0,1,0,1,0,0|1,0,0]=3 26833 B16R2.25684 O=C(c1c(cccc1F)O)C2CCOC2 1458a_100000763259_100000690089 [0,1,0,1,0,0|2,0,0]=4 26834 B16R2.25684 O=C(c1c(cccc1F)O)N2CCCC2 527a_100000188435_100000763259 [0,1,0,1,0,0|1,0,0]=3 26835 B16R2.25684 O=C(c1c(cccc1F)O)N2CCSC2 527a_100011215254_100000763259 [0,1,0,1,0,0|2,0,0]=4 26836 B16R2.25684 O=C(c1c(cccc1I)Br)C2CCCC2 1458a_100010232521_100000179811 [0,1,0,1,0,0|2,0,0]=4 26837 B16R2.25684 O=C(c1c(cccc1I)Br)N2CCCC2 240690a_100000188435_100010232521 [0,1,0,1,0,0|2,0,0]=4 26838 B16R2.25684 O=C(c1c(cccc1I)Br)N2CCCC2 527a_100000188435_100010232521 [0,1,0,1,0,0|2,0,0]=4 26839 B16R2.25684 O=C(c1c(cccc1I)Cl)C2CCCC2 1458a_100000702859_100000179811 [0,1,0,1,0,0|2,0,0]=4 26840 B16R2.25684 O=C(c1c(cccc1I)Cl)N2CCCC2 240690a_100000188435_100000702859 [0,1,0,1,0,0|2,0,0]=4 26841 B16R2.25684 O=C(c1c(cccc1I)Cl)N2CCCC2 527a_100000188435_100000702859 [0,1,0,1,0,0|2,0,0]=4 26842 B16R2.25684 O=C(c1c(cccc1I)F)C2CCCC2 1458a_100000023732_100000179811 [0,1,0,1,0,0|2,0,0]=4 26843 B16R2.25684 O=C(c1c(cccc1I)F)N2CCCC2 240690a_100000188435_100000023732 [0,1,0,1,0,0|2,0,0]=4 26844 B16R2.25684 O=C(c1c(cccc1O)O)C2CCCC2 1458a_100000755285_100000179811 [0,1,0,1,0,0|1,0,0]=3 26845 B16R2.25684 O=C(c1c(cccc1O)O)C2CCOC2 1458a_100000755285_100000690089 [0,1,0,1,0,0|2,0,0]=4 26846 B16R2.25684 O=C(c1c(cccc1O)O)N2CCCC2 527a_100000188435_100000755285 [0,1,0,1,0,0|1,0,0]=3 26847 B16R2.25684 O=C(c1c(cccc1O)O)N2CCSC2 527a_100011215254_100000755285 [0,1,0,1,0,0|2,0,0]=4 26848 B16R2.25775 Cc1cccc(c1C(=O)CC2CCC2)Br 1458a_100000701904_100000763275 [0,1,0,1,0,0|2,0,0]=4 26849 B16R2.25775 Cc1cccc(c1C(=O)CC2CCC2)C 1458a_100000758298_100000763275 [0,1,0,1,0,0|2,0,0]=4 26850 B16R2.25775 Cc1cccc(c1C(=O)CC2CCC2)Cl 1458a_100000692601_100000763275 [0,1,0,1,0,0|2,0,0]=4 26851 B16R2.25775 Cc1cccc(c1C(=O)CC2CCC2)F 1458a_100000762013_100000763275 [0,1,0,1,0,0|2,0,0]=4 26852 B16R2.25775 Cc1cccc(c1C(=O)CC2CCC2)I 1458a_100000688020_100000763275 [0,1,0,1,0,0|2,0,0]=4 26853 B16R2.25775 Cc1cccc(c1C(=O)CC2CCC2)O 1458a_100011934116_100000763275 [0,1,0,1,0,0|1,0,0]=3 26854 B16R2.25775 Cc1cccc(c1C(=O)CC2CCO2)O 1458a_100011934116_100000103362 [0,1,0,1,0,0|2,0,0]=4 26855 B16R2.25775 Cc1cccc(c1C(=O)CC2COC2)O 1458a_100011934116_100010264016 [0,1,0,1,0,0|2,0,0]=4 26856 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Br 11a_100000749019_100000701904 [0,1,0,1,0,0|2,0,0]=4 26857 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Br 1626a_100000749019_100000701904 [0,1,0,1,0,0|2,0,0]=4 26858 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Br 240690a_100000749019_100000701904 [0,1,0,1,0,0|2,0,0]=4 26859 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Br 527a_100000749019_100000701904 [0,1,0,1,0,0|2,0,0]=4 26860 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)C 11a_100000749019_100000758298 [0,1,0,1,0,0|2,0,0]=4 26861 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)C 1626a_100000749019_100000758298 [0,1,0,1,0,0|2,0,0]=4 26862 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)C 240690a_100000749019_100000758298 [0,1,0,1,0,0|2,0,0]=4 26863 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Cl 11a_100000749019_100000692601 [0,1,0,1,0,0|2,0,0]=4 26864 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Cl 1626a_100000749019_100000692601 [0,1,0,1,0,0|2,0,0]=4 26865 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)Cl 240690a_100000749019_100000692601 [0,1,0,1,0,0|2,0,0]=4 26866 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)F 11a_100000749019_100000762013 [0,1,0,1,0,0|2,0,0]=4 26867 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)F 1626a_100000749019_100000762013 [0,1,0,1,0,0|2,0,0]=4 26868 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)F 240690a_100000749019_100000762013 [0,1,0,1,0,0|2,0,0]=4 26869 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)F 527a_100000749019_100000762013 [0,1,0,1,0,0|2,0,0]=4 26870 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)I 11a_100000749019_100000688020 [0,1,0,1,0,0|2,0,0]=4 26871 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)I 1626a_100000749019_100000688020 [0,1,0,1,0,0|2,0,0]=4 26872 B16R2.25775 Cc1cccc(c1C(=O)NC2CCC2)I 240690a_100000749019_100000688020 [0,1,0,1,0,0|2,0,0]=4 26873 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Br)Br 1458a_100000690891_100000763275 [0,1,0,1,0,0|2,0,0]=4 26874 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Br)Cl 1458a_100011253703_100000763275 [0,1,0,1,0,0|2,0,0]=4 26875 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Br)F 1458a_100000752694_100000763275 [0,1,0,1,0,0|2,0,0]=4 26876 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Br)O 1458a_100011935254_100000763275 [0,1,0,1,0,0|1,0,0]=3 26877 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Cl)Cl 1458a_100000210656_100000763275 [0,1,0,1,0,0|2,0,0]=4 26878 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Cl)F 1458a_100000210369_100000763275 [0,1,0,1,0,0|2,0,0]=4 26879 B16R2.25775 O=C(CC1CCC1)c2c(cccc2Cl)O 1458a_100000745519_100000763275 [0,1,0,1,0,0|1,0,0]=3 26880 B16R2.25775 O=C(CC1CCC1)c2c(cccc2F)F 1458a_100000210804_100000763275 [0,1,0,1,0,0|2,0,0]=4 26881 B16R2.25775 O=C(CC1CCC1)c2c(cccc2F)O 1458a_100000763259_100000763275 [0,1,0,1,0,0|1,0,0]=3 26882 B16R2.25775 O=C(CC1CCC1)c2c(cccc2I)Br 1458a_100010232521_100000763275 [0,1,0,1,0,0|2,0,0]=4 26883 B16R2.25775 O=C(CC1CCC1)c2c(cccc2I)Cl 1458a_100000702859_100000763275 [0,1,0,1,0,0|2,0,0]=4 26884 B16R2.25775 O=C(CC1CCC1)c2c(cccc2I)F 1458a_100000023732_100000763275 [0,1,0,1,0,0|2,0,0]=4 26885 B16R2.25775 O=C(CC1CCC1)c2c(cccc2O)O 1458a_100000755285_100000763275 [0,1,0,1,0,0|1,0,0]=3 26886 B16R2.25775 O=C(CC1CCO1)c2c(cccc2Br)O 1458a_100011935254_100000103362 [0,1,0,1,0,0|2,0,0]=4 26887 B16R2.25775 O=C(CC1CCO1)c2c(cccc2Cl)O 1458a_100000745519_100000103362 [0,1,0,1,0,0|2,0,0]=4 26888 B16R2.25775 O=C(CC1CCO1)c2c(cccc2F)O 1458a_100000763259_100000103362 [0,1,0,1,0,0|2,0,0]=4 26889 B16R2.25775 O=C(CC1CCO1)c2c(cccc2O)O 1458a_100000755285_100000103362 [0,1,0,1,0,0|2,0,0]=4 26890 B16R2.25775 O=C(CC1COC1)c2c(cccc2Br)O 1458a_100011935254_100010264016 [0,1,0,1,0,0|2,0,0]=4 26891 B16R2.25775 O=C(CC1COC1)c2c(cccc2Cl)O 1458a_100000745519_100010264016 [0,1,0,1,0,0|2,0,0]=4 26892 B16R2.25775 O=C(CC1COC1)c2c(cccc2F)O 1458a_100000763259_100010264016 [0,1,0,1,0,0|2,0,0]=4 26893 B16R2.25775 O=C(CC1COC1)c2c(cccc2O)O 1458a_100000755285_100010264016 [0,1,0,1,0,0|2,0,0]=4 26894 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Br 11a_100000749019_100000690891 [0,1,0,1,0,0|2,0,0]=4 26895 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Br 1626a_100000749019_100000690891 [0,1,0,1,0,0|2,0,0]=4 26896 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Br 240690a_100000749019_100000690891 [0,1,0,1,0,0|2,0,0]=4 26897 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Br 527a_100000749019_100000690891 [0,1,0,1,0,0|2,0,0]=4 26898 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Cl 11a_100000749019_100011253703 [0,1,0,1,0,0|2,0,0]=4 26899 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Cl 1626a_100000749019_100011253703 [0,1,0,1,0,0|2,0,0]=4 26900 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Cl 240690a_100000749019_100011253703 [0,1,0,1,0,0|2,0,0]=4 26901 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)Cl 527a_100000749019_100011253703 [0,1,0,1,0,0|2,0,0]=4 26902 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)F 11a_100000749019_100000752694 [0,1,0,1,0,0|2,0,0]=4 26903 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)F 1626a_100000749019_100000752694 [0,1,0,1,0,0|2,0,0]=4 26904 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)F 240690a_100000749019_100000752694 [0,1,0,1,0,0|2,0,0]=4 26905 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)F 527a_100000749019_100000752694 [0,1,0,1,0,0|2,0,0]=4 26906 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)O 240690a_100000749019_100011935254 [0,1,0,1,0,0|1,0,0]=3 26907 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Br)O 527a_100000749019_100011935254 [0,1,0,1,0,0|1,0,0]=3 26908 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)Cl 11a_100000749019_100000210656 [0,1,0,1,0,0|2,0,0]=4 26909 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)Cl 1626a_100000749019_100000210656 [0,1,0,1,0,0|2,0,0]=4 26910 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)Cl 240690a_100000749019_100000210656 [0,1,0,1,0,0|2,0,0]=4 26911 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)F 11a_100000749019_100000210369 [0,1,0,1,0,0|2,0,0]=4 26912 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)F 1626a_100000749019_100000210369 [0,1,0,1,0,0|2,0,0]=4 26913 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)F 240690a_100000749019_100000210369 [0,1,0,1,0,0|2,0,0]=4 26914 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)F 527a_100000749019_100000210369 [0,1,0,1,0,0|2,0,0]=4 26915 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)O 240690a_100000749019_100000745519 [0,1,0,1,0,0|1,0,0]=3 26916 B16R2.25775 O=C(NC1CCC1)c2c(cccc2Cl)O 527a_100000749019_100000745519 [0,1,0,1,0,0|1,0,0]=3 26917 B16R2.25775 O=C(NC1CCC1)c2c(cccc2F)F 11a_100000749019_100000210804 [0,1,0,1,0,0|2,0,0]=4 26918 B16R2.25775 O=C(NC1CCC1)c2c(cccc2F)F 1626a_100000749019_100000210804 [0,1,0,1,0,0|2,0,0]=4 26919 B16R2.25775 O=C(NC1CCC1)c2c(cccc2F)F 240690a_100000749019_100000210804 [0,1,0,1,0,0|2,0,0]=4 26920 B16R2.25775 O=C(NC1CCC1)c2c(cccc2F)F 527a_100000749019_100000210804 [0,1,0,1,0,0|2,0,0]=4 26921 B16R2.25775 O=C(NC1CCC1)c2c(cccc2F)O 527a_100000749019_100000763259 [0,1,0,1,0,0|1,0,0]=3 26922 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Br 11a_100000749019_100010232521 [0,1,0,1,0,0|2,0,0]=4 26923 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Br 1626a_100000749019_100010232521 [0,1,0,1,0,0|2,0,0]=4 26924 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Br 240690a_100000749019_100010232521 [0,1,0,1,0,0|2,0,0]=4 26925 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Br 527a_100000749019_100010232521 [0,1,0,1,0,0|2,0,0]=4 26926 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Cl 11a_100000749019_100000702859 [0,1,0,1,0,0|2,0,0]=4 26927 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Cl 1626a_100000749019_100000702859 [0,1,0,1,0,0|2,0,0]=4 26928 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Cl 240690a_100000749019_100000702859 [0,1,0,1,0,0|2,0,0]=4 26929 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)Cl 527a_100000749019_100000702859 [0,1,0,1,0,0|2,0,0]=4 26930 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)F 11a_100000749019_100000023732 [0,1,0,1,0,0|2,0,0]=4 26931 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)F 1626a_100000749019_100000023732 [0,1,0,1,0,0|2,0,0]=4 26932 B16R2.25775 O=C(NC1CCC1)c2c(cccc2I)F 240690a_100000749019_100000023732 [0,1,0,1,0,0|2,0,0]=4 26933 B16R2.25775 O=C(NC1CCC1)c2c(cccc2O)O 527a_100000749019_100000755285 [0,1,0,1,0,0|1,0,0]=3 26934 B16R2.25775 O=C(NC1COC1)c2c(cccc2Br)O 240690a_100016991112_100011935254 [0,1,0,1,0,0|2,0,0]=4 26935 B16R2.25775 O=C(NC1COC1)c2c(cccc2Br)O 527a_100016991112_100011935254 [0,1,0,1,0,0|2,0,0]=4 26936 B16R2.25775 O=C(NC1COC1)c2c(cccc2Cl)O 240690a_100016991112_100000745519 [0,1,0,1,0,0|2,0,0]=4 26937 B16R2.25775 O=C(NC1COC1)c2c(cccc2Cl)O 527a_100016991112_100000745519 [0,1,0,1,0,0|2,0,0]=4 26938 B16R2.25775 O=C(NC1COC1)c2c(cccc2F)O 527a_100016991112_100000763259 [0,1,0,1,0,0|2,0,0]=4 26939 B16R2.25775 O=C(NC1COC1)c2c(cccc2O)O 527a_100016991112_100000755285 [0,1,0,1,0,0|2,0,0]=4 26940 B16R2.25775 O=C(NC1CSC1)c2c(cccc2Br)O 240690a_100016994217_100011935254 [0,1,0,1,0,0|2,0,0]=4 26941 B16R2.25775 O=C(NC1CSC1)c2c(cccc2Br)O 527a_100016994217_100011935254 [0,1,0,1,0,0|2,0,0]=4 26942 B16R2.25775 O=C(NC1CSC1)c2c(cccc2Cl)O 240690a_100016994217_100000745519 [0,1,0,1,0,0|2,0,0]=4 26943 B16R2.25775 O=C(NC1CSC1)c2c(cccc2Cl)O 527a_100016994217_100000745519 [0,1,0,1,0,0|2,0,0]=4 26944 B16R2.25775 O=C(NC1CSC1)c2c(cccc2F)O 527a_100016994217_100000763259 [0,1,0,1,0,0|2,0,0]=4 26945 B16R2.25775 O=C(NC1CSC1)c2c(cccc2O)O 527a_100016994217_100000755285 [0,1,0,1,0,0|2,0,0]=4 26946 B16R2.25791 Cc1cccc(c1C2=CCCCCC2)O 271570a_200009888920_100000686692 [0,1,0,1,0,0|2,0,0]=4 26947 B16R2.25791 Nc1cccc(c1C2=CCCCCC2)O 271570a_200009888920_100012183704 [0,1,0,1,0,0|2,0,0]=4 26948 B16R2.25791 Oc1cccc(c1C2=CCCCCC2)Br 271570a_200009888920_100010187912 [0,1,0,1,0,0|2,0,0]=4 26949 B16R2.25791 Oc1cccc(c1C2=CCCCCC2)Cl 271570a_200009888920_100000050174 [0,1,0,1,0,0|2,0,0]=4 26950 B16R2.25791 Oc1cccc(c1C2=CCCCCC2)F 271570a_200009888920_100009820682 [0,1,0,1,0,0|2,0,0]=4 26951 B16R2.25791 Oc1cccc(c1C2=CCCCCC2)O 271570a_200009888920_100010205330 [0,1,0,1,0,0|2,0,0]=4 26952 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)Br 11a_100000755817_100000690891 [0,1,0,1,0,0|2,0,0]=4 26953 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)Br 240690a_100000755817_100000690891 [0,1,0,1,0,0|2,0,0]=4 26954 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)Br 527a_100000755817_100000690891 [0,1,0,1,0,0|2,0,0]=4 26955 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)Cl 11a_100000755817_100011253703 [0,1,0,1,0,0|2,0,0]=4 26956 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)Cl 240690a_100000755817_100011253703 [0,1,0,1,0,0|2,0,0]=4 26957 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)Cl 527a_100000755817_100011253703 [0,1,0,1,0,0|2,0,0]=4 26958 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)F 11a_100000755817_100000752694 [0,1,0,1,0,0|2,0,0]=4 26959 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)F 240690a_100000755817_100000752694 [0,1,0,1,0,0|2,0,0]=4 26960 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)F 527a_100000755817_100000752694 [0,1,0,1,0,0|2,0,0]=4 26961 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)O 240690a_100000755817_100011935254 [0,1,0,1,0,0|1,0,0]=3 26962 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Br)O 527a_100000755817_100011935254 [0,1,0,1,0,0|1,0,0]=3 26963 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)Cl 11a_100000755817_100000210656 [0,1,0,1,0,0|2,0,0]=4 26964 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)Cl 240690a_100000755817_100000210656 [0,1,0,1,0,0|2,0,0]=4 26965 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)F 11a_100000755817_100000210369 [0,1,0,1,0,0|2,0,0]=4 26966 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)F 240690a_100000755817_100000210369 [0,1,0,1,0,0|2,0,0]=4 26967 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)F 527a_100000755817_100000210369 [0,1,0,1,0,0|2,0,0]=4 26968 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)O 240690a_100000755817_100000745519 [0,1,0,1,0,0|1,0,0]=3 26969 B16R2.136416 CC1CCN1C(=O)c2c(cccc2Cl)O 527a_100000755817_100000745519 [0,1,0,1,0,0|1,0,0]=3 26970 B16R2.136416 CC1CCN1C(=O)c2c(cccc2F)F 11a_100000755817_100000210804 [0,1,0,1,0,0|2,0,0]=4 26971 B16R2.136416 CC1CCN1C(=O)c2c(cccc2F)F 240690a_100000755817_100000210804 [0,1,0,1,0,0|2,0,0]=4 26972 B16R2.136416 CC1CCN1C(=O)c2c(cccc2F)F 527a_100000755817_100000210804 [0,1,0,1,0,0|2,0,0]=4 26973 B16R2.136416 CC1CCN1C(=O)c2c(cccc2F)O 527a_100000755817_100000763259 [0,1,0,1,0,0|1,0,0]=3 26974 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)Br 11a_100000755817_100010232521 [0,1,0,1,0,0|2,0,0]=4 26975 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)Br 240690a_100000755817_100010232521 [0,1,0,1,0,0|2,0,0]=4 26976 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)Br 527a_100000755817_100010232521 [0,1,0,1,0,0|2,0,0]=4 26977 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)Cl 11a_100000755817_100000702859 [0,1,0,1,0,0|2,0,0]=4 26978 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)Cl 240690a_100000755817_100000702859 [0,1,0,1,0,0|2,0,0]=4 26979 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)Cl 527a_100000755817_100000702859 [0,1,0,1,0,0|2,0,0]=4 26980 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)F 11a_100000755817_100000023732 [0,1,0,1,0,0|2,0,0]=4 26981 B16R2.136416 CC1CCN1C(=O)c2c(cccc2I)F 240690a_100000755817_100000023732 [0,1,0,1,0,0|2,0,0]=4 26982 B16R2.136416 CC1CCN1C(=O)c2c(cccc2O)O 527a_100000755817_100000755285 [0,1,0,1,0,0|1,0,0]=3 26983 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)Br 11a_100000755817_100000701904 [0,1,0,1,0,0|2,0,0]=4 26984 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)Br 240690a_100000755817_100000701904 [0,1,0,1,0,0|2,0,0]=4 26985 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)Br 527a_100000755817_100000701904 [0,1,0,1,0,0|2,0,0]=4 26986 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)C 11a_100000755817_100000758298 [0,1,0,1,0,0|2,0,0]=4 26987 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)C 240690a_100000755817_100000758298 [0,1,0,1,0,0|2,0,0]=4 26988 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)Cl 11a_100000755817_100000692601 [0,1,0,1,0,0|2,0,0]=4 26989 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)Cl 240690a_100000755817_100000692601 [0,1,0,1,0,0|2,0,0]=4 26990 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)F 11a_100000755817_100000762013 [0,1,0,1,0,0|2,0,0]=4 26991 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)F 240690a_100000755817_100000762013 [0,1,0,1,0,0|2,0,0]=4 26992 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)F 527a_100000755817_100000762013 [0,1,0,1,0,0|2,0,0]=4 26993 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)I 11a_100000755817_100000688020 [0,1,0,1,0,0|2,0,0]=4 26994 B16R2.136416 Cc1cccc(c1C(=O)N2CCC2C)I 240690a_100000755817_100000688020 [0,1,0,1,0,0|2,0,0]=4 26995 B16R2.136632 O=C(N[C@@H]1C[C@@H]1F)c2c(cccc2Br)O 240690a_100015190264_100011935254 [0,1,0,1,0,0|2,0,0]=4 26996 B16R2.136632 O=C(N[C@@H]1C[C@@H]1F)c2c(cccc2Br)O 527a_100015190264_100011935254 [0,1,0,1,0,0|2,0,0]=4 26997 B16R2.136632 O=C(N[C@@H]1C[C@@H]1F)c2c(cccc2Cl)O 240690a_100015190264_100000745519 [0,1,0,1,0,0|2,0,0]=4 26998 B16R2.136632 O=C(N[C@@H]1C[C@@H]1F)c2c(cccc2Cl)O 527a_100015190264_100000745519 [0,1,0,1,0,0|2,0,0]=4 26999 B16R2.136632 O=C(N[C@@H]1C[C@@H]1F)c2c(cccc2F)O 527a_100015190264_100000763259 [0,1,0,1,0,0|2,0,0]=4 27000 B16R2.136632 O=C(N[C@@H]1C[C@@H]1F)c2c(cccc2O)O 527a_100015190264_100000755285 [0,1,0,1,0,0|2,0,0]=4 27001 B16R2.136632 O=C(N[C@@H]1C[C@H]1F)c2c(cccc2Br)O 240690a_100025746932_100011935254 [0,1,0,1,0,0|2,0,0]=4 27002 B16R2.136632 O=C(N[C@@H]1C[C@H]1F)c2c(cccc2Br)O 527a_100025746932_100011935254 [0,1,0,1,0,0|2,0,0]=4 27003 B16R2.136632 O=C(N[C@@H]1C[C@H]1F)c2c(cccc2Cl)O 240690a_100025746932_100000745519 [0,1,0,1,0,0|2,0,0]=4 27004 B16R2.136632 O=C(N[C@@H]1C[C@H]1F)c2c(cccc2Cl)O 527a_100025746932_100000745519 [0,1,0,1,0,0|2,0,0]=4 27005 B16R2.136632 O=C(N[C@@H]1C[C@H]1F)c2c(cccc2F)O 527a_100025746932_100000763259 [0,1,0,1,0,0|2,0,0]=4 27006 B16R2.136632 O=C(N[C@@H]1C[C@H]1F)c2c(cccc2O)O 527a_100025746932_100000755285 [0,1,0,1,0,0|2,0,0]=4 27007 B16R3.1813 c1ccc2c(csc2c1)OC3CCC3 34a_100000077758_100000749161 [0,0,0,2,0,0|1,1,0]=4 27008 B16R3.1813 c1ccc2c(noc2c1)SC3CCC3 62a_200000703156_100000749161 [0,0,0,2,0,0|1,1,0]=4 27009 B16R3.1814 c1ccc2c(coc2c1)SCC3CC3 62a_100000756562_100009812202 [0,0,0,2,0,0|1,1,0]=4 27010 B16R3.1814 c1ccc2c(csc2c1)OCC3CC3 34a_100000077758_100000742324 [0,0,0,2,0,0|1,1,0]=4 27011 B16R3.1814 c1ccc2c(csc2c1)OCC3CC3 7a_100000077758_100000742324 [0,0,0,2,0,0|1,1,0]=4 27012 B16R3.1814 c1ccc2c(noc2c1)SCC3CC3 62a_100000756562_200000703156 [0,0,0,2,0,0|1,1,0]=4 27013 B16R3.1814 c1ccc2c(noc2c1)SCC3CC3 62a_200000703156_100000742324 [0,0,0,2,0,0|1,1,0]=4 27014 B16R1.1696 CCCC#CC(=O)CCc1ccccc1O 1458a_200011218047_100000722297 [0,0,0,0,0,2|1,0,1]=4 27015 B16R1.1696 CCCC#CC(=O)NCc1ccccc1O 240690a_100000185550_200011218047 [0,0,0,0,0,2|1,0,1]=4 27016 B16R1.1696 CCCC=CC(=O)CCc1ccccc1O 1458a_100000212230_100000722297 [0,0,0,0,0,2|1,0,1]=4 27017 B16R1.1696 CCCC=CC(=O)NCc1ccccc1O 240690a_100000185550_100000212230 [0,0,0,0,0,2|1,0,1]=4 27018 B16R1.1696 CCCCCC(=O)C#Cc1ccccc1F 1458a_100011892747_100000210326 [0,0,0,0,0,2|2,0,0]=4 27019 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1Br 1458a_100000719032_100000210326 [0,0,0,0,0,2|2,0,0]=4 27020 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1Cl 1458a_100000720304_100000210326 [0,0,0,0,0,2|2,0,0]=4 27021 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1F 1458a_100016256065_100000210326 [0,0,0,0,0,2|2,0,0]=4 27022 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000210326 [0,0,0,0,0,2|1,0,0]=3 27023 B16R1.1696 CCCCCC(=O)CCc1ccccc1Br 1458a_100000212188_100012161201 [0,0,0,0,0,2|2,0,0]=4 27024 B16R1.1696 CCCCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000210326 [0,0,0,0,0,2|2,0,0]=4 27025 B16R1.1696 CCCCCC(=O)CCc1ccccc1C 1458a_100000212188_100011713688 [0,0,0,0,0,2|2,0,0]=4 27026 B16R1.1696 CCCCCC(=O)CCc1ccccc1C 1458a_100000748742_100000210326 [0,0,0,0,0,2|2,0,0]=4 27027 B16R1.1696 CCCCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000210326 [0,0,0,0,0,2|2,0,0]=4 27028 B16R1.1696 CCCCCC(=O)CCc1ccccc1Cl 1458a_100000212188_100011713703 [0,0,0,0,0,2|2,0,0]=4 27029 B16R1.1696 CCCCCC(=O)CCc1ccccc1F 1458a_100000189703_100000210326 [0,0,0,0,0,2|2,0,0]=4 27030 B16R1.1696 CCCCCC(=O)CCc1ccccc1F 1458a_100000212188_100000720011 [0,0,0,0,0,2|2,0,0]=4 27031 B16R1.1696 CCCCCC(=O)CCc1ccccc1I 1458a_100000037306_100000210326 [0,0,0,0,0,2|2,0,0]=4 27032 B16R1.1696 CCCCCC(=O)CCc1ccccc1O 1458a_100000181328_100000210326 [0,0,0,0,0,2|1,0,0]=3 27033 B16R1.1696 CCCCCC(=O)CCc1ccccc1O 1458a_100000212188_100000722297 [0,0,0,0,0,2|1,0,0]=3 27034 B16R1.1696 CCCCCC(=O)CNc1ccccc1Br 34a_100000210017_200012276598 [0,0,0,0,0,2|2,0,0]=4 27035 B16R1.1696 CCCCCC(=O)CNc1ccccc1C 34a_100015192222_200012276598 [0,0,0,0,0,2|2,0,0]=4 27036 B16R1.1696 CCCCCC(=O)CNc1ccccc1Cl 34a_100000185783_200012276598 [0,0,0,0,0,2|2,0,0]=4 27037 B16R1.1696 CCCCCC(=O)CNc1ccccc1F 34a_100000210422_200012276598 [0,0,0,0,0,2|2,0,0]=4 27038 B16R1.1696 CCCCCC(=O)CNc1ccccc1I 34a_100000210053_200012276598 [0,0,0,0,0,2|2,0,0]=4 27039 B16R1.1696 CCCCCC(=O)CNc1ccccc1O 34a_100000185747_200012276598 [0,0,0,0,0,2|1,0,0]=3 27040 B16R1.1696 CCCCCC(=O)COc1ccccc1Br 1458a_100000216496_100000210326 [0,0,0,0,0,2|2,0,0]=4 27041 B16R1.1696 CCCCCC(=O)COc1ccccc1Br 34a_100000181306_200012276598 [0,0,0,0,0,2|2,0,0]=4 27042 B16R1.1696 CCCCCC(=O)COc1ccccc1Br 7a_100000181306_200012276598 [0,0,0,0,0,2|2,0,0]=4 27043 B16R1.1696 CCCCCC(=O)COc1ccccc1C 1458a_100000182418_100000210326 [0,0,0,0,0,2|2,0,0]=4 27044 B16R1.1696 CCCCCC(=O)COc1ccccc1C 34a_100000210338_200012276598 [0,0,0,0,0,2|2,0,0]=4 27045 B16R1.1696 CCCCCC(=O)COc1ccccc1C 7a_100000210338_200012276598 [0,0,0,0,0,2|2,0,0]=4 27046 B16R1.1696 CCCCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210326 [0,0,0,0,0,2|2,0,0]=4 27047 B16R1.1696 CCCCCC(=O)COc1ccccc1Cl 34a_100000210172_200012276598 [0,0,0,0,0,2|2,0,0]=4 27048 B16R1.1696 CCCCCC(=O)COc1ccccc1Cl 7a_100000210172_200012276598 [0,0,0,0,0,2|2,0,0]=4 27049 B16R1.1696 CCCCCC(=O)COc1ccccc1F 1458a_100000182486_100000210326 [0,0,0,0,0,2|2,0,0]=4 27050 B16R1.1696 CCCCCC(=O)COc1ccccc1F 34a_100000210171_200012276598 [0,0,0,0,0,2|2,0,0]=4 27051 B16R1.1696 CCCCCC(=O)COc1ccccc1F 7a_100000210171_200012276598 [0,0,0,0,0,2|2,0,0]=4 27052 B16R1.1696 CCCCCC(=O)COc1ccccc1I 34a_100000739446_200012276598 [0,0,0,0,0,2|2,0,0]=4 27053 B16R1.1696 CCCCCC(=O)COc1ccccc1I 7a_100000739446_200012276598 [0,0,0,0,0,2|2,0,0]=4 27054 B16R1.1696 CCCCCC(=O)COc1ccccc1N 34a_100000185747_200012276598 [0,0,0,0,0,2|2,0,0]=4 27055 B16R1.1696 CCCCCC(=O)COc1ccccc1N 7a_100000185747_200012276598 [0,0,0,0,0,2|2,0,0]=4 27056 B16R1.1696 CCCCCC(=O)COc1ccccc1O 1458a_100000183020_100000210326 [0,0,0,0,0,2|1,0,0]=3 27057 B16R1.1696 CCCCCC(=O)CSc1ccccc1Br 62a_100000695589_200012276598 [0,0,0,0,0,2|2,0,0]=4 27058 B16R1.1696 CCCCCC(=O)CSc1ccccc1Br 62a_200012276598_100000695589 [0,0,0,0,0,2|2,0,0]=4 27059 B16R1.1696 CCCCCC(=O)CSc1ccccc1C 1458a_100000183026_100000210326 [0,0,0,0,0,2|2,0,0]=4 27060 B16R1.1696 CCCCCC(=O)CSc1ccccc1C 62a_100000210755_200012276598 [0,0,0,0,0,2|2,0,0]=4 27061 B16R1.1696 CCCCCC(=O)CSc1ccccc1C 62a_200012276598_100000210755 [0,0,0,0,0,2|2,0,0]=4 27062 B16R1.1696 CCCCCC(=O)CSc1ccccc1Cl 62a_100000764095_200012276598 [0,0,0,0,0,2|2,0,0]=4 27063 B16R1.1696 CCCCCC(=O)CSc1ccccc1Cl 62a_200012276598_100000764095 [0,0,0,0,0,2|2,0,0]=4 27064 B16R1.1696 CCCCCC(=O)CSc1ccccc1F 1458a_100000179528_100000210326 [0,0,0,0,0,2|2,0,0]=4 27065 B16R1.1696 CCCCCC(=O)CSc1ccccc1F 62a_100011215700_200012276598 [0,0,0,0,0,2|2,0,0]=4 27066 B16R1.1696 CCCCCC(=O)CSc1ccccc1F 62a_200012276598_100011215700 [0,0,0,0,0,2|2,0,0]=4 27067 B16R1.1696 CCCCCC(=O)CSc1ccccc1N 62a_100000210017_200012276598 [0,0,0,0,0,2|2,0,0]=4 27068 B16R1.1696 CCCCCC(=O)CSc1ccccc1N 62a_200012276598_100000210017 [0,0,0,0,0,2|2,0,0]=4 27069 B16R1.1696 CCCCCC(=O)CSc1ccccc1O 1458a_100000695322_100000210326 [0,0,0,0,0,2|1,0,0]=3 27070 B16R1.1696 CCCCCC(=O)CSc1ccccc1O 62a_100000739446_200012276598 [0,0,0,0,0,2|1,0,0]=3 27071 B16R1.1696 CCCCCC(=O)CSc1ccccc1O 62a_200012276598_100000739446 [0,0,0,0,0,2|1,0,0]=3 27072 B16R1.1696 CCCCCC(=O)CSc1cccnc1O 62a_100000760158_200012276598 [0,0,0,0,0,2|2,0,0]=4 27073 B16R1.1696 CCCCCC(=O)CSc1cccnc1O 62a_200012276598_100000760158 [0,0,0,0,0,2|2,0,0]=4 27074 B16R1.1696 CCCCCC(=O)CSc1ccncc1O 62a_100009817591_200012276598 [0,0,0,0,0,2|2,0,0]=4 27075 B16R1.1696 CCCCCC(=O)CSc1ccncc1O 62a_200012276598_100009817591 [0,0,0,0,0,2|2,0,0]=4 27076 B16R1.1696 CCCCCC(=O)CSc1ncccc1O 62a_100000034122_200012276598 [0,0,0,0,0,2|2,0,0]=4 27077 B16R1.1696 CCCCCC(=O)CSc1ncccc1O 62a_200012276598_100000034122 [0,0,0,0,0,2|2,0,0]=4 27078 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 11a_100000689332_100000212188 [0,0,0,0,0,2|2,0,0]=4 27079 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000212188 [0,0,0,0,0,2|2,0,0]=4 27080 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000212188 [0,0,0,0,0,2|2,0,0]=4 27081 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 527a_100000689332_100000212188 [0,0,0,0,0,2|2,0,0]=4 27082 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 11a_100000174972_100000212188 [0,0,0,0,0,2|2,0,0]=4 27083 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 1626a_100000174972_100000212188 [0,0,0,0,0,2|2,0,0]=4 27084 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 240690a_100000174972_100000212188 [0,0,0,0,0,2|2,0,0]=4 27085 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 527a_100000174972_100000212188 [0,0,0,0,0,2|2,0,0]=4 27086 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000212188 [0,0,0,0,0,2|2,0,0]=4 27087 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000212188 [0,0,0,0,0,2|2,0,0]=4 27088 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000212188 [0,0,0,0,0,2|2,0,0]=4 27089 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000212188 [0,0,0,0,0,2|2,0,0]=4 27090 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 11a_100000174869_100000212188 [0,0,0,0,0,2|2,0,0]=4 27091 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 1626a_100000174869_100000212188 [0,0,0,0,0,2|2,0,0]=4 27092 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 240690a_100000174869_100000212188 [0,0,0,0,0,2|2,0,0]=4 27093 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 527a_100000174869_100000212188 [0,0,0,0,0,2|2,0,0]=4 27094 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 11a_100015347259_100000212188 [0,0,0,0,0,2|2,0,0]=4 27095 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 1626a_100015347259_100000212188 [0,0,0,0,0,2|2,0,0]=4 27096 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 240690a_100015347259_100000212188 [0,0,0,0,0,2|2,0,0]=4 27097 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 527a_100015347259_100000212188 [0,0,0,0,0,2|2,0,0]=4 27098 B16R1.1696 CCCCCC(=O)NCc1ccccc1O 240690a_100000185550_100000212188 [0,0,0,0,0,2|1,0,0]=3 27099 B16R1.1696 CCCCCC(=O)NCc1ccccc1O 527a_100000185550_100000212188 [0,0,0,0,0,2|1,0,0]=3 27100 B16R1.1696 CCCCCC(=O)NNc1ccccc1Br 22a_100000241748_100000212188 [0,0,0,0,0,2|2,0,0]=4 27101 B16R1.1696 CCCCCC(=O)NNc1ccccc1C 22a_100000184220_100000212188 [0,0,0,0,0,2|2,0,0]=4 27102 B16R1.1696 CCCCCC(=O)NNc1ccccc1Cl 22a_100000683529_100000212188 [0,0,0,0,0,2|2,0,0]=4 27103 B16R1.1696 CCCCCC(=O)NNc1ccccc1F 22a_100000239246_100000212188 [0,0,0,0,0,2|2,0,0]=4 27104 B16R1.1696 CCCCCC(=O)NNc1ccccc1I 22a_100011218156_100000212188 [0,0,0,0,0,2|2,0,0]=4 27105 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br 11a_100000102301_100000719032 [0,0,0,0,0,2|2,0,0]=4 27106 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br 1626a_100000102301_100000719032 [0,0,0,0,0,2|2,0,0]=4 27107 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br 240690a_100000102301_100000719032 [0,0,0,0,0,2|2,0,0]=4 27108 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1C 1626a_100000102301_100016266485 [0,0,0,0,0,2|2,0,0]=4 27109 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Cl 11a_100000102301_100000720304 [0,0,0,0,0,2|2,0,0]=4 27110 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Cl 1626a_100000102301_100000720304 [0,0,0,0,0,2|2,0,0]=4 27111 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Cl 240690a_100000102301_100000720304 [0,0,0,0,0,2|2,0,0]=4 27112 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1F 11a_100000102301_100016256065 [0,0,0,0,0,2|2,0,0]=4 27113 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1F 1626a_100000102301_100016256065 [0,0,0,0,0,2|2,0,0]=4 27114 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1F 240690a_100000102301_100016256065 [0,0,0,0,0,2|2,0,0]=4 27115 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 11a_100000102301_100000740810 [0,0,0,0,0,2|2,0,0]=4 27116 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 1626a_100000102301_100000740810 [0,0,0,0,0,2|2,0,0]=4 27117 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 240690a_100000102301_100000740810 [0,0,0,0,0,2|2,0,0]=4 27118 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 527a_100000102301_100000740810 [0,0,0,0,0,2|2,0,0]=4 27119 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 11a_100000102301_100000748742 [0,0,0,0,0,2|2,0,0]=4 27120 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 1626a_100000102301_100000748742 [0,0,0,0,0,2|2,0,0]=4 27121 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 240690a_100000102301_100000748742 [0,0,0,0,0,2|2,0,0]=4 27122 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 527a_100000102301_100000748742 [0,0,0,0,0,2|2,0,0]=4 27123 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 11a_100000102301_100000184300 [0,0,0,0,0,2|2,0,0]=4 27124 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 1626a_100000102301_100000184300 [0,0,0,0,0,2|2,0,0]=4 27125 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 240690a_100000102301_100000184300 [0,0,0,0,0,2|2,0,0]=4 27126 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 527a_100000102301_100000184300 [0,0,0,0,0,2|2,0,0]=4 27127 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 11a_100000102301_100000189703 [0,0,0,0,0,2|2,0,0]=4 27128 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 1626a_100000102301_100000189703 [0,0,0,0,0,2|2,0,0]=4 27129 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 240690a_100000102301_100000189703 [0,0,0,0,0,2|2,0,0]=4 27130 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 527a_100000102301_100000189703 [0,0,0,0,0,2|2,0,0]=4 27131 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 11a_100000102301_100000037306 [0,0,0,0,0,2|2,0,0]=4 27132 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 1626a_100000102301_100000037306 [0,0,0,0,0,2|2,0,0]=4 27133 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 240690a_100000102301_100000037306 [0,0,0,0,0,2|2,0,0]=4 27134 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 527a_100000102301_100000037306 [0,0,0,0,0,2|2,0,0]=4 27135 B16R1.1696 CCCCNC(=O)CCc1ccccc1O 11a_100000102301_100000181328 [0,0,0,0,0,2|1,0,0]=3 27136 B16R1.1696 CCCCNC(=O)CCc1ccccc1O 240690a_100000102301_100000181328 [0,0,0,0,0,2|1,0,0]=3 27137 B16R1.1696 CCCCNC(=O)CCc1ccccc1O 527a_100000102301_100000181328 [0,0,0,0,0,2|1,0,0]=3 27138 B16R1.1696 CCCCNC(=O)CNc1ccccc1Br 34a_100000210017_100000182744 [0,0,0,0,0,2|2,0,0]=4 27139 B16R1.1696 CCCCNC(=O)CNc1ccccc1C 34a_100015192222_100000182744 [0,0,0,0,0,2|2,0,0]=4 27140 B16R1.1696 CCCCNC(=O)CNc1ccccc1Cl 34a_100000185783_100000182744 [0,0,0,0,0,2|2,0,0]=4 27141 B16R1.1696 CCCCNC(=O)CNc1ccccc1F 34a_100000210422_100000182744 [0,0,0,0,0,2|2,0,0]=4 27142 B16R1.1696 CCCCNC(=O)CNc1ccccc1I 34a_100000210053_100000182744 [0,0,0,0,0,2|2,0,0]=4 27143 B16R1.1696 CCCCNC(=O)CNc1ccccc1O 34a_100000185747_100000182744 [0,0,0,0,0,2|1,0,0]=3 27144 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 11a_100000102301_100000216496 [0,0,0,0,0,2|2,0,0]=4 27145 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 1626a_100000102301_100000216496 [0,0,0,0,0,2|2,0,0]=4 27146 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 240690a_100000102301_100000216496 [0,0,0,0,0,2|2,0,0]=4 27147 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 34a_100000181306_100000182744 [0,0,0,0,0,2|2,0,0]=4 27148 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 527a_100000102301_100000216496 [0,0,0,0,0,2|2,0,0]=4 27149 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 7a_100000181306_100000182744 [0,0,0,0,0,2|2,0,0]=4 27150 B16R1.1696 CCCCNC(=O)COc1ccccc1C 11a_100000102301_100000182418 [0,0,0,0,0,2|2,0,0]=4 27151 B16R1.1696 CCCCNC(=O)COc1ccccc1C 1626a_100000102301_100000182418 [0,0,0,0,0,2|2,0,0]=4 27152 B16R1.1696 CCCCNC(=O)COc1ccccc1C 240690a_100000102301_100000182418 [0,0,0,0,0,2|2,0,0]=4 27153 B16R1.1696 CCCCNC(=O)COc1ccccc1C 34a_100000210338_100000182744 [0,0,0,0,0,2|2,0,0]=4 27154 B16R1.1696 CCCCNC(=O)COc1ccccc1C 527a_100000102301_100000182418 [0,0,0,0,0,2|2,0,0]=4 27155 B16R1.1696 CCCCNC(=O)COc1ccccc1C 7a_100000210338_100000182744 [0,0,0,0,0,2|2,0,0]=4 27156 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 11a_100000102301_100000185159 [0,0,0,0,0,2|2,0,0]=4 27157 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 1626a_100000102301_100000185159 [0,0,0,0,0,2|2,0,0]=4 27158 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 240690a_100000102301_100000185159 [0,0,0,0,0,2|2,0,0]=4 27159 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 34a_100000210172_100000182744 [0,0,0,0,0,2|2,0,0]=4 27160 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 527a_100000102301_100000185159 [0,0,0,0,0,2|2,0,0]=4 27161 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 7a_100000210172_100000182744 [0,0,0,0,0,2|2,0,0]=4 27162 B16R1.1696 CCCCNC(=O)COc1ccccc1F 11a_100000102301_100000182486 [0,0,0,0,0,2|2,0,0]=4 27163 B16R1.1696 CCCCNC(=O)COc1ccccc1F 1626a_100000102301_100000182486 [0,0,0,0,0,2|2,0,0]=4 27164 B16R1.1696 CCCCNC(=O)COc1ccccc1F 240690a_100000102301_100000182486 [0,0,0,0,0,2|2,0,0]=4 27165 B16R1.1696 CCCCNC(=O)COc1ccccc1F 34a_100000210171_100000182744 [0,0,0,0,0,2|2,0,0]=4 27166 B16R1.1696 CCCCNC(=O)COc1ccccc1F 527a_100000102301_100000182486 [0,0,0,0,0,2|2,0,0]=4 27167 B16R1.1696 CCCCNC(=O)COc1ccccc1F 7a_100000210171_100000182744 [0,0,0,0,0,2|2,0,0]=4 27168 B16R1.1696 CCCCNC(=O)COc1ccccc1I 34a_100000739446_100000182744 [0,0,0,0,0,2|2,0,0]=4 27169 B16R1.1696 CCCCNC(=O)COc1ccccc1I 7a_100000739446_100000182744 [0,0,0,0,0,2|2,0,0]=4 27170 B16R1.1696 CCCCNC(=O)COc1ccccc1N 34a_100000185747_100000182744 [0,0,0,0,0,2|2,0,0]=4 27171 B16R1.1696 CCCCNC(=O)COc1ccccc1N 7a_100000185747_100000182744 [0,0,0,0,0,2|2,0,0]=4 27172 B16R1.1696 CCCCNC(=O)COc1ccccc1O 240690a_100000102301_100000183020 [0,0,0,0,0,2|1,0,0]=3 27173 B16R1.1696 CCCCNC(=O)COc1ccccc1O 527a_100000102301_100000183020 [0,0,0,0,0,2|1,0,0]=3 27174 B16R1.1696 CCCCNC(=O)CSc1ccccc1Br 62a_100000182744_100000695589 [0,0,0,0,0,2|2,0,0]=4 27175 B16R1.1696 CCCCNC(=O)CSc1ccccc1Br 62a_100000695589_100000182744 [0,0,0,0,0,2|2,0,0]=4 27176 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 11a_100000102301_100000183026 [0,0,0,0,0,2|2,0,0]=4 27177 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 1626a_100000102301_100000183026 [0,0,0,0,0,2|2,0,0]=4 27178 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 240690a_100000102301_100000183026 [0,0,0,0,0,2|2,0,0]=4 27179 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 527a_100000102301_100000183026 [0,0,0,0,0,2|2,0,0]=4 27180 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 62a_100000182744_100000210755 [0,0,0,0,0,2|2,0,0]=4 27181 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 62a_100000210755_100000182744 [0,0,0,0,0,2|2,0,0]=4 27182 B16R1.1696 CCCCNC(=O)CSc1ccccc1Cl 62a_100000182744_100000764095 [0,0,0,0,0,2|2,0,0]=4 27183 B16R1.1696 CCCCNC(=O)CSc1ccccc1Cl 62a_100000764095_100000182744 [0,0,0,0,0,2|2,0,0]=4 27184 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 11a_100000102301_100000179528 [0,0,0,0,0,2|2,0,0]=4 27185 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 1626a_100000102301_100000179528 [0,0,0,0,0,2|2,0,0]=4 27186 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 240690a_100000102301_100000179528 [0,0,0,0,0,2|2,0,0]=4 27187 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 62a_100000182744_100011215700 [0,0,0,0,0,2|2,0,0]=4 27188 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 62a_100011215700_100000182744 [0,0,0,0,0,2|2,0,0]=4 27189 B16R1.1696 CCCCNC(=O)CSc1ccccc1N 62a_100000182744_100000210017 [0,0,0,0,0,2|2,0,0]=4 27190 B16R1.1696 CCCCNC(=O)CSc1ccccc1N 62a_100000210017_100000182744 [0,0,0,0,0,2|2,0,0]=4 27191 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 240690a_100000102301_100000695322 [0,0,0,0,0,2|1,0,0]=3 27192 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 527a_100000102301_100000695322 [0,0,0,0,0,2|1,0,0]=3 27193 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 62a_100000182744_100000739446 [0,0,0,0,0,2|1,0,0]=3 27194 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 62a_100000739446_100000182744 [0,0,0,0,0,2|1,0,0]=3 27195 B16R1.1696 CCCCNC(=O)CSc1cccnc1O 62a_100000182744_100000760158 [0,0,0,0,0,2|2,0,0]=4 27196 B16R1.1696 CCCCNC(=O)CSc1cccnc1O 62a_100000760158_100000182744 [0,0,0,0,0,2|2,0,0]=4 27197 B16R1.1696 CCCCNC(=O)CSc1ccncc1O 62a_100000182744_100009817591 [0,0,0,0,0,2|2,0,0]=4 27198 B16R1.1696 CCCCNC(=O)CSc1ccncc1O 62a_100009817591_100000182744 [0,0,0,0,0,2|2,0,0]=4 27199 B16R1.1696 CCCCNC(=O)CSc1ncccc1O 62a_100000034122_100000182744 [0,0,0,0,0,2|2,0,0]=4 27200 B16R1.1696 CCCCNC(=O)CSc1ncccc1O 62a_100000182744_100000034122 [0,0,0,0,0,2|2,0,0]=4 27201 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 2708a_100000102301_100000689332 [0,0,0,0,0,2|2,0,0]=4 27202 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 2708a_100000689332_100000102301 [0,0,0,0,0,2|2,0,0]=4 27203 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 273464a_100000102301_100000689332 [0,0,0,0,0,2|2,0,0]=4 27204 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 273464a_100000689332_100000102301 [0,0,0,0,0,2|2,0,0]=4 27205 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 512a_100000102301_100000689332 [0,0,0,0,0,2|2,0,0]=4 27206 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 512a_100000689332_100000102301 [0,0,0,0,0,2|2,0,0]=4 27207 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 2708a_100000102301_100000174972 [0,0,0,0,0,2|2,0,0]=4 27208 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 2708a_100000174972_100000102301 [0,0,0,0,0,2|2,0,0]=4 27209 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 273464a_100000102301_100000174972 [0,0,0,0,0,2|2,0,0]=4 27210 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 273464a_100000174972_100000102301 [0,0,0,0,0,2|2,0,0]=4 27211 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 512a_100000102301_100000174972 [0,0,0,0,0,2|2,0,0]=4 27212 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 512a_100000174972_100000102301 [0,0,0,0,0,2|2,0,0]=4 27213 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 2708a_100000102301_100000174879 [0,0,0,0,0,2|2,0,0]=4 27214 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 2708a_100000174879_100000102301 [0,0,0,0,0,2|2,0,0]=4 27215 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 273464a_100000102301_100000174879 [0,0,0,0,0,2|2,0,0]=4 27216 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 273464a_100000174879_100000102301 [0,0,0,0,0,2|2,0,0]=4 27217 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 512a_100000102301_100000174879 [0,0,0,0,0,2|2,0,0]=4 27218 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 2708a_100000102301_100000174869 [0,0,0,0,0,2|2,0,0]=4 27219 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 2708a_100000174869_100000102301 [0,0,0,0,0,2|2,0,0]=4 27220 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 273464a_100000102301_100000174869 [0,0,0,0,0,2|2,0,0]=4 27221 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 273464a_100000174869_100000102301 [0,0,0,0,0,2|2,0,0]=4 27222 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 512a_100000102301_100000174869 [0,0,0,0,0,2|2,0,0]=4 27223 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 512a_100000174869_100000102301 [0,0,0,0,0,2|2,0,0]=4 27224 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 2708a_100000102301_100015347259 [0,0,0,0,0,2|2,0,0]=4 27225 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 2708a_100015347259_100000102301 [0,0,0,0,0,2|2,0,0]=4 27226 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 273464a_100000102301_100015347259 [0,0,0,0,0,2|2,0,0]=4 27227 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 273464a_100015347259_100000102301 [0,0,0,0,0,2|2,0,0]=4 27228 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 512a_100000102301_100015347259 [0,0,0,0,0,2|2,0,0]=4 27229 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 512a_100015347259_100000102301 [0,0,0,0,0,2|2,0,0]=4 27230 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 2708a_100000102301_100000185550 [0,0,0,0,0,2|1,0,0]=3 27231 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 2708a_100000185550_100000102301 [0,0,0,0,0,2|1,0,0]=3 27232 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 273464a_100000102301_100000185550 [0,0,0,0,0,2|1,0,0]=3 27233 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 273464a_100000185550_100000102301 [0,0,0,0,0,2|1,0,0]=3 27234 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 512a_100000185550_100000102301 [0,0,0,0,0,2|1,0,0]=3 27235 B16R1.1696 CCCCNC(=O)NNc1ccccc1Br 273464a_100000102301_100000241748 [0,0,0,0,0,2|2,0,0]=4 27236 B16R1.1696 CCCCNC(=O)NNc1ccccc1Br 512a_100000102301_100000241748 [0,0,0,0,0,2|2,0,0]=4 27237 B16R1.1696 CCCCNC(=O)NNc1ccccc1C 273464a_100000102301_100000184220 [0,0,0,0,0,2|2,0,0]=4 27238 B16R1.1696 CCCCNC(=O)NNc1ccccc1C 512a_100000102301_100000184220 [0,0,0,0,0,2|2,0,0]=4 27239 B16R1.1696 CCCCNC(=O)NNc1ccccc1Cl 273464a_100000102301_100000683529 [0,0,0,0,0,2|2,0,0]=4 27240 B16R1.1696 CCCCNC(=O)NNc1ccccc1Cl 512a_100000102301_100000683529 [0,0,0,0,0,2|2,0,0]=4 27241 B16R1.1696 CCCCNC(=O)NNc1ccccc1F 273464a_100000102301_100000239246 [0,0,0,0,0,2|2,0,0]=4 27242 B16R1.1696 CCCCNC(=O)NNc1ccccc1F 512a_100000102301_100000239246 [0,0,0,0,0,2|2,0,0]=4 27243 B16R1.1696 CCCCNC(=O)NNc1ccccc1I 273464a_100000102301_100011218156 [0,0,0,0,0,2|2,0,0]=4 27244 B16R1.1696 CCCCNC(=O)NNc1ccccc1I 512a_100000102301_100011218156 [0,0,0,0,0,2|2,0,0]=4 27245 B16R1.1696 CCCCOC(=O)CNc1ccccc1Br 34a_100000210017_100000211628 [0,0,0,0,0,2|1,0,0]=3 27246 B16R1.1696 CCCCOC(=O)CNc1ccccc1C 34a_100015192222_100000211628 [0,0,0,0,0,2|1,0,0]=3 27247 B16R1.1696 CCCCOC(=O)CNc1ccccc1Cl 34a_100000185783_100000211628 [0,0,0,0,0,2|1,0,0]=3 27248 B16R1.1696 CCCCOC(=O)CNc1ccccc1F 34a_100000210422_100000211628 [0,0,0,0,0,2|1,0,0]=3 27249 B16R1.1696 CCCCOC(=O)CNc1ccccc1I 34a_100000210053_100000211628 [0,0,0,0,0,2|1,0,0]=3 27250 B16R1.1696 CCCCOC(=O)CNc1ccccc1O 34a_100000185747_100000211628 [0,0,0,0,0,2|0,0,0]=2 27251 B16R1.1696 CCCCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000211628 [0,0,0,0,0,2|1,0,1]=4 27252 B16R1.1696 CCCCOC(=O)COc1ccccc1Br 34a_100000181306_100000211628 [0,0,0,0,0,2|1,0,0]=3 27253 B16R1.1696 CCCCOC(=O)COc1ccccc1Br 7a_100000181306_100000211628 [0,0,0,0,0,2|1,0,0]=3 27254 B16R1.1696 CCCCOC(=O)COc1ccccc1C 34a_100000210338_100000211628 [0,0,0,0,0,2|1,0,0]=3 27255 B16R1.1696 CCCCOC(=O)COc1ccccc1C 7a_100000210338_100000211628 [0,0,0,0,0,2|1,0,0]=3 27256 B16R1.1696 CCCCOC(=O)COc1ccccc1Cl 34a_100000210172_100000211628 [0,0,0,0,0,2|1,0,0]=3 27257 B16R1.1696 CCCCOC(=O)COc1ccccc1Cl 7a_100000210172_100000211628 [0,0,0,0,0,2|1,0,0]=3 27258 B16R1.1696 CCCCOC(=O)COc1ccccc1F 34a_100000210171_100000211628 [0,0,0,0,0,2|1,0,0]=3 27259 B16R1.1696 CCCCOC(=O)COc1ccccc1F 7a_100000210171_100000211628 [0,0,0,0,0,2|1,0,0]=3 27260 B16R1.1696 CCCCOC(=O)COc1ccccc1I 34a_100000739446_100000211628 [0,0,0,0,0,2|1,0,0]=3 27261 B16R1.1696 CCCCOC(=O)COc1ccccc1I 7a_100000739446_100000211628 [0,0,0,0,0,2|1,0,0]=3 27262 B16R1.1696 CCCCOC(=O)COc1ccccc1N 34a_100000185747_100000211628 [0,0,0,0,0,2|1,0,0]=3 27263 B16R1.1696 CCCCOC(=O)COc1ccccc1N 7a_100000185747_100000211628 [0,0,0,0,0,2|1,0,0]=3 27264 B16R1.1696 CCCCOC(=O)COc1cccnc1Br 34a_100000744436_100000211628 [0,0,0,0,0,2|2,0,0]=4 27265 B16R1.1696 CCCCOC(=O)COc1cccnc1Br 7a_100000744436_100000211628 [0,0,0,0,0,2|2,0,0]=4 27266 B16R1.1696 CCCCOC(=O)COc1cccnc1C 34a_100000745507_100000211628 [0,0,0,0,0,2|2,0,0]=4 27267 B16R1.1696 CCCCOC(=O)COc1cccnc1C 7a_100000745507_100000211628 [0,0,0,0,0,2|2,0,0]=4 27268 B16R1.1696 CCCCOC(=O)COc1cccnc1Cl 34a_100000757616_100000211628 [0,0,0,0,0,2|2,0,0]=4 27269 B16R1.1696 CCCCOC(=O)COc1cccnc1Cl 7a_100000757616_100000211628 [0,0,0,0,0,2|2,0,0]=4 27270 B16R1.1696 CCCCOC(=O)COc1cccnc1F 34a_100000061740_100000211628 [0,0,0,0,0,2|2,0,0]=4 27271 B16R1.1696 CCCCOC(=O)COc1cccnc1F 7a_100000061740_100000211628 [0,0,0,0,0,2|2,0,0]=4 27272 B16R1.1696 CCCCOC(=O)COc1cccnc1I 34a_100000034122_100000211628 [0,0,0,0,0,2|2,0,0]=4 27273 B16R1.1696 CCCCOC(=O)COc1cccnc1I 7a_100000034122_100000211628 [0,0,0,0,0,2|2,0,0]=4 27274 B16R1.1696 CCCCOC(=O)COc1cccnc1N 34a_100000211975_100000211628 [0,0,0,0,0,2|2,0,0]=4 27275 B16R1.1696 CCCCOC(=O)COc1cccnc1N 7a_100000211975_100000211628 [0,0,0,0,0,2|2,0,0]=4 27276 B16R1.1696 CCCCOC(=O)COc1cccoc1=O 34a_100000077404_100000211628 [0,0,0,0,0,2|1,0,1]=4 27277 B16R1.1696 CCCCOC(=O)COc1cccoc1=O 7a_100000077404_100000211628 [0,0,0,0,0,2|1,0,1]=4 27278 B16R1.1696 CCCCOC(=O)COc1ccncc1Br 34a_100011996408_100000211628 [0,0,0,0,0,2|2,0,0]=4 27279 B16R1.1696 CCCCOC(=O)COc1ccncc1C 34a_100000694293_100000211628 [0,0,0,0,0,2|2,0,0]=4 27280 B16R1.1696 CCCCOC(=O)COc1ccncc1Cl 34a_100011997054_100000211628 [0,0,0,0,0,2|2,0,0]=4 27281 B16R1.1696 CCCCOC(=O)COc1ccncc1F 34a_200000081243_100000211628 [0,0,0,0,0,2|2,0,0]=4 27282 B16R1.1696 CCCCOC(=O)COc1cnccc1C 34a_100011997053_100000211628 [0,0,0,0,0,2|2,0,0]=4 27283 B16R1.1696 CCCCOC(=O)COc1cnccc1C 7a_100011997053_100000211628 [0,0,0,0,0,2|2,0,0]=4 27284 B16R1.1696 CCCCOC(=O)COc1cnccc1Cl 34a_100011996695_100000211628 [0,0,0,0,0,2|2,0,0]=4 27285 B16R1.1696 CCCCOC(=O)COc1cnccc1I 34a_100000050107_100000211628 [0,0,0,0,0,2|2,0,0]=4 27286 B16R1.1696 CCCCOC(=O)COc1cnccc1N 34a_100000753702_100000211628 [0,0,0,0,0,2|2,0,0]=4 27287 B16R1.1696 CCCCOC(=O)COc1coccc1=O 34a_100000060831_100000211628 [0,0,0,0,0,2|1,0,1]=4 27288 B16R1.1696 CCCCOC(=O)COc1ncccc1Cl 34a_100011290957_100000211628 [0,0,0,0,0,2|2,0,0]=4 27289 B16R1.1696 CCCCOC(=O)COc1ncccc1F 34a_100011219419_100000211628 [0,0,0,0,0,2|2,0,0]=4 27290 B16R1.1696 CCCCOC(=O)COc1ncccc1N 34a_100000746358_100000211628 [0,0,0,0,0,2|2,0,0]=4 27291 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=O 62a_100000211628_100009998708 [0,0,0,0,0,2|1,0,1]=4 27292 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000211628 [0,0,0,0,0,2|1,0,1]=4 27293 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=S 62a_100000211628_200012280681 [0,0,0,0,0,2|1,1,0]=4 27294 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000211628 [0,0,0,0,0,2|1,1,0]=4 27295 B16R1.1696 CCCCOC(=O)CSc1cccc[n+]1C 62a_100000211628_100000212160 [0,0,0,0,0,2|2,0,0]=4 27296 B16R1.1696 CCCCOC(=O)CSc1cccc[n+]1[O-] 62a_100000211628_200000042595 [0,0,0,0,0,2|1,0,1]=4 27297 B16R1.1696 CCCCOC(=O)CSc1ccccc1Br 62a_100000211628_100000695589 [0,0,0,0,0,2|1,0,0]=3 27298 B16R1.1696 CCCCOC(=O)CSc1ccccc1Br 62a_100000695589_100000211628 [0,0,0,0,0,2|1,0,0]=3 27299 B16R1.1696 CCCCOC(=O)CSc1ccccc1C 62a_100000210755_100000211628 [0,0,0,0,0,2|1,0,0]=3 27300 B16R1.1696 CCCCOC(=O)CSc1ccccc1C 62a_100000211628_100000210755 [0,0,0,0,0,2|1,0,0]=3 27301 B16R1.1696 CCCCOC(=O)CSc1ccccc1Cl 62a_100000211628_100000764095 [0,0,0,0,0,2|1,0,0]=3 27302 B16R1.1696 CCCCOC(=O)CSc1ccccc1Cl 62a_100000764095_100000211628 [0,0,0,0,0,2|1,0,0]=3 27303 B16R1.1696 CCCCOC(=O)CSc1ccccc1F 62a_100000211628_100011215700 [0,0,0,0,0,2|1,0,0]=3 27304 B16R1.1696 CCCCOC(=O)CSc1ccccc1F 62a_100011215700_100000211628 [0,0,0,0,0,2|1,0,0]=3 27305 B16R1.1696 CCCCOC(=O)CSc1ccccc1N 62a_100000210017_100000211628 [0,0,0,0,0,2|1,0,0]=3 27306 B16R1.1696 CCCCOC(=O)CSc1ccccc1N 62a_100000211628_100000210017 [0,0,0,0,0,2|1,0,0]=3 27307 B16R1.1696 CCCCOC(=O)CSc1ccccc1O 62a_100000211628_100000739446 [0,0,0,0,0,2|0,0,0]=2 27308 B16R1.1696 CCCCOC(=O)CSc1ccccc1O 62a_100000739446_100000211628 [0,0,0,0,0,2|0,0,0]=2 27309 B16R1.1696 CCCCOC(=O)CSc1cccnc1Br 62a_100000211628_100010202626 [0,0,0,0,0,2|2,0,0]=4 27310 B16R1.1696 CCCCOC(=O)CSc1cccnc1Br 62a_100010202626_100000211628 [0,0,0,0,0,2|2,0,0]=4 27311 B16R1.1696 CCCCOC(=O)CSc1cccnc1C 62a_100000211628_100000751574 [0,0,0,0,0,2|2,0,0]=4 27312 B16R1.1696 CCCCOC(=O)CSc1cccnc1C 62a_100000751574_100000211628 [0,0,0,0,0,2|2,0,0]=4 27313 B16R1.1696 CCCCOC(=O)CSc1cccnc1Cl 62a_100000036424_100000211628 [0,0,0,0,0,2|2,0,0]=4 27314 B16R1.1696 CCCCOC(=O)CSc1cccnc1Cl 62a_100000211628_100000036424 [0,0,0,0,0,2|2,0,0]=4 27315 B16R1.1696 CCCCOC(=O)CSc1cccnc1F 62a_100000211628_100009816115 [0,0,0,0,0,2|2,0,0]=4 27316 B16R1.1696 CCCCOC(=O)CSc1cccnc1F 62a_100009816115_100000211628 [0,0,0,0,0,2|2,0,0]=4 27317 B16R1.1696 CCCCOC(=O)CSc1cccnc1N 62a_100000045569_100000211628 [0,0,0,0,0,2|2,0,0]=4 27318 B16R1.1696 CCCCOC(=O)CSc1cccnc1N 62a_100000211628_100000045569 [0,0,0,0,0,2|2,0,0]=4 27319 B16R1.1696 CCCCOC(=O)CSc1cccnc1O 62a_100000211628_100000760158 [0,0,0,0,0,2|1,0,0]=3 27320 B16R1.1696 CCCCOC(=O)CSc1cccnc1O 62a_100000760158_100000211628 [0,0,0,0,0,2|1,0,0]=3 27321 B16R1.1696 CCCCOC(=O)CSc1ccncc1Br 62a_100000211628_100000726257 [0,0,0,0,0,2|2,0,0]=4 27322 B16R1.1696 CCCCOC(=O)CSc1ccncc1Br 62a_100000726257_100000211628 [0,0,0,0,0,2|2,0,0]=4 27323 B16R1.1696 CCCCOC(=O)CSc1ccncc1C 62a_100000211628_100000765111 [0,0,0,0,0,2|2,0,0]=4 27324 B16R1.1696 CCCCOC(=O)CSc1ccncc1C 62a_100000765111_100000211628 [0,0,0,0,0,2|2,0,0]=4 27325 B16R1.1696 CCCCOC(=O)CSc1ccncc1Cl 62a_100000211628_100000708259 [0,0,0,0,0,2|2,0,0]=4 27326 B16R1.1696 CCCCOC(=O)CSc1ccncc1Cl 62a_100000708259_100000211628 [0,0,0,0,0,2|2,0,0]=4 27327 B16R1.1696 CCCCOC(=O)CSc1ccncc1F 62a_100000047030_100000211628 [0,0,0,0,0,2|2,0,0]=4 27328 B16R1.1696 CCCCOC(=O)CSc1ccncc1F 62a_100000211628_100000047030 [0,0,0,0,0,2|2,0,0]=4 27329 B16R1.1696 CCCCOC(=O)CSc1ccncc1N 62a_100000211628_100000756074 [0,0,0,0,0,2|2,0,0]=4 27330 B16R1.1696 CCCCOC(=O)CSc1ccncc1N 62a_100000756074_100000211628 [0,0,0,0,0,2|2,0,0]=4 27331 B16R1.1696 CCCCOC(=O)CSc1ccncc1O 62a_100000211628_100009817591 [0,0,0,0,0,2|1,0,0]=3 27332 B16R1.1696 CCCCOC(=O)CSc1ccncc1O 62a_100009817591_100000211628 [0,0,0,0,0,2|1,0,0]=3 27333 B16R1.1696 CCCCOC(=O)CSc1cnccc1Br 62a_100000211628_100010138639 [0,0,0,0,0,2|2,0,0]=4 27334 B16R1.1696 CCCCOC(=O)CSc1cnccc1Br 62a_100010138639_100000211628 [0,0,0,0,0,2|2,0,0]=4 27335 B16R1.1696 CCCCOC(=O)CSc1cnccc1C 62a_100000211628_100000761580 [0,0,0,0,0,2|2,0,0]=4 27336 B16R1.1696 CCCCOC(=O)CSc1cnccc1C 62a_100000761580_100000211628 [0,0,0,0,0,2|2,0,0]=4 27337 B16R1.1696 CCCCOC(=O)CSc1cnccc1Cl 62a_100000211628_100009995489 [0,0,0,0,0,2|2,0,0]=4 27338 B16R1.1696 CCCCOC(=O)CSc1cnccc1Cl 62a_100009995489_100000211628 [0,0,0,0,0,2|2,0,0]=4 27339 B16R1.1696 CCCCOC(=O)CSc1cnccc1F 62a_100000211628_100009820683 [0,0,0,0,0,2|2,0,0]=4 27340 B16R1.1696 CCCCOC(=O)CSc1cnccc1F 62a_100009820683_100000211628 [0,0,0,0,0,2|2,0,0]=4 27341 B16R1.1696 CCCCOC(=O)CSc1cnccc1N 62a_100000047001_100000211628 [0,0,0,0,0,2|2,0,0]=4 27342 B16R1.1696 CCCCOC(=O)CSc1cnccc1N 62a_100000211628_100000047001 [0,0,0,0,0,2|2,0,0]=4 27343 B16R1.1696 CCCCOC(=O)CSc1cncnc1O 62a_100000211628_100000751107 [0,0,0,0,0,2|2,0,0]=4 27344 B16R1.1696 CCCCOC(=O)CSc1cncnc1O 62a_100000751107_100000211628 [0,0,0,0,0,2|2,0,0]=4 27345 B16R1.1696 CCCCOC(=O)CSc1ncccc1Br 62a_100000211628_100000696092 [0,0,0,0,0,2|2,0,0]=4 27346 B16R1.1696 CCCCOC(=O)CSc1ncccc1Br 62a_100000696092_100000211628 [0,0,0,0,0,2|2,0,0]=4 27347 B16R1.1696 CCCCOC(=O)CSc1ncccc1C 62a_100000211628_100000751373 [0,0,0,0,0,2|2,0,0]=4 27348 B16R1.1696 CCCCOC(=O)CSc1ncccc1C 62a_100000751373_100000211628 [0,0,0,0,0,2|2,0,0]=4 27349 B16R1.1696 CCCCOC(=O)CSc1ncccc1Cl 62a_100000211628_100011356963 [0,0,0,0,0,2|2,0,0]=4 27350 B16R1.1696 CCCCOC(=O)CSc1ncccc1Cl 62a_100011356963_100000211628 [0,0,0,0,0,2|2,0,0]=4 27351 B16R1.1696 CCCCOC(=O)CSc1ncccc1F 62a_100000211628_100000685392 [0,0,0,0,0,2|2,0,0]=4 27352 B16R1.1696 CCCCOC(=O)CSc1ncccc1F 62a_100000685392_100000211628 [0,0,0,0,0,2|2,0,0]=4 27353 B16R1.1696 CCCCOC(=O)CSc1ncccc1N 62a_100000211628_100000688686 [0,0,0,0,0,2|2,0,0]=4 27354 B16R1.1696 CCCCOC(=O)CSc1ncccc1N 62a_100000688686_100000211628 [0,0,0,0,0,2|2,0,0]=4 27355 B16R1.1696 CCCCOC(=O)CSc1ncccc1O 62a_100000034122_100000211628 [0,0,0,0,0,2|1,0,0]=3 27356 B16R1.1696 CCCCOC(=O)CSc1ncccc1O 62a_100000211628_100000034122 [0,0,0,0,0,2|1,0,0]=3 27357 B16R1.1696 CCCNNC(=O)C=Cc1ccccc1O 22a_100000740057_100016263591 [0,0,0,0,0,2|2,0,0]=4 27358 B16R1.1696 CCCNNC(=O)CCc1ccccc1O 22a_100000740057_100000181328 [0,0,0,0,0,2|2,0,0]=4 27359 B16R1.1696 CCCNNC(=O)COc1ccccc1O 22a_100000740057_100000183020 [0,0,0,0,0,2|2,0,0]=4 27360 B16R1.1696 CCCNNC(=O)CSc1ccccc1O 22a_100000740057_100000695322 [0,0,0,0,0,2|2,0,0]=4 27361 B16R1.1696 CCCNNC(=O)NCc1ccccc1O 273464a_100000185550_100000740057 [0,0,0,0,0,2|2,0,0]=4 27362 B16R1.1696 CCCNNC(=O)NCc1ccccc1O 512a_100000185550_100000740057 [0,0,0,0,0,2|2,0,0]=4 27363 B16R1.1696 CCCOCC(=O)CCc1ccccc1O 1458a_100000745993_100000722297 [0,0,0,0,0,2|2,0,0]=4 27364 B16R1.1696 CCCOCC(=O)NCc1ccccc1O 240690a_100000185550_100000745993 [0,0,0,0,0,2|2,0,0]=4 27365 B16R1.1696 CCCOCC(=O)NCc1ccccc1O 527a_100000185550_100000745993 [0,0,0,0,0,2|2,0,0]=4 27366 B16R1.1696 CCCSCC(=O)CCc1ccccc1O 1458a_100000217233_100000722297 [0,0,0,0,0,2|2,0,0]=4 27367 B16R1.1696 CCCSCC(=O)NCc1ccccc1O 240690a_100000185550_100000217233 [0,0,0,0,0,2|2,0,0]=4 27368 B16R1.1696 CCCSCC(=O)NCc1ccccc1O 527a_100000185550_100000217233 [0,0,0,0,0,2|2,0,0]=4 27369 B16R1.1696 CCOCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100011215890 [0,0,0,0,0,2|2,0,0]=4 27370 B16R1.1696 CCOCCC(=O)CCc1ccccc1O 1458a_100000181328_100011215890 [0,0,0,0,0,2|2,0,0]=4 27371 B16R1.1696 CCOCCC(=O)CCc1ccccc1O 1458a_100000749530_100000722297 [0,0,0,0,0,2|2,0,0]=4 27372 B16R1.1696 CCOCCC(=O)COc1ccccc1O 1458a_100000183020_100011215890 [0,0,0,0,0,2|2,0,0]=4 27373 B16R1.1696 CCOCCC(=O)CSc1ccccc1O 1458a_100000695322_100011215890 [0,0,0,0,0,2|2,0,0]=4 27374 B16R1.1696 CCOCCC(=O)NCc1ccccc1O 240690a_100000185550_100000749530 [0,0,0,0,0,2|2,0,0]=4 27375 B16R1.1696 CCOCCC(=O)NCc1ccccc1O 527a_100000185550_100000749530 [0,0,0,0,0,2|2,0,0]=4 27376 B16R1.1696 CCSCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000757381 [0,0,0,0,0,2|2,0,0]=4 27377 B16R1.1696 CCSCCC(=O)CCc1ccccc1O 1458a_100000181328_100000757381 [0,0,0,0,0,2|2,0,0]=4 27378 B16R1.1696 CCSCCC(=O)CCc1ccccc1O 1458a_100000230768_100000722297 [0,0,0,0,0,2|2,0,0]=4 27379 B16R1.1696 CCSCCC(=O)COc1ccccc1O 1458a_100000183020_100000757381 [0,0,0,0,0,2|2,0,0]=4 27380 B16R1.1696 CCSCCC(=O)CSc1ccccc1O 1458a_100000695322_100000757381 [0,0,0,0,0,2|2,0,0]=4 27381 B16R1.1696 CCSCCC(=O)NCc1ccccc1O 240690a_100000185550_100000230768 [0,0,0,0,0,2|2,0,0]=4 27382 B16R1.1696 CCSCCC(=O)NCc1ccccc1O 527a_100000185550_100000230768 [0,0,0,0,0,2|2,0,0]=4 27383 B16R1.1696 COCCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000740836 [0,0,0,0,0,2|2,0,0]=4 27384 B16R1.1696 COCCCC(=O)CCc1ccccc1O 1458a_100000181328_100000740836 [0,0,0,0,0,2|2,0,0]=4 27385 B16R1.1696 COCCCC(=O)CCc1ccccc1O 1458a_100000741012_100000722297 [0,0,0,0,0,2|2,0,0]=4 27386 B16R1.1696 COCCCC(=O)COc1ccccc1O 1458a_100000183020_100000740836 [0,0,0,0,0,2|2,0,0]=4 27387 B16R1.1696 COCCCC(=O)CSc1ccccc1O 1458a_100000695322_100000740836 [0,0,0,0,0,2|2,0,0]=4 27388 B16R1.1696 COCCCC(=O)NCc1ccccc1O 240690a_100000185550_100000741012 [0,0,0,0,0,2|2,0,0]=4 27389 B16R1.1696 COCCCC(=O)NCc1ccccc1O 527a_100000185550_100000741012 [0,0,0,0,0,2|2,0,0]=4 27390 B16R1.1696 COCCNC(=O)CCc1ccccc1O 240690a_100000209980_100000181328 [0,0,0,0,0,2|2,0,0]=4 27391 B16R1.1696 COCCNC(=O)CCc1ccccc1O 527a_100000209980_100000181328 [0,0,0,0,0,2|2,0,0]=4 27392 B16R1.1696 COCCNC(=O)CNc1ccccc1O 34a_100000185747_100000183275 [0,0,0,0,0,2|2,0,0]=4 27393 B16R1.1696 COCCNC(=O)COc1ccccc1O 240690a_100000209980_100000183020 [0,0,0,0,0,2|2,0,0]=4 27394 B16R1.1696 COCCNC(=O)COc1ccccc1O 527a_100000209980_100000183020 [0,0,0,0,0,2|2,0,0]=4 27395 B16R1.1696 COCCNC(=O)CSc1ccccc1O 240690a_100000209980_100000695322 [0,0,0,0,0,2|2,0,0]=4 27396 B16R1.1696 COCCNC(=O)CSc1ccccc1O 527a_100000209980_100000695322 [0,0,0,0,0,2|2,0,0]=4 27397 B16R1.1696 COCCNC(=O)CSc1ccccc1O 62a_100000183275_100000739446 [0,0,0,0,0,2|2,0,0]=4 27398 B16R1.1696 COCCNC(=O)CSc1ccccc1O 62a_100000739446_100000183275 [0,0,0,0,0,2|2,0,0]=4 27399 B16R1.1696 COCCNC(=O)NCc1ccccc1O 2708a_100000185550_100000209980 [0,0,0,0,0,2|2,0,0]=4 27400 B16R1.1696 COCCNC(=O)NCc1ccccc1O 273464a_100000185550_100000209980 [0,0,0,0,0,2|2,0,0]=4 27401 B16R1.1696 COCCNC(=O)NCc1ccccc1O 273464a_100000209980_100000185550 [0,0,0,0,0,2|2,0,0]=4 27402 B16R1.1696 COCCOC(=O)CNc1ccccc1Br 34a_100000210017_200000040189 [0,0,0,0,0,2|2,0,0]=4 27403 B16R1.1696 COCCOC(=O)CNc1ccccc1C 34a_100015192222_200000040189 [0,0,0,0,0,2|2,0,0]=4 27404 B16R1.1696 COCCOC(=O)CNc1ccccc1Cl 34a_100000185783_200000040189 [0,0,0,0,0,2|2,0,0]=4 27405 B16R1.1696 COCCOC(=O)CNc1ccccc1F 34a_100000210422_200000040189 [0,0,0,0,0,2|2,0,0]=4 27406 B16R1.1696 COCCOC(=O)CNc1ccccc1I 34a_100000210053_200000040189 [0,0,0,0,0,2|2,0,0]=4 27407 B16R1.1696 COCCOC(=O)CNc1ccccc1O 34a_100000185747_200000040189 [0,0,0,0,0,2|1,0,0]=3 27408 B16R1.1696 COCCOC(=O)COc1ccccc1Br 34a_100000181306_200000040189 [0,0,0,0,0,2|2,0,0]=4 27409 B16R1.1696 COCCOC(=O)COc1ccccc1Br 7a_100000181306_200000040189 [0,0,0,0,0,2|2,0,0]=4 27410 B16R1.1696 COCCOC(=O)COc1ccccc1C 34a_100000210338_200000040189 [0,0,0,0,0,2|2,0,0]=4 27411 B16R1.1696 COCCOC(=O)COc1ccccc1C 7a_100000210338_200000040189 [0,0,0,0,0,2|2,0,0]=4 27412 B16R1.1696 COCCOC(=O)COc1ccccc1Cl 34a_100000210172_200000040189 [0,0,0,0,0,2|2,0,0]=4 27413 B16R1.1696 COCCOC(=O)COc1ccccc1Cl 7a_100000210172_200000040189 [0,0,0,0,0,2|2,0,0]=4 27414 B16R1.1696 COCCOC(=O)COc1ccccc1F 34a_100000210171_200000040189 [0,0,0,0,0,2|2,0,0]=4 27415 B16R1.1696 COCCOC(=O)COc1ccccc1F 7a_100000210171_200000040189 [0,0,0,0,0,2|2,0,0]=4 27416 B16R1.1696 COCCOC(=O)COc1ccccc1I 34a_100000739446_200000040189 [0,0,0,0,0,2|2,0,0]=4 27417 B16R1.1696 COCCOC(=O)COc1ccccc1I 7a_100000739446_200000040189 [0,0,0,0,0,2|2,0,0]=4 27418 B16R1.1696 COCCOC(=O)COc1ccccc1N 34a_100000185747_200000040189 [0,0,0,0,0,2|2,0,0]=4 27419 B16R1.1696 COCCOC(=O)COc1ccccc1N 7a_100000185747_200000040189 [0,0,0,0,0,2|2,0,0]=4 27420 B16R1.1696 COCCOC(=O)CSc1ccccc1Br 62a_100000695589_200000040189 [0,0,0,0,0,2|2,0,0]=4 27421 B16R1.1696 COCCOC(=O)CSc1ccccc1Br 62a_200000040189_100000695589 [0,0,0,0,0,2|2,0,0]=4 27422 B16R1.1696 COCCOC(=O)CSc1ccccc1C 62a_100000210755_200000040189 [0,0,0,0,0,2|2,0,0]=4 27423 B16R1.1696 COCCOC(=O)CSc1ccccc1C 62a_200000040189_100000210755 [0,0,0,0,0,2|2,0,0]=4 27424 B16R1.1696 COCCOC(=O)CSc1ccccc1Cl 62a_100000764095_200000040189 [0,0,0,0,0,2|2,0,0]=4 27425 B16R1.1696 COCCOC(=O)CSc1ccccc1Cl 62a_200000040189_100000764095 [0,0,0,0,0,2|2,0,0]=4 27426 B16R1.1696 COCCOC(=O)CSc1ccccc1F 62a_100011215700_200000040189 [0,0,0,0,0,2|2,0,0]=4 27427 B16R1.1696 COCCOC(=O)CSc1ccccc1F 62a_200000040189_100011215700 [0,0,0,0,0,2|2,0,0]=4 27428 B16R1.1696 COCCOC(=O)CSc1ccccc1N 62a_100000210017_200000040189 [0,0,0,0,0,2|2,0,0]=4 27429 B16R1.1696 COCCOC(=O)CSc1ccccc1N 62a_200000040189_100000210017 [0,0,0,0,0,2|2,0,0]=4 27430 B16R1.1696 COCCOC(=O)CSc1ccccc1O 62a_100000739446_200000040189 [0,0,0,0,0,2|1,0,0]=3 27431 B16R1.1696 COCCOC(=O)CSc1ccccc1O 62a_200000040189_100000739446 [0,0,0,0,0,2|1,0,0]=3 27432 B16R1.1696 COCCOC(=O)CSc1cccnc1O 62a_100000760158_200000040189 [0,0,0,0,0,2|2,0,0]=4 27433 B16R1.1696 COCCOC(=O)CSc1cccnc1O 62a_200000040189_100000760158 [0,0,0,0,0,2|2,0,0]=4 27434 B16R1.1696 COCCOC(=O)CSc1ccncc1O 62a_100009817591_200000040189 [0,0,0,0,0,2|2,0,0]=4 27435 B16R1.1696 COCCOC(=O)CSc1ccncc1O 62a_200000040189_100009817591 [0,0,0,0,0,2|2,0,0]=4 27436 B16R1.1696 COCCOC(=O)CSc1ncccc1O 62a_100000034122_200000040189 [0,0,0,0,0,2|2,0,0]=4 27437 B16R1.1696 COCCOC(=O)CSc1ncccc1O 62a_200000040189_100000034122 [0,0,0,0,0,2|2,0,0]=4 27438 B16R1.1696 CSCCCC(=O)CCc1ccccc1O 1458a_100000173376_100000722297 [0,0,0,0,0,2|2,0,0]=4 27439 B16R1.1696 CSCCCC(=O)NCc1ccccc1O 240690a_100000185550_100000173376 [0,0,0,0,0,2|2,0,0]=4 27440 B16R1.1696 CSCCCC(=O)NCc1ccccc1O 527a_100000185550_100000173376 [0,0,0,0,0,2|2,0,0]=4 27441 B16R1.1696 CSCCNC(=O)CCc1ccccc1O 11a_100020590264_100000181328 [0,0,0,0,0,2|2,0,0]=4 27442 B16R1.1696 CSCCNC(=O)CCc1ccccc1O 240690a_100020590264_100000181328 [0,0,0,0,0,2|2,0,0]=4 27443 B16R1.1696 CSCCNC(=O)CCc1ccccc1O 527a_100020590264_100000181328 [0,0,0,0,0,2|2,0,0]=4 27444 B16R1.1696 CSCCNC(=O)COc1ccccc1O 240690a_100020590264_100000183020 [0,0,0,0,0,2|2,0,0]=4 27445 B16R1.1696 CSCCNC(=O)COc1ccccc1O 527a_100020590264_100000183020 [0,0,0,0,0,2|2,0,0]=4 27446 B16R1.1696 CSCCNC(=O)CSc1ccccc1O 240690a_100020590264_100000695322 [0,0,0,0,0,2|2,0,0]=4 27447 B16R1.1696 CSCCNC(=O)CSc1ccccc1O 527a_100020590264_100000695322 [0,0,0,0,0,2|2,0,0]=4 27448 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 2708a_100000185550_100020590264 [0,0,0,0,0,2|2,0,0]=4 27449 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 2708a_100020590264_100000185550 [0,0,0,0,0,2|2,0,0]=4 27450 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 273464a_100000185550_100020590264 [0,0,0,0,0,2|2,0,0]=4 27451 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 273464a_100020590264_100000185550 [0,0,0,0,0,2|2,0,0]=4 27452 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 512a_100000185550_100020590264 [0,0,0,0,0,2|2,0,0]=4 27453 B16R1.1696 O=C(C=Cc1ccccc1O)CCCCF 1458a_100016263591_100000729493 [0,0,0,0,0,2|2,0,0]=4 27454 B16R1.1696 O=C(C=Cc1ccccc1O)CCCCO 1458a_100016263591_100000210776 [0,0,0,0,0,2|2,0,0]=4 27455 B16R1.1696 O=C(CCCCF)CCc1ccccc1O 1458a_100000181328_100000729493 [0,0,0,0,0,2|2,0,0]=4 27456 B16R1.1696 O=C(CCCCF)COc1ccccc1O 1458a_100000183020_100000729493 [0,0,0,0,0,2|2,0,0]=4 27457 B16R1.1696 O=C(CCCCF)CSc1ccccc1O 1458a_100000695322_100000729493 [0,0,0,0,0,2|2,0,0]=4 27458 B16R1.1696 O=C(CCCCO)CCc1ccccc1O 1458a_100000181328_100000210776 [0,0,0,0,0,2|2,0,0]=4 27459 B16R1.1696 O=C(CCCCO)CCc1ccccc1O 1458a_100000695505_100000722297 [0,0,0,0,0,2|2,0,0]=4 27460 B16R1.1696 O=C(CCCCO)COc1ccccc1O 1458a_100000183020_100000210776 [0,0,0,0,0,2|2,0,0]=4 27461 B16R1.1696 O=C(CCCCO)CSc1ccccc1O 1458a_100000695322_100000210776 [0,0,0,0,0,2|2,0,0]=4 27462 B16R1.1696 O=C(CCc1ccccc1O)NCCCF 11a_100015189416_100000181328 [0,0,0,0,0,2|2,0,0]=4 27463 B16R1.1696 O=C(CCc1ccccc1O)NCCCF 240690a_100015189416_100000181328 [0,0,0,0,0,2|2,0,0]=4 27464 B16R1.1696 O=C(CCc1ccccc1O)NCCCF 527a_100015189416_100000181328 [0,0,0,0,0,2|2,0,0]=4 27465 B16R1.1696 O=C(CCc1ccccc1O)NCCCO 240690a_100000182051_100000181328 [0,0,0,0,0,2|2,0,0]=4 27466 B16R1.1696 O=C(CCc1ccccc1O)NCCCO 527a_100000182051_100000181328 [0,0,0,0,0,2|2,0,0]=4 27467 B16R1.1696 O=C(COc1ccccc1O)NCCCF 240690a_100015189416_100000183020 [0,0,0,0,0,2|2,0,0]=4 27468 B16R1.1696 O=C(COc1ccccc1O)NCCCF 527a_100015189416_100000183020 [0,0,0,0,0,2|2,0,0]=4 27469 B16R1.1696 O=C(COc1ccccc1O)NCCCO 240690a_100000182051_100000183020 [0,0,0,0,0,2|2,0,0]=4 27470 B16R1.1696 O=C(COc1ccccc1O)NCCCO 527a_100000182051_100000183020 [0,0,0,0,0,2|2,0,0]=4 27471 B16R1.1696 O=C(CSc1ccccc1O)NCCCF 240690a_100015189416_100000695322 [0,0,0,0,0,2|2,0,0]=4 27472 B16R1.1696 O=C(CSc1ccccc1O)NCCCF 527a_100015189416_100000695322 [0,0,0,0,0,2|2,0,0]=4 27473 B16R1.1696 O=C(CSc1ccccc1O)NCCCO 240690a_100000182051_100000695322 [0,0,0,0,0,2|2,0,0]=4 27474 B16R1.1696 O=C(CSc1ccccc1O)NCCCO 527a_100000182051_100000695322 [0,0,0,0,0,2|2,0,0]=4 27475 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 2708a_100000185550_100015189416 [0,0,0,0,0,2|2,0,0]=4 27476 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 2708a_100015189416_100000185550 [0,0,0,0,0,2|2,0,0]=4 27477 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 273464a_100000185550_100015189416 [0,0,0,0,0,2|2,0,0]=4 27478 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 273464a_100015189416_100000185550 [0,0,0,0,0,2|2,0,0]=4 27479 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 512a_100000185550_100015189416 [0,0,0,0,0,2|2,0,0]=4 27480 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 2708a_100000185550_100000182051 [0,0,0,0,0,2|2,0,0]=4 27481 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 273464a_100000182051_100000185550 [0,0,0,0,0,2|2,0,0]=4 27482 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 273464a_100000185550_100000182051 [0,0,0,0,0,2|2,0,0]=4 27483 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 512a_100000185550_100000182051 [0,0,0,0,0,2|2,0,0]=4