0 B13R1.17 C#CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000753159 [0,0,0,0,0,0|2,1,1]=4 1 B13R1.17 C#CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000753159 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.17 C#CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000753159 [0,0,0,0,0,0|2,0,1]=3 3 B13R1.17 C#CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000753159 [0,0,0,0,0,0|2,1,1]=4 4 B13R1.17 C#CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000753159 [0,0,0,0,0,0|2,1,1]=4 5 B13R1.17 C#CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000753159 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 11a_100000212058_100000185839 [0,0,0,0,0,0|1,1,1]=3 7 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 1626a_100000212058_100000185839 [0,0,0,0,0,0|1,1,1]=3 8 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 240690a_100000212058_100000185839 [0,0,0,0,0,0|1,1,1]=3 9 B13R1.17 C#CCNC(=O)c1ccc(cc1)Br 527a_100000212058_100000185839 [0,0,0,0,0,0|1,1,1]=3 10 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 11a_100000212058_100000188618 [0,0,0,0,0,0|2,0,1]=3 11 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 1626a_100000212058_100000188618 [0,0,0,0,0,0|2,0,1]=3 12 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 240690a_100000212058_100000188618 [0,0,0,0,0,0|2,0,1]=3 13 B13R1.17 C#CCNC(=O)c1ccc(cc1)C 527a_100000212058_100000188618 [0,0,0,0,0,0|2,0,1]=3 14 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 11a_100000212058_100000210187 [0,0,0,0,0,0|1,0,1]=2 15 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 1626a_100000212058_100000210187 [0,0,0,0,0,0|1,0,1]=2 16 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 240690a_100000212058_100000210187 [0,0,0,0,0,0|1,0,1]=2 17 B13R1.17 C#CCNC(=O)c1ccc(cc1)Cl 527a_100000212058_100000210187 [0,0,0,0,0,0|1,0,1]=2 18 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 11a_100000212058_100000187176 [0,0,0,0,0,0|1,1,1]=3 19 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 1626a_100000212058_100000187176 [0,0,0,0,0,0|1,1,1]=3 20 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 240690a_100000212058_100000187176 [0,0,0,0,0,0|1,1,1]=3 21 B13R1.17 C#CCNC(=O)c1ccc(cc1)F 527a_100000212058_100000187176 [0,0,0,0,0,0|1,1,1]=3 22 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 11a_100000212058_100000187904 [0,0,0,0,0,0|1,1,1]=3 23 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 1626a_100000212058_100000187904 [0,0,0,0,0,0|1,1,1]=3 24 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 240690a_100000212058_100000187904 [0,0,0,0,0,0|1,1,1]=3 25 B13R1.17 C#CCNC(=O)c1ccc(cc1)I 527a_100000212058_100000187904 [0,0,0,0,0,0|1,1,1]=3 26 B13R1.17 C#CCNC(=O)c1ccc(cc1)O 240690a_100000212058_100000212099 [0,0,0,0,0,0|2,0,1]=3 27 B13R1.17 C#CCNC(=O)c1ccc(cc1)O 527a_100000212058_100000212099 [0,0,0,0,0,0|2,0,1]=3 28 B13R1.17 C#CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000038162 [0,0,0,0,0,0|2,0,2]=4 29 B13R1.17 C#CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000184674 [0,0,0,0,0,0|2,0,2]=4 30 B13R1.17 C/C=C/CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100102629194 [0,0,0,0,0,0|2,0,2]=4 31 B13R1.17 C=CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000754431 [0,0,0,0,0,0|2,1,1]=4 32 B13R1.17 C=CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000754431 [0,0,0,0,0,0|3,0,1]=4 33 B13R1.17 C=CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000754431 [0,0,0,0,0,0|2,0,1]=3 34 B13R1.17 C=CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000754431 [0,0,0,0,0,0|2,1,1]=4 35 B13R1.17 C=CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000754431 [0,0,0,0,0,0|2,1,1]=4 36 B13R1.17 C=CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000754431 [0,0,0,0,0,0|3,0,1]=4 37 B13R1.17 C=CCCC(=O)c1ccc(cc1)O 271570a_203496583355_200012050250 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 1626a_100020586998_100000185839 [0,0,0,0,0,0|1,1,1]=3 39 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 240690a_100020586998_100000185839 [0,0,0,0,0,0|1,1,1]=3 40 B13R1.17 C=CCNC(=O)c1ccc(cc1)Br 527a_100020586998_100000185839 [0,0,0,0,0,0|1,1,1]=3 41 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 1626a_100020586998_100000188618 [0,0,0,0,0,0|2,0,1]=3 42 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 240690a_100020586998_100000188618 [0,0,0,0,0,0|2,0,1]=3 43 B13R1.17 C=CCNC(=O)c1ccc(cc1)C 527a_100020586998_100000188618 [0,0,0,0,0,0|2,0,1]=3 44 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 1626a_100020586998_100000210187 [0,0,0,0,0,0|1,0,1]=2 45 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 240690a_100020586998_100000210187 [0,0,0,0,0,0|1,0,1]=2 46 B13R1.17 C=CCNC(=O)c1ccc(cc1)Cl 527a_100020586998_100000210187 [0,0,0,0,0,0|1,0,1]=2 47 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 1626a_100020586998_100000187176 [0,0,0,0,0,0|1,1,1]=3 48 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 240690a_100020586998_100000187176 [0,0,0,0,0,0|1,1,1]=3 49 B13R1.17 C=CCNC(=O)c1ccc(cc1)F 527a_100020586998_100000187176 [0,0,0,0,0,0|1,1,1]=3 50 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 1626a_100020586998_100000187904 [0,0,0,0,0,0|1,1,1]=3 51 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 240690a_100020586998_100000187904 [0,0,0,0,0,0|1,1,1]=3 52 B13R1.17 C=CCNC(=O)c1ccc(cc1)I 527a_100020586998_100000187904 [0,0,0,0,0,0|1,1,1]=3 53 B13R1.17 C=CCNC(=O)c1ccc(cc1)O 240690a_100020586998_100000212099 [0,0,0,0,0,0|2,0,1]=3 54 B13R1.17 C=CCNC(=O)c1ccc(cc1)O 527a_100020586998_100000212099 [0,0,0,0,0,0|2,0,1]=3 55 B13R1.17 C=CCNC(C)c1ccc(cc1)Cl 2230a_100020586998_100000684792 [0,0,0,0,0,0|2,0,2]=4 56 B13R1.17 C=CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210623 [0,0,0,0,0,0|2,0,2]=4 57 B13R1.17 C=CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100015514636 [0,0,0,0,0,0|2,0,2]=4 58 B13R1.17 CC#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748600 [0,0,0,0,0,0|2,0,2]=4 59 B13R1.17 CC(NCCF)c1ccc(cc1)Br 269862a_100000724931_100000185794 [0,0,0,0,0,0|2,1,1]=4 60 B13R1.17 CC(NCCF)c1ccc(cc1)Br 34a_100000724931_100000755118 [0,0,0,0,0,0|2,1,1]=4 61 B13R1.17 CC(NCCF)c1ccc(cc1)Cl 269862a_100000724931_100000185797 [0,0,0,0,0,0|2,0,1]=3 62 B13R1.17 CC(NCCF)c1ccc(cc1)F 269862a_100000724931_100000185800 [0,0,0,0,0,0|2,1,1]=4 63 B13R1.17 CC(NCCF)c1ccc(cc1)F 34a_100000724931_100000743420 [0,0,0,0,0,0|2,1,1]=4 64 B13R1.17 CC(NCCF)c1ccc(cc1)I 269862a_100000724931_100000185465 [0,0,0,0,0,0|2,1,1]=4 65 B13R1.17 CC(NCCF)c1ccc(cn1)Cl 269862a_100000724931_100000692432 [0,0,0,0,0,0|3,0,1]=4 66 B13R1.17 CC(NCCF)c1ccc(nc1)Cl 269862a_100000724931_100000690552 [0,0,0,0,0,0|3,0,1]=4 67 B13R1.17 CC(NCCO)c1cc[n+](cc1)[O-] 269862a_100000210304_100000076990 [0,0,0,0,0,0|3,0,1]=4 68 B13R1.17 CC(NCCO)c1ccc(cc1)Br 2230a_100016997473_100000755118 [0,0,0,0,0,0|1,1,1]=3 69 B13R1.17 CC(NCCO)c1ccc(cc1)Br 269862a_100000210304_100000185794 [0,0,0,0,0,0|1,1,1]=3 70 B13R1.17 CC(NCCO)c1ccc(cc1)Br 34a_100016990907_100000755118 [0,0,0,0,0,0|1,1,1]=3 71 B13R1.17 CC(NCCO)c1ccc(cc1)Cl 2230a_100016997473_100000684792 [0,0,0,0,0,0|1,0,1]=2 72 B13R1.17 CC(NCCO)c1ccc(cc1)Cl 269862a_100000210304_100000185797 [0,0,0,0,0,0|1,0,1]=2 73 B13R1.17 CC(NCCO)c1ccc(cc1)F 2230a_100016997473_100000743420 [0,0,0,0,0,0|1,1,1]=3 74 B13R1.17 CC(NCCO)c1ccc(cc1)F 269862a_100000210304_100000185800 [0,0,0,0,0,0|1,1,1]=3 75 B13R1.17 CC(NCCO)c1ccc(cc1)F 34a_100016990907_100000743420 [0,0,0,0,0,0|1,1,1]=3 76 B13R1.17 CC(NCCO)c1ccc(cc1)I 269862a_100000210304_100000185465 [0,0,0,0,0,0|1,1,1]=3 77 B13R1.17 CC(NCCO)c1ccc(cn1)Br 2230a_100000723930_100000211926 [0,0,0,0,0,0|2,1,1]=4 78 B13R1.17 CC(NCCO)c1ccc(cn1)Br 269862a_100000210304_100000686046 [0,0,0,0,0,0|2,1,1]=4 79 B13R1.17 CC(NCCO)c1ccc(cn1)Br 270004a_100000210304_100000686046 [0,0,0,0,0,0|2,1,1]=4 80 B13R1.17 CC(NCCO)c1ccc(cn1)Cl 269862a_100000210304_100000692432 [0,0,0,0,0,0|2,0,1]=3 81 B13R1.17 CC(NCCO)c1ccc(cn1)Cl 270004a_100000210304_100000692432 [0,0,0,0,0,0|2,0,1]=3 82 B13R1.17 CC(NCCO)c1ccc(cn1)F 269862a_100000210304_100102946652 [0,0,0,0,0,0|2,1,1]=4 83 B13R1.17 CC(NCCO)c1ccc(cn1)F 270004a_100000210304_100102946652 [0,0,0,0,0,0|2,1,1]=4 84 B13R1.17 CC(NCCO)c1ccc(nc1)Br 269862a_100000210304_100000684857 [0,0,0,0,0,0|2,1,1]=4 85 B13R1.17 CC(NCCO)c1ccc(nc1)Cl 269862a_100000210304_100000690552 [0,0,0,0,0,0|2,0,1]=3 86 B13R1.17 CC(NCCO)c1ccc(nc1)F 269862a_100000210304_100000085738 [0,0,0,0,0,0|2,1,1]=4 87 B13R1.17 CC(NCCO)c1cnc(cn1)Cl 269862a_100000210304_100009883172 [0,0,0,0,0,0|3,0,1]=4 88 B13R1.17 CC(NCCO)c1cnc(cn1)Cl 270004a_100000210304_100009883172 [0,0,0,0,0,0|3,0,1]=4 89 B13R1.17 CC(OCCO)c1ccc(cc1)Br 34a_100000745893_100000211926 [0,0,0,0,0,0|2,1,1]=4 90 B13R1.17 CC(OCCO)c1ccc(cc1)Br 7a_100000745893_100000211926 [0,0,0,0,0,0|2,1,1]=4 91 B13R1.17 CC(OCCO)c1ccc(cc1)F 34a_100000181323_100000211926 [0,0,0,0,0,0|2,1,1]=4 92 B13R1.17 CC(OCCO)c1ccc(cc1)F 7a_100000181323_100000211926 [0,0,0,0,0,0|2,1,1]=4 93 B13R1.17 CC(OCCO)c1ccc(cc1)N 34a_100011216399_100000211926 [0,0,0,0,0,0|3,0,1]=4 94 B13R1.17 CC(OCCO)c1ccc(nc1)Cl 34a_200012017543_100000211926 [0,0,0,0,0,0|3,0,1]=4 95 B13R1.17 CC(OCCO)c1ccc(nc1)Cl 7a_200012017543_100000211926 [0,0,0,0,0,0|3,0,1]=4 96 B13R1.17 CC(SCCF)c1ccc(cc1)Cl 62a_100000684792_100011217306 [0,0,0,0,0,0|3,0,1]=4 97 B13R1.17 CC(SCCF)c1ccc(cc1)Cl 62a_100011217306_100000684792 [0,0,0,0,0,0|3,0,1]=4 98 B13R1.17 CC(SCCO)c1ccc(cc1)Br 62a_100000211926_100000755118 [0,0,0,0,0,0|2,1,1]=4 99 B13R1.17 CC(SCCO)c1ccc(cc1)Br 62a_100000755118_100000211926 [0,0,0,0,0,0|2,1,1]=4 100 B13R1.17 CC(SCCO)c1ccc(cc1)Cl 62a_100000211926_100000684792 [0,0,0,0,0,0|2,0,1]=3 101 B13R1.17 CC(SCCO)c1ccc(cc1)Cl 62a_100000684792_100000211926 [0,0,0,0,0,0|2,0,1]=3 102 B13R1.17 CC(SCCO)c1ccc(cc1)F 62a_100000211926_100000743420 [0,0,0,0,0,0|2,1,1]=4 103 B13R1.17 CC(SCCO)c1ccc(cc1)F 62a_100000743420_100000211926 [0,0,0,0,0,0|2,1,1]=4 104 B13R1.17 CC=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000070051 [0,0,0,0,0,0|2,0,2]=4 105 B13R1.17 CC=NNC(=O)c1ccc(cc1)Br 4a_100000183614_200000210099 [0,0,0,0,0,0|2,1,1]=4 106 B13R1.17 CC=NNC(=O)c1ccc(cc1)C 4a_100000189790_200000210099 [0,0,0,0,0,0|3,0,1]=4 107 B13R1.17 CC=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_200000210099 [0,0,0,0,0,0|2,0,1]=3 108 B13R1.17 CC=NNC(=O)c1ccc(cc1)F 4a_100000182866_200000210099 [0,0,0,0,0,0|2,1,1]=4 109 B13R1.17 CC=NNC(=O)c1ccc(cc1)I 4a_100000189773_200000210099 [0,0,0,0,0,0|2,1,1]=4 110 B13R1.17 CC=NNC(=O)c1ccc(cn1)Cl 4a_100012017650_200000210099 [0,0,0,0,0,0|3,0,1]=4 111 B13R1.17 CC=NNC(=O)c1ccc(nc1)Cl 4a_100000189807_200000210099 [0,0,0,0,0,0|3,0,1]=4 112 B13R1.17 CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210211 [0,0,0,0,0,0|2,1,0]=3 113 B13R1.17 CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210211 [0,0,0,0,0,0|3,0,0]=3 114 B13R1.17 CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210211 [0,0,0,0,0,0|2,0,0]=2 115 B13R1.17 CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210211 [0,0,0,0,0,0|2,1,0]=3 116 B13R1.17 CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210211 [0,0,0,0,0,0|2,1,0]=3 117 B13R1.17 CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210211 [0,0,0,0,0,0|3,0,0]=3 118 B13R1.17 CCCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011215321 [0,0,0,0,0,0|3,0,0]=3 119 B13R1.17 CCCCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210211 [0,0,0,0,0,0|4,0,0]=4 120 B13R1.17 CCCCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210211 [0,0,0,0,0,0|4,0,0]=4 121 B13R1.17 CCCCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210210 [0,0,0,0,0,0|4,0,0]=4 122 B13R1.17 CCCCS(=O)c1ccc(cc1)O 271570a_203496583355_100016336038 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 11a_100020643023_100000185839 [0,0,0,0,0,0|1,1,0]=2 124 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 1626a_100020643023_100000185839 [0,0,0,0,0,0|1,1,0]=2 125 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 240690a_100020643023_100000185839 [0,0,0,0,0,0|1,1,0]=2 126 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 527a_100020643023_100000185839 [0,0,0,0,0,0|1,1,0]=2 127 B13R1.17 CCCNC(=O)c1ccc(cc1)C 11a_100020643023_100000188618 [0,0,0,0,0,0|2,0,0]=2 128 B13R1.17 CCCNC(=O)c1ccc(cc1)C 1626a_100020643023_100000188618 [0,0,0,0,0,0|2,0,0]=2 129 B13R1.17 CCCNC(=O)c1ccc(cc1)C 240690a_100020643023_100000188618 [0,0,0,0,0,0|2,0,0]=2 130 B13R1.17 CCCNC(=O)c1ccc(cc1)C 527a_100020643023_100000188618 [0,0,0,0,0,0|2,0,0]=2 131 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 11a_100020643023_100000210187 [0,0,0,0,0,0|1,0,0]=1 132 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 1626a_100020643023_100000210187 [0,0,0,0,0,0|1,0,0]=1 133 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 240690a_100020643023_100000210187 [0,0,0,0,0,0|1,0,0]=1 134 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 527a_100020643023_100000210187 [0,0,0,0,0,0|1,0,0]=1 135 B13R1.17 CCCNC(=O)c1ccc(cc1)F 11a_100020643023_100000187176 [0,0,0,0,0,0|1,1,0]=2 136 B13R1.17 CCCNC(=O)c1ccc(cc1)F 1626a_100020643023_100000187176 [0,0,0,0,0,0|1,1,0]=2 137 B13R1.17 CCCNC(=O)c1ccc(cc1)F 240690a_100020643023_100000187176 [0,0,0,0,0,0|1,1,0]=2 138 B13R1.17 CCCNC(=O)c1ccc(cc1)F 527a_100020643023_100000187176 [0,0,0,0,0,0|1,1,0]=2 139 B13R1.17 CCCNC(=O)c1ccc(cc1)I 11a_100020643023_100000187904 [0,0,0,0,0,0|1,1,0]=2 140 B13R1.17 CCCNC(=O)c1ccc(cc1)I 1626a_100020643023_100000187904 [0,0,0,0,0,0|1,1,0]=2 141 B13R1.17 CCCNC(=O)c1ccc(cc1)I 240690a_100020643023_100000187904 [0,0,0,0,0,0|1,1,0]=2 142 B13R1.17 CCCNC(=O)c1ccc(cc1)I 527a_100020643023_100000187904 [0,0,0,0,0,0|1,1,0]=2 143 B13R1.17 CCCNC(=O)c1ccc(cc1)O 240690a_100020643023_100000212099 [0,0,0,0,0,0|2,0,0]=2 144 B13R1.17 CCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000152267 [0,0,0,0,0,0|2,0,0]=2 145 B13R1.17 CCCNC(=O)c1ccc(cc1)O 527a_100020643023_100000212099 [0,0,0,0,0,0|2,0,0]=2 146 B13R1.17 CCCNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781247 [0,0,0,0,0,0|3,0,0]=3 147 B13R1.17 CCCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000161739 [0,0,0,0,0,0|3,0,0]=3 148 B13R1.17 CCCNC(C)c1ccc(cc1)Br 269862a_100020643023_100000185794 [0,0,0,0,0,0|2,1,1]=4 149 B13R1.17 CCCNC(C)c1ccc(cc1)C 269862a_100020643023_100000185793 [0,0,0,0,0,0|3,0,1]=4 150 B13R1.17 CCCNC(C)c1ccc(cc1)Cl 269862a_100020643023_100000185797 [0,0,0,0,0,0|2,0,1]=3 151 B13R1.17 CCCNC(C)c1ccc(cc1)F 269862a_100020643023_100000185800 [0,0,0,0,0,0|2,1,1]=4 152 B13R1.17 CCCNC(C)c1ccc(cc1)I 269862a_100020643023_100000185465 [0,0,0,0,0,0|2,1,1]=4 153 B13R1.17 CCCNC(C)c1ccc(cn1)Cl 269862a_100020643023_100000692432 [0,0,0,0,0,0|3,0,1]=4 154 B13R1.17 CCCNC(C)c1ccc(cn1)Cl 270004a_100020643023_100000692432 [0,0,0,0,0,0|3,0,1]=4 155 B13R1.17 CCCNC(C)c1ccc(nc1)Cl 269862a_100020643023_100000690552 [0,0,0,0,0,0|3,0,1]=4 156 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210303 [0,0,0,0,0,0|2,1,1]=4 157 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210303 [0,0,0,0,0,0|2,1,1]=4 158 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210303 [0,0,0,0,0,0|2,1,1]=4 159 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210303 [0,0,0,0,0,0|3,0,1]=4 160 B13R1.17 CCCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210303 [0,0,0,0,0,0|2,1,1]=4 161 B13R1.17 CCCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210303 [0,0,0,0,0,0|3,0,1]=4 162 B13R1.17 CCCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210303 [0,0,0,0,0,0|3,0,1]=4 163 B13R1.17 CCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210303 [0,0,0,0,0,0|2,0,1]=3 164 B13R1.17 CCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210303 [0,0,0,0,0,0|2,0,1]=3 165 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210303 [0,0,0,0,0,0|3,0,1]=4 166 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210303 [0,0,0,0,0,0|3,0,1]=4 167 B13R1.17 CCCSC(C)c1ccc(cc1)Cl 62a_100000210303_100000684792 [0,0,0,0,0,0|3,0,1]=4 168 B13R1.17 CCCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210303 [0,0,0,0,0,0|3,0,1]=4 169 B13R1.17 CCNCC(=O)c1ccc(cc1)C 2230a_100015525214_100000211441 [0,0,0,0,0,0|4,0,0]=4 170 B13R1.17 CCNN=C(C)c1ccc(cc1)Cl 4a_100000756455_100000185797 [0,0,0,0,0,0|3,0,1]=4 171 B13R1.17 CCNNC(=O)c1ccc(cc1)Br 22a_100000756455_100000185839 [0,0,0,0,0,0|2,1,0]=3 172 B13R1.17 CCNNC(=O)c1ccc(cc1)C 22a_100000756455_100000188618 [0,0,0,0,0,0|3,0,0]=3 173 B13R1.17 CCNNC(=O)c1ccc(cc1)Cl 22a_100000756455_100000210187 [0,0,0,0,0,0|2,0,0]=2 174 B13R1.17 CCNNC(=O)c1ccc(cc1)F 22a_100000756455_100000187176 [0,0,0,0,0,0|2,1,0]=3 175 B13R1.17 CCNNC(=O)c1ccc(cc1)I 22a_100000756455_100000187904 [0,0,0,0,0,0|2,1,0]=3 176 B13R1.17 CCNNC(=O)c1ccc(cc1)O 22a_100000756455_100000212099 [0,0,0,0,0,0|3,0,0]=3 177 B13R1.17 CCOCC(=O)c1ccc(cc1)Br 34a_100121572206_100000188085 [0,0,0,0,0,0|3,1,0]=4 178 B13R1.17 CCOCC(=O)c1ccc(cc1)C 34a_100121572206_100000211441 [0,0,0,0,0,0|4,0,0]=4 179 B13R1.17 CCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210202 [0,0,0,0,0,0|3,1,0]=4 180 B13R1.17 CCOCC(=O)c1ccc(cc1)I 34a_100121572206_100011216261 [0,0,0,0,0,0|3,1,0]=4 181 B13R1.17 CCOCC(=O)c1ccc(cc1)O 34a_100121572206_100009814261 [0,0,0,0,0,0|4,0,0]=4 182 B13R1.17 CCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210202 [0,0,0,0,0,0|3,1,0]=4 183 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000210202_100000211441 [0,0,0,0,0,0|4,0,0]=4 184 B13R1.17 CCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210202 [0,0,0,0,0,0|4,0,0]=4 185 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000210202_100000211071 [0,0,0,0,0,0|3,0,0]=3 186 B13R1.17 CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210202 [0,0,0,0,0,0|3,0,0]=3 187 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000210202_100000211279 [0,0,0,0,0,0|3,1,0]=4 188 B13R1.17 CCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210202 [0,0,0,0,0,0|3,1,0]=4 189 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100000210202_100011216261 [0,0,0,0,0,0|3,1,0]=4 190 B13R1.17 CCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210202 [0,0,0,0,0,0|3,1,0]=4 191 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100000210202_100009814261 [0,0,0,0,0,0|4,0,0]=4 192 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210202 [0,0,0,0,0,0|4,0,0]=4 193 B13R1.17 CCSCC(=O)c1ccc(cn1)Cl 62a_100000210202_100016989621 [0,0,0,0,0,0|4,0,0]=4 194 B13R1.17 CCSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100000210202 [0,0,0,0,0,0|4,0,0]=4 195 B13R1.17 CCSCC(=O)c1ccc(nc1)Cl 62a_100000210202_100009864725 [0,0,0,0,0,0|4,0,0]=4 196 B13R1.17 CCSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100000210202 [0,0,0,0,0,0|4,0,0]=4 197 B13R1.17 CN(CCCF)c1ccc(cc1)Cl 2230a_100020629279_100011934791 [0,0,0,0,0,0|4,0,0]=4 198 B13R1.17 CN(CCCF)c1ccc(cc1)Cl 269982a_100020629279_100011934791 [0,0,0,0,0,0|4,0,0]=4 199 B13R1.17 CN(CCCF)c1ccc(cc1)Cl 34a_100020629279_100011934791 [0,0,0,0,0,0|4,0,0]=4 200 B13R1.17 CN(CCCO)c1ccc(cc1)Br 2230a_100000219623_100000230001 [0,0,0,0,0,0|3,1,0]=4 201 B13R1.17 CN(CCCO)c1ccc(cc1)Br 269982a_100000219623_100011215043 [0,0,0,0,0,0|3,1,0]=4 202 B13R1.17 CN(CCCO)c1ccc(cc1)Br 34a_100000219623_100000230001 [0,0,0,0,0,0|3,1,0]=4 203 B13R1.17 CN(CCCO)c1ccc(cc1)Cl 2230a_100020629279_100000230001 [0,0,0,0,0,0|3,0,0]=3 204 B13R1.17 CN(CCCO)c1ccc(cc1)Cl 269982a_100020629279_100011215043 [0,0,0,0,0,0|3,0,0]=3 205 B13R1.17 CN(CCCO)c1ccc(cc1)Cl 34a_100020629279_100000230001 [0,0,0,0,0,0|3,0,0]=3 206 B13R1.17 CN(CCCO)c1ccc(cc1)F 2230a_100000219829_100000230001 [0,0,0,0,0,0|3,1,0]=4 207 B13R1.17 CN(CCCO)c1ccc(cc1)F 269982a_100000219829_100011215043 [0,0,0,0,0,0|3,1,0]=4 208 B13R1.17 CN(CCCO)c1ccc(cc1)F 34a_100000219829_100000230001 [0,0,0,0,0,0|3,1,0]=4 209 B13R1.17 CN(CCCO)c1ccc(cc1)I 2230a_100000743151_100000230001 [0,0,0,0,0,0|3,1,0]=4 210 B13R1.17 CN(CCCO)c1ccc(cc1)I 269982a_100000743151_100011215043 [0,0,0,0,0,0|3,1,0]=4 211 B13R1.17 CN(CCCO)c1ccc(cc1)I 34a_100000743151_100000230001 [0,0,0,0,0,0|3,1,0]=4 212 B13R1.17 CN(CCCO)c1ccc(cc1)O 269982a_100000182112_100011215043 [0,0,0,0,0,0|4,0,0]=4 213 B13R1.17 CN(CCCO)c1ccc(cc1)O 34a_100000182112_100000230001 [0,0,0,0,0,0|4,0,0]=4 214 B13R1.17 CNCCC(=O)c1ccc(cc1)Br 7a_106832991635_100011215963 [0,0,0,0,0,0|3,1,0]=4 215 B13R1.17 CNCCC(=O)c1ccc(cc1)C 2230a_106832991635_100000701375 [0,0,0,0,0,0|4,0,0]=4 216 B13R1.17 CNCCC(=O)c1ccc(cc1)C 7a_106832991635_100000701375 [0,0,0,0,0,0|4,0,0]=4 217 B13R1.17 CNCCC(=O)c1ccc(cc1)Cl 7a_106832991635_100011216492 [0,0,0,0,0,0|3,0,0]=3 218 B13R1.17 CNCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211231 [0,0,0,0,0,0|3,1,0]=4 219 B13R1.17 CNCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211231 [0,0,0,0,0,0|3,1,0]=4 220 B13R1.17 CNCCC(=O)c1ccc(cc1)O 2230a_106832991635_100009879949 [0,0,0,0,0,0|4,0,0]=4 221 B13R1.17 CNCCC(=O)c1ccc(cc1)O 7a_106832991635_100009879949 [0,0,0,0,0,0|4,0,0]=4 222 B13R1.17 COCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000233755 [0,0,0,0,0,0|3,1,0]=4 223 B13R1.17 COCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000233755 [0,0,0,0,0,0|4,0,0]=4 224 B13R1.17 COCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000233755 [0,0,0,0,0,0|3,0,0]=3 225 B13R1.17 COCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000233755 [0,0,0,0,0,0|3,1,0]=4 226 B13R1.17 COCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000233755 [0,0,0,0,0,0|3,1,0]=4 227 B13R1.17 COCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000233755 [0,0,0,0,0,0|4,0,0]=4 228 B13R1.17 COCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000766300 [0,0,0,0,0,0|3,0,1]=4 229 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000751147 [0,0,0,0,0,0|3,1,0]=4 230 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_100011215963_200000210301 [0,0,0,0,0,0|3,1,0]=4 231 B13R1.17 CSCCC(=O)c1ccc(cc1)Br 62a_200000210301_100011215963 [0,0,0,0,0,0|3,1,0]=4 232 B13R1.17 CSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000751147 [0,0,0,0,0,0|4,0,0]=4 233 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_100000701375_200000210301 [0,0,0,0,0,0|4,0,0]=4 234 B13R1.17 CSCCC(=O)c1ccc(cc1)C 62a_200000210301_100000701375 [0,0,0,0,0,0|4,0,0]=4 235 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000751147 [0,0,0,0,0,0|3,0,0]=3 236 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200000210301 [0,0,0,0,0,0|3,0,0]=3 237 B13R1.17 CSCCC(=O)c1ccc(cc1)Cl 62a_200000210301_100011216492 [0,0,0,0,0,0|3,0,0]=3 238 B13R1.17 CSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000751147 [0,0,0,0,0,0|3,1,0]=4 239 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_100000211231_200000210301 [0,0,0,0,0,0|3,1,0]=4 240 B13R1.17 CSCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211231 [0,0,0,0,0,0|3,1,0]=4 241 B13R1.17 CSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000751147 [0,0,0,0,0,0|3,1,0]=4 242 B13R1.17 CSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000751147 [0,0,0,0,0,0|4,0,0]=4 243 B13R1.17 CSCCC(=O)c1ccc(cc1)O 62a_200000210301_100009879949 [0,0,0,0,0,0|4,0,0]=4 244 B13R1.17 CSCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100011218213 [0,0,0,0,0,0|3,0,1]=4 245 B13R1.17 CSCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100011218213 [0,0,0,0,0,0|3,0,1]=4 246 B13R1.17 C[C@@H](NCC#N)c1ccc(cc1)Cl 2230a_100015205461_100011215382 [0,0,0,0,0,0|2,0,2]=4 247 B13R1.17 C[C@@H](NCC=O)c1ccc(cc1)Cl 2230a_100015205461_200015260668 [0,0,0,0,0,0|1,0,3]=4 248 B13R1.17 C[C@@H](NCC=O)c1ccc(cc1)Cl 34a_100015205461_200009817547 [0,0,0,0,0,0|1,0,3]=4 249 B13R1.17 C[C@@H](NCCF)c1ccc(cc1)Br 2230a_100000720352_100011217306 [0,0,0,0,0,0|2,1,1]=4 250 B13R1.17 C[C@@H](NCCF)c1ccc(cc1)Cl 2230a_100015205461_100011217306 [0,0,0,0,0,0|2,0,1]=3 251 B13R1.17 C[C@@H](NCCF)c1ccc(cc1)Cl 34a_100015205461_100011217306 [0,0,0,0,0,0|2,0,1]=3 252 B13R1.17 C[C@@H](NCCO)c1ccc(cc1)Br 2230a_100000720352_100000211926 [0,0,0,0,0,0|1,1,1]=3 253 B13R1.17 C[C@@H](NCCO)c1ccc(cc1)Cl 2230a_100015205461_100000211926 [0,0,0,0,0,0|1,0,1]=2 254 B13R1.17 C[C@@H](NCCO)c1ccc(cc1)Cl 34a_100015205461_100000211926 [0,0,0,0,0,0|1,0,1]=2 255 B13R1.17 C[C@H](NCCF)c1ccc(cc1)F 2230a_100025705893_100011217306 [0,0,0,0,0,0|2,1,1]=4 256 B13R1.17 C[C@H](NCCF)c1ccc(cc1)F 34a_100025705893_100011217306 [0,0,0,0,0,0|2,1,1]=4 257 B13R1.17 C[C@H](NCCF)c1ccc(cc1)I 2230a_100000753911_100011217306 [0,0,0,0,0,0|2,1,1]=4 258 B13R1.17 C[C@H](NCCF)c1ccc(cc1)O 2230a_100161106496_100011217306 [0,0,0,0,0,0|3,0,1]=4 259 B13R1.17 C[C@H](NCCO)c1ccc(cc1)F 2230a_100025705893_100000211926 [0,0,0,0,0,0|1,1,1]=3 260 B13R1.17 C[C@H](NCCO)c1ccc(cc1)F 34a_100025705893_100000211926 [0,0,0,0,0,0|1,1,1]=3 261 B13R1.17 C[C@H](NCCO)c1ccc(cc1)I 2230a_100000753911_100000211926 [0,0,0,0,0,0|1,1,1]=3 262 B13R1.17 C[C@H](NCCO)c1ccc(cc1)O 2230a_100161106496_100000211926 [0,0,0,0,0,0|2,0,1]=3 263 B13R1.17 C[C@H](NCCO)c1ccc(nc1)Br 2230a_100015387476_100000211926 [0,0,0,0,0,0|2,1,1]=4 264 B13R1.17 C[C@H](OCCF)c1ccc(cc1)Cl 34a_100011852131_100011217306 [0,0,0,0,0,0|3,0,1]=4 265 B13R1.17 C[C@H](OCCF)c1ccc(cc1)Cl 7a_100011852131_100011217306 [0,0,0,0,0,0|3,0,1]=4 266 B13R1.17 C[C@H](OCCO)c1ccc(cc1)Cl 34a_100011852131_100000211926 [0,0,0,0,0,0|2,0,1]=3 267 B13R1.17 C[C@H](OCCO)c1ccc(cc1)Cl 7a_100011852131_100000211926 [0,0,0,0,0,0|2,0,1]=3 268 B13R1.17 Cc1ccc(cc1)C(=O)CCC#N 1458a_100000188618_100011215226 [0,0,0,0,0,0|3,0,1]=4 269 B13R1.17 Cc1ccc(cc1)C(=O)CCCF 1458a_100000188618_100011934791 [0,0,0,0,0,0|3,0,0]=3 270 B13R1.17 Cc1ccc(cc1)C(=O)CCCO 1458a_100000188618_100011215043 [0,0,0,0,0,0|2,0,0]=2 271 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_100000701375_200025704644 [0,0,0,0,0,0|4,0,0]=4 272 B13R1.17 Cc1ccc(cc1)C(=O)CCS[13CH3] 62a_200025704644_100000701375 [0,0,0,0,0,0|4,0,0]=4 273 B13R1.17 Cc1ccc(cc1)C(=O)CSCF 62a_100000211441_100015361967 [0,0,0,0,0,0|4,0,0]=4 274 B13R1.17 Cc1ccc(cc1)C(=O)CSCF 62a_100015361967_100000211441 [0,0,0,0,0,0|4,0,0]=4 275 B13R1.17 Cc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000188618 [0,0,0,0,0,0|2,0,1]=3 276 B13R1.17 Cc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000188618 [0,0,0,0,0,0|2,0,1]=3 277 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000188618 [0,0,0,0,0,0|2,0,0]=2 278 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000188618 [0,0,0,0,0,0|2,0,0]=2 279 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000188618 [0,0,0,0,0,0|2,0,0]=2 280 B13R1.17 Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000188618 [0,0,0,0,0,0|2,0,0]=2 281 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000188618 [0,0,0,0,0,0|1,0,0]=1 282 B13R1.17 Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000188618 [0,0,0,0,0,0|1,0,0]=1 283 B13R1.17 Cc1ccc(cc1)C(C)NCCF 269862a_100000724931_100000185793 [0,0,0,0,0,0|3,0,1]=4 284 B13R1.17 Cc1ccc(cc1)C(C)NCCF 34a_100000724931_100011261388 [0,0,0,0,0,0|3,0,1]=4 285 B13R1.17 Cc1ccc(cc1)C(C)NCCO 2230a_100016997473_100011261388 [0,0,0,0,0,0|2,0,1]=3 286 B13R1.17 Cc1ccc(cc1)C(C)NCCO 269862a_100000210304_100000185793 [0,0,0,0,0,0|2,0,1]=3 287 B13R1.17 Cc1ccc(cc1)C(C)NCCO 34a_100016990907_100011261388 [0,0,0,0,0,0|2,0,1]=3 288 B13R1.17 Cc1ccc(cc1)C(C)SCCO 62a_100000211926_100011261388 [0,0,0,0,0,0|3,0,1]=4 289 B13R1.17 Cc1ccc(cc1)C(C)SCCO 62a_100011261388_100000211926 [0,0,0,0,0,0|3,0,1]=4 290 B13R1.17 Cc1ccc(cc1)N(C)CCCO 2230a_100000219977_100000230001 [0,0,0,0,0,0|4,0,0]=4 291 B13R1.17 Cc1ccc(cc1)N(C)CCCO 269982a_100000219977_100011215043 [0,0,0,0,0,0|4,0,0]=4 292 B13R1.17 Cc1ccc(cc1)N(C)CCCO 34a_100000219977_100000230001 [0,0,0,0,0,0|4,0,0]=4 293 B13R1.17 Cc1ccc(cc1)[C@@H](C)NCCF 2230a_100016988085_100011217306 [0,0,0,0,0,0|3,0,1]=4 294 B13R1.17 Cc1ccc(cc1)[C@@H](C)NCCF 34a_100016988085_100011217306 [0,0,0,0,0,0|3,0,1]=4 295 B13R1.17 Cc1ccc(cc1)[C@@H](C)NCCO 2230a_100016988085_100000211926 [0,0,0,0,0,0|2,0,1]=3 296 B13R1.17 Cc1ccc(cc1)[C@@H](C)NCCO 34a_100016988085_100000211926 [0,0,0,0,0,0|2,0,1]=3 297 B13R1.17 Cc1ccc(cc1)[C@@H](C)OCCO 34a_100000690690_100000211926 [0,0,0,0,0,0|3,0,1]=4 298 B13R1.17 Cc1ccc(cc1)[C@@H](C)OCCO 7a_100000690690_100000211926 [0,0,0,0,0,0|3,0,1]=4 299 B13R1.17 Cc1ccc(cn1)C(C)NCCO 2230a_100011815741_100000211926 [0,0,0,0,0,0|3,0,1]=4 300 B13R1.17 Cc1ccc(cn1)C(C)NCCO 269862a_100000210304_100011280547 [0,0,0,0,0,0|3,0,1]=4 301 B13R1.17 Cc1ccc(cn1)C(C)NCCO 34a_100011815741_100000211926 [0,0,0,0,0,0|3,0,1]=4 302 B13R1.17 Cc1ccc(nc1)C(C)NCCO 269862a_100000210304_100000084104 [0,0,0,0,0,0|3,0,1]=4 303 B13R1.17 Cc1ccc(nc1)C(C)NCCO 270004a_100000210304_100000084104 [0,0,0,0,0,0|3,0,1]=4 304 B13R1.17 N#CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215226 [0,0,0,0,0,0|2,1,1]=4 305 B13R1.17 N#CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215226 [0,0,0,0,0,0|2,0,1]=3 306 B13R1.17 N#CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215226 [0,0,0,0,0,0|2,1,1]=4 307 B13R1.17 N#CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215226 [0,0,0,0,0,0|2,1,1]=4 308 B13R1.17 N#CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215226 [0,0,0,0,0,0|3,0,1]=4 309 B13R1.17 N#CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100000689336 [0,0,0,0,0,0|3,0,1]=4 310 B13R1.17 N#CCNC(=O)c1ccc(cc1)Br 1626a_100000734998_100000185839 [0,0,0,0,0,0|1,1,1]=3 311 B13R1.17 N#CCNC(=O)c1ccc(cc1)Br 527a_100000734998_100000185839 [0,0,0,0,0,0|1,1,1]=3 312 B13R1.17 N#CCNC(=O)c1ccc(cc1)Cl 1626a_100000734998_100000210187 [0,0,0,0,0,0|1,0,1]=2 313 B13R1.17 N#CCNC(=O)c1ccc(cc1)Cl 527a_100000734998_100000210187 [0,0,0,0,0,0|1,0,1]=2 314 B13R1.17 N#CCNC(=O)c1ccc(cc1)F 1626a_100000734998_100000187176 [0,0,0,0,0,0|1,1,1]=3 315 B13R1.17 N#CCNC(=O)c1ccc(cc1)F 527a_100000734998_100000187176 [0,0,0,0,0,0|1,1,1]=3 316 B13R1.17 N#CCNC(=O)c1ccc(cc1)I 1626a_100000734998_100000187904 [0,0,0,0,0,0|1,1,1]=3 317 B13R1.17 N#CCNC(=O)c1ccc(cc1)I 527a_100000734998_100000187904 [0,0,0,0,0,0|1,1,1]=3 318 B13R1.17 N#CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000752546 [0,0,0,0,0,0|2,0,1]=3 319 B13R1.17 N#CCNC(=O)c1ccc(cc1)O 527a_100000734998_100000212099 [0,0,0,0,0,0|2,0,1]=3 320 B13R1.17 O=C(CCCF)c1ccc(cc1)Br 1458a_100000185839_100011934791 [0,0,0,0,0,0|2,1,0]=3 321 B13R1.17 O=C(CCCF)c1ccc(cc1)Cl 1458a_100000210187_100011934791 [0,0,0,0,0,0|2,0,0]=2 322 B13R1.17 O=C(CCCF)c1ccc(cc1)F 1458a_100000187176_100011934791 [0,0,0,0,0,0|2,1,0]=3 323 B13R1.17 O=C(CCCF)c1ccc(cc1)I 1458a_100000187904_100011934791 [0,0,0,0,0,0|2,1,0]=3 324 B13R1.17 O=C(CCCF)c1ccc(cc1)O 1458a_100000212099_100011934791 [0,0,0,0,0,0|3,0,0]=3 325 B13R1.17 O=C(CCCO)c1ccc(cc1)Br 1458a_100000185839_100011215043 [0,0,0,0,0,0|1,1,0]=2 326 B13R1.17 O=C(CCCO)c1ccc(cc1)Cl 1458a_100000210187_100011215043 [0,0,0,0,0,0|1,0,0]=1 327 B13R1.17 O=C(CCCO)c1ccc(cc1)F 1458a_100000187176_100011215043 [0,0,0,0,0,0|1,1,0]=2 328 B13R1.17 O=C(CCCO)c1ccc(cc1)I 1458a_100000187904_100011215043 [0,0,0,0,0,0|1,1,0]=2 329 B13R1.17 O=C(CCCO)c1ccc(cc1)O 1458a_100000212099_100011215043 [0,0,0,0,0,0|2,0,0]=2 330 B13R1.17 O=C(COCF)c1ccc(cc1)F 34a_100000246311_100015361967 [0,0,0,0,0,0|3,1,0]=4 331 B13R1.17 O=C(CSCF)c1ccc(cc1)Br 62a_100000188085_100015361967 [0,0,0,0,0,0|3,1,0]=4 332 B13R1.17 O=C(CSCF)c1ccc(cc1)Cl 62a_100000211071_100015361967 [0,0,0,0,0,0|3,0,0]=3 333 B13R1.17 O=C(CSCF)c1ccc(cc1)Cl 62a_100015361967_100000211071 [0,0,0,0,0,0|3,0,0]=3 334 B13R1.17 O=C(CSCF)c1ccc(cc1)F 62a_100000211279_100015361967 [0,0,0,0,0,0|3,1,0]=4 335 B13R1.17 O=C(CSCF)c1ccc(cc1)F 62a_100015361967_100000211279 [0,0,0,0,0,0|3,1,0]=4 336 B13R1.17 O=C(CSCF)c1ccc(cc1)I 62a_100011216261_100015361967 [0,0,0,0,0,0|3,1,0]=4 337 B13R1.17 O=C(CSCF)c1ccc(cc1)I 62a_100015361967_100011216261 [0,0,0,0,0,0|3,1,0]=4 338 B13R1.17 O=C(CSCF)c1ccc(cc1)O 62a_100009814261_100015361967 [0,0,0,0,0,0|4,0,0]=4 339 B13R1.17 O=C(CSCF)c1ccc(cc1)O 62a_100015361967_100009814261 [0,0,0,0,0,0|4,0,0]=4 340 B13R1.17 O=C(CSCF)c1ccc(cn1)Cl 62a_100015361967_100016989621 [0,0,0,0,0,0|4,0,0]=4 341 B13R1.17 O=C(CSCF)c1ccc(cn1)Cl 62a_100016989621_100015361967 [0,0,0,0,0,0|4,0,0]=4 342 B13R1.17 O=C(CSCF)c1ccc(nc1)Cl 62a_100009864725_100015361967 [0,0,0,0,0,0|4,0,0]=4 343 B13R1.17 O=C(CSCF)c1ccc(nc1)Cl 62a_100015361967_100009864725 [0,0,0,0,0,0|4,0,0]=4 344 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 11a_100000724931_100000185839 [0,0,0,0,0,0|1,1,0]=2 345 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 1626a_100000724931_100000185839 [0,0,0,0,0,0|1,1,0]=2 346 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 240690a_100000724931_100000185839 [0,0,0,0,0,0|1,1,0]=2 347 B13R1.17 O=C(NCCF)c1ccc(cc1)Br 527a_100000724931_100000185839 [0,0,0,0,0,0|1,1,0]=2 348 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 11a_100000724931_100000210187 [0,0,0,0,0,0|1,0,0]=1 349 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 1626a_100000724931_100000210187 [0,0,0,0,0,0|1,0,0]=1 350 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 240690a_100000724931_100000210187 [0,0,0,0,0,0|1,0,0]=1 351 B13R1.17 O=C(NCCF)c1ccc(cc1)Cl 527a_100000724931_100000210187 [0,0,0,0,0,0|1,0,0]=1 352 B13R1.17 O=C(NCCF)c1ccc(cc1)F 11a_100000724931_100000187176 [0,0,0,0,0,0|1,1,0]=2 353 B13R1.17 O=C(NCCF)c1ccc(cc1)F 1626a_100000724931_100000187176 [0,0,0,0,0,0|1,1,0]=2 354 B13R1.17 O=C(NCCF)c1ccc(cc1)F 240690a_100000724931_100000187176 [0,0,0,0,0,0|1,1,0]=2 355 B13R1.17 O=C(NCCF)c1ccc(cc1)F 527a_100000724931_100000187176 [0,0,0,0,0,0|1,1,0]=2 356 B13R1.17 O=C(NCCF)c1ccc(cc1)I 11a_100000724931_100000187904 [0,0,0,0,0,0|1,1,0]=2 357 B13R1.17 O=C(NCCF)c1ccc(cc1)I 1626a_100000724931_100000187904 [0,0,0,0,0,0|1,1,0]=2 358 B13R1.17 O=C(NCCF)c1ccc(cc1)I 240690a_100000724931_100000187904 [0,0,0,0,0,0|1,1,0]=2 359 B13R1.17 O=C(NCCF)c1ccc(cc1)I 527a_100000724931_100000187904 [0,0,0,0,0,0|1,1,0]=2 360 B13R1.17 O=C(NCCF)c1ccc(cc1)O 240690a_100000724931_100000212099 [0,0,0,0,0,0|2,0,0]=2 361 B13R1.17 O=C(NCCF)c1ccc(cc1)O 527a_100000724931_100000212099 [0,0,0,0,0,0|2,0,0]=2 362 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 240690a_100000210304_100000185839 [0,0,0,0,0,0|0,1,0]=1 363 B13R1.17 O=C(NCCO)c1ccc(cc1)Br 527a_100000210304_100000185839 [0,0,0,0,0,0|0,1,0]=1 364 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 240690a_100000210304_100000210187 [0,0,0,0,0,0|0,0,0]=0 365 B13R1.17 O=C(NCCO)c1ccc(cc1)Cl 527a_100000210304_100000210187 [0,0,0,0,0,0|0,0,0]=0 366 B13R1.17 O=C(NCCO)c1ccc(cc1)F 240690a_100000210304_100000187176 [0,0,0,0,0,0|0,1,0]=1 367 B13R1.17 O=C(NCCO)c1ccc(cc1)F 527a_100000210304_100000187176 [0,0,0,0,0,0|0,1,0]=1 368 B13R1.17 O=C(NCCO)c1ccc(cc1)I 240690a_100000210304_100000187904 [0,0,0,0,0,0|0,1,0]=1 369 B13R1.17 O=C(NCCO)c1ccc(cc1)I 527a_100000210304_100000187904 [0,0,0,0,0,0|0,1,0]=1 370 B13R1.17 O=C(NCCO)c1ccc(cc1)O 240690a_100000210304_100000212099 [0,0,0,0,0,0|1,0,0]=1 371 B13R1.17 O=C(NCCO)c1ccc(cc1)O 271570a_203496583355_200000158904 [0,0,0,0,0,0|1,0,0]=1 372 B13R1.17 O=C(NCCO)c1ccc(cc1)O 527a_100000210304_100000212099 [0,0,0,0,0,0|1,0,0]=1 373 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_100011215963_200025704644 [0,0,0,0,0,0|3,1,0]=4 374 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Br 62a_200025704644_100011215963 [0,0,0,0,0,0|3,1,0]=4 375 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200025704644 [0,0,0,0,0,0|3,0,0]=3 376 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)Cl 62a_200025704644_100011216492 [0,0,0,0,0,0|3,0,0]=3 377 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_100000211231_200025704644 [0,0,0,0,0,0|3,1,0]=4 378 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211231 [0,0,0,0,0,0|3,1,0]=4 379 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)O 62a_200025704644_100009879949 [0,0,0,0,0,0|4,0,0]=4 380 B13R1.17 [2H]C(OCCO)c1ccc(cc1)F 34a_217856618577_100000211926 [0,0,0,0,0,0|2,1,1]=4 381 B13R1.17 [2H]C(OCCO)c1ccc(cc1)F 7a_217856618577_100000211926 [0,0,0,0,0,0|2,1,1]=4 382 B12R1.1 C#CCNCc1ccc(cc1)Cl 2230a_100000174871_100000038162 [1,0,0,0,0,0|1,0,2]=4 383 B12R1.1 C#CCNCc1ccc(cc1)Cl 34a_100000174871_100000184674 [1,0,0,0,0,0|1,0,2]=4 384 B12R1.1 C#CCNCc1ccc(cc1)Cl 34a_100000212058_100000694040 [1,0,0,0,0,0|1,0,2]=4 385 B12R1.1 C=CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210623 [1,0,0,0,0,0|1,0,2]=4 386 B12R1.1 C=CCNCc1ccc(cc1)Cl 2230a_100020586998_100000694040 [1,0,0,0,0,0|1,0,2]=4 387 B12R1.1 C=CCNCc1ccc(cc1)Cl 270004a_100020586998_100000189385 [1,0,0,0,0,0|1,0,2]=4 388 B12R1.1 C=CCNCc1ccc(cc1)Cl 34a_100000174871_100015514636 [1,0,0,0,0,0|1,0,2]=4 389 B12R1.1 CCCC=Cc1ccc(cc1)Br 271570a_100016258520_100000752885 [1,0,0,0,0,0|2,1,0]=4 390 B12R1.1 CCCC=Cc1ccc(cc1)C 271570a_100016258520_100000186775 [1,0,0,0,0,0|3,0,0]=4 391 B12R1.1 CCCC=Cc1ccc(cc1)Cl 271570a_100016258520_100000755918 [1,0,0,0,0,0|2,0,0]=3 392 B12R1.1 CCCC=Cc1ccc(cc1)F 271570a_100016258520_100000211213 [1,0,0,0,0,0|2,1,0]=4 393 B12R1.1 CCCC=Cc1ccc(cc1)N 271570a_100016258520_100000185761 [1,0,0,0,0,0|3,0,0]=4 394 B12R1.1 CCCC=Cc1ccc(cc1)O 271570a_100016258520_100000185759 [1,0,0,0,0,0|3,0,0]=4 395 B12R1.1 CCCC=Cc1ccc(cn1)Cl 271570a_100016258520_100011356976 [1,0,0,0,0,0|3,0,0]=4 396 B12R1.1 CCCC=Cc1ccc(nc1)Cl 271570a_100016258520_100000034144 [1,0,0,0,0,0|3,0,0]=4 397 B12R1.1 CCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210211 [1,0,0,0,0,0|3,0,0]=4 398 B12R1.1 CCCCNc1ccc(cc1)Cl 34a_100000210052_100000210210 [1,0,0,0,0,0|3,0,0]=4 399 B12R1.1 CCCCOc1ccc(cc1)Cl 34a_100000210216_100000210210 [1,0,0,0,0,0|3,0,0]=4 400 B12R1.1 CCCCOc1ccc(cc1)Cl 7a_100000210216_100000210211 [1,0,0,0,0,0|3,0,0]=4 401 B12R1.1 CCCCSc1ccc(cc1)Cl 62a_100000210211_100000755918 [1,0,0,0,0,0|3,0,0]=4 402 B12R1.1 CCCCSc1ccc(cc1)Cl 62a_100000755918_100000210210 [1,0,0,0,0,0|3,0,0]=4 403 B12R1.1 CCCNCc1ccc(cc1)Br 207a_100020643023_100000186029 [1,0,0,0,0,0|1,1,1]=4 404 B12R1.1 CCCNCc1ccc(cc1)Br 2230a_100000174875_100000210303 [1,0,0,0,0,0|1,1,1]=4 405 B12R1.1 CCCNCc1ccc(cc1)Br 270004a_100020643023_100000186029 [1,0,0,0,0,0|1,1,1]=4 406 B12R1.1 CCCNCc1ccc(cc1)Br 34a_100000174875_100000210303 [1,0,0,0,0,0|1,1,1]=4 407 B12R1.1 CCCNCc1ccc(cc1)C 207a_100020643023_100000211033 [1,0,0,0,0,0|2,0,1]=4 408 B12R1.1 CCCNCc1ccc(cc1)C 2230a_100000174908_100000210303 [1,0,0,0,0,0|2,0,1]=4 409 B12R1.1 CCCNCc1ccc(cc1)C 270004a_100020643023_100000211033 [1,0,0,0,0,0|2,0,1]=4 410 B12R1.1 CCCNCc1ccc(cc1)C 34a_100000174908_100000210303 [1,0,0,0,0,0|2,0,1]=4 411 B12R1.1 CCCNCc1ccc(cc1)Cl 207a_100020643023_100000189385 [1,0,0,0,0,0|1,0,1]=3 412 B12R1.1 CCCNCc1ccc(cc1)Cl 2230a_100000174871_100000210303 [1,0,0,0,0,0|1,0,1]=3 413 B12R1.1 CCCNCc1ccc(cc1)Cl 270004a_100020643023_100000189385 [1,0,0,0,0,0|1,0,1]=3 414 B12R1.1 CCCNCc1ccc(cc1)Cl 34a_100000174871_100000210303 [1,0,0,0,0,0|1,0,1]=3 415 B12R1.1 CCCNCc1ccc(cc1)F 207a_100020643023_100000210084 [1,0,0,0,0,0|1,1,1]=4 416 B12R1.1 CCCNCc1ccc(cc1)F 2230a_100000174882_100000210303 [1,0,0,0,0,0|1,1,1]=4 417 B12R1.1 CCCNCc1ccc(cc1)F 270004a_100020643023_100000210084 [1,0,0,0,0,0|1,1,1]=4 418 B12R1.1 CCCNCc1ccc(cc1)F 34a_100000174882_100000210303 [1,0,0,0,0,0|1,1,1]=4 419 B12R1.1 CCCNCc1ccc(cc1)I 207a_100020643023_100000188517 [1,0,0,0,0,0|1,1,1]=4 420 B12R1.1 CCCNCc1ccc(cc1)I 2230a_100016989417_100000210303 [1,0,0,0,0,0|1,1,1]=4 421 B12R1.1 CCCNCc1ccc(cc1)I 34a_100016989417_100000210303 [1,0,0,0,0,0|1,1,1]=4 422 B12R1.1 CCCNCc1ccc(cc1)O 34a_100000185549_100000210303 [1,0,0,0,0,0|2,0,1]=4 423 B12R1.1 CCCNCc1ccc(cn1)Cl 207a_100020643023_100011361569 [1,0,0,0,0,0|2,0,1]=4 424 B12R1.1 CCCNCc1ccc(cn1)Cl 270004a_100020643023_100011361569 [1,0,0,0,0,0|2,0,1]=4 425 B12R1.1 CCCNCc1ccc(cn1)Cl 34a_100000697193_100000210303 [1,0,0,0,0,0|2,0,1]=4 426 B12R1.1 CCCNCc1ccc(nc1)Cl 2230a_100000735879_100000210303 [1,0,0,0,0,0|2,0,1]=4 427 B12R1.1 CCCNCc1ccc(nc1)Cl 34a_100000735879_100000210303 [1,0,0,0,0,0|2,0,1]=4 428 B12R1.1 CCCOCc1ccc(cc1)Cl 34a_100000210258_100000694040 [1,0,0,0,0,0|2,0,1]=4 429 B12R1.1 CCCOCc1ccc(cc1)Cl 34a_100000211118_100000210303 [1,0,0,0,0,0|2,0,1]=4 430 B12R1.1 CCCOCc1ccc(cc1)Cl 7a_100000211118_100000210303 [1,0,0,0,0,0|2,0,1]=4 431 B12R1.1 CCCSCc1ccc(cc1)Cl 62a_100000187161_100000210303 [1,0,0,0,0,0|2,0,1]=4 432 B12R1.1 CCCSCc1ccc(cc1)Cl 62a_100000210303_100000187161 [1,0,0,0,0,0|2,0,1]=4 433 B12R1.1 CCNN=Cc1ccc(cc1)Cl 4a_100000756455_100000189385 [1,0,0,0,0,0|2,0,1]=4 434 B12R1.1 CCOC=Cc1ccc(cc1)Cl 271570a_100016256518_100000755918 [1,0,0,0,0,0|3,0,0]=4 435 B12R1.1 CNCC=Cc1ccc(cc1)Cl 270004a_106832991635_100102525842 [1,0,0,0,0,0|3,0,0]=4 436 B12R1.1 COCC=Cc1ccc(cc1)Cl 271570a_100016286323_100000755918 [1,0,0,0,0,0|3,0,0]=4 437 B12R1.1 COCNCc1ccc(cc1)Cl 2230a_100000174871_100000766300 [1,0,0,0,0,0|2,0,1]=4 438 B12R1.1 CSCNCc1ccc(cc1)Cl 2230a_100000174871_100011218213 [1,0,0,0,0,0|2,0,1]=4 439 B12R1.1 CSCNCc1ccc(cc1)Cl 34a_100000174871_100011218213 [1,0,0,0,0,0|2,0,1]=4 440 B12R1.1 Cc1ccc(cc1)CNCCF 2230a_100000174908_100011217306 [1,0,0,0,0,0|2,0,1]=4 441 B12R1.1 Cc1ccc(cc1)CNCCF 34a_100000174908_100011217306 [1,0,0,0,0,0|2,0,1]=4 442 B12R1.1 Cc1ccc(cc1)CNCCF 34a_100000724931_100000210814 [1,0,0,0,0,0|2,0,1]=4 443 B12R1.1 Cc1ccc(cc1)CNCCO 207a_100000210304_100000211033 [1,0,0,0,0,0|1,0,1]=3 444 B12R1.1 Cc1ccc(cc1)CNCCO 2230a_100000174908_100000211926 [1,0,0,0,0,0|1,0,1]=3 445 B12R1.1 Cc1ccc(cc1)CNCCO 2230a_100016997473_100000210814 [1,0,0,0,0,0|1,0,1]=3 446 B12R1.1 Cc1ccc(cc1)CNCCO 270004a_100000210304_100000211033 [1,0,0,0,0,0|1,0,1]=3 447 B12R1.1 Cc1ccc(cc1)CNCCO 34a_100000174908_100000211926 [1,0,0,0,0,0|1,0,1]=3 448 B12R1.1 Cc1ccc(cc1)CNCCO 34a_100016990907_100000210814 [1,0,0,0,0,0|1,0,1]=3 449 B12R1.1 Cc1ccc(cc1)COCCO 34a_100011215236_100000211926 [1,0,0,0,0,0|2,0,1]=4 450 B12R1.1 Cc1ccc(cc1)COCCO 7a_100011215236_100000211926 [1,0,0,0,0,0|2,0,1]=4 451 B12R1.1 Cc1ccc(cc1)CSCCO 62a_100000210814_100000211926 [1,0,0,0,0,0|2,0,1]=4 452 B12R1.1 Cc1ccc(cc1)CSCCO 62a_100000211926_100000210814 [1,0,0,0,0,0|2,0,1]=4 453 B12R1.1 Cc1ccc(cc1)NCCCO 34a_100000124888_100000230001 [1,0,0,0,0,0|3,0,0]=4 454 B12R1.1 Cc1ccc(cc1)OCCCO 34a_100000210336_100000230001 [1,0,0,0,0,0|3,0,0]=4 455 B12R1.1 Cc1ccc(cc1)OCCCO 7a_100000210336_100011215043 [1,0,0,0,0,0|3,0,0]=4 456 B12R1.1 Cc1ccc(cc1)SCCCO 62a_100000186775_100011215043 [1,0,0,0,0,0|3,0,0]=4 457 B12R1.1 Cc1ccc(cc1)SCCCO 62a_100011215043_100000186775 [1,0,0,0,0,0|3,0,0]=4 458 B12R1.1 Cc1ccc(cn1)CNCCO 2230a_100016997473_100016987292 [1,0,0,0,0,0|2,0,1]=4 459 B12R1.1 Cc1ccc(cn1)CNCCO 270004a_100000210304_100000743784 [1,0,0,0,0,0|2,0,1]=4 460 B12R1.1 Cc1ccc(cn1)CNCCO 34a_100000740942_100000211926 [1,0,0,0,0,0|2,0,1]=4 461 B12R1.1 Cc1ccc(cn1)CNCCO 34a_100016990907_100016987292 [1,0,0,0,0,0|2,0,1]=4 462 B12R1.1 Cc1ccc(nc1)CNCCO 207a_100000210304_100000050478 [1,0,0,0,0,0|2,0,1]=4 463 B12R1.1 Cc1ccc(nc1)CNCCO 2230a_100016997473_100000691093 [1,0,0,0,0,0|2,0,1]=4 464 B12R1.1 Cc1ccc(nc1)CNCCO 270004a_100000210304_100000050478 [1,0,0,0,0,0|2,0,1]=4 465 B12R1.1 Cc1ccc(nc1)CNCCO 34a_100015187455_100000211926 [1,0,0,0,0,0|2,0,1]=4 466 B12R1.1 Cc1ccc(nc1)CNCCO 34a_100016990907_100000691093 [1,0,0,0,0,0|2,0,1]=4 467 B12R1.1 Clc1ccc(cc1)COCCBr 34a_100000211926_100000694040 [1,0,0,0,0,0|2,0,1]=4 468 B12R1.1 FCCCNc1ccc(cc1)Cl 2230a_100000210052_100011934791 [1,0,0,0,0,0|3,0,0]=4 469 B12R1.1 FCCCNc1ccc(cc1)Cl 34a_100000210052_100011934791 [1,0,0,0,0,0|3,0,0]=4 470 B12R1.1 FCCCOc1ccc(cc1)Cl 34a_100000210216_100011934791 [1,0,0,0,0,0|3,0,0]=4 471 B12R1.1 FCCCOc1ccc(cc1)Cl 7a_100000210216_100011934791 [1,0,0,0,0,0|3,0,0]=4 472 B12R1.1 FCCCSc1ccc(cc1)Cl 62a_100000755918_100011934791 [1,0,0,0,0,0|3,0,0]=4 473 B12R1.1 FCCCSc1ccc(cc1)Cl 62a_100011934791_100000755918 [1,0,0,0,0,0|3,0,0]=4 474 B12R1.1 FCCNCc1ccc(cc1)Br 2230a_100000174875_100011217306 [1,0,0,0,0,0|1,1,1]=4 475 B12R1.1 FCCNCc1ccc(cc1)Br 34a_100000174875_100011217306 [1,0,0,0,0,0|1,1,1]=4 476 B12R1.1 FCCNCc1ccc(cc1)Br 34a_100000724931_100000189115 [1,0,0,0,0,0|1,1,1]=4 477 B12R1.1 FCCNCc1ccc(cc1)Cl 2230a_100000174871_100011217306 [1,0,0,0,0,0|1,0,1]=3 478 B12R1.1 FCCNCc1ccc(cc1)Cl 34a_100000174871_100011217306 [1,0,0,0,0,0|1,0,1]=3 479 B12R1.1 FCCNCc1ccc(cc1)Cl 34a_100000724931_100000694040 [1,0,0,0,0,0|1,0,1]=3 480 B12R1.1 FCCNCc1ccc(cc1)F 2230a_100000174882_100011217306 [1,0,0,0,0,0|1,1,1]=4 481 B12R1.1 FCCNCc1ccc(cc1)F 34a_100000174882_100011217306 [1,0,0,0,0,0|1,1,1]=4 482 B12R1.1 FCCNCc1ccc(cc1)F 34a_100000724931_100000198546 [1,0,0,0,0,0|1,1,1]=4 483 B12R1.1 FCCNCc1ccc(cc1)I 2230a_100016989417_100011217306 [1,0,0,0,0,0|1,1,1]=4 484 B12R1.1 FCCNCc1ccc(cc1)I 34a_100000724931_100000189116 [1,0,0,0,0,0|1,1,1]=4 485 B12R1.1 FCCNCc1ccc(cc1)I 34a_100016989417_100011217306 [1,0,0,0,0,0|1,1,1]=4 486 B12R1.1 FCCNCc1ccc(cn1)Cl 34a_100000697193_100011217306 [1,0,0,0,0,0|2,0,1]=4 487 B12R1.1 FCCNCc1ccc(cn1)Cl 34a_100000724931_100012066911 [1,0,0,0,0,0|2,0,1]=4 488 B12R1.1 FCCNCc1ccc(nc1)Cl 2230a_100000735879_100011217306 [1,0,0,0,0,0|2,0,1]=4 489 B12R1.1 FCCNCc1ccc(nc1)Cl 34a_100000724931_100000735431 [1,0,0,0,0,0|2,0,1]=4 490 B12R1.1 FCCNCc1ccc(nc1)Cl 34a_100000735879_100011217306 [1,0,0,0,0,0|2,0,1]=4 491 B12R1.1 FCCOCc1ccc(cc1)Cl 34a_100000211118_100011217306 [1,0,0,0,0,0|2,0,1]=4 492 B12R1.1 FCCOCc1ccc(cc1)Cl 7a_100000211118_100011217306 [1,0,0,0,0,0|2,0,1]=4 493 B12R1.1 FCCSCc1ccc(cc1)Cl 62a_100000187161_100011217306 [1,0,0,0,0,0|2,0,1]=4 494 B12R1.1 FCCSCc1ccc(cc1)Cl 62a_100011217306_100000187161 [1,0,0,0,0,0|2,0,1]=4 495 B12R1.1 N#CCNCc1ccc(cc1)Cl 2230a_100000174871_100011215382 [1,0,0,0,0,0|1,0,2]=4 496 B12R1.1 NCCOCc1ccc(cc1)Cl 34a_100000210304_100000694040 [1,0,0,0,0,0|2,0,1]=4 497 B12R1.1 Nc1ccc(cc1)COCCO 34a_100011215238_100000211926 [1,0,0,0,0,0|2,0,1]=4 498 B12R1.1 Nc1ccc(cc1)OCCCO 34a_100000185829_100000230001 [1,0,0,0,0,0|3,0,0]=4 499 B12R1.1 Nc1ccc(cc1)SCCCO 62a_100000185761_100011215043 [1,0,0,0,0,0|3,0,0]=4 500 B12R1.1 Nc1ccc(cc1)SCCCO 62a_100011215043_100000185761 [1,0,0,0,0,0|3,0,0]=4 501 B12R1.1 O=CCNCc1ccc(cc1)Cl 2230a_100000174871_200015260668 [1,0,0,0,0,0|0,0,3]=4 502 B12R1.1 O=CCNCc1ccc(cc1)Cl 34a_100000174871_200009817547 [1,0,0,0,0,0|0,0,3]=4 503 B12R1.1 OCCCNc1ccc(cc1)Br 2230a_100000210018_100000230001 [1,0,0,0,0,0|2,1,0]=4 504 B12R1.1 OCCCNc1ccc(cc1)Br 34a_100000210018_100000230001 [1,0,0,0,0,0|2,1,0]=4 505 B12R1.1 OCCCNc1ccc(cc1)Cl 2230a_100000210052_100000230001 [1,0,0,0,0,0|2,0,0]=3 506 B12R1.1 OCCCNc1ccc(cc1)Cl 34a_100000210052_100000230001 [1,0,0,0,0,0|2,0,0]=3 507 B12R1.1 OCCCNc1ccc(cc1)F 34a_100000185862_100000230001 [1,0,0,0,0,0|2,1,0]=4 508 B12R1.1 OCCCNc1ccc(cc1)I 34a_100000185761_100000230001 [1,0,0,0,0,0|2,1,0]=4 509 B12R1.1 OCCCNc1ccc(cc1)O 34a_100000185829_100000230001 [1,0,0,0,0,0|3,0,0]=4 510 B12R1.1 OCCCOc1ccc(cc1)Br 34a_100000185759_100000230001 [1,0,0,0,0,0|2,1,0]=4 511 B12R1.1 OCCCOc1ccc(cc1)Br 7a_100000185759_100011215043 [1,0,0,0,0,0|2,1,0]=4 512 B12R1.1 OCCCOc1ccc(cc1)Cl 34a_100000210216_100000230001 [1,0,0,0,0,0|2,0,0]=3 513 B12R1.1 OCCCOc1ccc(cc1)Cl 7a_100000210216_100011215043 [1,0,0,0,0,0|2,0,0]=3 514 B12R1.1 OCCCOc1ccc(cc1)F 34a_100000210339_100000230001 [1,0,0,0,0,0|2,1,0]=4 515 B12R1.1 OCCCOc1ccc(cc1)I 34a_100000212066_100000230001 [1,0,0,0,0,0|2,1,0]=4 516 B12R1.1 OCCCOc1ccc(cc1)I 7a_100000212066_100011215043 [1,0,0,0,0,0|2,1,0]=4 517 B12R1.1 OCCCOc1ccc(cc1)O 271570a_203496583355_100000756186 [1,0,0,0,0,0|3,0,0]=4 518 B12R1.1 OCCCOc1ccc(cn1)Cl 34a_100011215309_100000230001 [1,0,0,0,0,0|3,0,0]=4 519 B12R1.1 OCCCOc1ccc(nc1)Cl 34a_100000744096_100000230001 [1,0,0,0,0,0|3,0,0]=4 520 B12R1.1 OCCCOc1ccc(nc1)Cl 7a_100000744096_100011215043 [1,0,0,0,0,0|3,0,0]=4 521 B12R1.1 OCCCSc1ccc(cc1)Br 62a_100000752885_100011215043 [1,0,0,0,0,0|2,1,0]=4 522 B12R1.1 OCCCSc1ccc(cc1)Br 62a_100011215043_100000752885 [1,0,0,0,0,0|2,1,0]=4 523 B12R1.1 OCCCSc1ccc(cc1)Cl 62a_100000755918_100011215043 [1,0,0,0,0,0|2,0,0]=3 524 B12R1.1 OCCCSc1ccc(cc1)Cl 62a_100011215043_100000755918 [1,0,0,0,0,0|2,0,0]=3 525 B12R1.1 OCCCSc1ccc(cc1)F 62a_100000211213_100011215043 [1,0,0,0,0,0|2,1,0]=4 526 B12R1.1 OCCCSc1ccc(cc1)F 62a_100011215043_100000211213 [1,0,0,0,0,0|2,1,0]=4 527 B12R1.1 OCCCSc1ccc(cc1)O 62a_100011215043_100000185759 [1,0,0,0,0,0|3,0,0]=4 528 B12R1.1 OCCCSc1ccc(cn1)Cl 62a_100011215043_100011356976 [1,0,0,0,0,0|3,0,0]=4 529 B12R1.1 OCCCSc1ccc(cn1)Cl 62a_100011356976_100011215043 [1,0,0,0,0,0|3,0,0]=4 530 B12R1.1 OCCCSc1ccc(nc1)Cl 62a_100000034144_100011215043 [1,0,0,0,0,0|3,0,0]=4 531 B12R1.1 OCCCSc1ccc(nc1)Cl 62a_100011215043_100000034144 [1,0,0,0,0,0|3,0,0]=4 532 B12R1.1 OCCNCc1ccc(cc1)Br 207a_100000210304_100000186029 [1,0,0,0,0,0|0,1,1]=3 533 B12R1.1 OCCNCc1ccc(cc1)Br 2230a_100000174875_100000211926 [1,0,0,0,0,0|0,1,1]=3 534 B12R1.1 OCCNCc1ccc(cc1)Br 2230a_100016997473_100011217064 [1,0,0,0,0,0|0,1,1]=3 535 B12R1.1 OCCNCc1ccc(cc1)Br 270004a_100000210304_100000186029 [1,0,0,0,0,0|0,1,1]=3 536 B12R1.1 OCCNCc1ccc(cc1)Br 34a_100000174875_100000211926 [1,0,0,0,0,0|0,1,1]=3 537 B12R1.1 OCCNCc1ccc(cc1)Br 34a_100016990907_100000189115 [1,0,0,0,0,0|0,1,1]=3 538 B12R1.1 OCCNCc1ccc(cc1)Cl 207a_100000210304_100000189385 [1,0,0,0,0,0|0,0,1]=2 539 B12R1.1 OCCNCc1ccc(cc1)Cl 2230a_100000174871_100000211926 [1,0,0,0,0,0|0,0,1]=2 540 B12R1.1 OCCNCc1ccc(cc1)Cl 2230a_100016997473_100000694040 [1,0,0,0,0,0|0,0,1]=2 541 B12R1.1 OCCNCc1ccc(cc1)Cl 270004a_100000210304_100000189385 [1,0,0,0,0,0|0,0,1]=2 542 B12R1.1 OCCNCc1ccc(cc1)Cl 34a_100000174871_100000211926 [1,0,0,0,0,0|0,0,1]=2 543 B12R1.1 OCCNCc1ccc(cc1)Cl 34a_100016990907_100000694040 [1,0,0,0,0,0|0,0,1]=2 544 B12R1.1 OCCNCc1ccc(cc1)F 207a_100000210304_100000210084 [1,0,0,0,0,0|0,1,1]=3 545 B12R1.1 OCCNCc1ccc(cc1)F 2230a_100000174882_100000211926 [1,0,0,0,0,0|0,1,1]=3 546 B12R1.1 OCCNCc1ccc(cc1)F 2230a_100016997473_100000198546 [1,0,0,0,0,0|0,1,1]=3 547 B12R1.1 OCCNCc1ccc(cc1)F 270004a_100000210304_100000210084 [1,0,0,0,0,0|0,1,1]=3 548 B12R1.1 OCCNCc1ccc(cc1)F 34a_100000174882_100000211926 [1,0,0,0,0,0|0,1,1]=3 549 B12R1.1 OCCNCc1ccc(cc1)F 34a_100016990907_100000198546 [1,0,0,0,0,0|0,1,1]=3 550 B12R1.1 OCCNCc1ccc(cc1)I 207a_100000210304_100000188517 [1,0,0,0,0,0|0,1,1]=3 551 B12R1.1 OCCNCc1ccc(cc1)I 2230a_100016989417_100000211926 [1,0,0,0,0,0|0,1,1]=3 552 B12R1.1 OCCNCc1ccc(cc1)I 2230a_100016997473_100000189116 [1,0,0,0,0,0|0,1,1]=3 553 B12R1.1 OCCNCc1ccc(cc1)I 34a_100016989417_100000211926 [1,0,0,0,0,0|0,1,1]=3 554 B12R1.1 OCCNCc1ccc(cc1)I 34a_100016990907_100000189116 [1,0,0,0,0,0|0,1,1]=3 555 B12R1.1 OCCNCc1ccc(cc1)O 271570a_203496583355_100000186819 [1,0,0,0,0,0|1,0,1]=3 556 B12R1.1 OCCNCc1ccc(cc1)O 34a_100000185549_100000211926 [1,0,0,0,0,0|1,0,1]=3 557 B12R1.1 OCCNCc1ccc(cn1)Br 207a_100000210304_100000754260 [1,0,0,0,0,0|1,1,1]=4 558 B12R1.1 OCCNCc1ccc(cn1)Br 2230a_100016997473_100000702658 [1,0,0,0,0,0|1,1,1]=4 559 B12R1.1 OCCNCc1ccc(cn1)Br 270004a_100000210304_100000754260 [1,0,0,0,0,0|1,1,1]=4 560 B12R1.1 OCCNCc1ccc(cn1)Br 34a_100015188789_100000211926 [1,0,0,0,0,0|1,1,1]=4 561 B12R1.1 OCCNCc1ccc(cn1)Br 34a_100016990907_100000702658 [1,0,0,0,0,0|1,1,1]=4 562 B12R1.1 OCCNCc1ccc(cn1)Cl 207a_100000210304_100011361569 [1,0,0,0,0,0|1,0,1]=3 563 B12R1.1 OCCNCc1ccc(cn1)Cl 2230a_100016997473_100012066911 [1,0,0,0,0,0|1,0,1]=3 564 B12R1.1 OCCNCc1ccc(cn1)Cl 270004a_100000210304_100011361569 [1,0,0,0,0,0|1,0,1]=3 565 B12R1.1 OCCNCc1ccc(cn1)Cl 34a_100000697193_100000211926 [1,0,0,0,0,0|1,0,1]=3 566 B12R1.1 OCCNCc1ccc(cn1)Cl 34a_100016990907_100012066911 [1,0,0,0,0,0|1,0,1]=3 567 B12R1.1 OCCNCc1ccc(cn1)F 207a_100000210304_100011934744 [1,0,0,0,0,0|1,1,1]=4 568 B12R1.1 OCCNCc1ccc(cn1)F 2230a_100016997473_100000703193 [1,0,0,0,0,0|1,1,1]=4 569 B12R1.1 OCCNCc1ccc(cn1)F 270004a_100000210304_100011934744 [1,0,0,0,0,0|1,1,1]=4 570 B12R1.1 OCCNCc1ccc(cn1)F 34a_100016990907_100000703193 [1,0,0,0,0,0|1,1,1]=4 571 B12R1.1 OCCNCc1ccc(cn1)F 34a_100020620131_100000211926 [1,0,0,0,0,0|1,1,1]=4 572 B12R1.1 OCCNCc1ccc(nc1)Br 2230a_100009817727_100000211926 [1,0,0,0,0,0|1,1,1]=4 573 B12R1.1 OCCNCc1ccc(nc1)Br 2230a_100016997473_100009831999 [1,0,0,0,0,0|1,1,1]=4 574 B12R1.1 OCCNCc1ccc(nc1)Br 34a_100009817727_100000211926 [1,0,0,0,0,0|1,1,1]=4 575 B12R1.1 OCCNCc1ccc(nc1)Br 34a_100016990907_100009831999 [1,0,0,0,0,0|1,1,1]=4 576 B12R1.1 OCCNCc1ccc(nc1)Cl 2230a_100000735879_100000211926 [1,0,0,0,0,0|1,0,1]=3 577 B12R1.1 OCCNCc1ccc(nc1)Cl 2230a_100016997473_100000735431 [1,0,0,0,0,0|1,0,1]=3 578 B12R1.1 OCCNCc1ccc(nc1)Cl 34a_100000735879_100000211926 [1,0,0,0,0,0|1,0,1]=3 579 B12R1.1 OCCNCc1ccc(nc1)Cl 34a_100016990907_100000735431 [1,0,0,0,0,0|1,0,1]=3 580 B12R1.1 OCCNCc1ccc(nc1)F 2230a_100000101913_100000211926 [1,0,0,0,0,0|1,1,1]=4 581 B12R1.1 OCCNCc1ccc(nc1)F 2230a_100016997473_100009820150 [1,0,0,0,0,0|1,1,1]=4 582 B12R1.1 OCCNCc1ccc(nc1)F 34a_100000101913_100000211926 [1,0,0,0,0,0|1,1,1]=4 583 B12R1.1 OCCNCc1ccc(nc1)F 34a_100016990907_100000099788 [1,0,0,0,0,0|1,1,1]=4 584 B12R1.1 OCCNCc1ccc(nc1)O 207a_100000210304_100011361521 [1,0,0,0,0,0|2,0,1]=4 585 B12R1.1 OCCNCc1ccc(nc1)O 2230a_100000757128_100000211926 [1,0,0,0,0,0|2,0,1]=4 586 B12R1.1 OCCNCc1ccc(nn1)Cl 2230a_100016997473_100016992710 [1,0,0,0,0,0|2,0,1]=4 587 B12R1.1 OCCNCc1ccc(nn1)Cl 270004a_100000210304_100000044651 [1,0,0,0,0,0|2,0,1]=4 588 B12R1.1 OCCNCc1ccc(nn1)Cl 34a_100016990907_100016992710 [1,0,0,0,0,0|2,0,1]=4 589 B12R1.1 OCCNCc1cnc(cn1)Cl 270004a_100000210304_100012001714 [1,0,0,0,0,0|2,0,1]=4 590 B12R1.1 OCCOCc1ccc(cc1)Br 34a_100000695286_100000211926 [1,0,0,0,0,0|1,1,1]=4 591 B12R1.1 OCCOCc1ccc(cc1)Cl 34a_100000211118_100000211926 [1,0,0,0,0,0|1,0,1]=3 592 B12R1.1 OCCOCc1ccc(cc1)Cl 7a_100000211118_100000211926 [1,0,0,0,0,0|1,0,1]=3 593 B12R1.1 OCCOCc1ccc(cc1)F 34a_100000210977_100000211926 [1,0,0,0,0,0|1,1,1]=4 594 B12R1.1 OCCOCc1ccc(cc1)F 7a_100000210977_100000211926 [1,0,0,0,0,0|1,1,1]=4 595 B12R1.1 OCCOCc1ccc(cc1)I 34a_100000690907_100000211926 [1,0,0,0,0,0|1,1,1]=4 596 B12R1.1 OCCOCc1ccc(cc1)I 7a_100000690907_100000211926 [1,0,0,0,0,0|1,1,1]=4 597 B12R1.1 OCCOCc1ccc(cn1)Cl 34a_100000703999_100000211926 [1,0,0,0,0,0|2,0,1]=4 598 B12R1.1 OCCOCc1ccc(nc1)Cl 34a_100000755211_100000211926 [1,0,0,0,0,0|2,0,1]=4 599 B12R1.1 OCCOCc1ccc(nc1)Cl 7a_100000755211_100000211926 [1,0,0,0,0,0|2,0,1]=4 600 B12R1.1 OCCSCc1ccc(cc1)Br 62a_100000189115_100000211926 [1,0,0,0,0,0|1,1,1]=4 601 B12R1.1 OCCSCc1ccc(cc1)Br 62a_100000211926_100000189115 [1,0,0,0,0,0|1,1,1]=4 602 B12R1.1 OCCSCc1ccc(cc1)Cl 62a_100000187161_100000211926 [1,0,0,0,0,0|1,0,1]=3 603 B12R1.1 OCCSCc1ccc(cc1)Cl 62a_100000211926_100000187161 [1,0,0,0,0,0|1,0,1]=3 604 B12R1.1 OCCSCc1ccc(cc1)F 62a_100000198546_100000211926 [1,0,0,0,0,0|1,1,1]=4 605 B12R1.1 OCCSCc1ccc(cc1)F 62a_100000211926_100000187164 [1,0,0,0,0,0|1,1,1]=4 606 B12R1.1 OCCSCc1ccc(cc1)I 62a_100000189116_100000211926 [1,0,0,0,0,0|1,1,1]=4 607 B12R1.1 OCCSCc1ccc(cc1)I 62a_100000211926_100000189116 [1,0,0,0,0,0|1,1,1]=4 608 B12R1.1 OCCSCc1ccc(cn1)Cl 62a_100000211926_100000697101 [1,0,0,0,0,0|2,0,1]=4 609 B12R1.1 OCCSCc1ccc(cn1)Cl 62a_100012066911_100000211926 [1,0,0,0,0,0|2,0,1]=4 610 B12R1.1 OCCSCc1ccc(nc1)Cl 62a_100000211926_100000735431 [1,0,0,0,0,0|2,0,1]=4 611 B12R1.1 OCCSCc1ccc(nc1)Cl 62a_100000735431_100000211926 [1,0,0,0,0,0|2,0,1]=4 612 B12R1.1 Oc1ccc(cc1)CNCCF 34a_100000185549_100011217306 [1,0,0,0,0,0|2,0,1]=4 613 B12R1.16 C#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000184674 [1,0,0,0,0,0|1,1,1]=4 614 B12R1.16 C#CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000184674 [1,0,0,0,0,0|2,0,1]=4 615 B12R1.16 C#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000184674 [1,0,0,0,0,0|1,0,1]=3 616 B12R1.16 C#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000184674 [1,0,0,0,0,0|1,1,1]=4 617 B12R1.16 C#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000184674 [1,0,0,0,0,0|1,1,1]=4 618 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [1,0,0,0,0,0|2,0,1]=4 619 B12R1.16 C=CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210623 [1,0,0,0,0,0|1,1,1]=4 620 B12R1.16 C=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210623 [1,0,0,0,0,0|2,0,1]=4 621 B12R1.16 C=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210623 [1,0,0,0,0,0|1,0,1]=3 622 B12R1.16 C=CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210623 [1,0,0,0,0,0|1,1,1]=4 623 B12R1.16 C=CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210623 [1,0,0,0,0,0|1,1,1]=4 624 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [1,0,0,0,0,0|2,0,1]=4 625 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [1,0,0,0,0,0|2,0,1]=4 626 B12R1.16 CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210303 [1,0,0,0,0,0|1,1,0]=3 627 B12R1.16 CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210303 [1,0,0,0,0,0|2,0,0]=3 628 B12R1.16 CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210303 [1,0,0,0,0,0|1,0,0]=2 629 B12R1.16 CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210303 [1,0,0,0,0,0|1,1,0]=3 630 B12R1.16 CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210303 [1,0,0,0,0,0|1,1,0]=3 631 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [1,0,0,0,0,0|2,0,0]=3 632 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [1,0,0,0,0,0|2,0,0]=3 633 B12R1.16 CCCC(=O)c1ccc(nc1)O 271570a_203496583355_200012185933 [1,0,0,0,0,0|3,0,0]=4 634 B12R1.16 CCCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210303 [1,0,0,0,0,0|3,0,0]=4 635 B12R1.16 CCCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000210303 [1,0,0,0,0,0|3,0,0]=4 636 B12R1.16 CCCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210303 [1,0,0,0,0,0|3,0,0]=4 637 B12R1.16 CCNC(=O)c1ccc(cc1)Br 11a_100015525214_100000185839 [1,0,0,0,0,0|0,1,0]=2 638 B12R1.16 CCNC(=O)c1ccc(cc1)Br 240690a_100015525214_100000185839 [1,0,0,0,0,0|0,1,0]=2 639 B12R1.16 CCNC(=O)c1ccc(cc1)Br 527a_100015525214_100000185839 [1,0,0,0,0,0|0,1,0]=2 640 B12R1.16 CCNC(=O)c1ccc(cc1)C 11a_100015525214_100000188618 [1,0,0,0,0,0|1,0,0]=2 641 B12R1.16 CCNC(=O)c1ccc(cc1)C 240690a_100015525214_100000188618 [1,0,0,0,0,0|1,0,0]=2 642 B12R1.16 CCNC(=O)c1ccc(cc1)C 527a_100015525214_100000188618 [1,0,0,0,0,0|1,0,0]=2 643 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 11a_100015525214_100000210187 [1,0,0,0,0,0|0,0,0]=1 644 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 240690a_100015525214_100000210187 [1,0,0,0,0,0|0,0,0]=1 645 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 527a_100015525214_100000210187 [1,0,0,0,0,0|0,0,0]=1 646 B12R1.16 CCNC(=O)c1ccc(cc1)F 11a_100015525214_100000187176 [1,0,0,0,0,0|0,1,0]=2 647 B12R1.16 CCNC(=O)c1ccc(cc1)F 240690a_100015525214_100000187176 [1,0,0,0,0,0|0,1,0]=2 648 B12R1.16 CCNC(=O)c1ccc(cc1)F 527a_100015525214_100000187176 [1,0,0,0,0,0|0,1,0]=2 649 B12R1.16 CCNC(=O)c1ccc(cc1)I 11a_100015525214_100000187904 [1,0,0,0,0,0|0,1,0]=2 650 B12R1.16 CCNC(=O)c1ccc(cc1)I 240690a_100015525214_100000187904 [1,0,0,0,0,0|0,1,0]=2 651 B12R1.16 CCNC(=O)c1ccc(cc1)I 527a_100015525214_100000187904 [1,0,0,0,0,0|0,1,0]=2 652 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [1,0,0,0,0,0|1,0,0]=2 653 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [1,0,0,0,0,0|1,0,0]=2 654 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [1,0,0,0,0,0|1,0,0]=2 655 B12R1.16 CCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781264 [1,0,0,0,0,0|2,0,0]=3 656 B12R1.16 CCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000160145 [1,0,0,0,0,0|2,0,0]=3 657 B12R1.16 CCNC(C)c1ccc(cc1)Br 2230a_100015525214_100000755118 [1,0,0,0,0,0|1,1,1]=4 658 B12R1.16 CCNC(C)c1ccc(cc1)Br 269862a_100015525214_100000185794 [1,0,0,0,0,0|1,1,1]=4 659 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [1,0,0,0,0,0|2,0,1]=4 660 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [1,0,0,0,0,0|2,0,1]=4 661 B12R1.16 CCNC(C)c1ccc(cc1)Cl 2230a_100015525214_100000684792 [1,0,0,0,0,0|1,0,1]=3 662 B12R1.16 CCNC(C)c1ccc(cc1)Cl 269862a_100015525214_100000185797 [1,0,0,0,0,0|1,0,1]=3 663 B12R1.16 CCNC(C)c1ccc(cc1)F 2230a_100015525214_100000743420 [1,0,0,0,0,0|1,1,1]=4 664 B12R1.16 CCNC(C)c1ccc(cc1)F 269862a_100015525214_100000185800 [1,0,0,0,0,0|1,1,1]=4 665 B12R1.16 CCNC(C)c1ccc(cc1)I 269862a_100015525214_100000185465 [1,0,0,0,0,0|1,1,1]=4 666 B12R1.16 CCNC(C)c1ccc(cn1)Cl 269862a_100015525214_100000692432 [1,0,0,0,0,0|2,0,1]=4 667 B12R1.16 CCNC(C)c1ccc(cn1)Cl 270004a_100015525214_100000692432 [1,0,0,0,0,0|2,0,1]=4 668 B12R1.16 CCNC(C)c1ccc(nc1)Cl 269862a_100015525214_100000690552 [1,0,0,0,0,0|2,0,1]=4 669 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210202 [1,0,0,0,0,0|1,1,1]=4 670 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210202 [1,0,0,0,0,0|1,1,1]=4 671 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210202 [1,0,0,0,0,0|1,1,1]=4 672 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [1,0,0,0,0,0|2,0,1]=4 673 B12R1.16 CCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210202 [1,0,0,0,0,0|1,1,1]=4 674 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [1,0,0,0,0,0|2,0,1]=4 675 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [1,0,0,0,0,0|2,0,1]=4 676 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210202 [1,0,0,0,0,0|1,0,1]=3 677 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210202 [1,0,0,0,0,0|1,0,1]=3 678 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [1,0,0,0,0,0|2,0,0]=3 679 B12R1.16 CCOC(=O)c1ccc(cn1)O 271570a_203496583355_100011781174 [1,0,0,0,0,0|3,0,0]=4 680 B12R1.16 CCOC(=O)c1ccc(nc1)O 271570a_203496583355_100000170224 [1,0,0,0,0,0|3,0,0]=4 681 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [1,0,0,0,0,0|2,0,1]=4 682 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [1,0,0,0,0,0|2,0,1]=4 683 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000210202_100000684792 [1,0,0,0,0,0|2,0,1]=4 684 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210202 [1,0,0,0,0,0|2,0,1]=4 685 B12R1.16 CN(CCF)c1ccc(cc1)Cl 2230a_100020629279_100011217306 [1,0,0,0,0,0|3,0,0]=4 686 B12R1.16 CN(CCF)c1ccc(cc1)Cl 269982a_100020629279_100011217306 [1,0,0,0,0,0|3,0,0]=4 687 B12R1.16 CN(CCF)c1ccc(cc1)Cl 34a_100020629279_100011217306 [1,0,0,0,0,0|3,0,0]=4 688 B12R1.16 CN(CCO)c1ccc(cc1)Br 2230a_100000219623_100000211926 [1,0,0,0,0,0|2,1,0]=4 689 B12R1.16 CN(CCO)c1ccc(cc1)Br 269982a_100000219623_100000211926 [1,0,0,0,0,0|2,1,0]=4 690 B12R1.16 CN(CCO)c1ccc(cc1)Br 34a_100000219623_100000211926 [1,0,0,0,0,0|2,1,0]=4 691 B12R1.16 CN(CCO)c1ccc(cc1)Cl 2230a_100020629279_100000211926 [1,0,0,0,0,0|2,0,0]=3 692 B12R1.16 CN(CCO)c1ccc(cc1)Cl 269982a_100020629279_100000211926 [1,0,0,0,0,0|2,0,0]=3 693 B12R1.16 CN(CCO)c1ccc(cc1)Cl 34a_100020629279_100000211926 [1,0,0,0,0,0|2,0,0]=3 694 B12R1.16 CN(CCO)c1ccc(cc1)F 2230a_100000219829_100000211926 [1,0,0,0,0,0|2,1,0]=4 695 B12R1.16 CN(CCO)c1ccc(cc1)F 269982a_100000219829_100000211926 [1,0,0,0,0,0|2,1,0]=4 696 B12R1.16 CN(CCO)c1ccc(cc1)F 34a_100000219829_100000211926 [1,0,0,0,0,0|2,1,0]=4 697 B12R1.16 CN(CCO)c1ccc(cc1)I 2230a_100000743151_100000211926 [1,0,0,0,0,0|2,1,0]=4 698 B12R1.16 CN(CCO)c1ccc(cc1)I 269982a_100000743151_100000211926 [1,0,0,0,0,0|2,1,0]=4 699 B12R1.16 CN(CCO)c1ccc(cc1)I 34a_100000743151_100000211926 [1,0,0,0,0,0|2,1,0]=4 700 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [1,0,0,0,0,0|3,0,0]=4 701 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [1,0,0,0,0,0|3,0,0]=4 702 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [1,0,0,0,0,0|2,1,0]=4 703 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [1,0,0,0,0,0|2,1,0]=4 704 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [1,0,0,0,0,0|3,0,0]=4 705 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [1,0,0,0,0,0|3,0,0]=4 706 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [1,0,0,0,0,0|3,0,0]=4 707 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [1,0,0,0,0,0|2,0,0]=3 708 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [1,0,0,0,0,0|2,1,0]=4 709 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [1,0,0,0,0,0|2,1,0]=4 710 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [1,0,0,0,0,0|2,1,0]=4 711 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [1,0,0,0,0,0|3,0,0]=4 712 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [1,0,0,0,0,0|3,0,0]=4 713 B12R1.16 CNCC(=O)c1ccc(cn1)Cl 7a_106832991635_100016989621 [1,0,0,0,0,0|3,0,0]=4 714 B12R1.16 CNNC(=O)c1ccc(cc1)Br 22a_100016993582_100000185839 [1,0,0,0,0,0|1,1,0]=3 715 B12R1.16 CNNC(=O)c1ccc(cc1)C 22a_100016993582_100000188618 [1,0,0,0,0,0|2,0,0]=3 716 B12R1.16 CNNC(=O)c1ccc(cc1)Cl 22a_100016993582_100000210187 [1,0,0,0,0,0|1,0,0]=2 717 B12R1.16 CNNC(=O)c1ccc(cc1)F 22a_100016993582_100000187176 [1,0,0,0,0,0|1,1,0]=3 718 B12R1.16 CNNC(=O)c1ccc(cc1)I 22a_100016993582_100000187904 [1,0,0,0,0,0|1,1,0]=3 719 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [1,0,0,0,0,0|2,0,0]=3 720 B12R1.16 COCC(=O)c1ccc(cc1)Br 34a_100138415774_100000188085 [1,0,0,0,0,0|2,1,0]=4 721 B12R1.16 COCC(=O)c1ccc(cc1)C 34a_100138415774_100000211441 [1,0,0,0,0,0|3,0,0]=4 722 B12R1.16 COCC(=O)c1ccc(cc1)F 34a_100000246311_200000210301 [1,0,0,0,0,0|2,1,0]=4 723 B12R1.16 COCC(=O)c1ccc(cc1)I 34a_100138415774_100011216261 [1,0,0,0,0,0|2,1,0]=4 724 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [1,0,0,0,0,0|3,0,0]=4 725 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [1,0,0,0,0,0|3,0,0]=4 726 B12R1.16 CSCC(=O)c1ccc(cc1)Br 62a_100000188085_200000210301 [1,0,0,0,0,0|2,1,0]=4 727 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_100000211441_200000210301 [1,0,0,0,0,0|3,0,0]=4 728 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_200000210301_100000211441 [1,0,0,0,0,0|3,0,0]=4 729 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200000210301 [1,0,0,0,0,0|2,0,0]=3 730 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_200000210301_100000211071 [1,0,0,0,0,0|2,0,0]=3 731 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_100000211279_200000210301 [1,0,0,0,0,0|2,1,0]=4 732 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_200000210301_100000211279 [1,0,0,0,0,0|2,1,0]=4 733 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_100011216261_200000210301 [1,0,0,0,0,0|2,1,0]=4 734 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_200000210301_100011216261 [1,0,0,0,0,0|2,1,0]=4 735 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [1,0,0,0,0,0|3,0,0]=4 736 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [1,0,0,0,0,0|3,0,0]=4 737 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_200000210301 [1,0,0,0,0,0|3,0,0]=4 738 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_200000210301_100016989621 [1,0,0,0,0,0|3,0,0]=4 739 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_200000210301 [1,0,0,0,0,0|3,0,0]=4 740 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_200000210301_100009864725 [1,0,0,0,0,0|3,0,0]=4 741 B12R1.16 C[C@@H](NCF)c1ccc(cc1)Cl 34a_100015205461_100015361967 [1,0,0,0,0,0|2,0,1]=4 742 B12R1.16 Cc1ccc(cc1)C(=O)CC#N 1458a_100000188618_100011214920 [1,0,0,0,0,0|2,0,1]=4 743 B12R1.16 Cc1ccc(cc1)C(=O)CCF 1458a_100000188618_100011217306 [1,0,0,0,0,0|2,0,0]=3 744 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [1,0,0,0,0,0|1,0,0]=2 745 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_100000211441_200025704644 [1,0,0,0,0,0|3,0,0]=4 746 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000211441 [1,0,0,0,0,0|3,0,0]=4 747 B12R1.16 Cc1ccc(cc1)N(C)CCO 2230a_100000219977_100000211926 [1,0,0,0,0,0|3,0,0]=4 748 B12R1.16 Cc1ccc(cc1)N(C)CCO 269982a_100000219977_100000211926 [1,0,0,0,0,0|3,0,0]=4 749 B12R1.16 Cc1ccc(cc1)N(C)CCO 34a_100000219977_100000211926 [1,0,0,0,0,0|3,0,0]=4 750 B12R1.16 N#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011214920 [1,0,0,0,0,0|1,1,1]=4 751 B12R1.16 N#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011214920 [1,0,0,0,0,0|1,0,1]=3 752 B12R1.16 N#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100011214920 [1,0,0,0,0,0|1,1,1]=4 753 B12R1.16 N#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100011214920 [1,0,0,0,0,0|1,1,1]=4 754 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [1,0,0,0,0,0|2,0,1]=4 755 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [1,0,0,0,0,0|2,0,1]=4 756 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [1,0,0,0,0,0|2,0,1]=4 757 B12R1.16 O=C(CCF)c1ccc(cc1)Br 1458a_100000185839_100011217306 [1,0,0,0,0,0|1,1,0]=3 758 B12R1.16 O=C(CCF)c1ccc(cc1)Cl 1458a_100000210187_100011217306 [1,0,0,0,0,0|1,0,0]=2 759 B12R1.16 O=C(CCF)c1ccc(cc1)F 1458a_100000187176_100011217306 [1,0,0,0,0,0|1,1,0]=3 760 B12R1.16 O=C(CCF)c1ccc(cc1)I 1458a_100000187904_100011217306 [1,0,0,0,0,0|1,1,0]=3 761 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [1,0,0,0,0,0|2,0,0]=3 762 B12R1.16 O=C(CCO)c1ccc(cc1)Br 1458a_100000185839_100000211926 [1,0,0,0,0,0|0,1,0]=2 763 B12R1.16 O=C(CCO)c1ccc(cc1)Cl 1458a_100000210187_100000211926 [1,0,0,0,0,0|0,0,0]=1 764 B12R1.16 O=C(CCO)c1ccc(cc1)F 1458a_100000187176_100000211926 [1,0,0,0,0,0|0,1,0]=2 765 B12R1.16 O=C(CCO)c1ccc(cc1)I 1458a_100000187904_100000211926 [1,0,0,0,0,0|0,1,0]=2 766 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [1,0,0,0,0,0|1,0,0]=2 767 B12R1.16 [13CH3]OCC(=O)c1ccc(cc1)F 34a_100000246311_200025704644 [1,0,0,0,0,0|2,1,0]=4 768 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Br 62a_100000188085_200025704644 [1,0,0,0,0,0|2,1,0]=4 769 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_100000211071_200025704644 [1,0,0,0,0,0|2,0,0]=3 770 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_200025704644_100000211071 [1,0,0,0,0,0|2,0,0]=3 771 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_100000211279_200025704644 [1,0,0,0,0,0|2,1,0]=4 772 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_200025704644_100000211279 [1,0,0,0,0,0|2,1,0]=4 773 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_100011216261_200025704644 [1,0,0,0,0,0|2,1,0]=4 774 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_200025704644_100011216261 [1,0,0,0,0,0|2,1,0]=4 775 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [1,0,0,0,0,0|3,0,0]=4 776 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [1,0,0,0,0,0|3,0,0]=4 777 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_100016989621_200025704644 [1,0,0,0,0,0|3,0,0]=4 778 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_200025704644_100016989621 [1,0,0,0,0,0|3,0,0]=4 779 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_100009864725_200025704644 [1,0,0,0,0,0|3,0,0]=4 780 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_200025704644_100009864725 [1,0,0,0,0,0|3,0,0]=4 781 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [1,0,0,0,0,0|2,0,1]=4 782 B12R1.30 C#CCNC(=O)c1ccccc1 11a_100000212058_100000185807 [1,0,0,0,0,0|1,0,1]=3 783 B12R1.30 C#CCNC(=O)c1ccccc1 1626a_100000212058_100000185807 [1,0,0,0,0,0|1,0,1]=3 784 B12R1.30 C#CCNC(=O)c1ccccc1 240690a_100000212058_100000185807 [1,0,0,0,0,0|1,0,1]=3 785 B12R1.30 C#CCNC(=O)c1ccccc1 527a_100000212058_100000185807 [1,0,0,0,0,0|1,0,1]=3 786 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [1,0,0,0,0,0|2,0,1]=4 787 B12R1.30 C=CCNC(=O)c1ccccc1 1626a_100020586998_100000185807 [1,0,0,0,0,0|1,0,1]=3 788 B12R1.30 C=CCNC(=O)c1ccccc1 240690a_100020586998_100000185807 [1,0,0,0,0,0|1,0,1]=3 789 B12R1.30 C=CCNC(=O)c1ccccc1 527a_100020586998_100000185807 [1,0,0,0,0,0|1,0,1]=3 790 B12R1.30 CC(NCCF)c1ccccc1 269862a_100000724931_100000185851 [1,0,0,0,0,0|2,0,1]=4 791 B12R1.30 CC(NCCF)c1ccccc1 34a_100000724931_100000211855 [1,0,0,0,0,0|2,0,1]=4 792 B12R1.30 CC(NCCO)c1ccccc1 2230a_100016997473_100000230085 [1,0,0,0,0,0|1,0,1]=3 793 B12R1.30 CC(NCCO)c1ccccc1 269862a_100000210304_100000185851 [1,0,0,0,0,0|1,0,1]=3 794 B12R1.30 CC(NCCO)c1ccccc1 34a_100016990907_100000211855 [1,0,0,0,0,0|1,0,1]=3 795 B12R1.30 CC(NCCO)c1ccccn1 2230a_100000181244_100000211926 [1,0,0,0,0,0|2,0,1]=4 796 B12R1.30 CC(NCCO)c1ccccn1 269862a_100000210304_100000210467 [1,0,0,0,0,0|2,0,1]=4 797 B12R1.30 CC(NCCO)c1cccnc1 2230a_100000195435_100000211926 [1,0,0,0,0,0|2,0,1]=4 798 B12R1.30 CC(NCCO)c1cccnc1 269862a_100000210304_100000210468 [1,0,0,0,0,0|2,0,1]=4 799 B12R1.30 CC(NCCO)c1ccncc1 2230a_100000181269_100000211926 [1,0,0,0,0,0|2,0,1]=4 800 B12R1.30 CC(NCCO)c1ccncc1 269862a_100000210304_100000185792 [1,0,0,0,0,0|2,0,1]=4 801 B12R1.30 CC(SCCO)c1ccccc1 62a_100000211926_100000230085 [1,0,0,0,0,0|2,0,1]=4 802 B12R1.30 CC(SCCO)c1ccccc1 62a_100000230085_100000211926 [1,0,0,0,0,0|2,0,1]=4 803 B12R1.30 CC=NNC(=O)c1ccccc1 4a_100000184135_200000210099 [1,0,0,0,0,0|2,0,1]=4 804 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [1,0,0,0,0,0|2,0,0]=3 805 B12R1.30 CCCNC(=O)c1ccccc1 11a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 806 B12R1.30 CCCNC(=O)c1ccccc1 1626a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 807 B12R1.30 CCCNC(=O)c1ccccc1 240690a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 808 B12R1.30 CCCNC(=O)c1ccccc1 527a_100020643023_100000185807 [1,0,0,0,0,0|1,0,0]=2 809 B12R1.30 CCCNC(C)c1ccccc1 269862a_100020643023_100000185851 [1,0,0,0,0,0|2,0,1]=4 810 B12R1.30 CCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210303 [1,0,0,0,0,0|2,0,1]=4 811 B12R1.30 CCNNC(=O)c1ccccc1 22a_100000756455_100000185807 [1,0,0,0,0,0|2,0,0]=3 812 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000210202_100000211460 [1,0,0,0,0,0|3,0,0]=4 813 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000211460_100000210202 [1,0,0,0,0,0|3,0,0]=4 814 B12R1.30 CN(CCCO)c1ccccc1 2230a_100000210012_100000230001 [1,0,0,0,0,0|3,0,0]=4 815 B12R1.30 CN(CCCO)c1ccccc1 2230a_100000212590_200000210301 [1,0,0,0,0,0|3,0,0]=4 816 B12R1.30 CN(CCCO)c1ccccc1 269982a_100000210012_100011215043 [1,0,0,0,0,0|3,0,0]=4 817 B12R1.30 CN(CCCO)c1ccccc1 269982a_100000212590_200000210301 [1,0,0,0,0,0|3,0,0]=4 818 B12R1.30 CN(CCCO)c1ccccc1 34a_100000210012_100000230001 [1,0,0,0,0,0|3,0,0]=4 819 B12R1.30 CN(CCCO)c1ccccc1 34a_100000212590_200000210301 [1,0,0,0,0,0|3,0,0]=4 820 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [1,0,0,0,0,0|3,0,0]=4 821 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [1,0,0,0,0,0|3,0,0]=4 822 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [1,0,0,0,0,0|3,0,0]=4 823 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [1,0,0,0,0,0|3,0,0]=4 824 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [1,0,0,0,0,0|3,0,0]=4 825 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [1,0,0,0,0,0|3,0,0]=4 826 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [1,0,0,0,0,0|3,0,0]=4 827 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [1,0,0,0,0,0|3,0,0]=4 828 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [1,0,0,0,0,0|3,0,0]=4 829 B12R1.30 C[C@@H](NCCF)c1ccccc1 2230a_100000751104_100011217306 [1,0,0,0,0,0|2,0,1]=4 830 B12R1.30 C[C@@H](NCCO)c1ccccc1 2230a_100000751104_100000211926 [1,0,0,0,0,0|1,0,1]=3 831 B12R1.30 C[C@@H](OCCO)c1ccccc1 34a_100000761318_100000211926 [1,0,0,0,0,0|2,0,1]=4 832 B12R1.30 C[C@@H](OCCO)c1ccccc1 7a_100000761318_100000211926 [1,0,0,0,0,0|2,0,1]=4 833 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [1,0,0,0,0,0|2,0,1]=4 834 B12R1.30 N#CCNC(=O)c1ccccc1 1626a_100000734998_100000185807 [1,0,0,0,0,0|1,0,1]=3 835 B12R1.30 N#CCNC(=O)c1ccccc1 527a_100000734998_100000185807 [1,0,0,0,0,0|1,0,1]=3 836 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [1,0,0,0,0,0|2,0,0]=3 837 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [1,0,0,0,0,0|1,0,0]=2 838 B12R1.30 O=C(CSCF)c1ccccc1 62a_100000211460_100015361967 [1,0,0,0,0,0|3,0,0]=4 839 B12R1.30 O=C(CSCF)c1ccccc1 62a_100015361967_100000211460 [1,0,0,0,0,0|3,0,0]=4 840 B12R1.30 O=C(NCCF)c1ccccc1 11a_100000724931_100000185807 [1,0,0,0,0,0|1,0,0]=2 841 B12R1.30 O=C(NCCF)c1ccccc1 1626a_100000724931_100000185807 [1,0,0,0,0,0|1,0,0]=2 842 B12R1.30 O=C(NCCF)c1ccccc1 240690a_100000724931_100000185807 [1,0,0,0,0,0|1,0,0]=2 843 B12R1.30 O=C(NCCF)c1ccccc1 527a_100000724931_100000185807 [1,0,0,0,0,0|1,0,0]=2 844 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [1,0,0,0,0,0|0,0,0]=1 845 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [1,0,0,0,0,0|0,0,0]=1 846 B12R1.30 [13CH3]N(CCCO)c1ccccc1 2230a_100000212590_200025704644 [1,0,0,0,0,0|3,0,0]=4 847 B12R1.30 [13CH3]N(CCCO)c1ccccc1 269982a_100000212590_200025704644 [1,0,0,0,0,0|3,0,0]=4 848 B12R1.30 [13CH3]N(CCCO)c1ccccc1 34a_100000212590_200025704644 [1,0,0,0,0,0|3,0,0]=4 849 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [1,0,0,0,0,0|3,0,0]=4 850 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [1,0,0,0,0,0|3,0,0]=4 851 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [1,0,0,0,0,0|3,0,0]=4 852 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [1,0,0,0,0,0|3,0,0]=4 853 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Br 11a_100000707721_100000185839 [0,1,0,0,0,0|1,1,1]=4 854 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Br 1626a_100000707721_100000185839 [0,1,0,0,0,0|1,1,1]=4 855 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Br 240690a_100000707721_100000185839 [0,1,0,0,0,0|1,1,1]=4 856 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Br 527a_100000707721_100000185839 [0,1,0,0,0,0|1,1,1]=4 857 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)C 11a_100000707721_100000188618 [0,1,0,0,0,0|2,0,1]=4 858 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)C 1626a_100000707721_100000188618 [0,1,0,0,0,0|2,0,1]=4 859 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)C 240690a_100000707721_100000188618 [0,1,0,0,0,0|2,0,1]=4 860 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)C 527a_100000707721_100000188618 [0,1,0,0,0,0|2,0,1]=4 861 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Cl 11a_100000707721_100000210187 [0,1,0,0,0,0|1,0,1]=3 862 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Cl 1626a_100000707721_100000210187 [0,1,0,0,0,0|1,0,1]=3 863 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Cl 240690a_100000707721_100000210187 [0,1,0,0,0,0|1,0,1]=3 864 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)Cl 527a_100000707721_100000210187 [0,1,0,0,0,0|1,0,1]=3 865 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)F 11a_100000707721_100000187176 [0,1,0,0,0,0|1,1,1]=4 866 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)F 1626a_100000707721_100000187176 [0,1,0,0,0,0|1,1,1]=4 867 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)F 240690a_100000707721_100000187176 [0,1,0,0,0,0|1,1,1]=4 868 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)F 527a_100000707721_100000187176 [0,1,0,0,0,0|1,1,1]=4 869 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)I 11a_100000707721_100000187904 [0,1,0,0,0,0|1,1,1]=4 870 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)I 1626a_100000707721_100000187904 [0,1,0,0,0,0|1,1,1]=4 871 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)I 240690a_100000707721_100000187904 [0,1,0,0,0,0|1,1,1]=4 872 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)I 527a_100000707721_100000187904 [0,1,0,0,0,0|1,1,1]=4 873 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)O 240690a_100000707721_100000212099 [0,1,0,0,0,0|2,0,1]=4 874 B14R1.10 C#CC(C)NC(=O)c1ccc(cc1)O 527a_100000707721_100000212099 [0,1,0,0,0,0|2,0,1]=4 875 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)Br 11a_100000737613_100000185839 [0,1,0,0,0,0|1,1,1]=4 876 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)Br 1626a_100000737613_100000185839 [0,1,0,0,0,0|1,1,1]=4 877 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)Br 527a_100000737613_100000185839 [0,1,0,0,0,0|1,1,1]=4 878 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)Cl 11a_100000737613_100000210187 [0,1,0,0,0,0|1,0,1]=3 879 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)Cl 1626a_100000737613_100000210187 [0,1,0,0,0,0|1,0,1]=3 880 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)Cl 527a_100000737613_100000210187 [0,1,0,0,0,0|1,0,1]=3 881 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)F 11a_100000737613_100000187176 [0,1,0,0,0,0|1,1,1]=4 882 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)F 1626a_100000737613_100000187176 [0,1,0,0,0,0|1,1,1]=4 883 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)F 527a_100000737613_100000187176 [0,1,0,0,0,0|1,1,1]=4 884 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)I 11a_100000737613_100000187904 [0,1,0,0,0,0|1,1,1]=4 885 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)I 1626a_100000737613_100000187904 [0,1,0,0,0,0|1,1,1]=4 886 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)I 527a_100000737613_100000187904 [0,1,0,0,0,0|1,1,1]=4 887 B14R1.10 CC(C#N)NC(=O)c1ccc(cc1)O 527a_100000737613_100000212099 [0,1,0,0,0,0|2,0,1]=4 888 B14R1.10 CC(CO)N[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100012180447 [0,1,0,0,0,0|1,1,1]=4 889 B14R1.10 CC(CO)N[C@@H](C)c1ccc(cc1)F 34a_100025705893_100012180447 [0,1,0,0,0,0|1,1,1]=4 890 B14R1.10 CC(CO)N[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100012180447 [0,1,0,0,0,0|1,1,1]=4 891 B14R1.10 CC(CO)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100012180447 [0,1,0,0,0,0|2,0,1]=4 892 B14R1.10 CC(CO)N[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100012180447 [0,1,0,0,0,0|1,1,1]=4 893 B14R1.10 CC(CO)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100012180447 [0,1,0,0,0,0|1,0,1]=3 894 B14R1.10 CC(CO)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100012180447 [0,1,0,0,0,0|1,0,1]=3 895 B14R1.10 CC(CO)O[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100012180447 [0,1,0,0,0,0|2,0,1]=4 896 B14R1.10 CC(CO)O[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100012180447 [0,1,0,0,0,0|2,0,1]=4 897 B14R1.10 CC(CO)SC(C)c1ccc(cc1)Cl 62a_100012180447_100000684792 [0,1,0,0,0,0|2,0,1]=4 898 B14R1.10 CC(N[C@H](C)CF)c1ccc(cc1)Cl 269862a_100102880703_100000185797 [0,1,0,0,0,0|2,0,1]=4 899 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)Br 2230a_100000737577_100000755118 [0,1,0,0,0,0|1,1,1]=4 900 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)Br 269862a_100000737577_100000185794 [0,1,0,0,0,0|1,1,1]=4 901 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)Cl 2230a_100000737577_100000684792 [0,1,0,0,0,0|1,0,1]=3 902 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)Cl 269862a_100000737577_100000185797 [0,1,0,0,0,0|1,0,1]=3 903 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)F 2230a_100000737577_100000743420 [0,1,0,0,0,0|1,1,1]=4 904 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)F 269862a_100000737577_100000185800 [0,1,0,0,0,0|1,1,1]=4 905 B14R1.10 CC(N[C@H](C)CO)c1ccc(cc1)I 269862a_100000737577_100000185465 [0,1,0,0,0,0|1,1,1]=4 906 B14R1.10 CC(N[C@H](C)CO)c1ccc(cn1)Cl 269862a_100000737577_100000692432 [0,1,0,0,0,0|2,0,1]=4 907 B14R1.10 CC(N[C@H](C)CO)c1ccc(cn1)Cl 270004a_100000737577_100000692432 [0,1,0,0,0,0|2,0,1]=4 908 B14R1.10 CC(N[C@H](C)CO)c1ccc(nc1)Cl 269862a_100000737577_100000690552 [0,1,0,0,0,0|2,0,1]=4 909 B14R1.10 CC(S[C@H](C)CO)c1ccc(cc1)Cl 62a_100000684792_100016084084 [0,1,0,0,0,0|2,0,1]=4 910 B14R1.10 CC(S[C@H](C)CO)c1ccc(cc1)Cl 62a_100016084084_100000684792 [0,1,0,0,0,0|2,0,1]=4 911 B14R1.10 CCC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000747405 [0,1,0,0,0,0|2,0,1]=4 912 B14R1.10 CCC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210414_100000211071 [0,1,0,0,0,0|2,0,1]=4 913 B14R1.10 CCC(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000748023 [0,1,0,0,0,0|2,1,0]=4 914 B14R1.10 CCC(C)CC(=O)c1ccc(cc1)C 1458a_100000188618_100000748023 [0,1,0,0,0,0|3,0,0]=4 915 B14R1.10 CCC(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748023 [0,1,0,0,0,0|2,0,0]=3 916 B14R1.10 CCC(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000748023 [0,1,0,0,0,0|2,1,0]=4 917 B14R1.10 CCC(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000748023 [0,1,0,0,0,0|2,1,0]=4 918 B14R1.10 CCC(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000748023 [0,1,0,0,0,0|3,0,0]=4 919 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Br 11a_100000209981_100000185839 [0,1,0,0,0,0|1,1,0]=3 920 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Br 1626a_100000209981_100000185839 [0,1,0,0,0,0|1,1,0]=3 921 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Br 240690a_100000209981_100000185839 [0,1,0,0,0,0|1,1,0]=3 922 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Br 527a_100000209981_100000185839 [0,1,0,0,0,0|1,1,0]=3 923 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)C 11a_100000209981_100000188618 [0,1,0,0,0,0|2,0,0]=3 924 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)C 1626a_100000209981_100000188618 [0,1,0,0,0,0|2,0,0]=3 925 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)C 240690a_100000209981_100000188618 [0,1,0,0,0,0|2,0,0]=3 926 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)C 527a_100000209981_100000188618 [0,1,0,0,0,0|2,0,0]=3 927 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Cl 11a_100000209981_100000210187 [0,1,0,0,0,0|1,0,0]=2 928 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Cl 1626a_100000209981_100000210187 [0,1,0,0,0,0|1,0,0]=2 929 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Cl 240690a_100000209981_100000210187 [0,1,0,0,0,0|1,0,0]=2 930 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)Cl 527a_100000209981_100000210187 [0,1,0,0,0,0|1,0,0]=2 931 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)F 11a_100000209981_100000187176 [0,1,0,0,0,0|1,1,0]=3 932 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)F 1626a_100000209981_100000187176 [0,1,0,0,0,0|1,1,0]=3 933 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)F 240690a_100000209981_100000187176 [0,1,0,0,0,0|1,1,0]=3 934 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)F 527a_100000209981_100000187176 [0,1,0,0,0,0|1,1,0]=3 935 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)I 11a_100000209981_100000187904 [0,1,0,0,0,0|1,1,0]=3 936 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)I 1626a_100000209981_100000187904 [0,1,0,0,0,0|1,1,0]=3 937 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)I 240690a_100000209981_100000187904 [0,1,0,0,0,0|1,1,0]=3 938 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)I 527a_100000209981_100000187904 [0,1,0,0,0,0|1,1,0]=3 939 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)O 240690a_100000209981_100000212099 [0,1,0,0,0,0|2,0,0]=3 940 B14R1.10 CCC(C)NC(=O)c1ccc(cc1)O 527a_100000209981_100000212099 [0,1,0,0,0,0|2,0,0]=3 941 B14R1.10 CCC(C)NC(C)c1ccc(cc1)Cl 2230a_100000209981_100000684792 [0,1,0,0,0,0|2,0,1]=4 942 B14R1.10 CCC(C)NC(C)c1ccc(cc1)Cl 269862a_100000209981_100000185797 [0,1,0,0,0,0|2,0,1]=4 943 B14R1.10 CCC(C)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000758301 [0,1,0,0,0,0|2,0,1]=4 944 B14R1.10 CCC(C)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100011215416 [0,1,0,0,0,0|2,0,1]=4 945 B14R1.10 CCC(O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100011218378 [0,1,0,0,0,0|2,1,0]=4 946 B14R1.10 CCC(O)CC(=O)c1ccc(cc1)C 1458a_100000188618_100011218378 [0,1,0,0,0,0|3,0,0]=4 947 B14R1.10 CCC(O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011218378 [0,1,0,0,0,0|2,0,0]=3 948 B14R1.10 CCC(O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100011218378 [0,1,0,0,0,0|2,1,0]=4 949 B14R1.10 CCC(O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100011218378 [0,1,0,0,0,0|2,1,0]=4 950 B14R1.10 CCC(O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011218378 [0,1,0,0,0,0|3,0,0]=4 951 B14R1.10 CCN(C)CC(=O)c1ccc(cc1)Cl 269982a_100000225621_100000211071 [0,1,0,0,0,0|3,0,0]=4 952 B14R1.10 CC[C@H](C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100009816398 [0,1,0,0,0,0|2,1,0]=4 953 B14R1.10 CC[C@H](C)CC(=O)c1ccc(cc1)C 1458a_100000188618_100009816398 [0,1,0,0,0,0|3,0,0]=4 954 B14R1.10 CC[C@H](C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100009816398 [0,1,0,0,0,0|2,0,0]=3 955 B14R1.10 CC[C@H](C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100009816398 [0,1,0,0,0,0|2,1,0]=4 956 B14R1.10 CC[C@H](C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100009816398 [0,1,0,0,0,0|2,1,0]=4 957 B14R1.10 CC[C@H](C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100009816398 [0,1,0,0,0,0|3,0,0]=4 958 B14R1.10 CN(CC(O)CO)c1ccc(cc1)Cl 2230a_100020629279_100011219619 [0,1,0,0,0,0|3,0,0]=4 959 B14R1.10 CN(CC(O)CO)c1ccc(cc1)Cl 34a_100020629279_100011219619 [0,1,0,0,0,0|3,0,0]=4 960 B14R1.10 CN(C[C@@H](O)CO)c1ccc(cc1)Cl 2230a_100020629279_100009815848 [0,1,0,0,0,0|3,0,0]=4 961 B14R1.10 CN(C[C@@H](O)CO)c1ccc(cc1)Cl 34a_100020629279_100009815848 [0,1,0,0,0,0|3,0,0]=4 962 B14R1.10 C[C@@H](CO)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000059175 [0,1,0,0,0,0|1,1,0]=3 963 B14R1.10 C[C@@H](CO)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000059175 [0,1,0,0,0,0|1,0,0]=2 964 B14R1.10 C[C@@H](CO)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000059175 [0,1,0,0,0,0|1,1,0]=3 965 B14R1.10 C[C@@H](CO)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000059175 [0,1,0,0,0,0|1,1,0]=3 966 B14R1.10 C[C@@H](CO)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000059175 [0,1,0,0,0,0|2,0,0]=3 967 B14R1.10 C[C@@H](CO)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100000059175 [0,1,0,0,0,0|3,0,0]=4 968 B14R1.10 C[C@@H](CO)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100000059175 [0,1,0,0,0,0|3,0,0]=4 969 B14R1.10 C[C@@H](CO)CN(C)c1ccc(cc1)Cl 34a_100020629279_100000059175 [0,1,0,0,0,0|3,0,0]=4 970 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)Cl 240690a_100015205461_100000210174 [0,1,0,0,0,0|1,0,2]=4 971 B14R1.10 C[C@@H](NC(=O)CO)c1ccc(cc1)Cl 527a_100015205461_100000210174 [0,1,0,0,0,0|1,0,2]=4 972 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Br 11a_100102880703_100000185839 [0,1,0,0,0,0|1,1,0]=3 973 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Br 1626a_100102880703_100000185839 [0,1,0,0,0,0|1,1,0]=3 974 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Br 240690a_100102880703_100000185839 [0,1,0,0,0,0|1,1,0]=3 975 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Br 527a_100102880703_100000185839 [0,1,0,0,0,0|1,1,0]=3 976 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Cl 11a_100102880703_100000210187 [0,1,0,0,0,0|1,0,0]=2 977 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Cl 1626a_100102880703_100000210187 [0,1,0,0,0,0|1,0,0]=2 978 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Cl 240690a_100102880703_100000210187 [0,1,0,0,0,0|1,0,0]=2 979 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)Cl 527a_100102880703_100000210187 [0,1,0,0,0,0|1,0,0]=2 980 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)F 11a_100102880703_100000187176 [0,1,0,0,0,0|1,1,0]=3 981 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)F 1626a_100102880703_100000187176 [0,1,0,0,0,0|1,1,0]=3 982 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)F 240690a_100102880703_100000187176 [0,1,0,0,0,0|1,1,0]=3 983 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)F 527a_100102880703_100000187176 [0,1,0,0,0,0|1,1,0]=3 984 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)I 11a_100102880703_100000187904 [0,1,0,0,0,0|1,1,0]=3 985 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)I 1626a_100102880703_100000187904 [0,1,0,0,0,0|1,1,0]=3 986 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)I 240690a_100102880703_100000187904 [0,1,0,0,0,0|1,1,0]=3 987 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)I 527a_100102880703_100000187904 [0,1,0,0,0,0|1,1,0]=3 988 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)O 240690a_100102880703_100000212099 [0,1,0,0,0,0|2,0,0]=3 989 B14R1.10 C[C@H](CF)NC(=O)c1ccc(cc1)O 527a_100102880703_100000212099 [0,1,0,0,0,0|2,0,0]=3 990 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)Br 240690a_100000737577_100000185839 [0,1,0,0,0,0|0,1,0]=2 991 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)Br 527a_100000737577_100000185839 [0,1,0,0,0,0|0,1,0]=2 992 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)Cl 240690a_100000737577_100000210187 [0,1,0,0,0,0|0,0,0]=1 993 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)Cl 527a_100000737577_100000210187 [0,1,0,0,0,0|0,0,0]=1 994 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)F 240690a_100000737577_100000187176 [0,1,0,0,0,0|0,1,0]=2 995 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)F 527a_100000737577_100000187176 [0,1,0,0,0,0|0,1,0]=2 996 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)I 240690a_100000737577_100000187904 [0,1,0,0,0,0|0,1,0]=2 997 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)I 527a_100000737577_100000187904 [0,1,0,0,0,0|0,1,0]=2 998 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)O 240690a_100000737577_100000212099 [0,1,0,0,0,0|1,0,0]=2 999 B14R1.10 C[C@H](CO)NC(=O)c1ccc(cc1)O 527a_100000737577_100000212099 [0,1,0,0,0,0|1,0,0]=2 1000 B14R1.10 Cc1ccc(cc1)C(=O)CC(=O)CO 1458a_100000210174_100000211441 [0,1,0,0,0,0|2,0,1]=4 1001 B14R1.10 Cc1ccc(cc1)C(=O)C[C@@H](C)CO 1458a_100000188618_100000059175 [0,1,0,0,0,0|2,0,0]=3 1002 B14R1.10 Cc1ccc(cc1)C(=O)NC(C)C#N 11a_100000737613_100000188618 [0,1,0,0,0,0|2,0,1]=4 1003 B14R1.10 Cc1ccc(cc1)C(=O)NC(C)C#N 1626a_100000737613_100000188618 [0,1,0,0,0,0|2,0,1]=4 1004 B14R1.10 Cc1ccc(cc1)C(=O)NC(C)C#N 527a_100000737613_100000188618 [0,1,0,0,0,0|2,0,1]=4 1005 B14R1.10 Cc1ccc(cc1)C(=O)N[C@H](C)CF 11a_100102880703_100000188618 [0,1,0,0,0,0|2,0,0]=3 1006 B14R1.10 Cc1ccc(cc1)C(=O)N[C@H](C)CF 1626a_100102880703_100000188618 [0,1,0,0,0,0|2,0,0]=3 1007 B14R1.10 Cc1ccc(cc1)C(=O)N[C@H](C)CF 240690a_100102880703_100000188618 [0,1,0,0,0,0|2,0,0]=3 1008 B14R1.10 Cc1ccc(cc1)C(=O)N[C@H](C)CF 527a_100102880703_100000188618 [0,1,0,0,0,0|2,0,0]=3 1009 B14R1.10 Cc1ccc(cc1)C(=O)N[C@H](C)CO 240690a_100000737577_100000188618 [0,1,0,0,0,0|1,0,0]=2 1010 B14R1.10 Cc1ccc(cc1)C(=O)N[C@H](C)CO 527a_100000737577_100000188618 [0,1,0,0,0,0|1,0,0]=2 1011 B14R1.10 Cc1ccc(cc1)C(C)N[C@H](C)CO 2230a_100000737577_100011261388 [0,1,0,0,0,0|2,0,1]=4 1012 B14R1.10 Cc1ccc(cc1)C(C)N[C@H](C)CO 269862a_100000737577_100000185793 [0,1,0,0,0,0|2,0,1]=4 1013 B14R1.10 Cc1ccc(cc1)[C@@H](C)NC(C)CO 2230a_100016988085_100012180447 [0,1,0,0,0,0|2,0,1]=4 1014 B14R1.10 Cc1ccc(cc1)[C@@H](C)NC(C)CO 34a_100016988085_100012180447 [0,1,0,0,0,0|2,0,1]=4 1015 B14R1.10 O=C(CO)CC(=O)c1ccc(cc1)Br 1458a_100000210174_100000188085 [0,1,0,0,0,0|1,1,1]=4 1016 B14R1.10 O=C(CO)CC(=O)c1ccc(cc1)Cl 1458a_100000210174_100000211071 [0,1,0,0,0,0|1,0,1]=3 1017 B14R1.10 O=C(CO)CC(=O)c1ccc(cc1)F 1458a_100000210174_100000211279 [0,1,0,0,0,0|1,1,1]=4 1018 B14R1.10 O=C(CO)CC(=O)c1ccc(cc1)I 1458a_100000210174_100011216261 [0,1,0,0,0,0|1,1,1]=4 1019 B14R1.10 O=C(CO)CC(=O)c1ccc(cc1)O 1458a_100000210174_100009814261 [0,1,0,0,0,0|2,0,1]=4 1020 B14R1.10 O=C(CO)CC(=O)c1ccc(cn1)Cl 1458a_100000210174_100016989621 [0,1,0,0,0,0|2,0,1]=4 1021 B14R1.10 O=C(CO)CC(=O)c1ccc(nc1)Cl 1458a_100000210174_100009864725 [0,1,0,0,0,0|2,0,1]=4 1022 B14R1.19 C#CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000731252 [0,1,0,0,0,0|2,1,0]=4 1023 B14R1.19 C#CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000731252 [0,1,0,0,0,0|3,0,0]=4 1024 B14R1.19 C#CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000731252 [0,1,0,0,0,0|2,0,0]=3 1025 B14R1.19 C#CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000731252 [0,1,0,0,0,0|2,1,0]=4 1026 B14R1.19 C#CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000731252 [0,1,0,0,0,0|2,1,0]=4 1027 B14R1.19 C#CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000731252 [0,1,0,0,0,0|3,0,0]=4 1028 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Br 11a_100000755551_100000185839 [0,1,0,0,0,0|1,1,0]=3 1029 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Br 1626a_100000755551_100000185839 [0,1,0,0,0,0|1,1,0]=3 1030 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Br 240690a_100000755551_100000185839 [0,1,0,0,0,0|1,1,0]=3 1031 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Br 527a_100000755551_100000185839 [0,1,0,0,0,0|1,1,0]=3 1032 B14R1.19 C#CCCNC(=O)c1ccc(cc1)C 11a_100000755551_100000188618 [0,1,0,0,0,0|2,0,0]=3 1033 B14R1.19 C#CCCNC(=O)c1ccc(cc1)C 1626a_100000755551_100000188618 [0,1,0,0,0,0|2,0,0]=3 1034 B14R1.19 C#CCCNC(=O)c1ccc(cc1)C 240690a_100000755551_100000188618 [0,1,0,0,0,0|2,0,0]=3 1035 B14R1.19 C#CCCNC(=O)c1ccc(cc1)C 527a_100000755551_100000188618 [0,1,0,0,0,0|2,0,0]=3 1036 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Cl 11a_100000755551_100000210187 [0,1,0,0,0,0|1,0,0]=2 1037 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Cl 1626a_100000755551_100000210187 [0,1,0,0,0,0|1,0,0]=2 1038 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Cl 240690a_100000755551_100000210187 [0,1,0,0,0,0|1,0,0]=2 1039 B14R1.19 C#CCCNC(=O)c1ccc(cc1)Cl 527a_100000755551_100000210187 [0,1,0,0,0,0|1,0,0]=2 1040 B14R1.19 C#CCCNC(=O)c1ccc(cc1)F 11a_100000755551_100000187176 [0,1,0,0,0,0|1,1,0]=3 1041 B14R1.19 C#CCCNC(=O)c1ccc(cc1)F 1626a_100000755551_100000187176 [0,1,0,0,0,0|1,1,0]=3 1042 B14R1.19 C#CCCNC(=O)c1ccc(cc1)F 240690a_100000755551_100000187176 [0,1,0,0,0,0|1,1,0]=3 1043 B14R1.19 C#CCCNC(=O)c1ccc(cc1)F 527a_100000755551_100000187176 [0,1,0,0,0,0|1,1,0]=3 1044 B14R1.19 C#CCCNC(=O)c1ccc(cc1)I 11a_100000755551_100000187904 [0,1,0,0,0,0|1,1,0]=3 1045 B14R1.19 C#CCCNC(=O)c1ccc(cc1)I 1626a_100000755551_100000187904 [0,1,0,0,0,0|1,1,0]=3 1046 B14R1.19 C#CCCNC(=O)c1ccc(cc1)I 240690a_100000755551_100000187904 [0,1,0,0,0,0|1,1,0]=3 1047 B14R1.19 C#CCCNC(=O)c1ccc(cc1)I 527a_100000755551_100000187904 [0,1,0,0,0,0|1,1,0]=3 1048 B14R1.19 C#CCCNC(=O)c1ccc(cc1)O 240690a_100000755551_100000212099 [0,1,0,0,0,0|2,0,0]=3 1049 B14R1.19 C#CCCNC(=O)c1ccc(cc1)O 527a_100000755551_100000212099 [0,1,0,0,0,0|2,0,0]=3 1050 B14R1.19 C#CCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000688953 [0,1,0,0,0,0|2,0,1]=4 1051 B14R1.19 C#CCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000688953 [0,1,0,0,0,0|2,0,1]=4 1052 B14R1.19 C#CCNCC(=O)c1ccc(cc1)Br 34a_100000212058_100000188085 [0,1,0,0,0,0|1,1,1]=4 1053 B14R1.19 C#CCNCC(=O)c1ccc(cc1)C 34a_100000212058_100000211441 [0,1,0,0,0,0|2,0,1]=4 1054 B14R1.19 C#CCNCC(=O)c1ccc(cc1)I 34a_100000212058_100011216261 [0,1,0,0,0,0|1,1,1]=4 1055 B14R1.19 C#CCNCC(=O)c1ccc(cc1)O 34a_100000212058_100009814261 [0,1,0,0,0,0|2,0,1]=4 1056 B14R1.19 C#CCSCC(=O)c1ccc(cc1)Cl 62a_100000038162_100000211071 [0,1,0,0,0,0|2,0,1]=4 1057 B14R1.19 C=CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000757094 [0,1,0,0,0,0|2,1,0]=4 1058 B14R1.19 C=CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000757094 [0,1,0,0,0,0|3,0,0]=4 1059 B14R1.19 C=CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000757094 [0,1,0,0,0,0|2,0,0]=3 1060 B14R1.19 C=CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000757094 [0,1,0,0,0,0|2,1,0]=4 1061 B14R1.19 C=CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000757094 [0,1,0,0,0,0|2,1,0]=4 1062 B14R1.19 C=CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000757094 [0,1,0,0,0,0|3,0,0]=4 1063 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Br 11a_100015191253_100000185839 [0,1,0,0,0,0|1,1,0]=3 1064 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Br 1626a_100015191253_100000185839 [0,1,0,0,0,0|1,1,0]=3 1065 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Br 240690a_100015191253_100000185839 [0,1,0,0,0,0|1,1,0]=3 1066 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Br 527a_100015191253_100000185839 [0,1,0,0,0,0|1,1,0]=3 1067 B14R1.19 C=CCCNC(=O)c1ccc(cc1)C 11a_100015191253_100000188618 [0,1,0,0,0,0|2,0,0]=3 1068 B14R1.19 C=CCCNC(=O)c1ccc(cc1)C 1626a_100015191253_100000188618 [0,1,0,0,0,0|2,0,0]=3 1069 B14R1.19 C=CCCNC(=O)c1ccc(cc1)C 240690a_100015191253_100000188618 [0,1,0,0,0,0|2,0,0]=3 1070 B14R1.19 C=CCCNC(=O)c1ccc(cc1)C 527a_100015191253_100000188618 [0,1,0,0,0,0|2,0,0]=3 1071 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Cl 11a_100015191253_100000210187 [0,1,0,0,0,0|1,0,0]=2 1072 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Cl 1626a_100015191253_100000210187 [0,1,0,0,0,0|1,0,0]=2 1073 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Cl 240690a_100015191253_100000210187 [0,1,0,0,0,0|1,0,0]=2 1074 B14R1.19 C=CCCNC(=O)c1ccc(cc1)Cl 527a_100015191253_100000210187 [0,1,0,0,0,0|1,0,0]=2 1075 B14R1.19 C=CCCNC(=O)c1ccc(cc1)F 11a_100015191253_100000187176 [0,1,0,0,0,0|1,1,0]=3 1076 B14R1.19 C=CCCNC(=O)c1ccc(cc1)F 1626a_100015191253_100000187176 [0,1,0,0,0,0|1,1,0]=3 1077 B14R1.19 C=CCCNC(=O)c1ccc(cc1)F 240690a_100015191253_100000187176 [0,1,0,0,0,0|1,1,0]=3 1078 B14R1.19 C=CCCNC(=O)c1ccc(cc1)F 527a_100015191253_100000187176 [0,1,0,0,0,0|1,1,0]=3 1079 B14R1.19 C=CCCNC(=O)c1ccc(cc1)I 11a_100015191253_100000187904 [0,1,0,0,0,0|1,1,0]=3 1080 B14R1.19 C=CCCNC(=O)c1ccc(cc1)I 1626a_100015191253_100000187904 [0,1,0,0,0,0|1,1,0]=3 1081 B14R1.19 C=CCCNC(=O)c1ccc(cc1)I 240690a_100015191253_100000187904 [0,1,0,0,0,0|1,1,0]=3 1082 B14R1.19 C=CCCNC(=O)c1ccc(cc1)I 527a_100015191253_100000187904 [0,1,0,0,0,0|1,1,0]=3 1083 B14R1.19 C=CCCNC(=O)c1ccc(cc1)O 240690a_100015191253_100000212099 [0,1,0,0,0,0|2,0,0]=3 1084 B14R1.19 C=CCCNC(=O)c1ccc(cc1)O 527a_100015191253_100000212099 [0,1,0,0,0,0|2,0,0]=3 1085 B14R1.19 C=CCCNC(C)c1ccc(cc1)Cl 2230a_100015191253_100000684792 [0,1,0,0,0,0|2,0,1]=4 1086 B14R1.19 C=CCCNC(C)c1ccc(cc1)Cl 269862a_100015191253_100000185797 [0,1,0,0,0,0|2,0,1]=4 1087 B14R1.19 C=CCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000754431 [0,1,0,0,0,0|2,0,1]=4 1088 B14R1.19 C=CCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000754431 [0,1,0,0,0,0|2,0,1]=4 1089 B14R1.19 C=CCNCC(=O)c1ccc(cc1)C 2230a_100020586998_100000211441 [0,1,0,0,0,0|2,0,1]=4 1090 B14R1.19 C=CCNNC(=O)c1ccc(cc1)Br 22a_100020588587_100000185839 [0,1,0,0,0,0|1,1,1]=4 1091 B14R1.19 C=CCNNC(=O)c1ccc(cc1)C 22a_100020588587_100000188618 [0,1,0,0,0,0|2,0,1]=4 1092 B14R1.19 C=CCNNC(=O)c1ccc(cc1)Cl 22a_100020588587_100000210187 [0,1,0,0,0,0|1,0,1]=3 1093 B14R1.19 C=CCNNC(=O)c1ccc(cc1)F 22a_100020588587_100000187176 [0,1,0,0,0,0|1,1,1]=4 1094 B14R1.19 C=CCNNC(=O)c1ccc(cc1)I 22a_100020588587_100000187904 [0,1,0,0,0,0|1,1,1]=4 1095 B14R1.19 C=CCNNC(=O)c1ccc(cc1)O 22a_100020588587_100000212099 [0,1,0,0,0,0|2,0,1]=4 1096 B14R1.19 C=CCSCC(=O)c1ccc(cc1)Cl 62a_100000210623_100000211071 [0,1,0,0,0,0|2,0,1]=4 1097 B14R1.19 C=CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210623 [0,1,0,0,0,0|2,0,1]=4 1098 B14R1.19 C=COCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000039644 [0,1,0,0,0,0|2,0,1]=4 1099 B14R1.19 CC#CCNC(=O)c1ccc(cc1)Br 11a_100000685387_100000185839 [0,1,0,0,0,0|1,1,1]=4 1100 B14R1.19 CC#CCNC(=O)c1ccc(cc1)Br 1626a_100000685387_100000185839 [0,1,0,0,0,0|1,1,1]=4 1101 B14R1.19 CC#CCNC(=O)c1ccc(cc1)Br 527a_100000685387_100000185839 [0,1,0,0,0,0|1,1,1]=4 1102 B14R1.19 CC#CCNC(=O)c1ccc(cc1)C 11a_100000685387_100000188618 [0,1,0,0,0,0|2,0,1]=4 1103 B14R1.19 CC#CCNC(=O)c1ccc(cc1)C 1626a_100000685387_100000188618 [0,1,0,0,0,0|2,0,1]=4 1104 B14R1.19 CC#CCNC(=O)c1ccc(cc1)C 527a_100000685387_100000188618 [0,1,0,0,0,0|2,0,1]=4 1105 B14R1.19 CC#CCNC(=O)c1ccc(cc1)Cl 11a_100000685387_100000210187 [0,1,0,0,0,0|1,0,1]=3 1106 B14R1.19 CC#CCNC(=O)c1ccc(cc1)Cl 1626a_100000685387_100000210187 [0,1,0,0,0,0|1,0,1]=3 1107 B14R1.19 CC#CCNC(=O)c1ccc(cc1)Cl 527a_100000685387_100000210187 [0,1,0,0,0,0|1,0,1]=3 1108 B14R1.19 CC#CCNC(=O)c1ccc(cc1)F 11a_100000685387_100000187176 [0,1,0,0,0,0|1,1,1]=4 1109 B14R1.19 CC#CCNC(=O)c1ccc(cc1)F 1626a_100000685387_100000187176 [0,1,0,0,0,0|1,1,1]=4 1110 B14R1.19 CC#CCNC(=O)c1ccc(cc1)F 527a_100000685387_100000187176 [0,1,0,0,0,0|1,1,1]=4 1111 B14R1.19 CC#CCNC(=O)c1ccc(cc1)I 11a_100000685387_100000187904 [0,1,0,0,0,0|1,1,1]=4 1112 B14R1.19 CC#CCNC(=O)c1ccc(cc1)I 1626a_100000685387_100000187904 [0,1,0,0,0,0|1,1,1]=4 1113 B14R1.19 CC#CCNC(=O)c1ccc(cc1)I 527a_100000685387_100000187904 [0,1,0,0,0,0|1,1,1]=4 1114 B14R1.19 CC#CCNC(=O)c1ccc(cc1)O 527a_100000685387_100000212099 [0,1,0,0,0,0|2,0,1]=4 1115 B14R1.19 CC(=NNCCO)c1cc[n+](cc1)[O-] 4a_100000210001_100000076990 [0,1,0,0,0,0|3,0,0]=4 1116 B14R1.19 CC(=NNCCO)c1ccc(cc1)Br 4a_100000210001_100000185794 [0,1,0,0,0,0|1,1,0]=3 1117 B14R1.19 CC(=NNCCO)c1ccc(cc1)C 4a_100000210001_100000185793 [0,1,0,0,0,0|2,0,0]=3 1118 B14R1.19 CC(=NNCCO)c1ccc(cc1)Cl 4a_100000210001_100000185797 [0,1,0,0,0,0|1,0,0]=2 1119 B14R1.19 CC(=NNCCO)c1ccc(cc1)F 4a_100000210001_100000185800 [0,1,0,0,0,0|1,1,0]=3 1120 B14R1.19 CC(=NNCCO)c1ccc(cc1)I 4a_100000210001_100000185465 [0,1,0,0,0,0|1,1,0]=3 1121 B14R1.19 CC(=NNCCO)c1ccc(cc1)O 4a_100000210001_100000185113 [0,1,0,0,0,0|2,0,0]=3 1122 B14R1.19 CC(=NNCCO)c1ccc(cn1)Br 4a_100000210001_100000686046 [0,1,0,0,0,0|2,1,0]=4 1123 B14R1.19 CC(=NNCCO)c1ccc(cn1)C 4a_100000210001_100000084104 [0,1,0,0,0,0|3,0,0]=4 1124 B14R1.19 CC(=NNCCO)c1ccc(cn1)Cl 4a_100000210001_100000692432 [0,1,0,0,0,0|2,0,0]=3 1125 B14R1.19 CC(=NNCCO)c1ccc(cn1)F 4a_100000210001_100102946652 [0,1,0,0,0,0|2,1,0]=4 1126 B14R1.19 CC(=NNCCO)c1ccc(cn1)O 4a_100000210001_100012001710 [0,1,0,0,0,0|3,0,0]=4 1127 B14R1.19 CC(=NNCCO)c1ccc(nc1)Br 4a_100000210001_100000684857 [0,1,0,0,0,0|2,1,0]=4 1128 B14R1.19 CC(=NNCCO)c1ccc(nc1)C 4a_100000210001_100011280547 [0,1,0,0,0,0|3,0,0]=4 1129 B14R1.19 CC(=NNCCO)c1ccc(nc1)Cl 4a_100000210001_100000690552 [0,1,0,0,0,0|2,0,0]=3 1130 B14R1.19 CC(=NNCCO)c1ccc(nc1)F 4a_100000210001_100000085738 [0,1,0,0,0,0|2,1,0]=4 1131 B14R1.19 CC(=NNCCO)c1ccc(nc1)O 4a_100000210001_100012001708 [0,1,0,0,0,0|3,0,0]=4 1132 B14R1.19 CC(=NNCCO)c1cnc(cn1)Cl 4a_100000210001_100009883172 [0,1,0,0,0,0|3,0,0]=4 1133 B14R1.19 CC(CNCCO)c1ccc(cc1)O 34a_200015188644_100000211926 [0,1,0,0,0,0|2,0,1]=4 1134 B14R1.19 CC(NCCCF)c1ccc(cc1)Cl 2230a_100015189416_100000684792 [0,1,0,0,0,0|2,0,1]=4 1135 B14R1.19 CC(NCCCF)c1ccc(cc1)Cl 269862a_100015189416_100000185797 [0,1,0,0,0,0|2,0,1]=4 1136 B14R1.19 CC(NCCCO)c1ccc(cc1)Br 269862a_100000182051_100000185794 [0,1,0,0,0,0|1,1,1]=4 1137 B14R1.19 CC(NCCCO)c1ccc(cc1)Cl 269862a_100000182051_100000185797 [0,1,0,0,0,0|1,0,1]=3 1138 B14R1.19 CC(NCCCO)c1ccc(cc1)F 269862a_100000182051_100000185800 [0,1,0,0,0,0|1,1,1]=4 1139 B14R1.19 CC(NCCCO)c1ccc(cc1)I 269862a_100000182051_100000185465 [0,1,0,0,0,0|1,1,1]=4 1140 B14R1.19 CC(NCCCO)c1ccc(cn1)Cl 269862a_100000182051_100000692432 [0,1,0,0,0,0|2,0,1]=4 1141 B14R1.19 CC(NCCCO)c1ccc(cn1)Cl 270004a_100000182051_100000692432 [0,1,0,0,0,0|2,0,1]=4 1142 B14R1.19 CC(NCCCO)c1ccc(nc1)Cl 269862a_100000182051_100000690552 [0,1,0,0,0,0|2,0,1]=4 1143 B14R1.19 CC(SCCCO)c1ccc(cc1)Cl 62a_100000684792_100011215043 [0,1,0,0,0,0|2,0,1]=4 1144 B14R1.19 CC(SCCCO)c1ccc(cc1)Cl 62a_100011215043_100000684792 [0,1,0,0,0,0|2,0,1]=4 1145 B14R1.19 CC/C=C\CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100103147603 [0,1,0,0,0,0|2,0,1]=4 1146 B14R1.19 CCC#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100009813939 [0,1,0,0,0,0|2,0,1]=4 1147 B14R1.19 CCC=NNC(=O)c1ccc(cc1)Br 4a_100000183614_100000210100 [0,1,0,0,0,0|1,1,1]=4 1148 B14R1.19 CCC=NNC(=O)c1ccc(cc1)C 4a_100000189790_100000210100 [0,1,0,0,0,0|2,0,1]=4 1149 B14R1.19 CCC=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_100000210100 [0,1,0,0,0,0|1,0,1]=3 1150 B14R1.19 CCC=NNC(=O)c1ccc(cc1)F 4a_100000182866_100000210100 [0,1,0,0,0,0|1,1,1]=4 1151 B14R1.19 CCC=NNC(=O)c1ccc(cc1)I 4a_100000189773_100000210100 [0,1,0,0,0,0|1,1,1]=4 1152 B14R1.19 CCC=NNC(=O)c1ccc(cn1)Cl 4a_100012017650_100000210100 [0,1,0,0,0,0|2,0,1]=4 1153 B14R1.19 CCC=NNC(=O)c1ccc(nc1)Cl 4a_100000189807_100000210100 [0,1,0,0,0,0|2,0,1]=4 1154 B14R1.19 CCCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210326 [0,1,0,0,0,0|2,1,0]=4 1155 B14R1.19 CCCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210326 [0,1,0,0,0,0|3,0,0]=4 1156 B14R1.19 CCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210326 [0,1,0,0,0,0|2,0,0]=3 1157 B14R1.19 CCCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210326 [0,1,0,0,0,0|2,1,0]=4 1158 B14R1.19 CCCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210326 [0,1,0,0,0,0|2,1,0]=4 1159 B14R1.19 CCCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210326 [0,1,0,0,0,0|3,0,0]=4 1160 B14R1.19 CCCCCC(=O)c1ccc(cc1)O 271570a_203496583355_200011267725 [0,1,0,0,0,0|3,0,0]=4 1161 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 11a_100000102301_100000185839 [0,1,0,0,0,0|1,1,0]=3 1162 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 1626a_100000102301_100000185839 [0,1,0,0,0,0|1,1,0]=3 1163 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 240690a_100000102301_100000185839 [0,1,0,0,0,0|1,1,0]=3 1164 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 527a_100000102301_100000185839 [0,1,0,0,0,0|1,1,0]=3 1165 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 11a_100000102301_100000188618 [0,1,0,0,0,0|2,0,0]=3 1166 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 1626a_100000102301_100000188618 [0,1,0,0,0,0|2,0,0]=3 1167 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 240690a_100000102301_100000188618 [0,1,0,0,0,0|2,0,0]=3 1168 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 527a_100000102301_100000188618 [0,1,0,0,0,0|2,0,0]=3 1169 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 11a_100000102301_100000210187 [0,1,0,0,0,0|1,0,0]=2 1170 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 1626a_100000102301_100000210187 [0,1,0,0,0,0|1,0,0]=2 1171 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 240690a_100000102301_100000210187 [0,1,0,0,0,0|1,0,0]=2 1172 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 527a_100000102301_100000210187 [0,1,0,0,0,0|1,0,0]=2 1173 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 11a_100000102301_100000187176 [0,1,0,0,0,0|1,1,0]=3 1174 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 1626a_100000102301_100000187176 [0,1,0,0,0,0|1,1,0]=3 1175 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 240690a_100000102301_100000187176 [0,1,0,0,0,0|1,1,0]=3 1176 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 527a_100000102301_100000187176 [0,1,0,0,0,0|1,1,0]=3 1177 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 11a_100000102301_100000187904 [0,1,0,0,0,0|1,1,0]=3 1178 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 1626a_100000102301_100000187904 [0,1,0,0,0,0|1,1,0]=3 1179 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 240690a_100000102301_100000187904 [0,1,0,0,0,0|1,1,0]=3 1180 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 527a_100000102301_100000187904 [0,1,0,0,0,0|1,1,0]=3 1181 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 240690a_100000102301_100000212099 [0,1,0,0,0,0|2,0,0]=3 1182 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000154866 [0,1,0,0,0,0|2,0,0]=3 1183 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 527a_100000102301_100000212099 [0,1,0,0,0,0|2,0,0]=3 1184 B14R1.19 CCCCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781281 [0,1,0,0,0,0|3,0,0]=4 1185 B14R1.19 CCCCNC(C)c1ccc(cc1)Cl 2230a_100000102301_100000684792 [0,1,0,0,0,0|2,0,1]=4 1186 B14R1.19 CCCCNC(C)c1ccc(cc1)Cl 269862a_100000102301_100000185797 [0,1,0,0,0,0|2,0,1]=4 1187 B14R1.19 CCCCNC(C)c1ccc(cc1)Cl 7a_106832991798_100000684792 [0,1,0,0,0,0|2,0,1]=4 1188 B14R1.19 CCCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210211 [0,1,0,0,0,0|2,0,1]=4 1189 B14R1.19 CCCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210210 [0,1,0,0,0,0|2,0,1]=4 1190 B14R1.19 CCCNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100000210303 [0,1,0,0,0,0|1,0,2]=4 1191 B14R1.19 CCCNCC(O)c1ccc(cc1)Cl 34a_100000736658_100000210303 [0,1,0,0,0,0|1,0,2]=4 1192 B14R1.19 CCCNN=C(C)c1ccc(cc1)Br 4a_100000740057_100000185794 [0,1,0,0,0,0|2,1,0]=4 1193 B14R1.19 CCCNN=C(C)c1ccc(cc1)C 4a_100000740057_100000185793 [0,1,0,0,0,0|3,0,0]=4 1194 B14R1.19 CCCNN=C(C)c1ccc(cc1)Cl 4a_100000740057_100000185797 [0,1,0,0,0,0|2,0,0]=3 1195 B14R1.19 CCCNN=C(C)c1ccc(cc1)F 4a_100000740057_100000185800 [0,1,0,0,0,0|2,1,0]=4 1196 B14R1.19 CCCNN=C(C)c1ccc(cc1)I 4a_100000740057_100000185465 [0,1,0,0,0,0|2,1,0]=4 1197 B14R1.19 CCCNN=C(C)c1ccc(cc1)O 4a_100000740057_100000185113 [0,1,0,0,0,0|3,0,0]=4 1198 B14R1.19 CCCNN=C(C)c1ccc(cn1)Cl 4a_100000740057_100000692432 [0,1,0,0,0,0|3,0,0]=4 1199 B14R1.19 CCCNN=C(C)c1ccc(nc1)Cl 4a_100000740057_100000690552 [0,1,0,0,0,0|3,0,0]=4 1200 B14R1.19 CCCNNC(=O)c1ccc(cc1)Br 22a_100000740057_100000185839 [0,1,0,0,0,0|1,1,0]=3 1201 B14R1.19 CCCNNC(=O)c1ccc(cc1)C 22a_100000740057_100000188618 [0,1,0,0,0,0|2,0,0]=3 1202 B14R1.19 CCCNNC(=O)c1ccc(cc1)Cl 22a_100000740057_100000210187 [0,1,0,0,0,0|1,0,0]=2 1203 B14R1.19 CCCNNC(=O)c1ccc(cc1)F 22a_100000740057_100000187176 [0,1,0,0,0,0|1,1,0]=3 1204 B14R1.19 CCCNNC(=O)c1ccc(cc1)I 22a_100000740057_100000187904 [0,1,0,0,0,0|1,1,0]=3 1205 B14R1.19 CCCNNC(=O)c1ccc(cc1)O 22a_100000740057_100000212099 [0,1,0,0,0,0|2,0,0]=3 1206 B14R1.19 CCCOCC(=O)c1ccc(cc1)Br 34a_100000210258_100000188085 [0,1,0,0,0,0|2,1,0]=4 1207 B14R1.19 CCCOCC(=O)c1ccc(cc1)C 34a_100000210258_100000211441 [0,1,0,0,0,0|3,0,0]=4 1208 B14R1.19 CCCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210303 [0,1,0,0,0,0|2,1,0]=4 1209 B14R1.19 CCCOCC(=O)c1ccc(cc1)I 34a_100000210258_100011216261 [0,1,0,0,0,0|2,1,0]=4 1210 B14R1.19 CCCOCC(=O)c1ccc(cc1)O 34a_100000210258_100009814261 [0,1,0,0,0,0|3,0,0]=4 1211 B14R1.19 CCCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210303 [0,1,0,0,0,0|2,1,0]=4 1212 B14R1.19 CCCSCC(=O)c1ccc(cc1)C 62a_100000210303_100000211441 [0,1,0,0,0,0|3,0,0]=4 1213 B14R1.19 CCCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210303 [0,1,0,0,0,0|3,0,0]=4 1214 B14R1.19 CCCSCC(=O)c1ccc(cc1)Cl 62a_100000210303_100000211071 [0,1,0,0,0,0|2,0,0]=3 1215 B14R1.19 CCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210303 [0,1,0,0,0,0|2,0,0]=3 1216 B14R1.19 CCCSCC(=O)c1ccc(cc1)F 62a_100000210303_100000211279 [0,1,0,0,0,0|2,1,0]=4 1217 B14R1.19 CCCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210303 [0,1,0,0,0,0|2,1,0]=4 1218 B14R1.19 CCCSCC(=O)c1ccc(cc1)I 62a_100000210303_100011216261 [0,1,0,0,0,0|2,1,0]=4 1219 B14R1.19 CCCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210303 [0,1,0,0,0,0|2,1,0]=4 1220 B14R1.19 CCCSCC(=O)c1ccc(cc1)O 62a_100000210303_100009814261 [0,1,0,0,0,0|3,0,0]=4 1221 B14R1.19 CCCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210303 [0,1,0,0,0,0|3,0,0]=4 1222 B14R1.19 CCCSCC(=O)c1ccc(cn1)Cl 62a_100000210303_100016989621 [0,1,0,0,0,0|3,0,0]=4 1223 B14R1.19 CCCSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100000210303 [0,1,0,0,0,0|3,0,0]=4 1224 B14R1.19 CCCSCC(=O)c1ccc(nc1)Cl 62a_100000210303_100009864725 [0,1,0,0,0,0|3,0,0]=4 1225 B14R1.19 CCCSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100000210303 [0,1,0,0,0,0|3,0,0]=4 1226 B14R1.19 CCNCCC(=O)c1ccc(cc1)C 2230a_100015525214_100000701375 [0,1,0,0,0,0|3,0,0]=4 1227 B14R1.19 CCNCCC(=O)c1ccc(cc1)F 2230a_100015525214_100000211231 [0,1,0,0,0,0|2,1,0]=4 1228 B14R1.19 CCNCCC(=O)c1ccc(cc1)O 2230a_100015525214_100009879949 [0,1,0,0,0,0|3,0,0]=4 1229 B14R1.19 CCOCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215890 [0,1,0,0,0,0|2,1,0]=4 1230 B14R1.19 CCOCCC(=O)c1ccc(cc1)C 1458a_100000188618_100011215890 [0,1,0,0,0,0|3,0,0]=4 1231 B14R1.19 CCOCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215890 [0,1,0,0,0,0|2,0,0]=3 1232 B14R1.19 CCOCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215890 [0,1,0,0,0,0|2,1,0]=4 1233 B14R1.19 CCOCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215890 [0,1,0,0,0,0|2,1,0]=4 1234 B14R1.19 CCOCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215890 [0,1,0,0,0,0|3,0,0]=4 1235 B14R1.19 CCOCCC(=O)c1ccc(cc1)O 271570a_203496583355_100018808408 [0,1,0,0,0,0|3,0,0]=4 1236 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000757381 [0,1,0,0,0,0|2,1,0]=4 1237 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 62a_100000210202_100011215963 [0,1,0,0,0,0|2,1,0]=4 1238 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 62a_100011215963_100000210202 [0,1,0,0,0,0|2,1,0]=4 1239 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000757381 [0,1,0,0,0,0|3,0,0]=4 1240 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 62a_100000210202_100000701375 [0,1,0,0,0,0|3,0,0]=4 1241 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 62a_100000701375_100000210202 [0,1,0,0,0,0|3,0,0]=4 1242 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000757381 [0,1,0,0,0,0|2,0,0]=3 1243 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 62a_100000210202_100011216492 [0,1,0,0,0,0|2,0,0]=3 1244 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210202 [0,1,0,0,0,0|2,0,0]=3 1245 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000757381 [0,1,0,0,0,0|2,1,0]=4 1246 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 62a_100000210202_100000211231 [0,1,0,0,0,0|2,1,0]=4 1247 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 62a_100000211231_100000210202 [0,1,0,0,0,0|2,1,0]=4 1248 B14R1.19 CCSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000757381 [0,1,0,0,0,0|2,1,0]=4 1249 B14R1.19 CCSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000757381 [0,1,0,0,0,0|3,0,0]=4 1250 B14R1.19 CCSCCC(=O)c1ccc(cc1)O 62a_100000210202_100009879949 [0,1,0,0,0,0|3,0,0]=4 1251 B14R1.19 CN(CCCCO)c1ccc(cc1)Cl 2230a_100020629279_100000210776 [0,1,0,0,0,0|3,0,0]=4 1252 B14R1.19 CN(CCCCO)c1ccc(cc1)Cl 269982a_100020629279_100000210776 [0,1,0,0,0,0|3,0,0]=4 1253 B14R1.19 CN(CCCCO)c1ccc(cc1)Cl 34a_100020629279_100011216708 [0,1,0,0,0,0|3,0,0]=4 1254 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 2230a_106832991635_100000211046 [0,1,0,0,0,0|2,1,0]=4 1255 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 34a_100102657272_100000211046 [0,1,0,0,0,0|2,1,0]=4 1256 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 7a_106832991635_100000211046 [0,1,0,0,0,0|2,1,0]=4 1257 B14R1.19 CNCCCC(=O)c1ccc(cc1)Cl 7a_106832991635_200011217871 [0,1,0,0,0,0|2,0,0]=3 1258 B14R1.19 CNCCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211961 [0,1,0,0,0,0|2,1,0]=4 1259 B14R1.19 CNCCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211961 [0,1,0,0,0,0|2,1,0]=4 1260 B14R1.19 CNCCCC(=O)c1ccc(cc1)O 2230a_106832991635_100000039620 [0,1,0,0,0,0|3,0,0]=4 1261 B14R1.19 CNCCCC(=O)c1ccc(cc1)O 7a_106832991635_100000039620 [0,1,0,0,0,0|3,0,0]=4 1262 B14R1.19 CNCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_200000210301 [0,1,0,0,0,0|1,0,0]=2 1263 B14R1.19 CNCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_200000210301 [0,1,0,0,0,0|1,0,0]=2 1264 B14R1.19 CNCCNC(=O)c1ccc(cc1)F 2230a_100000753910_200000210301 [0,1,0,0,0,0|1,1,0]=3 1265 B14R1.19 CNCCNC(=O)c1ccc(cc1)F 34a_100000753910_200000210301 [0,1,0,0,0,0|1,1,0]=3 1266 B14R1.19 COCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000740836 [0,1,0,0,0,0|1,1,0]=3 1267 B14R1.19 COCCCC(=O)c1ccc(cc1)Br 34a_100138415774_100000211046 [0,1,0,0,0,0|1,1,0]=3 1268 B14R1.19 COCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000740836 [0,1,0,0,0,0|2,0,0]=3 1269 B14R1.19 COCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000740836 [0,1,0,0,0,0|1,0,0]=2 1270 B14R1.19 COCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000740836 [0,1,0,0,0,0|1,1,0]=3 1271 B14R1.19 COCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000740836 [0,1,0,0,0,0|1,1,0]=3 1272 B14R1.19 COCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000740836 [0,1,0,0,0,0|2,0,0]=3 1273 B14R1.19 COCCCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000740836 [0,1,0,0,0,0|3,0,0]=4 1274 B14R1.19 COCCCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000740836 [0,1,0,0,0,0|3,0,0]=4 1275 B14R1.19 COCCCN(C)c1ccc(cc1)Cl 34a_100020629279_100000740836 [0,1,0,0,0,0|3,0,0]=4 1276 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 1626a_100000209980_100000185839 [0,1,0,0,0,0|0,1,0]=2 1277 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 240690a_100000209980_100000185839 [0,1,0,0,0,0|0,1,0]=2 1278 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 34a_200000158904_200000210301 [0,1,0,0,0,0|0,1,0]=2 1279 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 527a_100000209980_100000185839 [0,1,0,0,0,0|0,1,0]=2 1280 B14R1.19 COCCNC(=O)c1ccc(cc1)C 1626a_100000209980_100000188618 [0,1,0,0,0,0|1,0,0]=2 1281 B14R1.19 COCCNC(=O)c1ccc(cc1)C 240690a_100000209980_100000188618 [0,1,0,0,0,0|1,0,0]=2 1282 B14R1.19 COCCNC(=O)c1ccc(cc1)C 34a_200000158910_200000210301 [0,1,0,0,0,0|1,0,0]=2 1283 B14R1.19 COCCNC(=O)c1ccc(cc1)C 527a_100000209980_100000188618 [0,1,0,0,0,0|1,0,0]=2 1284 B14R1.19 COCCNC(=O)c1ccc(cc1)C 7a_200000158910_200000210301 [0,1,0,0,0,0|1,0,0]=2 1285 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 1626a_100000209980_100000210187 [0,1,0,0,0,0|0,0,0]=1 1286 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 240690a_100000209980_100000210187 [0,1,0,0,0,0|0,0,0]=1 1287 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 527a_100000209980_100000210187 [0,1,0,0,0,0|0,0,0]=1 1288 B14R1.19 COCCNC(=O)c1ccc(cc1)F 1626a_100000209980_100000187176 [0,1,0,0,0,0|0,1,0]=2 1289 B14R1.19 COCCNC(=O)c1ccc(cc1)F 240690a_100000209980_100000187176 [0,1,0,0,0,0|0,1,0]=2 1290 B14R1.19 COCCNC(=O)c1ccc(cc1)F 527a_100000209980_100000187176 [0,1,0,0,0,0|0,1,0]=2 1291 B14R1.19 COCCNC(=O)c1ccc(cc1)I 1626a_100000209980_100000187904 [0,1,0,0,0,0|0,1,0]=2 1292 B14R1.19 COCCNC(=O)c1ccc(cc1)I 240690a_100000209980_100000187904 [0,1,0,0,0,0|0,1,0]=2 1293 B14R1.19 COCCNC(=O)c1ccc(cc1)I 527a_100000209980_100000187904 [0,1,0,0,0,0|0,1,0]=2 1294 B14R1.19 COCCNC(=O)c1ccc(cc1)N 34a_100000740983_200000210301 [0,1,0,0,0,0|1,0,0]=2 1295 B14R1.19 COCCNC(=O)c1ccc(cc1)O 240690a_100000209980_100000212099 [0,1,0,0,0,0|1,0,0]=2 1296 B14R1.19 COCCNC(=O)c1ccc(cc1)O 527a_100000209980_100000212099 [0,1,0,0,0,0|1,0,0]=2 1297 B14R1.19 COCCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000157854 [0,1,0,0,0,0|2,0,0]=3 1298 B14R1.19 COCCNC(C)c1ccc(cc1)Br 2230a_100000209980_100000755118 [0,1,0,0,0,0|1,1,1]=4 1299 B14R1.19 COCCNC(C)c1ccc(cc1)Br 269862a_100000209980_100000185794 [0,1,0,0,0,0|1,1,1]=4 1300 B14R1.19 COCCNC(C)c1ccc(cc1)C 2230a_100000209980_100011261388 [0,1,0,0,0,0|2,0,1]=4 1301 B14R1.19 COCCNC(C)c1ccc(cc1)C 269862a_100000209980_100000185793 [0,1,0,0,0,0|2,0,1]=4 1302 B14R1.19 COCCNC(C)c1ccc(cc1)Cl 2230a_100000209980_100000684792 [0,1,0,0,0,0|1,0,1]=3 1303 B14R1.19 COCCNC(C)c1ccc(cc1)Cl 269862a_100000209980_100000185797 [0,1,0,0,0,0|1,0,1]=3 1304 B14R1.19 COCCNC(C)c1ccc(cc1)F 2230a_100000209980_100000743420 [0,1,0,0,0,0|1,1,1]=4 1305 B14R1.19 COCCNC(C)c1ccc(cc1)F 269862a_100000209980_100000185800 [0,1,0,0,0,0|1,1,1]=4 1306 B14R1.19 COCCNC(C)c1ccc(cc1)I 269862a_100000209980_100000185465 [0,1,0,0,0,0|1,1,1]=4 1307 B14R1.19 COCCNC(C)c1ccc(cn1)Cl 269862a_100000209980_100000692432 [0,1,0,0,0,0|2,0,1]=4 1308 B14R1.19 COCCNC(C)c1ccc(cn1)Cl 270004a_100000209980_100000692432 [0,1,0,0,0,0|2,0,1]=4 1309 B14R1.19 COCCNC(C)c1ccc(nc1)Cl 269862a_100000209980_100000690552 [0,1,0,0,0,0|2,0,1]=4 1310 B14R1.19 COCCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100011201679 [0,1,0,0,0,0|1,1,1]=4 1311 B14R1.19 COCCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100011201679 [0,1,0,0,0,0|1,1,1]=4 1312 B14R1.19 COCCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100011201679 [0,1,0,0,0,0|1,1,1]=4 1313 B14R1.19 COCCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100011201679 [0,1,0,0,0,0|2,0,1]=4 1314 B14R1.19 COCCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100011201679 [0,1,0,0,0,0|1,1,1]=4 1315 B14R1.19 COCCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100011201679 [0,1,0,0,0,0|2,0,1]=4 1316 B14R1.19 COCCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100011201679 [0,1,0,0,0,0|2,0,1]=4 1317 B14R1.19 COCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100011201679 [0,1,0,0,0,0|1,0,1]=3 1318 B14R1.19 COCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100011201679 [0,1,0,0,0,0|1,0,1]=3 1319 B14R1.19 COCCOC(=O)c1ccc(cc1)C 7a_200000031072_200000210301 [0,1,0,0,0,0|2,0,0]=3 1320 B14R1.19 COCCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100011201679 [0,1,0,0,0,0|2,0,1]=4 1321 B14R1.19 COCCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000233755 [0,1,0,0,0,0|2,0,1]=4 1322 B14R1.19 COCCSC(C)c1ccc(cc1)Cl 62a_100000233755_100000684792 [0,1,0,0,0,0|2,0,1]=4 1323 B14R1.19 COCCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000233755 [0,1,0,0,0,0|2,0,1]=4 1324 B14R1.19 COCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000766300 [0,1,0,0,0,0|2,1,0]=4 1325 B14R1.19 COCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000766300 [0,1,0,0,0,0|3,0,0]=4 1326 B14R1.19 COCSCC(=O)c1ccc(cc1)C 62a_100000766300_100000211441 [0,1,0,0,0,0|3,0,0]=4 1327 B14R1.19 COCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000766300 [0,1,0,0,0,0|2,0,0]=3 1328 B14R1.19 COCSCC(=O)c1ccc(cc1)Cl 62a_100000766300_100000211071 [0,1,0,0,0,0|2,0,0]=3 1329 B14R1.19 COCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000766300 [0,1,0,0,0,0|2,1,0]=4 1330 B14R1.19 COCSCC(=O)c1ccc(cc1)F 62a_100000766300_100000211279 [0,1,0,0,0,0|2,1,0]=4 1331 B14R1.19 COCSCC(=O)c1ccc(cc1)I 62a_100000766300_100011216261 [0,1,0,0,0,0|2,1,0]=4 1332 B14R1.19 COCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000766300 [0,1,0,0,0,0|2,1,0]=4 1333 B14R1.19 COCSCC(=O)c1ccc(cc1)O 62a_100000766300_100009814261 [0,1,0,0,0,0|3,0,0]=4 1334 B14R1.19 COCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000766300 [0,1,0,0,0,0|3,0,0]=4 1335 B14R1.19 COCSCC(=O)c1ccc(cn1)Cl 62a_100000766300_100016989621 [0,1,0,0,0,0|3,0,0]=4 1336 B14R1.19 COCSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100000766300 [0,1,0,0,0,0|3,0,0]=4 1337 B14R1.19 COCSCC(=O)c1ccc(nc1)Cl 62a_100000766300_100009864725 [0,1,0,0,0,0|3,0,0]=4 1338 B14R1.19 COCSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100000766300 [0,1,0,0,0,0|3,0,0]=4 1339 B14R1.19 CSCCCC(=O)c1ccc(cc1)Br 62a_100000211046_200000210301 [0,1,0,0,0,0|1,2,0]=4 1340 B14R1.19 CSCCCC(=O)c1ccc(cc1)Br 62a_200000210301_100000211046 [0,1,0,0,0,0|1,2,0]=4 1341 B14R1.19 CSCCCC(=O)c1ccc(cc1)Cl 62a_200000210301_200011217871 [0,1,0,0,0,0|1,1,0]=3 1342 B14R1.19 CSCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_200000210301 [0,1,0,0,0,0|1,1,0]=3 1343 B14R1.19 CSCCCC(=O)c1ccc(cc1)F 62a_100000211961_200000210301 [0,1,0,0,0,0|1,2,0]=4 1344 B14R1.19 CSCCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211961 [0,1,0,0,0,0|1,2,0]=4 1345 B14R1.19 CSCCCC(=O)c1ccc(cc1)O 62a_200000210301_100000039620 [0,1,0,0,0,0|2,1,0]=4 1346 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 11a_100020590264_100000185839 [0,1,0,0,0,0|0,2,0]=3 1347 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 1626a_100020590264_100000185839 [0,1,0,0,0,0|0,2,0]=3 1348 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 240690a_100020590264_100000185839 [0,1,0,0,0,0|0,2,0]=3 1349 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 527a_100020590264_100000185839 [0,1,0,0,0,0|0,2,0]=3 1350 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 11a_100020590264_100000188618 [0,1,0,0,0,0|1,1,0]=3 1351 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 1626a_100020590264_100000188618 [0,1,0,0,0,0|1,1,0]=3 1352 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 240690a_100020590264_100000188618 [0,1,0,0,0,0|1,1,0]=3 1353 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 527a_100020590264_100000188618 [0,1,0,0,0,0|1,1,0]=3 1354 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 11a_100020590264_100000210187 [0,1,0,0,0,0|0,1,0]=2 1355 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 1626a_100020590264_100000210187 [0,1,0,0,0,0|0,1,0]=2 1356 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 240690a_100020590264_100000210187 [0,1,0,0,0,0|0,1,0]=2 1357 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 527a_100020590264_100000210187 [0,1,0,0,0,0|0,1,0]=2 1358 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 11a_100020590264_100000187176 [0,1,0,0,0,0|0,2,0]=3 1359 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 1626a_100020590264_100000187176 [0,1,0,0,0,0|0,2,0]=3 1360 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 240690a_100020590264_100000187176 [0,1,0,0,0,0|0,2,0]=3 1361 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 527a_100020590264_100000187176 [0,1,0,0,0,0|0,2,0]=3 1362 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 11a_100020590264_100000187904 [0,1,0,0,0,0|0,2,0]=3 1363 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 1626a_100020590264_100000187904 [0,1,0,0,0,0|0,2,0]=3 1364 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 240690a_100020590264_100000187904 [0,1,0,0,0,0|0,2,0]=3 1365 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 527a_100020590264_100000187904 [0,1,0,0,0,0|0,2,0]=3 1366 B14R1.19 CSCCNC(=O)c1ccc(cc1)O 240690a_100020590264_100000212099 [0,1,0,0,0,0|1,1,0]=3 1367 B14R1.19 CSCCNC(=O)c1ccc(cc1)O 527a_100020590264_100000212099 [0,1,0,0,0,0|1,1,0]=3 1368 B14R1.19 CSCCNC(C)c1ccc(cc1)Cl 2230a_100020590264_100000684792 [0,1,0,0,0,0|1,1,1]=4 1369 B14R1.19 CSCCNC(C)c1ccc(cc1)Cl 269862a_100020590264_100000185797 [0,1,0,0,0,0|1,1,1]=4 1370 B14R1.19 CSCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000751147 [0,1,0,0,0,0|1,1,1]=4 1371 B14R1.19 CSCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000212216 [0,1,0,0,0,0|1,1,1]=4 1372 B14R1.19 CSCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100011218213 [0,1,0,0,0,0|2,1,0]=4 1373 B14R1.19 CSCSCC(=O)c1ccc(cc1)Cl 62a_100011218213_100000211071 [0,1,0,0,0,0|2,1,0]=4 1374 B14R1.19 C[C@@H](NCCC#N)c1ccc(cc1)Cl 2230a_100015205461_100011215226 [0,1,0,0,0,0|2,0,1]=4 1375 B14R1.19 C[C@@H](NCCCF)c1ccc(cc1)Cl 2230a_100015205461_100011934791 [0,1,0,0,0,0|2,0,1]=4 1376 B14R1.19 C[C@@H](NCCCF)c1ccc(cc1)Cl 34a_100015205461_100011934791 [0,1,0,0,0,0|2,0,1]=4 1377 B14R1.19 C[C@@H](NCCCO)c1ccc(cc1)Br 2230a_100000720352_100000230001 [0,1,0,0,0,0|1,1,1]=4 1378 B14R1.19 C[C@@H](NCCCO)c1ccc(cc1)Cl 2230a_100015205461_100000230001 [0,1,0,0,0,0|1,0,1]=3 1379 B14R1.19 C[C@@H](NCCCO)c1ccc(cc1)Cl 34a_100015205461_100000230001 [0,1,0,0,0,0|1,0,1]=3 1380 B14R1.19 C[C@H](NCCCO)c1ccc(cc1)F 2230a_100025705893_100000230001 [0,1,0,0,0,0|1,1,1]=4 1381 B14R1.19 C[C@H](NCCCO)c1ccc(cc1)F 34a_100025705893_100000230001 [0,1,0,0,0,0|1,1,1]=4 1382 B14R1.19 C[C@H](NCCCO)c1ccc(cc1)I 2230a_100000753911_100000230001 [0,1,0,0,0,0|1,1,1]=4 1383 B14R1.19 C[C@H](NCCCO)c1ccc(cc1)O 2230a_100161106496_100000230001 [0,1,0,0,0,0|2,0,1]=4 1384 B14R1.19 C[C@H](OCCCO)c1ccc(cc1)Cl 34a_100011852131_100000230001 [0,1,0,0,0,0|2,0,1]=4 1385 B14R1.19 C[C@H](OCCCO)c1ccc(cc1)Cl 7a_100011852131_100011215043 [0,1,0,0,0,0|2,0,1]=4 1386 B14R1.19 Cc1ccc(cc1)C(=O)CC#CCO 1458a_100000188618_200000047223 [0,1,0,0,0,0|2,0,1]=4 1387 B14R1.19 Cc1ccc(cc1)C(=O)CCCC#N 1458a_100000188618_100000211468 [0,1,0,0,0,0|3,0,0]=4 1388 B14R1.19 Cc1ccc(cc1)C(=O)CCCCF 1458a_100000188618_100000729493 [0,1,0,0,0,0|3,0,0]=4 1389 B14R1.19 Cc1ccc(cc1)C(=O)CCCCO 1458a_100000188618_100000210776 [0,1,0,0,0,0|2,0,0]=3 1390 B14R1.19 Cc1ccc(cc1)C(=O)CCSCF 62a_100000701375_100015361967 [0,1,0,0,0,0|3,0,0]=4 1391 B14R1.19 Cc1ccc(cc1)C(=O)CCSCF 62a_100015361967_100000701375 [0,1,0,0,0,0|3,0,0]=4 1392 B14R1.19 Cc1ccc(cc1)C(=O)CNCCF 34a_100000724931_100000211441 [0,1,0,0,0,0|2,0,0]=3 1393 B14R1.19 Cc1ccc(cc1)C(=O)CNCCO 2230a_100016997473_100000211441 [0,1,0,0,0,0|1,0,0]=2 1394 B14R1.19 Cc1ccc(cc1)C(=O)CNCCO 34a_100016990907_100000211441 [0,1,0,0,0,0|1,0,0]=2 1395 B14R1.19 Cc1ccc(cc1)C(=O)COCCBr 34a_100000211926_100000211441 [0,1,0,0,0,0|3,0,0]=4 1396 B14R1.19 Cc1ccc(cc1)C(=O)COCCN 34a_100000210304_100000211441 [0,1,0,0,0,0|3,0,0]=4 1397 B14R1.19 Cc1ccc(cc1)C(=O)CSCCF 62a_100000211441_100011217306 [0,1,0,0,0,0|3,0,0]=4 1398 B14R1.19 Cc1ccc(cc1)C(=O)CSCCF 62a_100011217306_100000211441 [0,1,0,0,0,0|3,0,0]=4 1399 B14R1.19 Cc1ccc(cc1)C(=O)CSCCO 62a_100000211441_100000211926 [0,1,0,0,0,0|2,0,0]=3 1400 B14R1.19 Cc1ccc(cc1)C(=O)CSCCO 62a_100000211926_100000211441 [0,1,0,0,0,0|2,0,0]=3 1401 B14R1.19 Cc1ccc(cc1)C(=O)NCCC#N 11a_100000720768_100000188618 [0,1,0,0,0,0|2,0,0]=3 1402 B14R1.19 Cc1ccc(cc1)C(=O)NCCC#N 1626a_100000720768_100000188618 [0,1,0,0,0,0|2,0,0]=3 1403 B14R1.19 Cc1ccc(cc1)C(=O)NCCC#N 240690a_100000720768_100000188618 [0,1,0,0,0,0|2,0,0]=3 1404 B14R1.19 Cc1ccc(cc1)C(=O)NCCC#N 527a_100000720768_100000188618 [0,1,0,0,0,0|2,0,0]=3 1405 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000188618 [0,1,0,0,0,0|2,0,0]=3 1406 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000188618 [0,1,0,0,0,0|2,0,0]=3 1407 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000188618 [0,1,0,0,0,0|2,0,0]=3 1408 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000188618 [0,1,0,0,0,0|2,0,0]=3 1409 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000188618 [0,1,0,0,0,0|1,0,0]=2 1410 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000188618 [0,1,0,0,0,0|1,0,0]=2 1411 B14R1.19 Cc1ccc(cc1)C(=O)NCCO[13CH3] 34a_200000158910_200025704644 [0,1,0,0,0,0|1,0,0]=2 1412 B14R1.19 Cc1ccc(cc1)C(=O)NCCO[13CH3] 7a_200000158910_200025704644 [0,1,0,0,0,0|1,0,0]=2 1413 B14R1.19 Cc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100000188618 [0,1,0,0,0,0|1,0,0]=2 1414 B14R1.19 Cc1ccc(cc1)C(=O)OCCO[13CH3] 7a_200000031072_200025704644 [0,1,0,0,0,0|2,0,0]=3 1415 B14R1.19 Cc1ccc(cc1)C(C)NCCCO 269862a_100000182051_100000185793 [0,1,0,0,0,0|2,0,1]=4 1416 B14R1.19 Cc1ccc(cc1)C(O)CNCCO 2230a_200020610344_100000211926 [0,1,0,0,0,0|1,0,2]=4 1417 B14R1.19 Cc1ccc(cc1)C(O)CNCCO 34a_200020610344_100000211926 [0,1,0,0,0,0|1,0,2]=4 1418 B14R1.19 Cc1ccc(cc1)[C@@H](C)NCCCO 2230a_100016988085_100000230001 [0,1,0,0,0,0|2,0,1]=4 1419 B14R1.19 Cc1ccc(cc1)[C@@H](C)NCCCO 34a_100016988085_100000230001 [0,1,0,0,0,0|2,0,1]=4 1420 B14R1.19 Cc1ccc(cn1)C(=O)CSCCO 62a_100000211926_100012027583 [0,1,0,0,0,0|3,0,0]=4 1421 B14R1.19 Cc1ccc(cn1)C(=O)CSCCO 62a_100012027583_100000211926 [0,1,0,0,0,0|3,0,0]=4 1422 B14R1.19 N#CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000211468 [0,1,0,0,0,0|2,1,0]=4 1423 B14R1.19 N#CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000211468 [0,1,0,0,0,0|2,0,0]=3 1424 B14R1.19 N#CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000211468 [0,1,0,0,0,0|2,1,0]=4 1425 B14R1.19 N#CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000211468 [0,1,0,0,0,0|2,1,0]=4 1426 B14R1.19 N#CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000211468 [0,1,0,0,0,0|3,0,0]=4 1427 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Br 11a_100000720768_100000185839 [0,1,0,0,0,0|1,1,0]=3 1428 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Br 1626a_100000720768_100000185839 [0,1,0,0,0,0|1,1,0]=3 1429 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Br 240690a_100000720768_100000185839 [0,1,0,0,0,0|1,1,0]=3 1430 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Br 527a_100000720768_100000185839 [0,1,0,0,0,0|1,1,0]=3 1431 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Cl 11a_100000720768_100000210187 [0,1,0,0,0,0|1,0,0]=2 1432 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Cl 1626a_100000720768_100000210187 [0,1,0,0,0,0|1,0,0]=2 1433 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Cl 240690a_100000720768_100000210187 [0,1,0,0,0,0|1,0,0]=2 1434 B14R1.19 N#CCCNC(=O)c1ccc(cc1)Cl 527a_100000720768_100000210187 [0,1,0,0,0,0|1,0,0]=2 1435 B14R1.19 N#CCCNC(=O)c1ccc(cc1)F 11a_100000720768_100000187176 [0,1,0,0,0,0|1,1,0]=3 1436 B14R1.19 N#CCCNC(=O)c1ccc(cc1)F 1626a_100000720768_100000187176 [0,1,0,0,0,0|1,1,0]=3 1437 B14R1.19 N#CCCNC(=O)c1ccc(cc1)F 240690a_100000720768_100000187176 [0,1,0,0,0,0|1,1,0]=3 1438 B14R1.19 N#CCCNC(=O)c1ccc(cc1)F 527a_100000720768_100000187176 [0,1,0,0,0,0|1,1,0]=3 1439 B14R1.19 N#CCCNC(=O)c1ccc(cc1)I 11a_100000720768_100000187904 [0,1,0,0,0,0|1,1,0]=3 1440 B14R1.19 N#CCCNC(=O)c1ccc(cc1)I 1626a_100000720768_100000187904 [0,1,0,0,0,0|1,1,0]=3 1441 B14R1.19 N#CCCNC(=O)c1ccc(cc1)I 240690a_100000720768_100000187904 [0,1,0,0,0,0|1,1,0]=3 1442 B14R1.19 N#CCCNC(=O)c1ccc(cc1)I 527a_100000720768_100000187904 [0,1,0,0,0,0|1,1,0]=3 1443 B14R1.19 N#CCCNC(=O)c1ccc(cc1)O 240690a_100000720768_100000212099 [0,1,0,0,0,0|2,0,0]=3 1444 B14R1.19 N#CCCNC(=O)c1ccc(cc1)O 527a_100000720768_100000212099 [0,1,0,0,0,0|2,0,0]=3 1445 B14R1.19 N#CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100011215382 [0,1,0,0,0,0|2,0,1]=4 1446 B14R1.19 N#CCSCC(=O)c1ccc(cc1)Cl 62a_100011215382_100000211071 [0,1,0,0,0,0|2,0,1]=4 1447 B14R1.19 NCCOCC(=O)c1ccc(cc1)Br 34a_100000210304_100000188085 [0,1,0,0,0,0|2,1,0]=4 1448 B14R1.19 NCCOCC(=O)c1ccc(cc1)I 34a_100000210304_100011216261 [0,1,0,0,0,0|2,1,0]=4 1449 B14R1.19 NCCOCC(=O)c1ccc(cc1)O 34a_100000210304_100009814261 [0,1,0,0,0,0|3,0,0]=4 1450 B14R1.19 N[C@H](COCCO)c1ccc(cc1)Cl 34a_100009818818_100000211926 [0,1,0,0,0,0|2,0,1]=4 1451 B14R1.19 O=C(CC#CCO)c1ccc(cc1)Br 1458a_100000185839_200000047223 [0,1,0,0,0,0|1,1,1]=4 1452 B14R1.19 O=C(CC#CCO)c1ccc(cc1)Cl 1458a_100000210187_200000047223 [0,1,0,0,0,0|1,0,1]=3 1453 B14R1.19 O=C(CC#CCO)c1ccc(cc1)F 1458a_100000187176_200000047223 [0,1,0,0,0,0|1,1,1]=4 1454 B14R1.19 O=C(CC#CCO)c1ccc(cc1)I 1458a_100000187904_200000047223 [0,1,0,0,0,0|1,1,1]=4 1455 B14R1.19 O=C(CC#CCO)c1ccc(cc1)O 1458a_100000212099_200000047223 [0,1,0,0,0,0|2,0,1]=4 1456 B14R1.19 O=C(CCCCF)c1ccc(cc1)Br 1458a_100000185839_100000729493 [0,1,0,0,0,0|2,1,0]=4 1457 B14R1.19 O=C(CCCCF)c1ccc(cc1)Cl 1458a_100000210187_100000729493 [0,1,0,0,0,0|2,0,0]=3 1458 B14R1.19 O=C(CCCCF)c1ccc(cc1)F 1458a_100000187176_100000729493 [0,1,0,0,0,0|2,1,0]=4 1459 B14R1.19 O=C(CCCCF)c1ccc(cc1)I 1458a_100000187904_100000729493 [0,1,0,0,0,0|2,1,0]=4 1460 B14R1.19 O=C(CCCCF)c1ccc(cc1)O 1458a_100000212099_100000729493 [0,1,0,0,0,0|3,0,0]=4 1461 B14R1.19 O=C(CCCCO)c1ccc(cc1)Br 1458a_100000185839_100000210776 [0,1,0,0,0,0|1,1,0]=3 1462 B14R1.19 O=C(CCCCO)c1ccc(cc1)Cl 1458a_100000210187_100000210776 [0,1,0,0,0,0|1,0,0]=2 1463 B14R1.19 O=C(CCCCO)c1ccc(cc1)F 1458a_100000187176_100000210776 [0,1,0,0,0,0|1,1,0]=3 1464 B14R1.19 O=C(CCCCO)c1ccc(cc1)I 1458a_100000187904_100000210776 [0,1,0,0,0,0|1,1,0]=3 1465 B14R1.19 O=C(CCCCO)c1ccc(cc1)O 1458a_100000212099_100000210776 [0,1,0,0,0,0|2,0,0]=3 1466 B14R1.19 O=C(CCSCF)c1ccc(cc1)Br 62a_100011215963_100015361967 [0,1,0,0,0,0|2,1,0]=4 1467 B14R1.19 O=C(CCSCF)c1ccc(cc1)Br 62a_100015361967_100011215963 [0,1,0,0,0,0|2,1,0]=4 1468 B14R1.19 O=C(CCSCF)c1ccc(cc1)Cl 62a_100011216492_100015361967 [0,1,0,0,0,0|2,0,0]=3 1469 B14R1.19 O=C(CCSCF)c1ccc(cc1)Cl 62a_100015361967_100011216492 [0,1,0,0,0,0|2,0,0]=3 1470 B14R1.19 O=C(CCSCF)c1ccc(cc1)F 62a_100000211231_100015361967 [0,1,0,0,0,0|2,1,0]=4 1471 B14R1.19 O=C(CCSCF)c1ccc(cc1)F 62a_100015361967_100000211231 [0,1,0,0,0,0|2,1,0]=4 1472 B14R1.19 O=C(CCSCF)c1ccc(cc1)O 62a_100015361967_100009879949 [0,1,0,0,0,0|3,0,0]=4 1473 B14R1.19 O=C(CNCCF)c1ccc(cc1)Br 34a_100000724931_100000188085 [0,1,0,0,0,0|1,1,0]=3 1474 B14R1.19 O=C(CNCCF)c1ccc(cc1)I 34a_100000724931_100011216261 [0,1,0,0,0,0|1,1,0]=3 1475 B14R1.19 O=C(CNCCF)c1ccc(cc1)O 34a_100000724931_100009814261 [0,1,0,0,0,0|2,0,0]=3 1476 B14R1.19 O=C(CNCCO)c1ccc(cc1)Br 34a_100016990907_100000188085 [0,1,0,0,0,0|0,1,0]=2 1477 B14R1.19 O=C(CNCCO)c1ccc(cc1)I 34a_100016990907_100011216261 [0,1,0,0,0,0|0,1,0]=2 1478 B14R1.19 O=C(CNCCO)c1ccc(cc1)O 34a_100016990907_100009814261 [0,1,0,0,0,0|1,0,0]=2 1479 B14R1.19 O=C(COCCBr)c1ccc(cc1)Br 34a_100000211926_100000188085 [0,1,0,0,0,0|2,1,0]=4 1480 B14R1.19 O=C(COCCBr)c1ccc(cc1)I 34a_100000211926_100011216261 [0,1,0,0,0,0|2,1,0]=4 1481 B14R1.19 O=C(COCCBr)c1ccc(cc1)O 34a_100000211926_100009814261 [0,1,0,0,0,0|3,0,0]=4 1482 B14R1.19 O=C(COCCF)c1ccc(cc1)F 34a_100000246311_100011217306 [0,1,0,0,0,0|2,1,0]=4 1483 B14R1.19 O=C(COCCO)c1ccc(cc1)F 34a_100000246311_100000211926 [0,1,0,0,0,0|1,1,0]=3 1484 B14R1.19 O=C(CSCCF)c1ccc(cc1)Br 62a_100000188085_100011217306 [0,1,0,0,0,0|2,1,0]=4 1485 B14R1.19 O=C(CSCCF)c1ccc(cc1)Cl 62a_100000211071_100011217306 [0,1,0,0,0,0|2,0,0]=3 1486 B14R1.19 O=C(CSCCF)c1ccc(cc1)Cl 62a_100011217306_100000211071 [0,1,0,0,0,0|2,0,0]=3 1487 B14R1.19 O=C(CSCCF)c1ccc(cc1)F 62a_100000211279_100011217306 [0,1,0,0,0,0|2,1,0]=4 1488 B14R1.19 O=C(CSCCF)c1ccc(cc1)F 62a_100011217306_100000211279 [0,1,0,0,0,0|2,1,0]=4 1489 B14R1.19 O=C(CSCCF)c1ccc(cc1)I 62a_100011216261_100011217306 [0,1,0,0,0,0|2,1,0]=4 1490 B14R1.19 O=C(CSCCF)c1ccc(cc1)I 62a_100011217306_100011216261 [0,1,0,0,0,0|2,1,0]=4 1491 B14R1.19 O=C(CSCCF)c1ccc(cc1)O 62a_100009814261_100011217306 [0,1,0,0,0,0|3,0,0]=4 1492 B14R1.19 O=C(CSCCF)c1ccc(cc1)O 62a_100011217306_100009814261 [0,1,0,0,0,0|3,0,0]=4 1493 B14R1.19 O=C(CSCCF)c1ccc(cn1)Cl 62a_100011217306_100016989621 [0,1,0,0,0,0|3,0,0]=4 1494 B14R1.19 O=C(CSCCF)c1ccc(cn1)Cl 62a_100016989621_100011217306 [0,1,0,0,0,0|3,0,0]=4 1495 B14R1.19 O=C(CSCCF)c1ccc(nc1)Cl 62a_100009864725_100011217306 [0,1,0,0,0,0|3,0,0]=4 1496 B14R1.19 O=C(CSCCF)c1ccc(nc1)Cl 62a_100011217306_100009864725 [0,1,0,0,0,0|3,0,0]=4 1497 B14R1.19 O=C(CSCCO)c1ccc(cc1)Br 62a_100000188085_100000211926 [0,1,0,0,0,0|1,1,0]=3 1498 B14R1.19 O=C(CSCCO)c1ccc(cc1)Cl 62a_100000211071_100000211926 [0,1,0,0,0,0|1,0,0]=2 1499 B14R1.19 O=C(CSCCO)c1ccc(cc1)Cl 62a_100000211926_100000211071 [0,1,0,0,0,0|1,0,0]=2 1500 B14R1.19 O=C(CSCCO)c1ccc(cc1)F 62a_100000211279_100000211926 [0,1,0,0,0,0|1,1,0]=3 1501 B14R1.19 O=C(CSCCO)c1ccc(cc1)F 62a_100000211926_100000211279 [0,1,0,0,0,0|1,1,0]=3 1502 B14R1.19 O=C(CSCCO)c1ccc(cc1)I 62a_100000211926_100011216261 [0,1,0,0,0,0|1,1,0]=3 1503 B14R1.19 O=C(CSCCO)c1ccc(cc1)I 62a_100011216261_100000211926 [0,1,0,0,0,0|1,1,0]=3 1504 B14R1.19 O=C(CSCCO)c1ccc(cc1)O 62a_100000211926_100009814261 [0,1,0,0,0,0|2,0,0]=3 1505 B14R1.19 O=C(CSCCO)c1ccc(cc1)O 62a_100009814261_100000211926 [0,1,0,0,0,0|2,0,0]=3 1506 B14R1.19 O=C(CSCCO)c1ccc(cn1)Cl 62a_100000211926_100016989621 [0,1,0,0,0,0|2,0,0]=3 1507 B14R1.19 O=C(CSCCO)c1ccc(cn1)Cl 62a_100016989621_100000211926 [0,1,0,0,0,0|2,0,0]=3 1508 B14R1.19 O=C(CSCCO)c1ccc(nc1)Cl 62a_100000211926_100009864725 [0,1,0,0,0,0|2,0,0]=3 1509 B14R1.19 O=C(CSCCO)c1ccc(nc1)Cl 62a_100009864725_100000211926 [0,1,0,0,0,0|2,0,0]=3 1510 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 11a_100015189416_100000185839 [0,1,0,0,0,0|1,1,0]=3 1511 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 1626a_100015189416_100000185839 [0,1,0,0,0,0|1,1,0]=3 1512 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 240690a_100015189416_100000185839 [0,1,0,0,0,0|1,1,0]=3 1513 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 527a_100015189416_100000185839 [0,1,0,0,0,0|1,1,0]=3 1514 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 11a_100015189416_100000210187 [0,1,0,0,0,0|1,0,0]=2 1515 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 1626a_100015189416_100000210187 [0,1,0,0,0,0|1,0,0]=2 1516 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 240690a_100015189416_100000210187 [0,1,0,0,0,0|1,0,0]=2 1517 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 527a_100015189416_100000210187 [0,1,0,0,0,0|1,0,0]=2 1518 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 11a_100015189416_100000187176 [0,1,0,0,0,0|1,1,0]=3 1519 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 1626a_100015189416_100000187176 [0,1,0,0,0,0|1,1,0]=3 1520 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 240690a_100015189416_100000187176 [0,1,0,0,0,0|1,1,0]=3 1521 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 527a_100015189416_100000187176 [0,1,0,0,0,0|1,1,0]=3 1522 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 11a_100015189416_100000187904 [0,1,0,0,0,0|1,1,0]=3 1523 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 1626a_100015189416_100000187904 [0,1,0,0,0,0|1,1,0]=3 1524 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 240690a_100015189416_100000187904 [0,1,0,0,0,0|1,1,0]=3 1525 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 527a_100015189416_100000187904 [0,1,0,0,0,0|1,1,0]=3 1526 B14R1.19 O=C(NCCCF)c1ccc(cc1)O 240690a_100015189416_100000212099 [0,1,0,0,0,0|2,0,0]=3 1527 B14R1.19 O=C(NCCCF)c1ccc(cc1)O 527a_100015189416_100000212099 [0,1,0,0,0,0|2,0,0]=3 1528 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br 240690a_100000182051_100000185839 [0,1,0,0,0,0|0,1,0]=2 1529 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br 527a_100000182051_100000185839 [0,1,0,0,0,0|0,1,0]=2 1530 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl 240690a_100000182051_100000210187 [0,1,0,0,0,0|0,0,0]=1 1531 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl 527a_100000182051_100000210187 [0,1,0,0,0,0|0,0,0]=1 1532 B14R1.19 O=C(NCCCO)c1ccc(cc1)F 240690a_100000182051_100000187176 [0,1,0,0,0,0|0,1,0]=2 1533 B14R1.19 O=C(NCCCO)c1ccc(cc1)F 527a_100000182051_100000187176 [0,1,0,0,0,0|0,1,0]=2 1534 B14R1.19 O=C(NCCCO)c1ccc(cc1)I 240690a_100000182051_100000187904 [0,1,0,0,0,0|0,1,0]=2 1535 B14R1.19 O=C(NCCCO)c1ccc(cc1)I 527a_100000182051_100000187904 [0,1,0,0,0,0|0,1,0]=2 1536 B14R1.19 O=C(NCCCO)c1ccc(cc1)O 240690a_100000182051_100000212099 [0,1,0,0,0,0|1,0,0]=2 1537 B14R1.19 O=C(NCCCO)c1ccc(cc1)O 527a_100000182051_100000212099 [0,1,0,0,0,0|1,0,0]=2 1538 B14R1.19 O=C(NNCCO)c1ccc(cc1)Br 22a_100000210001_100000185839 [0,1,0,0,0,0|0,1,0]=2 1539 B14R1.19 O=C(NNCCO)c1ccc(cc1)Cl 22a_100000210001_100000210187 [0,1,0,0,0,0|0,0,0]=1 1540 B14R1.19 O=C(NNCCO)c1ccc(cc1)F 22a_100000210001_100000187176 [0,1,0,0,0,0|0,1,0]=2 1541 B14R1.19 O=C(NNCCO)c1ccc(cc1)I 22a_100000210001_100000187904 [0,1,0,0,0,0|0,1,0]=2 1542 B14R1.19 O=C(NNCCO)c1ccc(cc1)O 22a_100000210001_100000212099 [0,1,0,0,0,0|1,0,0]=2 1543 B14R1.19 O=CCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200015260668 [0,1,0,0,0,0|1,0,2]=4 1544 B14R1.19 O=CCSCC(=O)c1ccc(cc1)Cl 62a_200015260668_100000211071 [0,1,0,0,0,0|1,0,2]=4 1545 B14R1.19 OC(CNCCF)c1ccc(cc1)Cl 2230a_100000736658_100011217306 [0,1,0,0,0,0|1,0,2]=4 1546 B14R1.19 OC(CNCCF)c1ccc(cc1)Cl 34a_100000724931_200011996143 [0,1,0,0,0,0|1,0,2]=4 1547 B14R1.19 OC(CNCCF)c1ccc(cc1)Cl 34a_100000736658_100011217306 [0,1,0,0,0,0|1,0,2]=4 1548 B14R1.19 OCCNCC(O)c1ccc(cc1)Br 2230a_100020626992_100000211926 [0,1,0,0,0,0|0,1,2]=4 1549 B14R1.19 OCCNCC(O)c1ccc(cc1)Br 34a_100020626992_100000211926 [0,1,0,0,0,0|0,1,2]=4 1550 B14R1.19 OCCNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100000211926 [0,1,0,0,0,0|0,0,2]=3 1551 B14R1.19 OCCNCC(O)c1ccc(cc1)Cl 2230a_100016997473_200011996143 [0,1,0,0,0,0|0,0,2]=3 1552 B14R1.19 OCCNCC(O)c1ccc(cc1)Cl 34a_100000736658_100000211926 [0,1,0,0,0,0|0,0,2]=3 1553 B14R1.19 OCCNCC(O)c1ccc(cc1)Cl 34a_100016990907_200011996143 [0,1,0,0,0,0|0,0,2]=3 1554 B14R1.19 OCCNCC(O)c1ccc(cc1)O 34a_100000067596_100000211926 [0,1,0,0,0,0|1,0,2]=4 1555 B14R1.19 OCCNC[C@H](O)c1ccc(cc1)F 2230a_100016997473_100000720402 [0,1,0,0,0,0|0,1,2]=4 1556 B14R1.19 OCCNC[C@H](O)c1ccc(cc1)F 34a_100016990907_100000720402 [0,1,0,0,0,0|0,1,2]=4 1557 B14R1.19 OCCSCC(O)c1ccc(cc1)Cl 62a_100000211926_200011996143 [0,1,0,0,0,0|1,0,2]=4 1558 B14R1.19 OCCSCC(O)c1ccc(cc1)Cl 62a_200011996143_100000211926 [0,1,0,0,0,0|1,0,2]=4 1559 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_200025704644 [0,1,0,0,0,0|1,0,0]=2 1560 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_200025704644 [0,1,0,0,0,0|1,0,0]=2 1561 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)F 2230a_100000753910_200025704644 [0,1,0,0,0,0|1,1,0]=3 1562 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)F 34a_100000753910_200025704644 [0,1,0,0,0,0|1,1,0]=3 1563 B14R1.19 [13CH3]OCCNC(=O)c1ccc(cc1)Br 34a_200000158904_200025704644 [0,1,0,0,0,0|0,1,0]=2 1564 B14R1.19 [13CH3]OCCNC(=O)c1ccc(cc1)N 34a_100000740983_200025704644 [0,1,0,0,0,0|1,0,0]=2 1565 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Br 62a_100000211046_200025704644 [0,1,0,0,0,0|1,2,0]=4 1566 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Br 62a_200025704644_100000211046 [0,1,0,0,0,0|1,2,0]=4 1567 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_200025704644 [0,1,0,0,0,0|1,1,0]=3 1568 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Cl 62a_200025704644_200011217871 [0,1,0,0,0,0|1,1,0]=3 1569 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)F 62a_100000211961_200025704644 [0,1,0,0,0,0|1,2,0]=4 1570 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211961 [0,1,0,0,0,0|1,2,0]=4 1571 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)O 62a_200025704644_100000039620 [0,1,0,0,0,0|2,1,0]=4 1572 B14R1.21 C#CC(OCCO)c1ccc(cc1)Cl 34a_100011470666_100000211926 [0,1,0,0,0,0|2,0,1]=4 1573 B14R1.21 C#CC(OCCO)c1ccc(cc1)Cl 7a_100011470666_100000211926 [0,1,0,0,0,0|2,0,1]=4 1574 B14R1.21 CCC(NCCF)c1ccc(cc1)Cl 269862a_100000724931_100000210983 [0,1,0,0,0,0|2,0,1]=4 1575 B14R1.21 CCC(NCCO)c1ccc(cc1)Br 269862a_100000210304_100000211647 [0,1,0,0,0,0|1,1,1]=4 1576 B14R1.21 CCC(NCCO)c1ccc(cc1)C 2230a_100000749201_100000211926 [0,1,0,0,0,0|2,0,1]=4 1577 B14R1.21 CCC(NCCO)c1ccc(cc1)C 269862a_100000210304_100000185863 [0,1,0,0,0,0|2,0,1]=4 1578 B14R1.21 CCC(NCCO)c1ccc(cc1)C 34a_100000749201_100000211926 [0,1,0,0,0,0|2,0,1]=4 1579 B14R1.21 CCC(NCCO)c1ccc(cc1)Cl 269862a_100000210304_100000210983 [0,1,0,0,0,0|1,0,1]=3 1580 B14R1.21 CCC(NCCO)c1ccc(cc1)F 2230a_100011191751_100000211926 [0,1,0,0,0,0|1,1,1]=4 1581 B14R1.21 CCC(NCCO)c1ccc(cc1)F 269862a_100000210304_100000211089 [0,1,0,0,0,0|1,1,1]=4 1582 B14R1.21 CCC(NCCO)c1ccc(cc1)F 34a_100011191751_100000211926 [0,1,0,0,0,0|1,1,1]=4 1583 B14R1.21 CCC(NCCO)c1ccc(cc1)I 269862a_100000210304_100000763097 [0,1,0,0,0,0|1,1,1]=4 1584 B14R1.21 CCC(NCCO)c1ccc(cc1)O 34a_100015187210_100000211926 [0,1,0,0,0,0|2,0,1]=4 1585 B14R1.21 CCC(OCCO)c1ccc(cc1)Cl 34a_100000246471_100000211926 [0,1,0,0,0,0|2,0,1]=4 1586 B14R1.21 CCC(OCCO)c1ccc(cc1)Cl 7a_100000246471_100000211926 [0,1,0,0,0,0|2,0,1]=4 1587 B14R1.21 CCCNC(C#N)c1ccc(cc1)Cl 2230a_100000747793_100000210303 [0,1,0,0,0,0|2,0,1]=4 1588 B14R1.21 CCCNC(CC)c1ccc(cc1)Cl 269862a_100020643023_100000210983 [0,1,0,0,0,0|2,0,1]=4 1589 B14R1.21 CCCN[C@@H](CC)c1ccc(cc1)Cl 2230a_100015186824_100000210303 [0,1,0,0,0,0|2,0,1]=4 1590 B14R1.21 CCCN[C@@H](CC)c1ccc(cc1)Cl 34a_100015186824_100000210303 [0,1,0,0,0,0|2,0,1]=4 1591 B14R1.21 CCCN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100000210303 [0,1,0,0,0,0|1,0,2]=4 1592 B14R1.21 CCCN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000210303 [0,1,0,0,0,0|1,0,2]=4 1593 B14R1.21 CCN(CCCO)c1ccc(cc1)Cl 2230a_100000220165_100000230001 [0,1,0,0,0,0|3,0,0]=4 1594 B14R1.21 CCN(CCCO)c1ccc(cc1)Cl 269982a_100000220165_100011215043 [0,1,0,0,0,0|3,0,0]=4 1595 B14R1.21 CCN(CCCO)c1ccc(cc1)Cl 34a_100000220165_100000230001 [0,1,0,0,0,0|3,0,0]=4 1596 B14R1.21 CC[C@H](NCCF)c1ccc(cc1)Cl 2230a_100015186824_100011217306 [0,1,0,0,0,0|2,0,1]=4 1597 B14R1.21 CC[C@H](NCCF)c1ccc(cc1)Cl 34a_100015186824_100011217306 [0,1,0,0,0,0|2,0,1]=4 1598 B14R1.21 CC[C@H](NCCO)c1ccc(cc1)Br 2230a_100025736560_100000211926 [0,1,0,0,0,0|1,1,1]=4 1599 B14R1.21 CC[C@H](NCCO)c1ccc(cc1)Br 34a_100025736560_100000211926 [0,1,0,0,0,0|1,1,1]=4 1600 B14R1.21 CC[C@H](NCCO)c1ccc(cc1)Cl 2230a_100015186824_100000211926 [0,1,0,0,0,0|1,0,1]=3 1601 B14R1.21 CC[C@H](NCCO)c1ccc(cc1)Cl 34a_100015186824_100000211926 [0,1,0,0,0,0|1,0,1]=3 1602 B14R1.21 Cc1ccc(cc1)[C@H](CO)NCCO 2230a_100009818840_100000211926 [0,1,0,0,0,0|1,0,2]=4 1603 B14R1.21 Cc1ccc(cc1)[C@H](CO)NCCO 34a_100009818840_100000211926 [0,1,0,0,0,0|1,0,2]=4 1604 B14R1.21 N#CC(NCCF)c1ccc(cc1)Cl 2230a_100000747793_100011217306 [0,1,0,0,0,0|2,0,1]=4 1605 B14R1.21 N#CC(NCCO)c1ccc(cc1)Cl 2230a_100000747793_100000211926 [0,1,0,0,0,0|1,0,1]=3 1606 B14R1.21 N#CC(NCCO)c1ccc(cc1)F 2230a_100020612109_100000211926 [0,1,0,0,0,0|1,1,1]=4 1607 B14R1.21 N#CC(NCCO)c1ccc(cc1)F 34a_100020612109_100000211926 [0,1,0,0,0,0|1,1,1]=4 1608 B14R1.21 NCC(OCCO)c1ccc(cc1)Cl 34a_100000736658_100000211926 [0,1,0,0,0,0|2,0,1]=4 1609 B14R1.21 OCCNC(CO)c1ccc(cc1)Br 2230a_100000734186_100000211926 [0,1,0,0,0,0|0,1,2]=4 1610 B14R1.21 OCCNC(CO)c1ccc(cc1)Br 34a_100000734186_100000211926 [0,1,0,0,0,0|0,1,2]=4 1611 B14R1.21 OCCNC(CO)c1ccc(cc1)F 2230a_100000705410_100000211926 [0,1,0,0,0,0|0,1,2]=4 1612 B14R1.21 OCCNC(CO)c1ccc(cc1)F 34a_100000705410_100000211926 [0,1,0,0,0,0|0,1,2]=4 1613 B14R1.21 OCCN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100000211926 [0,1,0,0,0,0|0,0,2]=3 1614 B14R1.21 OCCN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000211926 [0,1,0,0,0,0|0,0,2]=3 1615 B14R1.21 OCCOC(CCl)c1ccc(cc1)Cl 34a_200011996143_100000211926 [0,1,0,0,0,0|2,0,1]=4 1616 B14R1.21 OCCOC(CCl)c1ccc(cc1)Cl 7a_200011996143_100000211926 [0,1,0,0,0,0|2,0,1]=4 1617 B14R1.21 OC[C@@H](NCCF)c1ccc(cc1)Cl 2230a_100009818818_100011217306 [0,1,0,0,0,0|1,0,2]=4 1618 B14R1.21 OC[C@@H](NCCF)c1ccc(cc1)Cl 34a_100009818818_100011217306 [0,1,0,0,0,0|1,0,2]=4 1619 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Br 11a_100000225692_100000185839 [0,1,0,0,0,0|1,1,1]=4 1620 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Br 1626a_100000225692_100000185839 [0,1,0,0,0,0|1,1,1]=4 1621 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Br 527a_100000225692_100000185839 [0,1,0,0,0,0|1,1,1]=4 1622 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)C 11a_100000225692_100000188618 [0,1,0,0,0,0|2,0,1]=4 1623 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)C 1626a_100000225692_100000188618 [0,1,0,0,0,0|2,0,1]=4 1624 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)C 527a_100000225692_100000188618 [0,1,0,0,0,0|2,0,1]=4 1625 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Cl 11a_100000225692_100000210187 [0,1,0,0,0,0|1,0,1]=3 1626 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Cl 1626a_100000225692_100000210187 [0,1,0,0,0,0|1,0,1]=3 1627 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Cl 527a_100000225692_100000210187 [0,1,0,0,0,0|1,0,1]=3 1628 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)F 11a_100000225692_100000187176 [0,1,0,0,0,0|1,1,1]=4 1629 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)F 1626a_100000225692_100000187176 [0,1,0,0,0,0|1,1,1]=4 1630 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)F 527a_100000225692_100000187176 [0,1,0,0,0,0|1,1,1]=4 1631 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)I 11a_100000225692_100000187904 [0,1,0,0,0,0|1,1,1]=4 1632 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)I 1626a_100000225692_100000187904 [0,1,0,0,0,0|1,1,1]=4 1633 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)I 527a_100000225692_100000187904 [0,1,0,0,0,0|1,1,1]=4 1634 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)O 527a_100000225692_100000212099 [0,1,0,0,0,0|2,0,1]=4 1635 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Br 11a_100000225617_100000185839 [0,1,0,0,0,0|1,1,1]=4 1636 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Br 1626a_100000225617_100000185839 [0,1,0,0,0,0|1,1,1]=4 1637 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Br 240690a_100000225617_100000185839 [0,1,0,0,0,0|1,1,1]=4 1638 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Br 527a_100000225617_100000185839 [0,1,0,0,0,0|1,1,1]=4 1639 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)C 11a_100000225617_100000188618 [0,1,0,0,0,0|2,0,1]=4 1640 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)C 1626a_100000225617_100000188618 [0,1,0,0,0,0|2,0,1]=4 1641 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)C 240690a_100000225617_100000188618 [0,1,0,0,0,0|2,0,1]=4 1642 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)C 527a_100000225617_100000188618 [0,1,0,0,0,0|2,0,1]=4 1643 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Cl 11a_100000225617_100000210187 [0,1,0,0,0,0|1,0,1]=3 1644 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Cl 1626a_100000225617_100000210187 [0,1,0,0,0,0|1,0,1]=3 1645 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Cl 240690a_100000225617_100000210187 [0,1,0,0,0,0|1,0,1]=3 1646 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)Cl 527a_100000225617_100000210187 [0,1,0,0,0,0|1,0,1]=3 1647 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)F 11a_100000225617_100000187176 [0,1,0,0,0,0|1,1,1]=4 1648 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)F 1626a_100000225617_100000187176 [0,1,0,0,0,0|1,1,1]=4 1649 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)F 240690a_100000225617_100000187176 [0,1,0,0,0,0|1,1,1]=4 1650 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)F 527a_100000225617_100000187176 [0,1,0,0,0,0|1,1,1]=4 1651 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)I 11a_100000225617_100000187904 [0,1,0,0,0,0|1,1,1]=4 1652 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)I 1626a_100000225617_100000187904 [0,1,0,0,0,0|1,1,1]=4 1653 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)I 240690a_100000225617_100000187904 [0,1,0,0,0,0|1,1,1]=4 1654 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)I 527a_100000225617_100000187904 [0,1,0,0,0,0|1,1,1]=4 1655 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)O 240690a_100000225617_100000212099 [0,1,0,0,0,0|2,0,1]=4 1656 B14R1.35 C=CCN(C)C(=O)c1ccc(cc1)O 527a_100000225617_100000212099 [0,1,0,0,0,0|2,0,1]=4 1657 B14R1.35 CC(C(=O)CCO)c1ccc(cc1)Cl 1458a_100011216001_100000211926 [0,1,0,0,0,0|2,0,1]=4 1658 B14R1.35 CC(C(=O)CCO)c1ccc(cc1)Cl 1458a_100011216618_100000684792 [0,1,0,0,0,0|2,0,1]=4 1659 B14R1.35 CC(CC#N)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100009813641 [0,1,0,0,0,0|2,0,1]=4 1660 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)Br 1458a_100000185839_100009893172 [0,1,0,0,0,0|1,1,0]=3 1661 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100009893172 [0,1,0,0,0,0|1,0,0]=2 1662 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)F 1458a_100000187176_100009893172 [0,1,0,0,0,0|1,1,0]=3 1663 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)I 1458a_100000187904_100009893172 [0,1,0,0,0,0|1,1,0]=3 1664 B14R1.35 CC(CCO)C(=O)c1ccc(cc1)O 1458a_100000212099_100009893172 [0,1,0,0,0,0|2,0,0]=3 1665 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Cl 2230a_100020629279_100009893172 [0,1,0,0,0,0|3,0,0]=4 1666 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Cl 269982a_100020629279_100009893172 [0,1,0,0,0,0|3,0,0]=4 1667 B14R1.35 CC(CCO)N(C)c1ccc(cc1)Cl 34a_100020629279_100009893172 [0,1,0,0,0,0|3,0,0]=4 1668 B14R1.35 CC(SCF)C(=O)c1ccc(cc1)Cl 62a_100000183210_100015361967 [0,1,0,0,0,0|3,0,0]=4 1669 B14R1.35 CC(SCF)C(=O)c1ccc(cc1)Cl 62a_100015361967_100000183210 [0,1,0,0,0,0|3,0,0]=4 1670 B14R1.35 CC(c1ccc(cc1)Br)N(C)CCO 2230a_100000210263_100000755118 [0,1,0,0,0,0|1,1,1]=4 1671 B14R1.35 CC(c1ccc(cc1)Br)N(C)CCO 2230a_100000231103_100000211926 [0,1,0,0,0,0|1,1,1]=4 1672 B14R1.35 CC(c1ccc(cc1)Br)N(C)CCO 269982a_100000210263_100000755118 [0,1,0,0,0,0|1,1,1]=4 1673 B14R1.35 CC(c1ccc(cc1)Br)N(C)CCO 269982a_100000231103_100000211926 [0,1,0,0,0,0|1,1,1]=4 1674 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CCF 2230a_100000231102_100011217306 [0,1,0,0,0,0|2,0,1]=4 1675 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CCF 269982a_100000231102_100011217306 [0,1,0,0,0,0|2,0,1]=4 1676 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CCO 2230a_100000210263_100000684792 [0,1,0,0,0,0|1,0,1]=3 1677 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CCO 2230a_100000231102_100000211926 [0,1,0,0,0,0|1,0,1]=3 1678 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CCO 269982a_100000210263_100000684792 [0,1,0,0,0,0|1,0,1]=3 1679 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CCO 269982a_100000231102_100000211926 [0,1,0,0,0,0|1,0,1]=3 1680 B14R1.35 CC(c1ccc(cc1)F)N(C)CCO 2230a_100000210263_100000743420 [0,1,0,0,0,0|1,1,1]=4 1681 B14R1.35 CC(c1ccc(cc1)F)N(C)CCO 2230a_100000222788_100000211926 [0,1,0,0,0,0|1,1,1]=4 1682 B14R1.35 CC(c1ccc(cc1)F)N(C)CCO 269982a_100000210263_100000743420 [0,1,0,0,0,0|1,1,1]=4 1683 B14R1.35 CC(c1ccc(cc1)F)N(C)CCO 269982a_100000222788_100000211926 [0,1,0,0,0,0|1,1,1]=4 1684 B14R1.35 CC(c1ccc(cc1)F)N(C)CCO 34a_100000222788_100000211926 [0,1,0,0,0,0|1,1,1]=4 1685 B14R1.35 CC(c1ccc(cn1)Cl)N(C)CCO 270004a_100000210263_100000692432 [0,1,0,0,0,0|2,0,1]=4 1686 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000766640 [0,1,0,0,0,0|2,1,0]=4 1687 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)C 1458a_100000188618_100000766640 [0,1,0,0,0,0|3,0,0]=4 1688 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000766640 [0,1,0,0,0,0|2,0,0]=3 1689 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000766640 [0,1,0,0,0,0|2,1,0]=4 1690 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000766640 [0,1,0,0,0,0|2,1,0]=4 1691 B14R1.35 CCCC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000766640 [0,1,0,0,0,0|3,0,0]=4 1692 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Br 11a_100000747261_100000185839 [0,1,0,0,0,0|1,1,0]=3 1693 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Br 1626a_100000747261_100000185839 [0,1,0,0,0,0|1,1,0]=3 1694 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Br 240690a_100000747261_100000185839 [0,1,0,0,0,0|1,1,0]=3 1695 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Br 527a_100000747261_100000185839 [0,1,0,0,0,0|1,1,0]=3 1696 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)C 11a_100000747261_100000188618 [0,1,0,0,0,0|2,0,0]=3 1697 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)C 1626a_100000747261_100000188618 [0,1,0,0,0,0|2,0,0]=3 1698 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)C 240690a_100000747261_100000188618 [0,1,0,0,0,0|2,0,0]=3 1699 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)C 527a_100000747261_100000188618 [0,1,0,0,0,0|2,0,0]=3 1700 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Cl 11a_100000747261_100000210187 [0,1,0,0,0,0|1,0,0]=2 1701 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Cl 1626a_100000747261_100000210187 [0,1,0,0,0,0|1,0,0]=2 1702 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Cl 240690a_100000747261_100000210187 [0,1,0,0,0,0|1,0,0]=2 1703 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)Cl 527a_100000747261_100000210187 [0,1,0,0,0,0|1,0,0]=2 1704 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)F 11a_100000747261_100000187176 [0,1,0,0,0,0|1,1,0]=3 1705 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)F 1626a_100000747261_100000187176 [0,1,0,0,0,0|1,1,0]=3 1706 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)F 240690a_100000747261_100000187176 [0,1,0,0,0,0|1,1,0]=3 1707 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)F 527a_100000747261_100000187176 [0,1,0,0,0,0|1,1,0]=3 1708 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)I 11a_100000747261_100000187904 [0,1,0,0,0,0|1,1,0]=3 1709 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)I 1626a_100000747261_100000187904 [0,1,0,0,0,0|1,1,0]=3 1710 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)I 240690a_100000747261_100000187904 [0,1,0,0,0,0|1,1,0]=3 1711 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)I 527a_100000747261_100000187904 [0,1,0,0,0,0|1,1,0]=3 1712 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)O 240690a_100000747261_100000212099 [0,1,0,0,0,0|2,0,0]=3 1713 B14R1.35 CCCN(C)C(=O)c1ccc(cc1)O 527a_100000747261_100000212099 [0,1,0,0,0,0|2,0,0]=3 1714 B14R1.35 CCCN(C)C(C)c1ccc(cc1)Cl 2230a_100000231102_100000210303 [0,1,0,0,0,0|2,0,1]=4 1715 B14R1.35 CCCN(C)C(C)c1ccc(cc1)Cl 2230a_100000747261_100000684792 [0,1,0,0,0,0|2,0,1]=4 1716 B14R1.35 CCCN(C)C(C)c1ccc(cc1)Cl 269982a_100000231102_100000210303 [0,1,0,0,0,0|2,0,1]=4 1717 B14R1.35 CCCN(C)C(C)c1ccc(cc1)Cl 269982a_100000747261_100000684792 [0,1,0,0,0,0|2,0,1]=4 1718 B14R1.35 CCNC(C)C(=O)c1ccc(cc1)Cl 2230a_100015525214_100000183210 [0,1,0,0,0,0|3,0,0]=4 1719 B14R1.35 CCSC(C)C(=O)c1ccc(cc1)Cl 62a_100000183210_100000210202 [0,1,0,0,0,0|3,0,0]=4 1720 B14R1.35 CCSC(C)C(=O)c1ccc(cc1)Cl 62a_100000210202_100000183210 [0,1,0,0,0,0|3,0,0]=4 1721 B14R1.35 CN(C(=O)CCO)c1ccc(cc1)Cl 22a_100020629279_100011216618 [0,1,0,0,0,0|3,0,0]=4 1722 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)Br 11a_100000748184_100000185839 [0,1,0,0,0,0|1,1,1]=4 1723 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)Br 1626a_100000748184_100000185839 [0,1,0,0,0,0|1,1,1]=4 1724 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)Cl 11a_100000748184_100000210187 [0,1,0,0,0,0|1,0,1]=3 1725 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)Cl 1626a_100000748184_100000210187 [0,1,0,0,0,0|1,0,1]=3 1726 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)F 11a_100000748184_100000187176 [0,1,0,0,0,0|1,1,1]=4 1727 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)F 1626a_100000748184_100000187176 [0,1,0,0,0,0|1,1,1]=4 1728 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)I 11a_100000748184_100000187904 [0,1,0,0,0,0|1,1,1]=4 1729 B14R1.35 CN(CC#N)C(=O)c1ccc(cc1)I 1626a_100000748184_100000187904 [0,1,0,0,0,0|1,1,1]=4 1730 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)Br 240690a_100000210263_100000185839 [0,1,0,0,0,0|0,1,0]=2 1731 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)Br 527a_100000210263_100000185839 [0,1,0,0,0,0|0,1,0]=2 1732 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)Cl 240690a_100000210263_100000210187 [0,1,0,0,0,0|0,0,0]=1 1733 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)Cl 527a_100000210263_100000210187 [0,1,0,0,0,0|0,0,0]=1 1734 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)F 240690a_100000210263_100000187176 [0,1,0,0,0,0|0,1,0]=2 1735 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)F 527a_100000210263_100000187176 [0,1,0,0,0,0|0,1,0]=2 1736 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)I 240690a_100000210263_100000187904 [0,1,0,0,0,0|0,1,0]=2 1737 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)I 527a_100000210263_100000187904 [0,1,0,0,0,0|0,1,0]=2 1738 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)O 240690a_100000210263_100000212099 [0,1,0,0,0,0|1,0,0]=2 1739 B14R1.35 CN(CCO)C(=O)c1ccc(cc1)O 527a_100000210263_100000212099 [0,1,0,0,0,0|1,0,0]=2 1740 B14R1.35 COCC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000765312 [0,1,0,0,0,0|3,0,0]=4 1741 B14R1.35 Cc1ccc(cc1)C(=O)C(C)CCO 1458a_100000188618_100009893172 [0,1,0,0,0,0|2,0,0]=3 1742 B14R1.35 Cc1ccc(cc1)C(=O)N(C)CC#N 11a_100000748184_100000188618 [0,1,0,0,0,0|2,0,1]=4 1743 B14R1.35 Cc1ccc(cc1)C(=O)N(C)CC#N 1626a_100000748184_100000188618 [0,1,0,0,0,0|2,0,1]=4 1744 B14R1.35 Cc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100000188618 [0,1,0,0,0,0|1,0,0]=2 1745 B14R1.35 Cc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100000188618 [0,1,0,0,0,0|1,0,0]=2 1746 B14R1.35 Cc1ccc(cc1)C(C)N(C)CCO 2230a_100000210263_100011261388 [0,1,0,0,0,0|2,0,1]=4 1747 B14R1.35 Cc1ccc(cc1)C(C)N(C)CCO 269982a_100000210263_100011261388 [0,1,0,0,0,0|2,0,1]=4 1748 B14R1.35 O=C(CCO)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000211926 [0,1,0,0,0,0|2,0,1]=4 1749 B14R1.35 O=C(CCO)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000211926 [0,1,0,0,0,0|1,0,2]=4 1750 B14R1.125 C#CCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000212058_100000209962 [0,1,0,0,0,0|2,0,1]=4 1751 B14R1.125 C#CCNS(=O)(=O)c1ccc(cc1)Cl 40a_100000212058_100000077732 [0,1,0,0,0,0|2,0,1]=4 1752 B14R1.125 C=CCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100020586998_100000209962 [0,1,0,0,0,0|2,0,1]=4 1753 B14R1.125 C=CCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100020586998_100000209962 [0,1,0,0,0,0|2,0,1]=4 1754 B14R1.125 C=CCNS(=O)(=O)c1ccc(cc1)Cl 40a_100020586998_100000077732 [0,1,0,0,0,0|2,0,1]=4 1755 B14R1.125 CC(C)(NCCF)c1ccc(cc1)Cl 2230a_100000750703_100011217306 [0,1,0,0,0,0|2,0,1]=4 1756 B14R1.125 CC(C)(NCCO)c1ccc(cc1)Br 2230a_100000739617_100000211926 [0,1,0,0,0,0|1,1,1]=4 1757 B14R1.125 CC(C)(NCCO)c1ccc(cc1)Cl 2230a_100000750703_100000211926 [0,1,0,0,0,0|1,0,1]=3 1758 B14R1.125 CC(C)(NCCO)c1ccc(cc1)F 2230a_100015193028_100000211926 [0,1,0,0,0,0|1,1,1]=4 1759 B14R1.125 CC(C)(NCCO)c1ccc(cc1)F 34a_100015193028_100000211926 [0,1,0,0,0,0|1,1,1]=4 1760 B14R1.125 CC(C)(OCCO)c1ccc(cc1)Cl 34a_100000750429_100000211926 [0,1,0,0,0,0|2,0,1]=4 1761 B14R1.125 CC(C)(OCCO)c1ccc(cc1)Cl 7a_100000750429_100000211926 [0,1,0,0,0,0|2,0,1]=4 1762 B14R1.125 CCCNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_100000210303 [0,1,0,0,0,0|2,0,1]=4 1763 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)Br 270084a_100020643023_100000182491 [0,1,0,0,0,0|2,1,0]=4 1764 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)Br 274078a_100020643023_100000182491 [0,1,0,0,0,0|2,1,0]=4 1765 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)Br 40a_100020643023_100010306709 [0,1,0,0,0,0|2,1,0]=4 1766 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)C 270084a_100020643023_100000211267 [0,1,0,0,0,0|3,0,0]=4 1767 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)C 274078a_100020643023_100000211267 [0,1,0,0,0,0|3,0,0]=4 1768 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)C 40a_100020643023_100000039673 [0,1,0,0,0,0|3,0,0]=4 1769 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100020643023_100000209962 [0,1,0,0,0,0|2,0,0]=3 1770 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100020643023_100000209962 [0,1,0,0,0,0|2,0,0]=3 1771 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100020643023_100000077732 [0,1,0,0,0,0|2,0,0]=3 1772 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)F 270084a_100020643023_100000184267 [0,1,0,0,0,0|2,1,0]=4 1773 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)F 274078a_100020643023_100000184267 [0,1,0,0,0,0|2,1,0]=4 1774 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)F 40a_100020643023_100000081159 [0,1,0,0,0,0|2,1,0]=4 1775 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)I 270084a_100020643023_100011205396 [0,1,0,0,0,0|2,1,0]=4 1776 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)I 274078a_100020643023_100011205396 [0,1,0,0,0,0|2,1,0]=4 1777 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)N 40a_100020643023_100000054796 [0,1,0,0,0,0|3,0,0]=4 1778 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)O 270084a_100020643023_100020667864 [0,1,0,0,0,0|3,0,0]=4 1779 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000165445 [0,1,0,0,0,0|3,0,0]=4 1780 B14R1.125 CCCNS(=O)(=O)c1ccc(cc1)O 274078a_100020643023_100020667864 [0,1,0,0,0,0|3,0,0]=4 1781 B14R1.125 CCCNS(=O)(=O)c1ccc(nc1)Cl 270084a_100020643023_100000184283 [0,1,0,0,0,0|3,0,0]=4 1782 B14R1.125 CCCNS(=O)(=O)c1ccc(nc1)Cl 274078a_100020643023_100000184283 [0,1,0,0,0,0|3,0,0]=4 1783 B14R1.125 CCNNS(=O)(=O)c1ccc(cc1)Cl 40a_100000756455_100000077732 [0,1,0,0,0,0|3,0,0]=4 1784 B14R1.125 Cc1ccc(cc1)C(C)(C)NCCO 2230a_200011345931_100000211926 [0,1,0,0,0,0|2,0,1]=4 1785 B14R1.125 Cc1ccc(cc1)C(C)(C)NCCO 34a_200011345931_100000211926 [0,1,0,0,0,0|2,0,1]=4 1786 B14R1.125 Cc1ccc(cc1)S(=O)(=O)NCCF 270084a_100000724931_100000211267 [0,1,0,0,0,0|3,0,0]=4 1787 B14R1.125 Cc1ccc(cc1)S(=O)(=O)NCCF 274078a_100000724931_100000211267 [0,1,0,0,0,0|3,0,0]=4 1788 B14R1.125 Cc1ccc(cc1)S(=O)(=O)NCCF 40a_100000724931_100000039673 [0,1,0,0,0,0|3,0,0]=4 1789 B14R1.125 Cc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000211267 [0,1,0,0,0,0|2,0,0]=3 1790 B14R1.125 Cc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000211267 [0,1,0,0,0,0|2,0,0]=3 1791 B14R1.125 Cc1ccc(cc1)S(=O)(=O)NCCO 40a_100000210304_100000039673 [0,1,0,0,0,0|2,0,0]=3 1792 B14R1.125 Cc1ccc(cn1)S(=O)(=O)NCCO 270084a_100000210304_100000719016 [0,1,0,0,0,0|3,0,0]=4 1793 B14R1.125 Cc1ccc(cn1)S(=O)(=O)NCCO 274078a_100000210304_100000719016 [0,1,0,0,0,0|3,0,0]=4 1794 B14R1.125 N#CCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000734998_100000209962 [0,1,0,0,0,0|2,0,1]=4 1795 B14R1.125 Nc1ccc(cc1)S(=O)(=O)NCCF 40a_100000724931_100000054796 [0,1,0,0,0,0|3,0,0]=4 1796 B14R1.125 Nc1ccc(cc1)S(=O)(=O)NCCO 40a_100000210304_100000054796 [0,1,0,0,0,0|2,0,0]=3 1797 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)Br 270084a_100000724931_100000182491 [0,1,0,0,0,0|2,1,0]=4 1798 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)Br 274078a_100000724931_100000182491 [0,1,0,0,0,0|2,1,0]=4 1799 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)Br 40a_100000724931_100010306709 [0,1,0,0,0,0|2,1,0]=4 1800 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)Cl 270084a_100000724931_100000209962 [0,1,0,0,0,0|2,0,0]=3 1801 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)Cl 274078a_100000724931_100000209962 [0,1,0,0,0,0|2,0,0]=3 1802 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)Cl 40a_100000724931_100000077732 [0,1,0,0,0,0|2,0,0]=3 1803 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)F 270084a_100000724931_100000184267 [0,1,0,0,0,0|2,1,0]=4 1804 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)F 274078a_100000724931_100000184267 [0,1,0,0,0,0|2,1,0]=4 1805 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)F 40a_100000724931_100000081159 [0,1,0,0,0,0|2,1,0]=4 1806 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)I 270084a_100000724931_100011205396 [0,1,0,0,0,0|2,1,0]=4 1807 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)I 274078a_100000724931_100011205396 [0,1,0,0,0,0|2,1,0]=4 1808 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)O 270084a_100000724931_100020667864 [0,1,0,0,0,0|3,0,0]=4 1809 B14R1.125 O=S(=O)(NCCF)c1ccc(cc1)O 274078a_100000724931_100020667864 [0,1,0,0,0,0|3,0,0]=4 1810 B14R1.125 O=S(=O)(NCCF)c1ccc(nc1)Cl 270084a_100000724931_100000184283 [0,1,0,0,0,0|3,0,0]=4 1811 B14R1.125 O=S(=O)(NCCF)c1ccc(nc1)Cl 274078a_100000724931_100000184283 [0,1,0,0,0,0|3,0,0]=4 1812 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)Br 270084a_100000210304_100000182491 [0,1,0,0,0,0|1,1,0]=3 1813 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)Br 274078a_100000210304_100000182491 [0,1,0,0,0,0|1,1,0]=3 1814 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)Br 40a_100000210304_100010306709 [0,1,0,0,0,0|1,1,0]=3 1815 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)Cl 270084a_100000210304_100000209962 [0,1,0,0,0,0|1,0,0]=2 1816 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)Cl 274078a_100000210304_100000209962 [0,1,0,0,0,0|1,0,0]=2 1817 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)Cl 40a_100000210304_100000077732 [0,1,0,0,0,0|1,0,0]=2 1818 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)F 270084a_100000210304_100000184267 [0,1,0,0,0,0|1,1,0]=3 1819 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)F 274078a_100000210304_100000184267 [0,1,0,0,0,0|1,1,0]=3 1820 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)F 40a_100000210304_100000081159 [0,1,0,0,0,0|1,1,0]=3 1821 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)I 270084a_100000210304_100011205396 [0,1,0,0,0,0|1,1,0]=3 1822 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)I 274078a_100000210304_100011205396 [0,1,0,0,0,0|1,1,0]=3 1823 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)O 270084a_100000210304_100020667864 [0,1,0,0,0,0|2,0,0]=3 1824 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)O 271570a_203496583355_100000186246 [0,1,0,0,0,0|2,0,0]=3 1825 B14R1.125 O=S(=O)(NCCO)c1ccc(cc1)O 274078a_100000210304_100020667864 [0,1,0,0,0,0|2,0,0]=3 1826 B14R1.125 O=S(=O)(NCCO)c1ccc(cn1)Br 270084a_100000210304_100011361808 [0,1,0,0,0,0|2,1,0]=4 1827 B14R1.125 O=S(=O)(NCCO)c1ccc(cn1)Br 274078a_100000210304_100011361808 [0,1,0,0,0,0|2,1,0]=4 1828 B14R1.125 O=S(=O)(NCCO)c1ccc(nc1)Cl 270084a_100000210304_100000184283 [0,1,0,0,0,0|2,0,0]=3 1829 B14R1.125 O=S(=O)(NCCO)c1ccc(nc1)Cl 274078a_100000210304_100000184283 [0,1,0,0,0,0|2,0,0]=3 1830 B14R1.125 O=S(=O)(NCCO)c1cnc(nc1)Cl 270084a_100000210304_100015804485 [0,1,0,0,0,0|3,0,0]=4 1831 B14R1.125 O=S(=O)(NCCO)c1cnc(nc1)Cl 274078a_100000210304_100015804485 [0,1,0,0,0,0|3,0,0]=4 1832 B14R1.678 C=C(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000730704 [0,1,0,0,0,0|2,0,1]=4 1833 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 11a_100000765925_100000185839 [0,1,0,0,0,0|1,1,1]=4 1834 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 1626a_100000765925_100000185839 [0,1,0,0,0,0|1,1,1]=4 1835 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 240690a_100000765925_100000185839 [0,1,0,0,0,0|1,1,1]=4 1836 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Br 527a_100000765925_100000185839 [0,1,0,0,0,0|1,1,1]=4 1837 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 11a_100000765925_100000188618 [0,1,0,0,0,0|2,0,1]=4 1838 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 1626a_100000765925_100000188618 [0,1,0,0,0,0|2,0,1]=4 1839 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 240690a_100000765925_100000188618 [0,1,0,0,0,0|2,0,1]=4 1840 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)C 527a_100000765925_100000188618 [0,1,0,0,0,0|2,0,1]=4 1841 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 11a_100000765925_100000210187 [0,1,0,0,0,0|1,0,1]=3 1842 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 1626a_100000765925_100000210187 [0,1,0,0,0,0|1,0,1]=3 1843 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 240690a_100000765925_100000210187 [0,1,0,0,0,0|1,0,1]=3 1844 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)Cl 527a_100000765925_100000210187 [0,1,0,0,0,0|1,0,1]=3 1845 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 11a_100000765925_100000187176 [0,1,0,0,0,0|1,1,1]=4 1846 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 1626a_100000765925_100000187176 [0,1,0,0,0,0|1,1,1]=4 1847 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 240690a_100000765925_100000187176 [0,1,0,0,0,0|1,1,1]=4 1848 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)F 527a_100000765925_100000187176 [0,1,0,0,0,0|1,1,1]=4 1849 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 11a_100000765925_100000187904 [0,1,0,0,0,0|1,1,1]=4 1850 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 1626a_100000765925_100000187904 [0,1,0,0,0,0|1,1,1]=4 1851 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 240690a_100000765925_100000187904 [0,1,0,0,0,0|1,1,1]=4 1852 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)I 527a_100000765925_100000187904 [0,1,0,0,0,0|1,1,1]=4 1853 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)O 240690a_100000765925_100000212099 [0,1,0,0,0,0|2,0,1]=4 1854 B14R1.678 C=C(C)CNC(=O)c1ccc(cc1)O 527a_100000765925_100000212099 [0,1,0,0,0,0|2,0,1]=4 1855 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)C 1458a_100000183637_200000210301 [0,1,0,0,0,0|1,0,2]=4 1856 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_200000210301 [0,1,0,0,0,0|0,0,2]=3 1857 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_200000210301 [0,1,0,0,0,0|0,1,2]=4 1858 B14R1.678 CC(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_200000210301 [0,1,0,0,0,0|1,0,2]=4 1859 B14R1.678 CC(=O)NNC(=O)c1ccc(cc1)Cl 22a_100000184390_100000070787 [0,1,0,0,0,0|1,0,2]=4 1860 B14R1.678 CC(=O)NNC(=O)c1ccc(cc1)Cl 22a_100000189765_100000210187 [0,1,0,0,0,0|1,0,2]=4 1861 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210312 [0,1,0,0,0,0|2,1,0]=4 1862 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210312 [0,1,0,0,0,0|2,0,0]=3 1863 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210312 [0,1,0,0,0,0|2,1,0]=4 1864 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210312 [0,1,0,0,0,0|2,1,0]=4 1865 B14R1.678 CC(C)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210312 [0,1,0,0,0,0|3,0,0]=4 1866 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 11a_100000210953_100000185839 [0,1,0,0,0,0|1,1,0]=3 1867 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 1626a_100000210953_100000185839 [0,1,0,0,0,0|1,1,0]=3 1868 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 240690a_100000210953_100000185839 [0,1,0,0,0,0|1,1,0]=3 1869 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br 527a_100000210953_100000185839 [0,1,0,0,0,0|1,1,0]=3 1870 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 11a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1871 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 1626a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1872 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 240690a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1873 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl 527a_100000210953_100000210187 [0,1,0,0,0,0|1,0,0]=2 1874 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 11a_100000210953_100000187176 [0,1,0,0,0,0|1,1,0]=3 1875 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 1626a_100000210953_100000187176 [0,1,0,0,0,0|1,1,0]=3 1876 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 240690a_100000210953_100000187176 [0,1,0,0,0,0|1,1,0]=3 1877 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F 527a_100000210953_100000187176 [0,1,0,0,0,0|1,1,0]=3 1878 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 11a_100000210953_100000187904 [0,1,0,0,0,0|1,1,0]=3 1879 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 1626a_100000210953_100000187904 [0,1,0,0,0,0|1,1,0]=3 1880 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 240690a_100000210953_100000187904 [0,1,0,0,0,0|1,1,0]=3 1881 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)I 527a_100000210953_100000187904 [0,1,0,0,0,0|1,1,0]=3 1882 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)O 240690a_100000210953_100000212099 [0,1,0,0,0,0|2,0,0]=3 1883 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)O 271570a_203496583355_200000155730 [0,1,0,0,0,0|2,0,0]=3 1884 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)O 527a_100000210953_100000212099 [0,1,0,0,0,0|2,0,0]=3 1885 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Cl 2230a_100000210953_100000684792 [0,1,0,0,0,0|2,0,1]=4 1886 B14R1.678 CC(C)CNC(C)c1ccc(cc1)Cl 269862a_100000210953_100000185797 [0,1,0,0,0,0|2,0,1]=4 1887 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210760 [0,1,0,0,0,0|2,0,1]=4 1888 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Cl 270004a_100015205461_100000210432 [0,1,0,0,0,0|2,0,1]=4 1889 B14R1.678 CC(C)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210624 [0,1,0,0,0,0|2,0,1]=4 1890 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)Br 22a_100000741168_100000185839 [0,1,0,0,0,0|2,1,0]=4 1891 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)Cl 22a_100000741168_100000210187 [0,1,0,0,0,0|2,0,0]=3 1892 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)F 22a_100000741168_100000187176 [0,1,0,0,0,0|2,1,0]=4 1893 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)I 22a_100000741168_100000187904 [0,1,0,0,0,0|2,1,0]=4 1894 B14R1.678 CC(C)NNC(=O)c1ccc(cc1)O 22a_100000741168_100000212099 [0,1,0,0,0,0|3,0,0]=4 1895 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000210206_100000211071 [0,1,0,0,0,0|3,0,0]=4 1896 B14R1.678 CC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210206 [0,1,0,0,0,0|3,0,0]=4 1897 B14R1.678 CC(NCC(=O)O)c1ccc(cc1)Cl 269956a_100016091260_100000684792 [0,1,0,0,0,0|1,0,2]=4 1898 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100012276601 [0,1,0,0,0,0|1,1,0]=3 1899 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100012276601 [0,1,0,0,0,0|1,0,0]=2 1900 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)F 1458a_100000187176_100012276601 [0,1,0,0,0,0|1,1,0]=3 1901 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)I 1458a_100000187904_100012276601 [0,1,0,0,0,0|1,1,0]=3 1902 B14R1.678 CC(O)CCC(=O)c1ccc(cc1)O 1458a_100000212099_100012276601 [0,1,0,0,0,0|2,0,0]=3 1903 B14R1.678 CC(O)CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100012276601 [0,1,0,0,0,0|3,0,0]=4 1904 B14R1.678 CC(O)CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100012276601 [0,1,0,0,0,0|3,0,0]=4 1905 B14R1.678 CC(O)CCN(C)c1ccc(cc1)Cl 34a_100020629279_100012276601 [0,1,0,0,0,0|3,0,0]=4 1906 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Br 11a_100000210904_100000185839 [0,1,0,0,0,0|0,1,0]=2 1907 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Br 240690a_100000210904_100000185839 [0,1,0,0,0,0|0,1,0]=2 1908 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Br 527a_100000210904_100000185839 [0,1,0,0,0,0|0,1,0]=2 1909 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Cl 11a_100000210904_100000210187 [0,1,0,0,0,0|0,0,0]=1 1910 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Cl 240690a_100000210904_100000210187 [0,1,0,0,0,0|0,0,0]=1 1911 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)Cl 527a_100000210904_100000210187 [0,1,0,0,0,0|0,0,0]=1 1912 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)F 11a_100000210904_100000187176 [0,1,0,0,0,0|0,1,0]=2 1913 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)F 240690a_100000210904_100000187176 [0,1,0,0,0,0|0,1,0]=2 1914 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)F 527a_100000210904_100000187176 [0,1,0,0,0,0|0,1,0]=2 1915 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)I 11a_100000210904_100000187904 [0,1,0,0,0,0|0,1,0]=2 1916 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)I 240690a_100000210904_100000187904 [0,1,0,0,0,0|0,1,0]=2 1917 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)I 527a_100000210904_100000187904 [0,1,0,0,0,0|0,1,0]=2 1918 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)O 240690a_100000210904_100000212099 [0,1,0,0,0,0|1,0,0]=2 1919 B14R1.678 CC(O)CNC(=O)c1ccc(cc1)O 527a_100000210904_100000212099 [0,1,0,0,0,0|1,0,0]=2 1920 B14R1.678 CC(O)CNC(C)c1ccc(cc1)Br 2230a_100000210904_100000755118 [0,1,0,0,0,0|1,1,1]=4 1921 B14R1.678 CC(O)CNC(C)c1ccc(cc1)Br 269862a_100000210904_100000185794 [0,1,0,0,0,0|1,1,1]=4 1922 B14R1.678 CC(O)CNC(C)c1ccc(cc1)Br 34a_100000210904_100000755118 [0,1,0,0,0,0|1,1,1]=4 1923 B14R1.678 CC(O)CNC(C)c1ccc(cc1)Cl 2230a_100000210904_100000684792 [0,1,0,0,0,0|1,0,1]=3 1924 B14R1.678 CC(O)CNC(C)c1ccc(cc1)Cl 269862a_100000210904_100000185797 [0,1,0,0,0,0|1,0,1]=3 1925 B14R1.678 CC(O)CNC(C)c1ccc(cc1)F 2230a_100000210904_100000743420 [0,1,0,0,0,0|1,1,1]=4 1926 B14R1.678 CC(O)CNC(C)c1ccc(cc1)F 269862a_100000210904_100000185800 [0,1,0,0,0,0|1,1,1]=4 1927 B14R1.678 CC(O)CNC(C)c1ccc(cc1)F 34a_100000210904_100000743420 [0,1,0,0,0,0|1,1,1]=4 1928 B14R1.678 CC(O)CNC(C)c1ccc(cc1)I 269862a_100000210904_100000185465 [0,1,0,0,0,0|1,1,1]=4 1929 B14R1.678 CC(O)CNC(C)c1ccc(cn1)Cl 269862a_100000210904_100000692432 [0,1,0,0,0,0|2,0,1]=4 1930 B14R1.678 CC(O)CNC(C)c1ccc(cn1)Cl 270004a_100000210904_100000692432 [0,1,0,0,0,0|2,0,1]=4 1931 B14R1.678 CC(O)CNC(C)c1ccc(nc1)Cl 269862a_100000210904_100000690552 [0,1,0,0,0,0|2,0,1]=4 1932 B14R1.678 CC(O)CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100011218427 [0,1,0,0,0,0|1,1,1]=4 1933 B14R1.678 CC(O)CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100011218427 [0,1,0,0,0,0|1,1,1]=4 1934 B14R1.678 CC(O)CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100011218427 [0,1,0,0,0,0|1,1,1]=4 1935 B14R1.678 CC(O)CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100011218427 [0,1,0,0,0,0|2,0,1]=4 1936 B14R1.678 CC(O)CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100011218427 [0,1,0,0,0,0|1,1,1]=4 1937 B14R1.678 CC(O)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100011218427 [0,1,0,0,0,0|1,0,1]=3 1938 B14R1.678 CC(O)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100011218427 [0,1,0,0,0,0|1,0,1]=3 1939 B14R1.678 CC(O)CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100011218427 [0,1,0,0,0,0|2,0,1]=4 1940 B14R1.678 CC(O)CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100011218427 [0,1,0,0,0,0|2,0,1]=4 1941 B14R1.678 CC(O)CSC(C)c1ccc(cc1)Cl 62a_100000684792_100011218427 [0,1,0,0,0,0|2,0,1]=4 1942 B14R1.678 CC(O)CSC(C)c1ccc(cc1)Cl 62a_100011218427_100000684792 [0,1,0,0,0,0|2,0,1]=4 1943 B14R1.678 CC(SC[C@@H](C)O)c1ccc(cc1)Cl 62a_100000684792_100009817552 [0,1,0,0,0,0|2,0,1]=4 1944 B14R1.678 CC(SC[C@@H](C)O)c1ccc(cc1)Cl 62a_100009817552_100000684792 [0,1,0,0,0,0|2,0,1]=4 1945 B14R1.678 CN(C)CCC(=O)c1ccc(cc1)Cl 269982a_100102631434_100011216492 [0,1,0,0,0,0|3,0,0]=4 1946 B14R1.678 C[C@@H](NCC(F)F)c1ccc(cc1)Cl 2230a_100015205461_100011934356 [0,1,0,0,0,0|2,0,1]=4 1947 B14R1.678 C[C@@H](NCC(F)F)c1ccc(cc1)Cl 34a_100015205461_100011934356 [0,1,0,0,0,0|2,0,1]=4 1948 B14R1.678 C[C@@H](O)CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100009817552 [0,1,0,0,0,0|1,1,1]=4 1949 B14R1.678 C[C@@H](O)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100009817552 [0,1,0,0,0,0|1,0,1]=3 1950 B14R1.678 C[C@@H](O)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100009817552 [0,1,0,0,0,0|1,0,1]=3 1951 B14R1.678 C[C@H](NC[C@@H](C)O)c1ccc(cc1)F 2230a_100025705893_100009817552 [0,1,0,0,0,0|1,1,1]=4 1952 B14R1.678 C[C@H](NC[C@@H](C)O)c1ccc(cc1)F 34a_100025705893_100009817552 [0,1,0,0,0,0|1,1,1]=4 1953 B14R1.678 C[C@H](NC[C@@H](C)O)c1ccc(cc1)I 2230a_100000753911_100009817552 [0,1,0,0,0,0|1,1,1]=4 1954 B14R1.678 C[C@H](NC[C@@H](C)O)c1ccc(cc1)O 2230a_100161106496_100009817552 [0,1,0,0,0,0|2,0,1]=4 1955 B14R1.678 C[C@H](OC[C@@H](C)O)c1ccc(cc1)Cl 34a_100011852131_100009817552 [0,1,0,0,0,0|2,0,1]=4 1956 B14R1.678 C[C@H](OC[C@@H](C)O)c1ccc(cc1)Cl 7a_100011852131_100009817552 [0,1,0,0,0,0|2,0,1]=4 1957 B14R1.678 Cc1ccc(cc1)C(=O)CCC(C)C 1458a_100000188618_100000210312 [0,1,0,0,0,0|3,0,0]=4 1958 B14R1.678 Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100000188618_100012276601 [0,1,0,0,0,0|2,0,0]=3 1959 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)N 11a_100000711301_100000188618 [0,1,0,0,0,0|1,0,2]=4 1960 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)N 240690a_100000711301_100000188618 [0,1,0,0,0,0|1,0,2]=4 1961 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)N 527a_100000711301_100000188618 [0,1,0,0,0,0|1,0,2]=4 1962 B14R1.678 Cc1ccc(cc1)C(=O)NCC(=O)[13CH3] 1458a_100000183637_200025704644 [0,1,0,0,0,0|1,0,2]=4 1963 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000188618 [0,1,0,0,0,0|2,0,0]=3 1964 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000188618 [0,1,0,0,0,0|2,0,0]=3 1965 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000188618 [0,1,0,0,0,0|2,0,0]=3 1966 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000188618 [0,1,0,0,0,0|2,0,0]=3 1967 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000188618 [0,1,0,0,0,0|1,0,0]=2 1968 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000188618 [0,1,0,0,0,0|1,0,0]=2 1969 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000188618 [0,1,0,0,0,0|1,0,0]=2 1970 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000188618 [0,1,0,0,0,0|2,0,0]=3 1971 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000188618 [0,1,0,0,0,0|2,0,0]=3 1972 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000188618 [0,1,0,0,0,0|2,0,0]=3 1973 B14R1.678 Cc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000188618 [0,1,0,0,0,0|2,0,0]=3 1974 B14R1.678 Cc1ccc(cc1)C(=O)NNC(C)C 22a_100000741168_100000188618 [0,1,0,0,0,0|3,0,0]=4 1975 B14R1.678 Cc1ccc(cc1)C(C)NCC(C)O 2230a_100000210904_100011261388 [0,1,0,0,0,0|2,0,1]=4 1976 B14R1.678 Cc1ccc(cc1)C(C)NCC(C)O 269862a_100000210904_100000185793 [0,1,0,0,0,0|2,0,1]=4 1977 B14R1.678 Cc1ccc(cc1)C(C)NCC(C)O 34a_100000210904_100011261388 [0,1,0,0,0,0|2,0,1]=4 1978 B14R1.678 Cc1ccc(cc1)[C@@H](C)NCC(C)O 2230a_100016988085_100011218427 [0,1,0,0,0,0|2,0,1]=4 1979 B14R1.678 Cc1ccc(cc1)[C@@H](C)NCC(C)O 34a_100016988085_100011218427 [0,1,0,0,0,0|2,0,1]=4 1980 B14R1.678 Cc1ccc(cc1)[C@@H](C)NC[C@@H](C)O 2230a_100016988085_100009817552 [0,1,0,0,0,0|2,0,1]=4 1981 B14R1.678 Cc1ccc(cc1)[C@@H](C)NC[C@@H](C)O 34a_100016988085_100009817552 [0,1,0,0,0,0|2,0,1]=4 1982 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Br 11a_100000711301_100000185839 [0,1,0,0,0,0|0,1,2]=4 1983 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Br 240690a_100000711301_100000185839 [0,1,0,0,0,0|0,1,2]=4 1984 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Br 527a_100000711301_100000185839 [0,1,0,0,0,0|0,1,2]=4 1985 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Cl 11a_100000711301_100000210187 [0,1,0,0,0,0|0,0,2]=3 1986 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Cl 240690a_100000711301_100000210187 [0,1,0,0,0,0|0,0,2]=3 1987 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)Cl 527a_100000711301_100000210187 [0,1,0,0,0,0|0,0,2]=3 1988 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)F 11a_100000711301_100000187176 [0,1,0,0,0,0|0,1,2]=4 1989 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)F 240690a_100000711301_100000187176 [0,1,0,0,0,0|0,1,2]=4 1990 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)F 527a_100000711301_100000187176 [0,1,0,0,0,0|0,1,2]=4 1991 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)I 11a_100000711301_100000187904 [0,1,0,0,0,0|0,1,2]=4 1992 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)I 240690a_100000711301_100000187904 [0,1,0,0,0,0|0,1,2]=4 1993 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)I 527a_100000711301_100000187904 [0,1,0,0,0,0|0,1,2]=4 1994 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)O 240690a_100000711301_100000212099 [0,1,0,0,0,0|1,0,2]=4 1995 B14R1.678 NC(=O)CNC(=O)c1ccc(cc1)O 527a_100000711301_100000212099 [0,1,0,0,0,0|1,0,2]=4 1996 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 11a_100000765723_100000185839 [0,1,0,0,0,0|1,1,0]=3 1997 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 1626a_100000765723_100000185839 [0,1,0,0,0,0|1,1,0]=3 1998 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 240690a_100000765723_100000185839 [0,1,0,0,0,0|1,1,0]=3 1999 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Br 527a_100000765723_100000185839 [0,1,0,0,0,0|1,1,0]=3 2000 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 11a_100000765723_100000210187 [0,1,0,0,0,0|1,0,0]=2 2001 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 1626a_100000765723_100000210187 [0,1,0,0,0,0|1,0,0]=2 2002 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 240690a_100000765723_100000210187 [0,1,0,0,0,0|1,0,0]=2 2003 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)Cl 527a_100000765723_100000210187 [0,1,0,0,0,0|1,0,0]=2 2004 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 11a_100000765723_100000187176 [0,1,0,0,0,0|1,1,0]=3 2005 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 1626a_100000765723_100000187176 [0,1,0,0,0,0|1,1,0]=3 2006 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 240690a_100000765723_100000187176 [0,1,0,0,0,0|1,1,0]=3 2007 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)F 527a_100000765723_100000187176 [0,1,0,0,0,0|1,1,0]=3 2008 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 11a_100000765723_100000187904 [0,1,0,0,0,0|1,1,0]=3 2009 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 1626a_100000765723_100000187904 [0,1,0,0,0,0|1,1,0]=3 2010 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 240690a_100000765723_100000187904 [0,1,0,0,0,0|1,1,0]=3 2011 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)I 527a_100000765723_100000187904 [0,1,0,0,0,0|1,1,0]=3 2012 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)O 240690a_100000765723_100000212099 [0,1,0,0,0,0|2,0,0]=3 2013 B14R1.678 O=C(NCC(F)F)c1ccc(cc1)O 527a_100000765723_100000212099 [0,1,0,0,0,0|2,0,0]=3 2014 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_200025704644 [0,1,0,0,0,0|0,0,2]=3 2015 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_200025704644 [0,1,0,0,0,0|0,1,2]=4 2016 B14R1.678 [13CH3]C(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_200025704644 [0,1,0,0,0,0|1,0,2]=4 2017 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#C 11a_100000212058_100011217615 [0,1,0,0,0,0|2,0,1]=4 2018 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#C 1626a_100000212058_100011217615 [0,1,0,0,0,0|2,0,1]=4 2019 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#C 240690a_100000212058_100011217615 [0,1,0,0,0,0|2,0,1]=4 2020 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#C 527a_100000212058_100011217615 [0,1,0,0,0,0|2,0,1]=4 2021 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#N 11a_100000212058_100000210717 [0,1,0,0,0,0|2,0,1]=4 2022 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#N 1626a_100000212058_100000210717 [0,1,0,0,0,0|2,0,1]=4 2023 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#N 240690a_100000212058_100000210717 [0,1,0,0,0,0|2,0,1]=4 2024 B14R1.926 C#CCNC(=O)c1ccc(cc1)C#N 527a_100000212058_100000210717 [0,1,0,0,0,0|2,0,1]=4 2025 B14R1.926 C#CCNC(=O)c1ccc(cc1)C=C 11a_100000212058_100000687532 [0,1,0,0,0,0|2,0,1]=4 2026 B14R1.926 C#CCNC(=O)c1ccc(cc1)C=C 1626a_100000212058_100000687532 [0,1,0,0,0,0|2,0,1]=4 2027 B14R1.926 C#CCNC(=O)c1ccc(cc1)C=C 240690a_100000212058_100000687532 [0,1,0,0,0,0|2,0,1]=4 2028 B14R1.926 C#CCNC(=O)c1ccc(cc1)C=C 527a_100000212058_100000687532 [0,1,0,0,0,0|2,0,1]=4 2029 B14R1.926 C#CCNC(=O)c1ccc(cc1)CC 11a_100000212058_100000211226 [0,1,0,0,0,0|2,0,1]=4 2030 B14R1.926 C#CCNC(=O)c1ccc(cc1)CC 1626a_100000212058_100000211226 [0,1,0,0,0,0|2,0,1]=4 2031 B14R1.926 C#CCNC(=O)c1ccc(cc1)CC 240690a_100000212058_100000211226 [0,1,0,0,0,0|2,0,1]=4 2032 B14R1.926 C#CCNC(=O)c1ccc(cc1)CC 527a_100000212058_100000211226 [0,1,0,0,0,0|2,0,1]=4 2033 B14R1.926 C#CCNC(=O)c1ccc(cc1)CO 1626a_100000212058_100000183892 [0,1,0,0,0,0|2,0,1]=4 2034 B14R1.926 C#CCNC(=O)c1ccc(cc1)CO 240690a_100000212058_100000183892 [0,1,0,0,0,0|2,0,1]=4 2035 B14R1.926 C#CCNC(=O)c1ccc(cc1)OC 11a_100000212058_100000184203 [0,1,0,0,0,0|2,0,1]=4 2036 B14R1.926 C#CCNC(=O)c1ccc(cc1)OC 1626a_100000212058_100000184203 [0,1,0,0,0,0|2,0,1]=4 2037 B14R1.926 C#CCNC(=O)c1ccc(cc1)OC 240690a_100000212058_100000184203 [0,1,0,0,0,0|2,0,1]=4 2038 B14R1.926 C#CCNC(=O)c1ccc(cc1)OC 527a_100000212058_100000184203 [0,1,0,0,0,0|2,0,1]=4 2039 B14R1.926 C#CCNC(=O)c1ccc(cc1)SC 11a_100000212058_100000189692 [0,1,0,0,0,0|2,0,1]=4 2040 B14R1.926 C#CCNC(=O)c1ccc(cc1)SC 1626a_100000212058_100000189692 [0,1,0,0,0,0|2,0,1]=4 2041 B14R1.926 C#CCNC(=O)c1ccc(cc1)SC 240690a_100000212058_100000189692 [0,1,0,0,0,0|2,0,1]=4 2042 B14R1.926 C#CCNC(=O)c1ccc(cc1)SC 527a_100000212058_100000189692 [0,1,0,0,0,0|2,0,1]=4 2043 B14R1.926 C#Cc1ccc(cc1)C(=O)CCCC 1458a_100011217615_100000210211 [0,1,0,0,0,0|3,0,0]=4 2044 B14R1.926 C#Cc1ccc(cc1)C(=O)CCCF 1458a_100011217615_100011934791 [0,1,0,0,0,0|3,0,0]=4 2045 B14R1.926 C#Cc1ccc(cc1)C(=O)CCCO 1458a_100011217615_100011215043 [0,1,0,0,0,0|2,0,0]=3 2046 B14R1.926 C#Cc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100011217615 [0,1,0,0,0,0|2,0,1]=4 2047 B14R1.926 C#Cc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100011217615 [0,1,0,0,0,0|2,0,1]=4 2048 B14R1.926 C#Cc1ccc(cc1)C(=O)NCC=C 1626a_100020586998_100011217615 [0,1,0,0,0,0|2,0,1]=4 2049 B14R1.926 C#Cc1ccc(cc1)C(=O)NCC=C 240690a_100020586998_100011217615 [0,1,0,0,0,0|2,0,1]=4 2050 B14R1.926 C#Cc1ccc(cc1)C(=O)NCC=C 527a_100020586998_100011217615 [0,1,0,0,0,0|2,0,1]=4 2051 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCC 11a_100020643023_100011217615 [0,1,0,0,0,0|2,0,0]=3 2052 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCC 1626a_100020643023_100011217615 [0,1,0,0,0,0|2,0,0]=3 2053 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCC 240690a_100020643023_100011217615 [0,1,0,0,0,0|2,0,0]=3 2054 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCC 527a_100020643023_100011217615 [0,1,0,0,0,0|2,0,0]=3 2055 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100011217615 [0,1,0,0,0,0|2,0,0]=3 2056 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100011217615 [0,1,0,0,0,0|2,0,0]=3 2057 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100011217615 [0,1,0,0,0,0|2,0,0]=3 2058 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100011217615 [0,1,0,0,0,0|2,0,0]=3 2059 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100011217615 [0,1,0,0,0,0|1,0,0]=2 2060 B14R1.926 C#Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100011217615 [0,1,0,0,0,0|1,0,0]=2 2061 B14R1.926 C#Cc1ccc(cc1)C(=O)NNCC 22a_100000756455_100011217615 [0,1,0,0,0,0|3,0,0]=4 2062 B14R1.926 C=CCNC(=O)c1ccc(cc1)C#N 1626a_100020586998_100000210717 [0,1,0,0,0,0|2,0,1]=4 2063 B14R1.926 C=CCNC(=O)c1ccc(cc1)C#N 240690a_100020586998_100000210717 [0,1,0,0,0,0|2,0,1]=4 2064 B14R1.926 C=CCNC(=O)c1ccc(cc1)C#N 527a_100020586998_100000210717 [0,1,0,0,0,0|2,0,1]=4 2065 B14R1.926 C=CCNC(=O)c1ccc(cc1)C=C 1626a_100020586998_100000687532 [0,1,0,0,0,0|2,0,1]=4 2066 B14R1.926 C=CCNC(=O)c1ccc(cc1)C=C 240690a_100020586998_100000687532 [0,1,0,0,0,0|2,0,1]=4 2067 B14R1.926 C=CCNC(=O)c1ccc(cc1)C=C 527a_100020586998_100000687532 [0,1,0,0,0,0|2,0,1]=4 2068 B14R1.926 C=CCNC(=O)c1ccc(cc1)CC 1626a_100020586998_100000211226 [0,1,0,0,0,0|2,0,1]=4 2069 B14R1.926 C=CCNC(=O)c1ccc(cc1)CC 240690a_100020586998_100000211226 [0,1,0,0,0,0|2,0,1]=4 2070 B14R1.926 C=CCNC(=O)c1ccc(cc1)CC 527a_100020586998_100000211226 [0,1,0,0,0,0|2,0,1]=4 2071 B14R1.926 C=CCNC(=O)c1ccc(cc1)CO 1626a_100020586998_100000183892 [0,1,0,0,0,0|2,0,1]=4 2072 B14R1.926 C=CCNC(=O)c1ccc(cc1)CO 240690a_100020586998_100000183892 [0,1,0,0,0,0|2,0,1]=4 2073 B14R1.926 C=CCNC(=O)c1ccc(cc1)NC 2230a_100000742746_200000210301 [0,1,0,0,0,0|2,0,1]=4 2074 B14R1.926 C=CCNC(=O)c1ccc(cc1)NC 34a_100000742746_200000210301 [0,1,0,0,0,0|2,0,1]=4 2075 B14R1.926 C=CCNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000742746_200025704644 [0,1,0,0,0,0|2,0,1]=4 2076 B14R1.926 C=CCNC(=O)c1ccc(cc1)N[13CH3] 34a_100000742746_200025704644 [0,1,0,0,0,0|2,0,1]=4 2077 B14R1.926 C=CCNC(=O)c1ccc(cc1)OC 1626a_100020586998_100000184203 [0,1,0,0,0,0|2,0,1]=4 2078 B14R1.926 C=CCNC(=O)c1ccc(cc1)OC 240690a_100020586998_100000184203 [0,1,0,0,0,0|2,0,1]=4 2079 B14R1.926 C=CCNC(=O)c1ccc(cc1)OC 527a_100020586998_100000184203 [0,1,0,0,0,0|2,0,1]=4 2080 B14R1.926 C=CCNC(=O)c1ccc(cc1)SC 1626a_100020586998_100000189692 [0,1,0,0,0,0|2,0,1]=4 2081 B14R1.926 C=CCNC(=O)c1ccc(cc1)SC 240690a_100020586998_100000189692 [0,1,0,0,0,0|2,0,1]=4 2082 B14R1.926 C=CCNC(=O)c1ccc(cc1)SC 527a_100020586998_100000189692 [0,1,0,0,0,0|2,0,1]=4 2083 B14R1.926 C=Cc1ccc(cc1)C(=O)CCCC 1458a_100000687532_100000210211 [0,1,0,0,0,0|3,0,0]=4 2084 B14R1.926 C=Cc1ccc(cc1)C(=O)CCCC 271570a_100011290941_100011215321 [0,1,0,0,0,0|3,0,0]=4 2085 B14R1.926 C=Cc1ccc(cc1)C(=O)CCCF 1458a_100000687532_100011934791 [0,1,0,0,0,0|3,0,0]=4 2086 B14R1.926 C=Cc1ccc(cc1)C(=O)CCCO 1458a_100000687532_100011215043 [0,1,0,0,0,0|2,0,0]=3 2087 B14R1.926 C=Cc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000687532 [0,1,0,0,0,0|2,0,1]=4 2088 B14R1.926 C=Cc1ccc(cc1)C(=O)NCC#N 271570a_100011290941_100000752546 [0,1,0,0,0,0|2,0,1]=4 2089 B14R1.926 C=Cc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000687532 [0,1,0,0,0,0|2,0,1]=4 2090 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCC 11a_100020643023_100000687532 [0,1,0,0,0,0|2,0,0]=3 2091 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCC 1626a_100020643023_100000687532 [0,1,0,0,0,0|2,0,0]=3 2092 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCC 240690a_100020643023_100000687532 [0,1,0,0,0,0|2,0,0]=3 2093 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCC 271570a_100011290941_200000152267 [0,1,0,0,0,0|2,0,0]=3 2094 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCC 527a_100020643023_100000687532 [0,1,0,0,0,0|2,0,0]=3 2095 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000687532 [0,1,0,0,0,0|2,0,0]=3 2096 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000687532 [0,1,0,0,0,0|2,0,0]=3 2097 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000687532 [0,1,0,0,0,0|2,0,0]=3 2098 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000687532 [0,1,0,0,0,0|2,0,0]=3 2099 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000687532 [0,1,0,0,0,0|1,0,0]=2 2100 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCO 271570a_100011290941_200000158904 [0,1,0,0,0,0|1,0,0]=2 2101 B14R1.926 C=Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000687532 [0,1,0,0,0,0|1,0,0]=2 2102 B14R1.926 C=Cc1ccc(cc1)C(=O)NNCC 22a_100000756455_100000687532 [0,1,0,0,0,0|3,0,0]=4 2103 B14R1.926 C=Cc1ccc(cc1)C(C)NCCO 2230a_200012023546_100000211926 [0,1,0,0,0,0|2,0,1]=4 2104 B14R1.926 C=Cc1ccc(cc1)C(C)NCCO 34a_200012023546_100000211926 [0,1,0,0,0,0|2,0,1]=4 2105 B14R1.926 C=Cc1ccc(cn1)C(=O)NCCC 271570a_100011290941_100000161739 [0,1,0,0,0,0|3,0,0]=4 2106 B14R1.926 C=Cc1ccc(nc1)C(=O)NCCC 271570a_100011290941_100011781247 [0,1,0,0,0,0|3,0,0]=4 2107 B14R1.926 CC(NCCO)c1ccc(cc1)C#N 269862a_100000210304_100000182420 [0,1,0,0,0,0|2,0,1]=4 2108 B14R1.926 CC(NCCO)c1ccc(cc1)CO 269862a_100000210304_100000082505 [0,1,0,0,0,0|2,0,1]=4 2109 B14R1.926 CCCCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210211 [0,1,0,0,0,0|3,0,0]=4 2110 B14R1.926 CCCCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210211 [0,1,0,0,0,0|3,0,0]=4 2111 B14R1.926 CCCCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210211 [0,1,0,0,0,0|3,0,0]=4 2112 B14R1.926 CCCCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210211 [0,1,0,0,0,0|3,0,0]=4 2113 B14R1.926 CCCCC(=O)c1ccc(cc1)OC 34a_100000040048_200000210301 [0,1,0,0,0,0|3,0,0]=4 2114 B14R1.926 CCCCC(=O)c1ccc(cc1)OC 7a_100000040048_200000210301 [0,1,0,0,0,0|3,0,0]=4 2115 B14R1.926 CCCCC(=O)c1ccc(cc1)O[13CH3] 34a_100000040048_200025704644 [0,1,0,0,0,0|3,0,0]=4 2116 B14R1.926 CCCCC(=O)c1ccc(cc1)O[13CH3] 7a_100000040048_200025704644 [0,1,0,0,0,0|3,0,0]=4 2117 B14R1.926 CCCCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210211 [0,1,0,0,0,0|3,0,0]=4 2118 B14R1.926 CCCCC(=O)c1ccc(cc1)SC 62a_100011215321_200000210301 [0,1,0,0,0,0|3,0,0]=4 2119 B14R1.926 CCCCC(=O)c1ccc(cc1)SC 62a_200000210301_100011215321 [0,1,0,0,0,0|3,0,0]=4 2120 B14R1.926 CCCCC(=O)c1ccc(cc1)S[13CH3] 62a_100011215321_200025704644 [0,1,0,0,0,0|3,0,0]=4 2121 B14R1.926 CCCCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011215321 [0,1,0,0,0,0|3,0,0]=4 2122 B14R1.926 CCCNC(=O)c1ccc(cc1)C#N 11a_100020643023_100000210717 [0,1,0,0,0,0|2,0,0]=3 2123 B14R1.926 CCCNC(=O)c1ccc(cc1)C#N 1626a_100020643023_100000210717 [0,1,0,0,0,0|2,0,0]=3 2124 B14R1.926 CCCNC(=O)c1ccc(cc1)C#N 240690a_100020643023_100000210717 [0,1,0,0,0,0|2,0,0]=3 2125 B14R1.926 CCCNC(=O)c1ccc(cc1)C#N 527a_100020643023_100000210717 [0,1,0,0,0,0|2,0,0]=3 2126 B14R1.926 CCCNC(=O)c1ccc(cc1)CC 11a_100020643023_100000211226 [0,1,0,0,0,0|2,0,0]=3 2127 B14R1.926 CCCNC(=O)c1ccc(cc1)CC 1626a_100020643023_100000211226 [0,1,0,0,0,0|2,0,0]=3 2128 B14R1.926 CCCNC(=O)c1ccc(cc1)CC 240690a_100020643023_100000211226 [0,1,0,0,0,0|2,0,0]=3 2129 B14R1.926 CCCNC(=O)c1ccc(cc1)CC 527a_100020643023_100000211226 [0,1,0,0,0,0|2,0,0]=3 2130 B14R1.926 CCCNC(=O)c1ccc(cc1)CO 1626a_100020643023_100000183892 [0,1,0,0,0,0|2,0,0]=3 2131 B14R1.926 CCCNC(=O)c1ccc(cc1)CO 240690a_100020643023_100000183892 [0,1,0,0,0,0|2,0,0]=3 2132 B14R1.926 CCCNC(=O)c1ccc(cc1)NC 2230a_100000725496_200000210301 [0,1,0,0,0,0|2,0,0]=3 2133 B14R1.926 CCCNC(=O)c1ccc(cc1)NC 27a_100102657272_200000152267 [0,1,0,0,0,0|2,0,0]=3 2134 B14R1.926 CCCNC(=O)c1ccc(cc1)NC 34a_100000725496_200000210301 [0,1,0,0,0,0|2,0,0]=3 2135 B14R1.926 CCCNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000725496_200025704644 [0,1,0,0,0,0|2,0,0]=3 2136 B14R1.926 CCCNC(=O)c1ccc(cc1)N[13CH3] 34a_100000725496_200025704644 [0,1,0,0,0,0|2,0,0]=3 2137 B14R1.926 CCCNC(=O)c1ccc(cc1)OC 11a_100020643023_100000184203 [0,1,0,0,0,0|2,0,0]=3 2138 B14R1.926 CCCNC(=O)c1ccc(cc1)OC 1626a_100020643023_100000184203 [0,1,0,0,0,0|2,0,0]=3 2139 B14R1.926 CCCNC(=O)c1ccc(cc1)OC 240690a_100020643023_100000184203 [0,1,0,0,0,0|2,0,0]=3 2140 B14R1.926 CCCNC(=O)c1ccc(cc1)OC 34a_100000187946_200000210301 [0,1,0,0,0,0|2,0,0]=3 2141 B14R1.926 CCCNC(=O)c1ccc(cc1)OC 527a_100020643023_100000184203 [0,1,0,0,0,0|2,0,0]=3 2142 B14R1.926 CCCNC(=O)c1ccc(cc1)OC 7a_100000187946_200000210301 [0,1,0,0,0,0|2,0,0]=3 2143 B14R1.926 CCCNC(=O)c1ccc(cc1)O[13CH3] 34a_100000187946_200025704644 [0,1,0,0,0,0|2,0,0]=3 2144 B14R1.926 CCCNC(=O)c1ccc(cc1)O[13CH3] 7a_100000187946_200025704644 [0,1,0,0,0,0|2,0,0]=3 2145 B14R1.926 CCCNC(=O)c1ccc(cc1)SC 11a_100020643023_100000189692 [0,1,0,0,0,0|2,0,0]=3 2146 B14R1.926 CCCNC(=O)c1ccc(cc1)SC 1626a_100020643023_100000189692 [0,1,0,0,0,0|2,0,0]=3 2147 B14R1.926 CCCNC(=O)c1ccc(cc1)SC 240690a_100020643023_100000189692 [0,1,0,0,0,0|2,0,0]=3 2148 B14R1.926 CCCNC(=O)c1ccc(cc1)SC 527a_100020643023_100000189692 [0,1,0,0,0,0|2,0,0]=3 2149 B14R1.926 CCCNC(=O)c1ccc(cc1)SC 62a_200000152267_200000210301 [0,1,0,0,0,0|2,0,0]=3 2150 B14R1.926 CCCNC(=O)c1ccc(cc1)SC 62a_200000210301_200000152267 [0,1,0,0,0,0|2,0,0]=3 2151 B14R1.926 CCCNC(=O)c1ccc(cc1)S[13CH3] 62a_200000152267_200025704644 [0,1,0,0,0,0|2,0,0]=3 2152 B14R1.926 CCCNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_200000152267 [0,1,0,0,0,0|2,0,0]=3 2153 B14R1.926 CCCNC(=O)c1ccc(cn1)NC 27a_100102657272_100011781247 [0,1,0,0,0,0|3,0,0]=4 2154 B14R1.926 CCCNC(=O)c1ccc(cn1)SC 62a_100011781247_200000210301 [0,1,0,0,0,0|3,0,0]=4 2155 B14R1.926 CCCNC(=O)c1ccc(cn1)SC 62a_200000210301_100011781247 [0,1,0,0,0,0|3,0,0]=4 2156 B14R1.926 CCCNC(=O)c1ccc(cn1)S[13CH3] 62a_100011781247_200025704644 [0,1,0,0,0,0|3,0,0]=4 2157 B14R1.926 CCCNC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100011781247 [0,1,0,0,0,0|3,0,0]=4 2158 B14R1.926 CCCNC(=O)c1ccc(nc1)NC 27a_100102657272_100000161739 [0,1,0,0,0,0|3,0,0]=4 2159 B14R1.926 CCCNC(=O)c1ccc(nc1)SC 62a_100000161739_200000210301 [0,1,0,0,0,0|3,0,0]=4 2160 B14R1.926 CCCNC(=O)c1ccc(nc1)SC 62a_200000210301_100000161739 [0,1,0,0,0,0|3,0,0]=4 2161 B14R1.926 CCCNC(=O)c1ccc(nc1)S[13CH3] 62a_100000161739_200025704644 [0,1,0,0,0,0|3,0,0]=4 2162 B14R1.926 CCCNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000161739 [0,1,0,0,0,0|3,0,0]=4 2163 B14R1.926 CCCOC(=O)c1ccc(cc1)OC 34a_100000169887_200000210301 [0,1,0,0,0,0|3,0,0]=4 2164 B14R1.926 CCCOC(=O)c1ccc(cc1)OC 7a_100000169887_200000210301 [0,1,0,0,0,0|3,0,0]=4 2165 B14R1.926 CCCOC(=O)c1ccc(cc1)O[13CH3] 34a_100000169887_200025704644 [0,1,0,0,0,0|3,0,0]=4 2166 B14R1.926 CCCOC(=O)c1ccc(cc1)O[13CH3] 7a_100000169887_200025704644 [0,1,0,0,0,0|3,0,0]=4 2167 B14R1.926 CCNNC(=O)c1ccc(cc1)C#N 22a_100000756455_100000210717 [0,1,0,0,0,0|3,0,0]=4 2168 B14R1.926 CCNNC(=O)c1ccc(cc1)CC 22a_100000756455_100000211226 [0,1,0,0,0,0|3,0,0]=4 2169 B14R1.926 CCNNC(=O)c1ccc(cc1)CO 22a_100000756455_100000183892 [0,1,0,0,0,0|3,0,0]=4 2170 B14R1.926 CCNNC(=O)c1ccc(cc1)OC 22a_100000756455_100000184203 [0,1,0,0,0,0|3,0,0]=4 2171 B14R1.926 CCNNC(=O)c1ccc(cc1)SC 22a_100000756455_100000189692 [0,1,0,0,0,0|3,0,0]=4 2172 B14R1.926 CCc1ccc(cc1)C(=O)CCCF 1458a_100000211226_100011934791 [0,1,0,0,0,0|3,0,0]=4 2173 B14R1.926 CCc1ccc(cc1)C(=O)CCCO 1458a_100000211226_100011215043 [0,1,0,0,0,0|2,0,0]=3 2174 B14R1.926 CCc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000211226 [0,1,0,0,0,0|2,0,1]=4 2175 B14R1.926 CCc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000211226 [0,1,0,0,0,0|2,0,1]=4 2176 B14R1.926 CCc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000211226 [0,1,0,0,0,0|2,0,0]=3 2177 B14R1.926 CCc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000211226 [0,1,0,0,0,0|2,0,0]=3 2178 B14R1.926 CCc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000211226 [0,1,0,0,0,0|2,0,0]=3 2179 B14R1.926 CCc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000211226 [0,1,0,0,0,0|2,0,0]=3 2180 B14R1.926 CCc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000211226 [0,1,0,0,0,0|1,0,0]=2 2181 B14R1.926 CCc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000211226 [0,1,0,0,0,0|1,0,0]=2 2182 B14R1.926 CCc1ccc(cc1)C(C)NCCO 2230a_100015186439_100000211926 [0,1,0,0,0,0|2,0,1]=4 2183 B14R1.926 CCc1ccc(cc1)C(C)NCCO 269862a_100000210304_100000211630 [0,1,0,0,0,0|2,0,1]=4 2184 B14R1.926 CCc1ccc(cc1)C(C)NCCO 34a_100015186439_100000211926 [0,1,0,0,0,0|2,0,1]=4 2185 B14R1.926 CNc1ccc(cc1)C(=O)NCC#N 27a_100102657272_100000752546 [0,1,0,0,0,0|2,0,1]=4 2186 B14R1.926 CNc1ccc(cc1)C(=O)NCCO 27a_100102657272_200000158904 [0,1,0,0,0,0|1,0,0]=2 2187 B14R1.926 CNc1ccc(cc1)C(=O)NCCO 34a_100000740983_200000210301 [0,1,0,0,0,0|1,0,0]=2 2188 B14R1.926 CNc1ccc(cc1)C(C)NCCO 269862a_100000210304_100011806243 [0,1,0,0,0,0|2,0,1]=4 2189 B14R1.926 COc1ccc(cc1)C(=O)CCCCl 7a_100000039620_200000210301 [0,1,0,0,0,0|3,0,0]=4 2190 B14R1.926 COc1ccc(cc1)C(=O)CCCF 1458a_100000184203_100011934791 [0,1,0,0,0,0|3,0,0]=4 2191 B14R1.926 COc1ccc(cc1)C(=O)CCCO 1458a_100000184203_100011215043 [0,1,0,0,0,0|2,0,0]=3 2192 B14R1.926 COc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000184203 [0,1,0,0,0,0|2,0,1]=4 2193 B14R1.926 COc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000184203 [0,1,0,0,0,0|2,0,1]=4 2194 B14R1.926 COc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000184203 [0,1,0,0,0,0|2,0,0]=3 2195 B14R1.926 COc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000184203 [0,1,0,0,0,0|2,0,0]=3 2196 B14R1.926 COc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000184203 [0,1,0,0,0,0|2,0,0]=3 2197 B14R1.926 COc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000184203 [0,1,0,0,0,0|2,0,0]=3 2198 B14R1.926 COc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000184203 [0,1,0,0,0,0|1,0,0]=2 2199 B14R1.926 COc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000184203 [0,1,0,0,0,0|1,0,0]=2 2200 B14R1.926 COc1ccc(cc1)C(=O)OCCO 34a_100000031026_200000210301 [0,1,0,0,0,0|2,0,0]=3 2201 B14R1.926 COc1ccc(cc1)C(=O)OCCO 7a_100000031026_200000210301 [0,1,0,0,0,0|2,0,0]=3 2202 B14R1.926 COc1ccc(cc1)C(C)NCCO 269862a_100000210304_100000169859 [0,1,0,0,0,0|2,0,1]=4 2203 B14R1.926 COc1ccc(cc1)[C@@H](C)NCCO 2230a_100011830352_100000211926 [0,1,0,0,0,0|2,0,1]=4 2204 B14R1.926 CSc1ccc(cc1)C(=O)CCCF 1458a_100000189692_100011934791 [0,1,0,0,0,0|3,0,0]=4 2205 B14R1.926 CSc1ccc(cc1)C(=O)CCCO 1458a_100000189692_100011215043 [0,1,0,0,0,0|2,0,0]=3 2206 B14R1.926 CSc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000189692 [0,1,0,0,0,0|2,0,1]=4 2207 B14R1.926 CSc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000189692 [0,1,0,0,0,0|2,0,1]=4 2208 B14R1.926 CSc1ccc(cc1)C(=O)NCC#N 62a_100000752546_200000210301 [0,1,0,0,0,0|2,0,1]=4 2209 B14R1.926 CSc1ccc(cc1)C(=O)NCC#N 62a_200000210301_100000752546 [0,1,0,0,0,0|2,0,1]=4 2210 B14R1.926 CSc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000189692 [0,1,0,0,0,0|2,0,0]=3 2211 B14R1.926 CSc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000189692 [0,1,0,0,0,0|2,0,0]=3 2212 B14R1.926 CSc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000189692 [0,1,0,0,0,0|2,0,0]=3 2213 B14R1.926 CSc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000189692 [0,1,0,0,0,0|2,0,0]=3 2214 B14R1.926 CSc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000189692 [0,1,0,0,0,0|1,0,0]=2 2215 B14R1.926 CSc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000189692 [0,1,0,0,0,0|1,0,0]=2 2216 B14R1.926 CSc1ccc(cc1)C(=O)NCCO 62a_200000158904_200000210301 [0,1,0,0,0,0|1,0,0]=2 2217 B14R1.926 CSc1ccc(cc1)C(=O)NCCO 62a_200000210301_200000158904 [0,1,0,0,0,0|1,0,0]=2 2218 B14R1.926 CSc1ccc(cc1)C(C)NCCO 2230a_100000738722_100000211926 [0,1,0,0,0,0|2,0,1]=4 2219 B14R1.926 CSc1ccc(cc1)C(C)NCCO 269862a_100000210304_100000185071 [0,1,0,0,0,0|2,0,1]=4 2220 B14R1.926 C[C@@H](NCCO)c1ccc(cc1)C#N 2230a_100016991473_100000211926 [0,1,0,0,0,0|2,0,1]=4 2221 B14R1.926 C[C@@H](NCCO)c1ccc(cc1)C#N 34a_100016991473_100000211926 [0,1,0,0,0,0|2,0,1]=4 2222 B14R1.926 N#CCNC(=O)c1ccc(cc1)C#N 1626a_100000734998_100000210717 [0,1,0,0,0,0|2,0,1]=4 2223 B14R1.926 N#CCNC(=O)c1ccc(cc1)C#N 527a_100000734998_100000210717 [0,1,0,0,0,0|2,0,1]=4 2224 B14R1.926 N#CCNC(=O)c1ccc(cc1)CO 1626a_100000734998_100000183892 [0,1,0,0,0,0|2,0,1]=4 2225 B14R1.926 N#Cc1ccc(cc1)C(=O)CCCF 1458a_100000210717_100011934791 [0,1,0,0,0,0|3,0,0]=4 2226 B14R1.926 N#Cc1ccc(cc1)C(=O)CCCO 1458a_100000210717_100011215043 [0,1,0,0,0,0|2,0,0]=3 2227 B14R1.926 N#Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000210717 [0,1,0,0,0,0|2,0,0]=3 2228 B14R1.926 N#Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000210717 [0,1,0,0,0,0|2,0,0]=3 2229 B14R1.926 N#Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000210717 [0,1,0,0,0,0|2,0,0]=3 2230 B14R1.926 N#Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000210717 [0,1,0,0,0,0|2,0,0]=3 2231 B14R1.926 N#Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000210717 [0,1,0,0,0,0|1,0,0]=2 2232 B14R1.926 N#Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000210717 [0,1,0,0,0,0|1,0,0]=2 2233 B14R1.926 O=C(CCCF)c1ccc(cc1)CO 1458a_100000183892_100011934791 [0,1,0,0,0,0|3,0,0]=4 2234 B14R1.926 O=C(CCCO)c1ccc(cc1)CO 1458a_100000183892_100011215043 [0,1,0,0,0,0|2,0,0]=3 2235 B14R1.926 O=C(NCCF)c1ccc(cc1)CO 1626a_100000724931_100000183892 [0,1,0,0,0,0|2,0,0]=3 2236 B14R1.926 O=C(NCCF)c1ccc(cc1)CO 240690a_100000724931_100000183892 [0,1,0,0,0,0|2,0,0]=3 2237 B14R1.926 O=C(NCCO)c1ccc(cc1)CO 240690a_100000210304_100000183892 [0,1,0,0,0,0|1,0,0]=2 2238 B14R1.926 [13CH3]Nc1ccc(cc1)C(=O)NCCO 34a_100000740983_200025704644 [0,1,0,0,0,0|1,0,0]=2 2239 B14R1.926 [13CH3]Oc1ccc(cc1)C(=O)CCCCl 7a_100000039620_200025704644 [0,1,0,0,0,0|3,0,0]=4 2240 B14R1.926 [13CH3]Oc1ccc(cc1)C(=O)OCCO 34a_100000031026_200025704644 [0,1,0,0,0,0|2,0,0]=3 2241 B14R1.926 [13CH3]Oc1ccc(cc1)C(=O)OCCO 7a_100000031026_200025704644 [0,1,0,0,0,0|2,0,0]=3 2242 B14R1.926 [13CH3]Sc1ccc(cc1)C(=O)NCC#N 62a_100000752546_200025704644 [0,1,0,0,0,0|2,0,1]=4 2243 B14R1.926 [13CH3]Sc1ccc(cc1)C(=O)NCC#N 62a_200025704644_100000752546 [0,1,0,0,0,0|2,0,1]=4 2244 B14R1.926 [13CH3]Sc1ccc(cc1)C(=O)NCCO 62a_200000158904_200025704644 [0,1,0,0,0,0|1,0,0]=2 2245 B14R1.926 [13CH3]Sc1ccc(cc1)C(=O)NCCO 62a_200025704644_200000158904 [0,1,0,0,0,0|1,0,0]=2 2246 B14R1.941 C#CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000753159 [0,1,0,0,0,0|2,0,1]=4 2247 B14R1.941 C#CCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000753159 [0,1,0,0,0,0|2,0,1]=4 2248 B14R1.941 C#CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000753159 [0,1,0,0,0,0|2,0,1]=4 2249 B14R1.941 C#CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000753159 [0,1,0,0,0,0|2,0,1]=4 2250 B14R1.941 C#CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000753159 [0,1,0,0,0,0|2,0,1]=4 2251 B14R1.941 C#CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000753159 [0,1,0,0,0,0|2,0,1]=4 2252 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Br 11a_100000212058_100012339404 [0,1,0,0,0,0|1,1,1]=4 2253 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Br 1626a_100000212058_100012339404 [0,1,0,0,0,0|1,1,1]=4 2254 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Br 240690a_100000212058_100012339404 [0,1,0,0,0,0|1,1,1]=4 2255 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Br 527a_100000212058_100012339404 [0,1,0,0,0,0|1,1,1]=4 2256 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)C 11a_100000212058_100000186397 [0,1,0,0,0,0|2,0,1]=4 2257 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)C 1626a_100000212058_100000186397 [0,1,0,0,0,0|2,0,1]=4 2258 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)C 240690a_100000212058_100000186397 [0,1,0,0,0,0|2,0,1]=4 2259 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)C 527a_100000212058_100000186397 [0,1,0,0,0,0|2,0,1]=4 2260 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Cl 11a_100000212058_100000691181 [0,1,0,0,0,0|1,0,1]=3 2261 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000212058_100000691181 [0,1,0,0,0,0|1,0,1]=3 2262 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000212058_100000691181 [0,1,0,0,0,0|1,0,1]=3 2263 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000212058_100000691181 [0,1,0,0,0,0|1,0,1]=3 2264 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)F 11a_100000212058_100000760357 [0,1,0,0,0,0|1,1,1]=4 2265 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)F 1626a_100000212058_100000760357 [0,1,0,0,0,0|1,1,1]=4 2266 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)F 240690a_100000212058_100000760357 [0,1,0,0,0,0|1,1,1]=4 2267 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)F 527a_100000212058_100000760357 [0,1,0,0,0,0|1,1,1]=4 2268 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)I 11a_100000212058_100000739115 [0,1,0,0,0,0|1,1,1]=4 2269 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)I 1626a_100000212058_100000739115 [0,1,0,0,0,0|1,1,1]=4 2270 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)I 240690a_100000212058_100000739115 [0,1,0,0,0,0|1,1,1]=4 2271 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)I 527a_100000212058_100000739115 [0,1,0,0,0,0|1,1,1]=4 2272 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Br)O 240690a_100000212058_100000189672 [0,1,0,0,0,0|2,0,1]=4 2273 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Br 11a_100000212058_100000692631 [0,1,0,0,0,0|1,1,1]=4 2274 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Br 1626a_100000212058_100000692631 [0,1,0,0,0,0|1,1,1]=4 2275 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Br 240690a_100000212058_100000692631 [0,1,0,0,0,0|1,1,1]=4 2276 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Br 527a_100000212058_100000692631 [0,1,0,0,0,0|1,1,1]=4 2277 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)C 11a_100000212058_100000210898 [0,1,0,0,0,0|2,0,1]=4 2278 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)C 1626a_100000212058_100000210898 [0,1,0,0,0,0|2,0,1]=4 2279 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)C 240690a_100000212058_100000210898 [0,1,0,0,0,0|2,0,1]=4 2280 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)C 527a_100000212058_100000210898 [0,1,0,0,0,0|2,0,1]=4 2281 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Cl 11a_100000212058_100000686306 [0,1,0,0,0,0|1,0,1]=3 2282 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Cl 1626a_100000212058_100000686306 [0,1,0,0,0,0|1,0,1]=3 2283 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Cl 240690a_100000212058_100000686306 [0,1,0,0,0,0|1,0,1]=3 2284 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)Cl 527a_100000212058_100000686306 [0,1,0,0,0,0|1,0,1]=3 2285 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)F 11a_100000212058_100000751819 [0,1,0,0,0,0|1,1,1]=4 2286 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)F 1626a_100000212058_100000751819 [0,1,0,0,0,0|1,1,1]=4 2287 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)F 240690a_100000212058_100000751819 [0,1,0,0,0,0|1,1,1]=4 2288 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)F 527a_100000212058_100000751819 [0,1,0,0,0,0|1,1,1]=4 2289 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)I 11a_100000212058_100000751300 [0,1,0,0,0,0|1,1,1]=4 2290 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)I 1626a_100000212058_100000751300 [0,1,0,0,0,0|1,1,1]=4 2291 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)I 240690a_100000212058_100000751300 [0,1,0,0,0,0|1,1,1]=4 2292 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)I 527a_100000212058_100000751300 [0,1,0,0,0,0|1,1,1]=4 2293 B14R1.941 C#CCNC(=O)c1ccc(c(c1)C)O 240690a_100000212058_100000685612 [0,1,0,0,0,0|2,0,1]=4 2294 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Br 11a_100000212058_100000687082 [0,1,0,0,0,0|1,1,1]=4 2295 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000212058_100000687082 [0,1,0,0,0,0|1,1,1]=4 2296 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000212058_100000687082 [0,1,0,0,0,0|1,1,1]=4 2297 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Br 527a_100000212058_100000687082 [0,1,0,0,0,0|1,1,1]=4 2298 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)C 11a_100000212058_100000751740 [0,1,0,0,0,0|2,0,1]=4 2299 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)C 1626a_100000212058_100000751740 [0,1,0,0,0,0|2,0,1]=4 2300 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)C 240690a_100000212058_100000751740 [0,1,0,0,0,0|2,0,1]=4 2301 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)C 527a_100000212058_100000751740 [0,1,0,0,0,0|2,0,1]=4 2302 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000212058_100000210401 [0,1,0,0,0,0|1,0,1]=3 2303 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000212058_100000210401 [0,1,0,0,0,0|1,0,1]=3 2304 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000212058_100000210401 [0,1,0,0,0,0|1,0,1]=3 2305 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000212058_100000210401 [0,1,0,0,0,0|1,0,1]=3 2306 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)F 11a_100000212058_100000686462 [0,1,0,0,0,0|1,1,1]=4 2307 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)F 1626a_100000212058_100000686462 [0,1,0,0,0,0|1,1,1]=4 2308 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)F 240690a_100000212058_100000686462 [0,1,0,0,0,0|1,1,1]=4 2309 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)F 527a_100000212058_100000686462 [0,1,0,0,0,0|1,1,1]=4 2310 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)I 11a_100000212058_100000684831 [0,1,0,0,0,0|1,1,1]=4 2311 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)I 1626a_100000212058_100000684831 [0,1,0,0,0,0|1,1,1]=4 2312 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)I 240690a_100000212058_100000684831 [0,1,0,0,0,0|1,1,1]=4 2313 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)I 527a_100000212058_100000684831 [0,1,0,0,0,0|1,1,1]=4 2314 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000212058_100000212196 [0,1,0,0,0,0|2,0,1]=4 2315 B14R1.941 C#CCNC(=O)c1ccc(c(c1)Cl)O 527a_100000212058_100000212196 [0,1,0,0,0,0|2,0,1]=4 2316 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Br 11a_100000212058_100000743946 [0,1,0,0,0,0|1,1,1]=4 2317 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Br 1626a_100000212058_100000743946 [0,1,0,0,0,0|1,1,1]=4 2318 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Br 240690a_100000212058_100000743946 [0,1,0,0,0,0|1,1,1]=4 2319 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Br 527a_100000212058_100000743946 [0,1,0,0,0,0|1,1,1]=4 2320 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)C 11a_100000212058_100000212313 [0,1,0,0,0,0|2,0,1]=4 2321 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)C 1626a_100000212058_100000212313 [0,1,0,0,0,0|2,0,1]=4 2322 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)C 240690a_100000212058_100000212313 [0,1,0,0,0,0|2,0,1]=4 2323 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)C 527a_100000212058_100000212313 [0,1,0,0,0,0|2,0,1]=4 2324 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Cl 11a_100000212058_100000743183 [0,1,0,0,0,0|1,0,1]=3 2325 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000212058_100000743183 [0,1,0,0,0,0|1,0,1]=3 2326 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Cl 240690a_100000212058_100000743183 [0,1,0,0,0,0|1,0,1]=3 2327 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)Cl 527a_100000212058_100000743183 [0,1,0,0,0,0|1,0,1]=3 2328 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)F 11a_100000212058_100000209822 [0,1,0,0,0,0|1,1,1]=4 2329 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)F 1626a_100000212058_100000209822 [0,1,0,0,0,0|1,1,1]=4 2330 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)F 240690a_100000212058_100000209822 [0,1,0,0,0,0|1,1,1]=4 2331 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)F 527a_100000212058_100000209822 [0,1,0,0,0,0|1,1,1]=4 2332 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)I 11a_100000212058_100000062624 [0,1,0,0,0,0|1,1,1]=4 2333 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)I 1626a_100000212058_100000062624 [0,1,0,0,0,0|1,1,1]=4 2334 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)I 240690a_100000212058_100000062624 [0,1,0,0,0,0|1,1,1]=4 2335 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)I 527a_100000212058_100000062624 [0,1,0,0,0,0|1,1,1]=4 2336 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)O 240690a_100000212058_100000185466 [0,1,0,0,0,0|2,0,1]=4 2337 B14R1.941 C#CCNC(=O)c1ccc(c(c1)F)O 527a_100000212058_100000185466 [0,1,0,0,0,0|2,0,1]=4 2338 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Br 11a_100000212058_100012343876 [0,1,0,0,0,0|1,1,1]=4 2339 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Br 1626a_100000212058_100012343876 [0,1,0,0,0,0|1,1,1]=4 2340 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Br 240690a_100000212058_100012343876 [0,1,0,0,0,0|1,1,1]=4 2341 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Br 527a_100000212058_100012343876 [0,1,0,0,0,0|1,1,1]=4 2342 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)C 11a_100000212058_100000751299 [0,1,0,0,0,0|2,0,1]=4 2343 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)C 1626a_100000212058_100000751299 [0,1,0,0,0,0|2,0,1]=4 2344 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)C 240690a_100000212058_100000751299 [0,1,0,0,0,0|2,0,1]=4 2345 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)C 527a_100000212058_100000751299 [0,1,0,0,0,0|2,0,1]=4 2346 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Cl 11a_100000212058_100000739381 [0,1,0,0,0,0|1,0,1]=3 2347 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000212058_100000739381 [0,1,0,0,0,0|1,0,1]=3 2348 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Cl 240690a_100000212058_100000739381 [0,1,0,0,0,0|1,0,1]=3 2349 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)Cl 527a_100000212058_100000739381 [0,1,0,0,0,0|1,0,1]=3 2350 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)F 11a_100000212058_100000688015 [0,1,0,0,0,0|1,1,1]=4 2351 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)F 1626a_100000212058_100000688015 [0,1,0,0,0,0|1,1,1]=4 2352 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)F 240690a_100000212058_100000688015 [0,1,0,0,0,0|1,1,1]=4 2353 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)F 527a_100000212058_100000688015 [0,1,0,0,0,0|1,1,1]=4 2354 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)I 11a_100000212058_100000725830 [0,1,0,0,0,0|1,1,1]=4 2355 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)I 1626a_100000212058_100000725830 [0,1,0,0,0,0|1,1,1]=4 2356 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)I 240690a_100000212058_100000725830 [0,1,0,0,0,0|1,1,1]=4 2357 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)I 527a_100000212058_100000725830 [0,1,0,0,0,0|1,1,1]=4 2358 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)O 1626a_100000212058_100000037485 [0,1,0,0,0,0|2,0,1]=4 2359 B14R1.941 C#CCNC(=O)c1ccc(c(c1)I)O 240690a_100000212058_100000037485 [0,1,0,0,0,0|2,0,1]=4 2360 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)Br 240690a_100000212058_100000689001 [0,1,0,0,0,0|1,1,1]=4 2361 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)Br 527a_100000212058_100000689001 [0,1,0,0,0,0|1,1,1]=4 2362 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)C 240690a_100000212058_100000233767 [0,1,0,0,0,0|2,0,1]=4 2363 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000212058_100011933997 [0,1,0,0,0,0|1,0,1]=3 2364 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)Cl 527a_100000212058_100011933997 [0,1,0,0,0,0|1,0,1]=3 2365 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)F 240690a_100000212058_100000035894 [0,1,0,0,0,0|1,1,1]=4 2366 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)F 527a_100000212058_100000035894 [0,1,0,0,0,0|1,1,1]=4 2367 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)I 1626a_100000212058_100000239334 [0,1,0,0,0,0|1,1,1]=4 2368 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)I 240690a_100000212058_100000239334 [0,1,0,0,0,0|1,1,1]=4 2369 B14R1.941 C#CCNC(=O)c1ccc(c(c1)O)I 527a_100000212058_100000239334 [0,1,0,0,0,0|1,1,1]=4 2370 B14R1.941 C=CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000754431 [0,1,0,0,0,0|2,0,1]=4 2371 B14R1.941 C=CCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000754431 [0,1,0,0,0,0|2,0,1]=4 2372 B14R1.941 C=CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000754431 [0,1,0,0,0,0|2,0,1]=4 2373 B14R1.941 C=CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000754431 [0,1,0,0,0,0|2,0,1]=4 2374 B14R1.941 C=CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000754431 [0,1,0,0,0,0|2,0,1]=4 2375 B14R1.941 C=CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000754431 [0,1,0,0,0,0|2,0,1]=4 2376 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)Br 1626a_100020586998_100012339404 [0,1,0,0,0,0|1,1,1]=4 2377 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)Br 240690a_100020586998_100012339404 [0,1,0,0,0,0|1,1,1]=4 2378 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)Br 527a_100020586998_100012339404 [0,1,0,0,0,0|1,1,1]=4 2379 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)C 1626a_100020586998_100000186397 [0,1,0,0,0,0|2,0,1]=4 2380 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)C 240690a_100020586998_100000186397 [0,1,0,0,0,0|2,0,1]=4 2381 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)C 527a_100020586998_100000186397 [0,1,0,0,0,0|2,0,1]=4 2382 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100020586998_100000691181 [0,1,0,0,0,0|1,0,1]=3 2383 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100020586998_100000691181 [0,1,0,0,0,0|1,0,1]=3 2384 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100020586998_100000691181 [0,1,0,0,0,0|1,0,1]=3 2385 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)F 1626a_100020586998_100000760357 [0,1,0,0,0,0|1,1,1]=4 2386 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)F 240690a_100020586998_100000760357 [0,1,0,0,0,0|1,1,1]=4 2387 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)F 527a_100020586998_100000760357 [0,1,0,0,0,0|1,1,1]=4 2388 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)I 1626a_100020586998_100000739115 [0,1,0,0,0,0|1,1,1]=4 2389 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)I 240690a_100020586998_100000739115 [0,1,0,0,0,0|1,1,1]=4 2390 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)I 527a_100020586998_100000739115 [0,1,0,0,0,0|1,1,1]=4 2391 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Br)O 240690a_100020586998_100000189672 [0,1,0,0,0,0|2,0,1]=4 2392 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)Br 1626a_100020586998_100000692631 [0,1,0,0,0,0|1,1,1]=4 2393 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)Br 240690a_100020586998_100000692631 [0,1,0,0,0,0|1,1,1]=4 2394 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)Br 527a_100020586998_100000692631 [0,1,0,0,0,0|1,1,1]=4 2395 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)C 1626a_100020586998_100000210898 [0,1,0,0,0,0|2,0,1]=4 2396 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)C 240690a_100020586998_100000210898 [0,1,0,0,0,0|2,0,1]=4 2397 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)C 527a_100020586998_100000210898 [0,1,0,0,0,0|2,0,1]=4 2398 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)Cl 1626a_100020586998_100000686306 [0,1,0,0,0,0|1,0,1]=3 2399 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)Cl 240690a_100020586998_100000686306 [0,1,0,0,0,0|1,0,1]=3 2400 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)Cl 527a_100020586998_100000686306 [0,1,0,0,0,0|1,0,1]=3 2401 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)F 1626a_100020586998_100000751819 [0,1,0,0,0,0|1,1,1]=4 2402 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)F 240690a_100020586998_100000751819 [0,1,0,0,0,0|1,1,1]=4 2403 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)F 527a_100020586998_100000751819 [0,1,0,0,0,0|1,1,1]=4 2404 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)I 1626a_100020586998_100000751300 [0,1,0,0,0,0|1,1,1]=4 2405 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)I 240690a_100020586998_100000751300 [0,1,0,0,0,0|1,1,1]=4 2406 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)I 527a_100020586998_100000751300 [0,1,0,0,0,0|1,1,1]=4 2407 B14R1.941 C=CCNC(=O)c1ccc(c(c1)C)O 240690a_100020586998_100000685612 [0,1,0,0,0,0|2,0,1]=4 2408 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100020586998_100000687082 [0,1,0,0,0,0|1,1,1]=4 2409 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100020586998_100000687082 [0,1,0,0,0,0|1,1,1]=4 2410 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)Br 527a_100020586998_100000687082 [0,1,0,0,0,0|1,1,1]=4 2411 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)C 1626a_100020586998_100000751740 [0,1,0,0,0,0|2,0,1]=4 2412 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)C 240690a_100020586998_100000751740 [0,1,0,0,0,0|2,0,1]=4 2413 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)C 527a_100020586998_100000751740 [0,1,0,0,0,0|2,0,1]=4 2414 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100020586998_100000210401 [0,1,0,0,0,0|1,0,1]=3 2415 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100020586998_100000210401 [0,1,0,0,0,0|1,0,1]=3 2416 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100020586998_100000210401 [0,1,0,0,0,0|1,0,1]=3 2417 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)F 1626a_100020586998_100000686462 [0,1,0,0,0,0|1,1,1]=4 2418 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)F 240690a_100020586998_100000686462 [0,1,0,0,0,0|1,1,1]=4 2419 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)F 527a_100020586998_100000686462 [0,1,0,0,0,0|1,1,1]=4 2420 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)I 1626a_100020586998_100000684831 [0,1,0,0,0,0|1,1,1]=4 2421 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)I 240690a_100020586998_100000684831 [0,1,0,0,0,0|1,1,1]=4 2422 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)I 527a_100020586998_100000684831 [0,1,0,0,0,0|1,1,1]=4 2423 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)O 240690a_100020586998_100000212196 [0,1,0,0,0,0|2,0,1]=4 2424 B14R1.941 C=CCNC(=O)c1ccc(c(c1)Cl)O 527a_100020586998_100000212196 [0,1,0,0,0,0|2,0,1]=4 2425 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)Br 1626a_100020586998_100000743946 [0,1,0,0,0,0|1,1,1]=4 2426 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)Br 240690a_100020586998_100000743946 [0,1,0,0,0,0|1,1,1]=4 2427 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)Br 527a_100020586998_100000743946 [0,1,0,0,0,0|1,1,1]=4 2428 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)C 1626a_100020586998_100000212313 [0,1,0,0,0,0|2,0,1]=4 2429 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)C 240690a_100020586998_100000212313 [0,1,0,0,0,0|2,0,1]=4 2430 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)C 527a_100020586998_100000212313 [0,1,0,0,0,0|2,0,1]=4 2431 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)Cl 1626a_100020586998_100000743183 [0,1,0,0,0,0|1,0,1]=3 2432 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)Cl 240690a_100020586998_100000743183 [0,1,0,0,0,0|1,0,1]=3 2433 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)Cl 527a_100020586998_100000743183 [0,1,0,0,0,0|1,0,1]=3 2434 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)F 1626a_100020586998_100000209822 [0,1,0,0,0,0|1,1,1]=4 2435 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)F 240690a_100020586998_100000209822 [0,1,0,0,0,0|1,1,1]=4 2436 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)F 527a_100020586998_100000209822 [0,1,0,0,0,0|1,1,1]=4 2437 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)I 1626a_100020586998_100000062624 [0,1,0,0,0,0|1,1,1]=4 2438 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)I 240690a_100020586998_100000062624 [0,1,0,0,0,0|1,1,1]=4 2439 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)I 527a_100020586998_100000062624 [0,1,0,0,0,0|1,1,1]=4 2440 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)O 240690a_100020586998_100000185466 [0,1,0,0,0,0|2,0,1]=4 2441 B14R1.941 C=CCNC(=O)c1ccc(c(c1)F)O 527a_100020586998_100000185466 [0,1,0,0,0,0|2,0,1]=4 2442 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)Br 1626a_100020586998_100012343876 [0,1,0,0,0,0|1,1,1]=4 2443 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)Br 240690a_100020586998_100012343876 [0,1,0,0,0,0|1,1,1]=4 2444 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)Br 527a_100020586998_100012343876 [0,1,0,0,0,0|1,1,1]=4 2445 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)C 1626a_100020586998_100000751299 [0,1,0,0,0,0|2,0,1]=4 2446 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)C 240690a_100020586998_100000751299 [0,1,0,0,0,0|2,0,1]=4 2447 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)C 527a_100020586998_100000751299 [0,1,0,0,0,0|2,0,1]=4 2448 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)Cl 1626a_100020586998_100000739381 [0,1,0,0,0,0|1,0,1]=3 2449 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)Cl 240690a_100020586998_100000739381 [0,1,0,0,0,0|1,0,1]=3 2450 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)Cl 527a_100020586998_100000739381 [0,1,0,0,0,0|1,0,1]=3 2451 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)F 1626a_100020586998_100000688015 [0,1,0,0,0,0|1,1,1]=4 2452 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)F 240690a_100020586998_100000688015 [0,1,0,0,0,0|1,1,1]=4 2453 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)F 527a_100020586998_100000688015 [0,1,0,0,0,0|1,1,1]=4 2454 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)I 1626a_100020586998_100000725830 [0,1,0,0,0,0|1,1,1]=4 2455 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)I 240690a_100020586998_100000725830 [0,1,0,0,0,0|1,1,1]=4 2456 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)I 527a_100020586998_100000725830 [0,1,0,0,0,0|1,1,1]=4 2457 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)O 1626a_100020586998_100000037485 [0,1,0,0,0,0|2,0,1]=4 2458 B14R1.941 C=CCNC(=O)c1ccc(c(c1)I)O 240690a_100020586998_100000037485 [0,1,0,0,0,0|2,0,1]=4 2459 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)Br 240690a_100020586998_100000689001 [0,1,0,0,0,0|1,1,1]=4 2460 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)Br 527a_100020586998_100000689001 [0,1,0,0,0,0|1,1,1]=4 2461 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)C 240690a_100020586998_100000233767 [0,1,0,0,0,0|2,0,1]=4 2462 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)Cl 240690a_100020586998_100011933997 [0,1,0,0,0,0|1,0,1]=3 2463 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)Cl 527a_100020586998_100011933997 [0,1,0,0,0,0|1,0,1]=3 2464 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)F 240690a_100020586998_100000035894 [0,1,0,0,0,0|1,1,1]=4 2465 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)F 527a_100020586998_100000035894 [0,1,0,0,0,0|1,1,1]=4 2466 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)I 1626a_100020586998_100000239334 [0,1,0,0,0,0|1,1,1]=4 2467 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)I 240690a_100020586998_100000239334 [0,1,0,0,0,0|1,1,1]=4 2468 B14R1.941 C=CCNC(=O)c1ccc(c(c1)O)I 527a_100020586998_100000239334 [0,1,0,0,0,0|1,1,1]=4 2469 B14R1.941 CC(NCCF)c1ccc(c(c1)Br)Cl 269862a_100000724931_100012356427 [0,1,0,0,0,0|2,0,1]=4 2470 B14R1.941 CC(NCCF)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100011217306 [0,1,0,0,0,0|2,0,1]=4 2471 B14R1.941 CC(NCCF)c1ccc(c(c1)Cl)Cl 269862a_100000724931_100000210641 [0,1,0,0,0,0|2,0,1]=4 2472 B14R1.941 CC(NCCF)c1ccc(c(c1)Cl)Cl 34a_100000743459_100011217306 [0,1,0,0,0,0|2,0,1]=4 2473 B14R1.941 CC(NCCF)c1ccc(c(c1)F)Cl 269862a_100000724931_100000693814 [0,1,0,0,0,0|2,0,1]=4 2474 B14R1.941 CC(NCCO)c1ccc(c(c1)Br)Br 269862a_100000210304_100009814466 [0,1,0,0,0,0|1,1,1]=4 2475 B14R1.941 CC(NCCO)c1ccc(c(c1)Br)Cl 269862a_100000210304_100012356427 [0,1,0,0,0,0|1,0,1]=3 2476 B14R1.941 CC(NCCO)c1ccc(c(c1)Br)F 269862a_100000210304_100000239719 [0,1,0,0,0,0|1,1,1]=4 2477 B14R1.941 CC(NCCO)c1ccc(c(c1)Br)I 269862a_100000210304_100010146554 [0,1,0,0,0,0|1,1,1]=4 2478 B14R1.941 CC(NCCO)c1ccc(c(c1)Br)O 269862a_100000210304_100011772453 [0,1,0,0,0,0|2,0,1]=4 2479 B14R1.941 CC(NCCO)c1ccc(c(c1)Cl)Br 269862a_100000210304_100012353846 [0,1,0,0,0,0|1,1,1]=4 2480 B14R1.941 CC(NCCO)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100000211926 [0,1,0,0,0,0|1,0,1]=3 2481 B14R1.941 CC(NCCO)c1ccc(c(c1)Cl)Cl 269862a_100000210304_100000210641 [0,1,0,0,0,0|1,0,1]=3 2482 B14R1.941 CC(NCCO)c1ccc(c(c1)Cl)Cl 34a_100000743459_100000211926 [0,1,0,0,0,0|1,0,1]=3 2483 B14R1.941 CC(NCCO)c1ccc(c(c1)Cl)F 269862a_100000210304_100000737303 [0,1,0,0,0,0|1,1,1]=4 2484 B14R1.941 CC(NCCO)c1ccc(c(c1)Cl)O 269862a_100000210304_100000188625 [0,1,0,0,0,0|2,0,1]=4 2485 B14R1.941 CC(NCCO)c1ccc(c(c1)F)Br 269862a_100000210304_100000690002 [0,1,0,0,0,0|1,1,1]=4 2486 B14R1.941 CC(NCCO)c1ccc(c(c1)F)Cl 269862a_100000210304_100000693814 [0,1,0,0,0,0|1,0,1]=3 2487 B14R1.941 CC(NCCO)c1ccc(c(c1)F)F 2230a_100000756309_100000211926 [0,1,0,0,0,0|1,1,1]=4 2488 B14R1.941 CC(NCCO)c1ccc(c(c1)F)F 269862a_100000210304_100000184692 [0,1,0,0,0,0|1,1,1]=4 2489 B14R1.941 CC(NCCO)c1ccc(c(c1)F)F 34a_100000756309_100000211926 [0,1,0,0,0,0|1,1,1]=4 2490 B14R1.941 CC(NCCO)c1ccc(c(c1)F)O 269862a_100000210304_100000751691 [0,1,0,0,0,0|2,0,1]=4 2491 B14R1.941 CC(NCCO)c1ccc(c(c1)I)Br 269862a_100000210304_100010146556 [0,1,0,0,0,0|1,1,1]=4 2492 B14R1.941 CC(NCCO)c1ccc(c(c1)O)F 269862a_100000210304_100000117923 [0,1,0,0,0,0|1,1,1]=4 2493 B14R1.941 CC(NCCO)c1cnc(c(c1)Cl)Cl 269862a_100000210304_100000099843 [0,1,0,0,0,0|2,0,1]=4 2494 B14R1.941 CC(OCCO)c1ccc(c(c1)Cl)Cl 34a_100000742046_100000211926 [0,1,0,0,0,0|2,0,1]=4 2495 B14R1.941 CC(OCCO)c1ccc(c(c1)Cl)Cl 7a_100000742046_100000211926 [0,1,0,0,0,0|2,0,1]=4 2496 B14R1.941 CC(OCCO)c1ccc(c(c1)F)Cl 34a_100011944057_100000211926 [0,1,0,0,0,0|2,0,1]=4 2497 B14R1.941 CC(OCCO)c1ccc(c(c1)F)Cl 7a_100011944057_100000211926 [0,1,0,0,0,0|2,0,1]=4 2498 B14R1.941 CC=NNC(=O)c1ccc(c(c1)C)Cl 4a_200011996897_200000210099 [0,1,0,0,0,0|2,0,1]=4 2499 B14R1.941 CC=NNC(=O)c1ccc(c(c1)Cl)Cl 4a_100000187931_200000210099 [0,1,0,0,0,0|2,0,1]=4 2500 B14R1.941 CC=NNC(=O)c1ccc(c(c1)I)Cl 4a_100000046573_200000210099 [0,1,0,0,0,0|2,0,1]=4 2501 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210211 [0,1,0,0,0,0|2,1,0]=4 2502 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210211 [0,1,0,0,0,0|3,0,0]=4 2503 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210211 [0,1,0,0,0,0|2,0,0]=3 2504 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210211 [0,1,0,0,0,0|2,1,0]=4 2505 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210211 [0,1,0,0,0,0|2,1,0]=4 2506 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210211 [0,1,0,0,0,0|3,0,0]=4 2507 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210211 [0,1,0,0,0,0|2,1,0]=4 2508 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210211 [0,1,0,0,0,0|3,0,0]=4 2509 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210211 [0,1,0,0,0,0|2,0,0]=3 2510 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210211 [0,1,0,0,0,0|2,1,0]=4 2511 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210211 [0,1,0,0,0,0|2,1,0]=4 2512 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210211 [0,1,0,0,0,0|3,0,0]=4 2513 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210211 [0,1,0,0,0,0|2,1,0]=4 2514 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210211 [0,1,0,0,0,0|3,0,0]=4 2515 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210211 [0,1,0,0,0,0|2,0,0]=3 2516 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210211 [0,1,0,0,0,0|2,1,0]=4 2517 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210211 [0,1,0,0,0,0|2,1,0]=4 2518 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210211 [0,1,0,0,0,0|3,0,0]=4 2519 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210211 [0,1,0,0,0,0|2,1,0]=4 2520 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210211 [0,1,0,0,0,0|3,0,0]=4 2521 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210211 [0,1,0,0,0,0|2,0,0]=3 2522 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210211 [0,1,0,0,0,0|2,1,0]=4 2523 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210211 [0,1,0,0,0,0|2,1,0]=4 2524 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210211 [0,1,0,0,0,0|3,0,0]=4 2525 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210211 [0,1,0,0,0,0|2,1,0]=4 2526 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210211 [0,1,0,0,0,0|3,0,0]=4 2527 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210211 [0,1,0,0,0,0|2,0,0]=3 2528 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210211 [0,1,0,0,0,0|2,1,0]=4 2529 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210211 [0,1,0,0,0,0|2,1,0]=4 2530 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210211 [0,1,0,0,0,0|3,0,0]=4 2531 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210211 [0,1,0,0,0,0|2,1,0]=4 2532 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210211 [0,1,0,0,0,0|3,0,0]=4 2533 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210211 [0,1,0,0,0,0|2,0,0]=3 2534 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210211 [0,1,0,0,0,0|2,1,0]=4 2535 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210211 [0,1,0,0,0,0|2,1,0]=4 2536 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210211 [0,1,0,0,0,0|3,0,0]=4 2537 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 11a_100020643023_100012339404 [0,1,0,0,0,0|1,1,0]=3 2538 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100020643023_100012339404 [0,1,0,0,0,0|1,1,0]=3 2539 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100020643023_100012339404 [0,1,0,0,0,0|1,1,0]=3 2540 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 527a_100020643023_100012339404 [0,1,0,0,0,0|1,1,0]=3 2541 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 11a_100020643023_100000186397 [0,1,0,0,0,0|2,0,0]=3 2542 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 1626a_100020643023_100000186397 [0,1,0,0,0,0|2,0,0]=3 2543 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 240690a_100020643023_100000186397 [0,1,0,0,0,0|2,0,0]=3 2544 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 527a_100020643023_100000186397 [0,1,0,0,0,0|2,0,0]=3 2545 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100020643023_100000691181 [0,1,0,0,0,0|1,0,0]=2 2546 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100020643023_100000691181 [0,1,0,0,0,0|1,0,0]=2 2547 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100020643023_100000691181 [0,1,0,0,0,0|1,0,0]=2 2548 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100020643023_100000691181 [0,1,0,0,0,0|1,0,0]=2 2549 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 11a_100020643023_100000760357 [0,1,0,0,0,0|1,1,0]=3 2550 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 1626a_100020643023_100000760357 [0,1,0,0,0,0|1,1,0]=3 2551 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 240690a_100020643023_100000760357 [0,1,0,0,0,0|1,1,0]=3 2552 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 527a_100020643023_100000760357 [0,1,0,0,0,0|1,1,0]=3 2553 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 11a_100020643023_100000739115 [0,1,0,0,0,0|1,1,0]=3 2554 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 1626a_100020643023_100000739115 [0,1,0,0,0,0|1,1,0]=3 2555 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 240690a_100020643023_100000739115 [0,1,0,0,0,0|1,1,0]=3 2556 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 527a_100020643023_100000739115 [0,1,0,0,0,0|1,1,0]=3 2557 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)O 240690a_100020643023_100000189672 [0,1,0,0,0,0|2,0,0]=3 2558 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 11a_100020643023_100000692631 [0,1,0,0,0,0|1,1,0]=3 2559 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 1626a_100020643023_100000692631 [0,1,0,0,0,0|1,1,0]=3 2560 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 240690a_100020643023_100000692631 [0,1,0,0,0,0|1,1,0]=3 2561 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 527a_100020643023_100000692631 [0,1,0,0,0,0|1,1,0]=3 2562 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 11a_100020643023_100000210898 [0,1,0,0,0,0|2,0,0]=3 2563 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 1626a_100020643023_100000210898 [0,1,0,0,0,0|2,0,0]=3 2564 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 240690a_100020643023_100000210898 [0,1,0,0,0,0|2,0,0]=3 2565 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 527a_100020643023_100000210898 [0,1,0,0,0,0|2,0,0]=3 2566 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 11a_100020643023_100000686306 [0,1,0,0,0,0|1,0,0]=2 2567 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100020643023_100000686306 [0,1,0,0,0,0|1,0,0]=2 2568 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100020643023_100000686306 [0,1,0,0,0,0|1,0,0]=2 2569 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 527a_100020643023_100000686306 [0,1,0,0,0,0|1,0,0]=2 2570 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 11a_100020643023_100000751819 [0,1,0,0,0,0|1,1,0]=3 2571 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 1626a_100020643023_100000751819 [0,1,0,0,0,0|1,1,0]=3 2572 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 240690a_100020643023_100000751819 [0,1,0,0,0,0|1,1,0]=3 2573 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 527a_100020643023_100000751819 [0,1,0,0,0,0|1,1,0]=3 2574 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 11a_100020643023_100000751300 [0,1,0,0,0,0|1,1,0]=3 2575 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 1626a_100020643023_100000751300 [0,1,0,0,0,0|1,1,0]=3 2576 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 240690a_100020643023_100000751300 [0,1,0,0,0,0|1,1,0]=3 2577 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 527a_100020643023_100000751300 [0,1,0,0,0,0|1,1,0]=3 2578 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)O 240690a_100020643023_100000685612 [0,1,0,0,0,0|2,0,0]=3 2579 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012357430 [0,1,0,0,0,0|2,0,0]=3 2580 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100020643023_100000687082 [0,1,0,0,0,0|1,1,0]=3 2581 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100020643023_100000687082 [0,1,0,0,0,0|1,1,0]=3 2582 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100020643023_100000687082 [0,1,0,0,0,0|1,1,0]=3 2583 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100020643023_100000687082 [0,1,0,0,0,0|1,1,0]=3 2584 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 11a_100020643023_100000751740 [0,1,0,0,0,0|2,0,0]=3 2585 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100020643023_100000751740 [0,1,0,0,0,0|2,0,0]=3 2586 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100020643023_100000751740 [0,1,0,0,0,0|2,0,0]=3 2587 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 527a_100020643023_100000751740 [0,1,0,0,0,0|2,0,0]=3 2588 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100020643023_100000210401 [0,1,0,0,0,0|1,0,0]=2 2589 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100020643023_100000210401 [0,1,0,0,0,0|1,0,0]=2 2590 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100020643023_100000210401 [0,1,0,0,0,0|1,0,0]=2 2591 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100020643023_100000210401 [0,1,0,0,0,0|1,0,0]=2 2592 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 11a_100020643023_100000686462 [0,1,0,0,0,0|1,1,0]=3 2593 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100020643023_100000686462 [0,1,0,0,0,0|1,1,0]=3 2594 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100020643023_100000686462 [0,1,0,0,0,0|1,1,0]=3 2595 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 527a_100020643023_100000686462 [0,1,0,0,0,0|1,1,0]=3 2596 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 11a_100020643023_100000684831 [0,1,0,0,0,0|1,1,0]=3 2597 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100020643023_100000684831 [0,1,0,0,0,0|1,1,0]=3 2598 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100020643023_100000684831 [0,1,0,0,0,0|1,1,0]=3 2599 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 527a_100020643023_100000684831 [0,1,0,0,0,0|1,1,0]=3 2600 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100020643023_100000212196 [0,1,0,0,0,0|2,0,0]=3 2601 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)O 527a_100020643023_100000212196 [0,1,0,0,0,0|2,0,0]=3 2602 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 11a_100020643023_100000743946 [0,1,0,0,0,0|1,1,0]=3 2603 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 1626a_100020643023_100000743946 [0,1,0,0,0,0|1,1,0]=3 2604 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 240690a_100020643023_100000743946 [0,1,0,0,0,0|1,1,0]=3 2605 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 527a_100020643023_100000743946 [0,1,0,0,0,0|1,1,0]=3 2606 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 11a_100020643023_100000212313 [0,1,0,0,0,0|2,0,0]=3 2607 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 1626a_100020643023_100000212313 [0,1,0,0,0,0|2,0,0]=3 2608 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 240690a_100020643023_100000212313 [0,1,0,0,0,0|2,0,0]=3 2609 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 527a_100020643023_100000212313 [0,1,0,0,0,0|2,0,0]=3 2610 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 11a_100020643023_100000743183 [0,1,0,0,0,0|1,0,0]=2 2611 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100020643023_100000743183 [0,1,0,0,0,0|1,0,0]=2 2612 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100020643023_100000743183 [0,1,0,0,0,0|1,0,0]=2 2613 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 527a_100020643023_100000743183 [0,1,0,0,0,0|1,0,0]=2 2614 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 11a_100020643023_100000209822 [0,1,0,0,0,0|1,1,0]=3 2615 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 1626a_100020643023_100000209822 [0,1,0,0,0,0|1,1,0]=3 2616 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 240690a_100020643023_100000209822 [0,1,0,0,0,0|1,1,0]=3 2617 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 527a_100020643023_100000209822 [0,1,0,0,0,0|1,1,0]=3 2618 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 11a_100020643023_100000062624 [0,1,0,0,0,0|1,1,0]=3 2619 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 1626a_100020643023_100000062624 [0,1,0,0,0,0|1,1,0]=3 2620 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 240690a_100020643023_100000062624 [0,1,0,0,0,0|1,1,0]=3 2621 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 527a_100020643023_100000062624 [0,1,0,0,0,0|1,1,0]=3 2622 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)O 240690a_100020643023_100000185466 [0,1,0,0,0,0|2,0,0]=3 2623 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)O 527a_100020643023_100000185466 [0,1,0,0,0,0|2,0,0]=3 2624 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 11a_100020643023_100012343876 [0,1,0,0,0,0|1,1,0]=3 2625 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 1626a_100020643023_100012343876 [0,1,0,0,0,0|1,1,0]=3 2626 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 240690a_100020643023_100012343876 [0,1,0,0,0,0|1,1,0]=3 2627 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 527a_100020643023_100012343876 [0,1,0,0,0,0|1,1,0]=3 2628 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 11a_100020643023_100000751299 [0,1,0,0,0,0|2,0,0]=3 2629 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 1626a_100020643023_100000751299 [0,1,0,0,0,0|2,0,0]=3 2630 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 240690a_100020643023_100000751299 [0,1,0,0,0,0|2,0,0]=3 2631 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 527a_100020643023_100000751299 [0,1,0,0,0,0|2,0,0]=3 2632 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 11a_100020643023_100000739381 [0,1,0,0,0,0|1,0,0]=2 2633 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100020643023_100000739381 [0,1,0,0,0,0|1,0,0]=2 2634 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100020643023_100000739381 [0,1,0,0,0,0|1,0,0]=2 2635 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 527a_100020643023_100000739381 [0,1,0,0,0,0|1,0,0]=2 2636 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 11a_100020643023_100000688015 [0,1,0,0,0,0|1,1,0]=3 2637 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 1626a_100020643023_100000688015 [0,1,0,0,0,0|1,1,0]=3 2638 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 240690a_100020643023_100000688015 [0,1,0,0,0,0|1,1,0]=3 2639 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 527a_100020643023_100000688015 [0,1,0,0,0,0|1,1,0]=3 2640 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 11a_100020643023_100000725830 [0,1,0,0,0,0|1,1,0]=3 2641 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 1626a_100020643023_100000725830 [0,1,0,0,0,0|1,1,0]=3 2642 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 240690a_100020643023_100000725830 [0,1,0,0,0,0|1,1,0]=3 2643 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 527a_100020643023_100000725830 [0,1,0,0,0,0|1,1,0]=3 2644 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)O 1626a_100020643023_100000037485 [0,1,0,0,0,0|2,0,0]=3 2645 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)O 240690a_100020643023_100000037485 [0,1,0,0,0,0|2,0,0]=3 2646 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Br 240690a_100020643023_100000689001 [0,1,0,0,0,0|1,1,0]=3 2647 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Br 527a_100020643023_100000689001 [0,1,0,0,0,0|1,1,0]=3 2648 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)C 240690a_100020643023_100000233767 [0,1,0,0,0,0|2,0,0]=3 2649 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100020643023_100011933997 [0,1,0,0,0,0|1,0,0]=2 2650 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Cl 527a_100020643023_100011933997 [0,1,0,0,0,0|1,0,0]=2 2651 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F 240690a_100020643023_100000035894 [0,1,0,0,0,0|1,1,0]=3 2652 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359901 [0,1,0,0,0,0|1,1,0]=3 2653 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F 527a_100020643023_100000035894 [0,1,0,0,0,0|1,1,0]=3 2654 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)I 1626a_100020643023_100000239334 [0,1,0,0,0,0|1,1,0]=3 2655 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)I 240690a_100020643023_100000239334 [0,1,0,0,0,0|1,1,0]=3 2656 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)I 527a_100020643023_100000239334 [0,1,0,0,0,0|1,1,0]=3 2657 B14R1.941 CCCNC(C)c1ccc(c(c1)Br)Cl 269862a_100020643023_100012356427 [0,1,0,0,0,0|2,0,1]=4 2658 B14R1.941 CCCNC(C)c1ccc(c(c1)C)Cl 269862a_100020643023_100011216000 [0,1,0,0,0,0|2,0,1]=4 2659 B14R1.941 CCCNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100000210303 [0,1,0,0,0,0|2,0,1]=4 2660 B14R1.941 CCCNC(C)c1ccc(c(c1)Cl)Cl 269862a_100020643023_100000210641 [0,1,0,0,0,0|2,0,1]=4 2661 B14R1.941 CCCNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_100000210303 [0,1,0,0,0,0|2,0,1]=4 2662 B14R1.941 CCCNC(C)c1ccc(c(c1)F)Cl 269862a_100020643023_100000693814 [0,1,0,0,0,0|2,0,1]=4 2663 B14R1.941 CCCN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_100000210303 [0,1,0,0,0,0|2,0,1]=4 2664 B14R1.941 CCCN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_100000210303 [0,1,0,0,0,0|2,0,1]=4 2665 B14R1.941 CCCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013322381 [0,1,0,0,0,0|3,0,0]=4 2666 B14R1.941 CCNCC(=O)c1ccc(c(c1)Cl)Cl 2230a_100015525214_100000211430 [0,1,0,0,0,0|3,0,0]=4 2667 B14R1.941 CCNCC(=O)c1ccc(c(c1)F)Cl 2230a_100015525214_100012351892 [0,1,0,0,0,0|3,0,0]=4 2668 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)Br 22a_100000756455_100012339404 [0,1,0,0,0,0|2,1,0]=4 2669 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)C 22a_100000756455_100000186397 [0,1,0,0,0,0|3,0,0]=4 2670 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)Cl 22a_100000756455_100000691181 [0,1,0,0,0,0|2,0,0]=3 2671 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)F 22a_100000756455_100000760357 [0,1,0,0,0,0|2,1,0]=4 2672 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)I 22a_100000756455_100000739115 [0,1,0,0,0,0|2,1,0]=4 2673 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)O 22a_100000756455_100000189672 [0,1,0,0,0,0|3,0,0]=4 2674 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)Br 22a_100000756455_100000692631 [0,1,0,0,0,0|2,1,0]=4 2675 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)C 22a_100000756455_100000210898 [0,1,0,0,0,0|3,0,0]=4 2676 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)Cl 22a_100000756455_100000686306 [0,1,0,0,0,0|2,0,0]=3 2677 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)F 22a_100000756455_100000751819 [0,1,0,0,0,0|2,1,0]=4 2678 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)I 22a_100000756455_100000751300 [0,1,0,0,0,0|2,1,0]=4 2679 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)O 22a_100000756455_100000685612 [0,1,0,0,0,0|3,0,0]=4 2680 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)Br 22a_100000756455_100000687082 [0,1,0,0,0,0|2,1,0]=4 2681 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)C 22a_100000756455_100000751740 [0,1,0,0,0,0|3,0,0]=4 2682 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)Cl 22a_100000756455_100000210401 [0,1,0,0,0,0|2,0,0]=3 2683 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)F 22a_100000756455_100000686462 [0,1,0,0,0,0|2,1,0]=4 2684 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)I 22a_100000756455_100000684831 [0,1,0,0,0,0|2,1,0]=4 2685 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)O 22a_100000756455_100000212196 [0,1,0,0,0,0|3,0,0]=4 2686 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)Br 22a_100000756455_100000743946 [0,1,0,0,0,0|2,1,0]=4 2687 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)C 22a_100000756455_100000212313 [0,1,0,0,0,0|3,0,0]=4 2688 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)Cl 22a_100000756455_100000743183 [0,1,0,0,0,0|2,0,0]=3 2689 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)F 22a_100000756455_100000209822 [0,1,0,0,0,0|2,1,0]=4 2690 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)I 22a_100000756455_100000062624 [0,1,0,0,0,0|2,1,0]=4 2691 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)O 22a_100000756455_100000185466 [0,1,0,0,0,0|3,0,0]=4 2692 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)Br 22a_100000756455_100012343876 [0,1,0,0,0,0|2,1,0]=4 2693 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)C 22a_100000756455_100000751299 [0,1,0,0,0,0|3,0,0]=4 2694 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)Cl 22a_100000756455_100000739381 [0,1,0,0,0,0|2,0,0]=3 2695 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)F 22a_100000756455_100000688015 [0,1,0,0,0,0|2,1,0]=4 2696 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)I 22a_100000756455_100000725830 [0,1,0,0,0,0|2,1,0]=4 2697 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)O 22a_100000756455_100000037485 [0,1,0,0,0,0|3,0,0]=4 2698 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)Br 22a_100000756455_100000689001 [0,1,0,0,0,0|2,1,0]=4 2699 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)C 22a_100000756455_100000233767 [0,1,0,0,0,0|3,0,0]=4 2700 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)Cl 22a_100000756455_100011933997 [0,1,0,0,0,0|2,0,0]=3 2701 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)F 22a_100000756455_100000035894 [0,1,0,0,0,0|2,1,0]=4 2702 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)I 22a_100000756455_100000239334 [0,1,0,0,0,0|2,1,0]=4 2703 B14R1.941 CCOCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_100000210202 [0,1,0,0,0,0|3,0,0]=4 2704 B14R1.941 CCOCC(=O)c1ccc(c(c1)F)Cl 34a_100121572206_100012351892 [0,1,0,0,0,0|3,0,0]=4 2705 B14R1.941 CCSCC(=O)c1ccc(c(c1)C)Cl 62a_100000210202_200011216723 [0,1,0,0,0,0|3,0,0]=4 2706 B14R1.941 CCSCC(=O)c1ccc(c(c1)C)Cl 62a_200011216723_100000210202 [0,1,0,0,0,0|3,0,0]=4 2707 B14R1.941 CCSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000210202_100000211430 [0,1,0,0,0,0|3,0,0]=4 2708 B14R1.941 CCSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_100000210202 [0,1,0,0,0,0|3,0,0]=4 2709 B14R1.941 CCSCC(=O)c1ccc(c(c1)F)Cl 62a_100000210202_100012351892 [0,1,0,0,0,0|3,0,0]=4 2710 B14R1.941 CCSCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_100000210202 [0,1,0,0,0,0|3,0,0]=4 2711 B14R1.941 CN(CCCO)c1ccc(c(c1)Cl)Cl 2230a_100000219944_100000230001 [0,1,0,0,0,0|3,0,0]=4 2712 B14R1.941 CN(CCCO)c1ccc(c(c1)Cl)Cl 269982a_100000219944_100011215043 [0,1,0,0,0,0|3,0,0]=4 2713 B14R1.941 CN(CCCO)c1ccc(c(c1)Cl)Cl 34a_100000219944_100000230001 [0,1,0,0,0,0|3,0,0]=4 2714 B14R1.941 CNCCC(=O)c1ccc(c(c1)Cl)Cl 2230a_106832991635_100012356702 [0,1,0,0,0,0|3,0,0]=4 2715 B14R1.941 CNCCC(=O)c1ccc(c(c1)Cl)Cl 7a_106832991635_100012356702 [0,1,0,0,0,0|3,0,0]=4 2716 B14R1.941 COCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000233755 [0,1,0,0,0,0|3,0,0]=4 2717 B14R1.941 COCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000233755 [0,1,0,0,0,0|3,0,0]=4 2718 B14R1.941 COCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000233755 [0,1,0,0,0,0|3,0,0]=4 2719 B14R1.941 COCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000233755 [0,1,0,0,0,0|3,0,0]=4 2720 B14R1.941 COCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000233755 [0,1,0,0,0,0|3,0,0]=4 2721 B14R1.941 COCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000233755 [0,1,0,0,0,0|3,0,0]=4 2722 B14R1.941 CSCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000751147 [0,1,0,0,0,0|3,0,0]=4 2723 B14R1.941 CSCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000751147 [0,1,0,0,0,0|3,0,0]=4 2724 B14R1.941 CSCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000751147 [0,1,0,0,0,0|3,0,0]=4 2725 B14R1.941 CSCCC(=O)c1ccc(c(c1)Cl)Cl 62a_100012356702_200000210301 [0,1,0,0,0,0|3,0,0]=4 2726 B14R1.941 CSCCC(=O)c1ccc(c(c1)Cl)Cl 62a_200000210301_100012356702 [0,1,0,0,0,0|3,0,0]=4 2727 B14R1.941 CSCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000751147 [0,1,0,0,0,0|3,0,0]=4 2728 B14R1.941 CSCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000751147 [0,1,0,0,0,0|3,0,0]=4 2729 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000751147 [0,1,0,0,0,0|3,0,0]=4 2730 B14R1.941 C[C@@H](NCCF)c1ccc(c(c1)F)Cl 2230a_100016987903_100011217306 [0,1,0,0,0,0|2,0,1]=4 2731 B14R1.941 C[C@@H](NCCF)c1ccc(c(c1)F)Cl 34a_100016987903_100011217306 [0,1,0,0,0,0|2,0,1]=4 2732 B14R1.941 C[C@@H](NCCO)c1ccc(c(c1)Cl)F 2230a_100016987892_100000211926 [0,1,0,0,0,0|1,1,1]=4 2733 B14R1.941 C[C@@H](NCCO)c1ccc(c(c1)Cl)F 34a_100016987892_100000211926 [0,1,0,0,0,0|1,1,1]=4 2734 B14R1.941 C[C@@H](NCCO)c1ccc(c(c1)F)Cl 2230a_100016987903_100000211926 [0,1,0,0,0,0|1,0,1]=3 2735 B14R1.941 C[C@@H](NCCO)c1ccc(c(c1)F)Cl 34a_100016987903_100000211926 [0,1,0,0,0,0|1,0,1]=3 2736 B14R1.941 C[C@H](NCCO)c1ccc(c(c1)Br)F 2230a_100000753309_100000211926 [0,1,0,0,0,0|1,1,1]=4 2737 B14R1.941 C[C@H](NCCO)c1ccc(c(c1)Br)F 34a_100000753309_100000211926 [0,1,0,0,0,0|1,1,1]=4 2738 B14R1.941 C[C@H](NCCO)c1ccc(c(c1)F)Br 2230a_100134618348_100000211926 [0,1,0,0,0,0|1,1,1]=4 2739 B14R1.941 C[C@H](NCCO)c1ccc(c(c1)F)Br 34a_100134618348_100000211926 [0,1,0,0,0,0|1,1,1]=4 2740 B14R1.941 Cc1cc(ccc1Br)C(=O)CCCF 1458a_100000692631_100011934791 [0,1,0,0,0,0|2,1,0]=4 2741 B14R1.941 Cc1cc(ccc1Br)C(=O)CCCO 1458a_100000692631_100011215043 [0,1,0,0,0,0|1,1,0]=3 2742 B14R1.941 Cc1cc(ccc1Br)C(=O)NCC#N 1626a_100000734998_100000692631 [0,1,0,0,0,0|1,1,1]=4 2743 B14R1.941 Cc1cc(ccc1Br)C(=O)NCC#N 527a_100000734998_100000692631 [0,1,0,0,0,0|1,1,1]=4 2744 B14R1.941 Cc1cc(ccc1Br)C(=O)NCCF 11a_100000724931_100000692631 [0,1,0,0,0,0|1,1,0]=3 2745 B14R1.941 Cc1cc(ccc1Br)C(=O)NCCF 1626a_100000724931_100000692631 [0,1,0,0,0,0|1,1,0]=3 2746 B14R1.941 Cc1cc(ccc1Br)C(=O)NCCF 240690a_100000724931_100000692631 [0,1,0,0,0,0|1,1,0]=3 2747 B14R1.941 Cc1cc(ccc1Br)C(=O)NCCF 527a_100000724931_100000692631 [0,1,0,0,0,0|1,1,0]=3 2748 B14R1.941 Cc1cc(ccc1Br)C(=O)NCCO 240690a_100000210304_100000692631 [0,1,0,0,0,0|0,1,0]=2 2749 B14R1.941 Cc1cc(ccc1Br)C(=O)NCCO 527a_100000210304_100000692631 [0,1,0,0,0,0|0,1,0]=2 2750 B14R1.941 Cc1cc(ccc1Br)C(C)NCCO 269862a_100000210304_100000697869 [0,1,0,0,0,0|1,1,1]=4 2751 B14R1.941 Cc1cc(ccc1Cl)C(=O)CCC#N 1458a_100000686306_100011215226 [0,1,0,0,0,0|2,0,1]=4 2752 B14R1.941 Cc1cc(ccc1Cl)C(=O)CCCF 1458a_100000686306_100011934791 [0,1,0,0,0,0|2,0,0]=3 2753 B14R1.941 Cc1cc(ccc1Cl)C(=O)CCCO 1458a_100000686306_100011215043 [0,1,0,0,0,0|1,0,0]=2 2754 B14R1.941 Cc1cc(ccc1Cl)C(=O)CSCF 62a_100015361967_200011216723 [0,1,0,0,0,0|3,0,0]=4 2755 B14R1.941 Cc1cc(ccc1Cl)C(=O)CSCF 62a_200011216723_100015361967 [0,1,0,0,0,0|3,0,0]=4 2756 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCC#N 1626a_100000734998_100000686306 [0,1,0,0,0,0|1,0,1]=3 2757 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCC#N 527a_100000734998_100000686306 [0,1,0,0,0,0|1,0,1]=3 2758 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCCF 11a_100000724931_100000686306 [0,1,0,0,0,0|1,0,0]=2 2759 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCCF 1626a_100000724931_100000686306 [0,1,0,0,0,0|1,0,0]=2 2760 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCCF 240690a_100000724931_100000686306 [0,1,0,0,0,0|1,0,0]=2 2761 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCCF 527a_100000724931_100000686306 [0,1,0,0,0,0|1,0,0]=2 2762 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCCO 240690a_100000210304_100000686306 [0,1,0,0,0,0|0,0,0]=1 2763 B14R1.941 Cc1cc(ccc1Cl)C(=O)NCCO 527a_100000210304_100000686306 [0,1,0,0,0,0|0,0,0]=1 2764 B14R1.941 Cc1cc(ccc1Cl)C(C)NCCF 269862a_100000724931_100011216000 [0,1,0,0,0,0|2,0,1]=4 2765 B14R1.941 Cc1cc(ccc1Cl)C(C)NCCO 269862a_100000210304_100011216000 [0,1,0,0,0,0|1,0,1]=3 2766 B14R1.941 Cc1cc(ccc1Cl)N(C)CCCO 2230a_114849113799_100000230001 [0,1,0,0,0,0|3,0,0]=4 2767 B14R1.941 Cc1cc(ccc1Cl)N(C)CCCO 269982a_114849113799_100011215043 [0,1,0,0,0,0|3,0,0]=4 2768 B14R1.941 Cc1cc(ccc1Cl)N(C)CCCO 34a_114849113799_100000230001 [0,1,0,0,0,0|3,0,0]=4 2769 B14R1.941 Cc1cc(ccc1F)C(=O)CCCF 1458a_100000751819_100011934791 [0,1,0,0,0,0|2,1,0]=4 2770 B14R1.941 Cc1cc(ccc1F)C(=O)CCCO 1458a_100000751819_100011215043 [0,1,0,0,0,0|1,1,0]=3 2771 B14R1.941 Cc1cc(ccc1F)C(=O)NCC#N 1626a_100000734998_100000751819 [0,1,0,0,0,0|1,1,1]=4 2772 B14R1.941 Cc1cc(ccc1F)C(=O)NCC#N 527a_100000734998_100000751819 [0,1,0,0,0,0|1,1,1]=4 2773 B14R1.941 Cc1cc(ccc1F)C(=O)NCCF 11a_100000724931_100000751819 [0,1,0,0,0,0|1,1,0]=3 2774 B14R1.941 Cc1cc(ccc1F)C(=O)NCCF 1626a_100000724931_100000751819 [0,1,0,0,0,0|1,1,0]=3 2775 B14R1.941 Cc1cc(ccc1F)C(=O)NCCF 240690a_100000724931_100000751819 [0,1,0,0,0,0|1,1,0]=3 2776 B14R1.941 Cc1cc(ccc1F)C(=O)NCCF 527a_100000724931_100000751819 [0,1,0,0,0,0|1,1,0]=3 2777 B14R1.941 Cc1cc(ccc1F)C(=O)NCCO 240690a_100000210304_100000751819 [0,1,0,0,0,0|0,1,0]=2 2778 B14R1.941 Cc1cc(ccc1F)C(=O)NCCO 527a_100000210304_100000751819 [0,1,0,0,0,0|0,1,0]=2 2779 B14R1.941 Cc1cc(ccc1F)C(C)NCCO 2230a_100000705826_100000211926 [0,1,0,0,0,0|1,1,1]=4 2780 B14R1.941 Cc1cc(ccc1F)C(C)NCCO 269862a_100000210304_100000754758 [0,1,0,0,0,0|1,1,1]=4 2781 B14R1.941 Cc1cc(ccc1F)C(C)NCCO 34a_100000705826_100000211926 [0,1,0,0,0,0|1,1,1]=4 2782 B14R1.941 Cc1cc(ccc1I)C(=O)CCCF 1458a_100000751300_100011934791 [0,1,0,0,0,0|2,1,0]=4 2783 B14R1.941 Cc1cc(ccc1I)C(=O)CCCO 1458a_100000751300_100011215043 [0,1,0,0,0,0|1,1,0]=3 2784 B14R1.941 Cc1cc(ccc1I)C(=O)NCC#N 1626a_100000734998_100000751300 [0,1,0,0,0,0|1,1,1]=4 2785 B14R1.941 Cc1cc(ccc1I)C(=O)NCC#N 527a_100000734998_100000751300 [0,1,0,0,0,0|1,1,1]=4 2786 B14R1.941 Cc1cc(ccc1I)C(=O)NCCF 11a_100000724931_100000751300 [0,1,0,0,0,0|1,1,0]=3 2787 B14R1.941 Cc1cc(ccc1I)C(=O)NCCF 1626a_100000724931_100000751300 [0,1,0,0,0,0|1,1,0]=3 2788 B14R1.941 Cc1cc(ccc1I)C(=O)NCCF 240690a_100000724931_100000751300 [0,1,0,0,0,0|1,1,0]=3 2789 B14R1.941 Cc1cc(ccc1I)C(=O)NCCF 527a_100000724931_100000751300 [0,1,0,0,0,0|1,1,0]=3 2790 B14R1.941 Cc1cc(ccc1I)C(=O)NCCO 240690a_100000210304_100000751300 [0,1,0,0,0,0|0,1,0]=2 2791 B14R1.941 Cc1cc(ccc1I)C(=O)NCCO 527a_100000210304_100000751300 [0,1,0,0,0,0|0,1,0]=2 2792 B14R1.941 Cc1cc(ccc1O)C(=O)CCCF 1458a_100000685612_100011934791 [0,1,0,0,0,0|3,0,0]=4 2793 B14R1.941 Cc1cc(ccc1O)C(=O)CCCO 1458a_100000685612_100011215043 [0,1,0,0,0,0|2,0,0]=3 2794 B14R1.941 Cc1cc(ccc1O)C(=O)NCCF 240690a_100000724931_100000685612 [0,1,0,0,0,0|2,0,0]=3 2795 B14R1.941 Cc1cc(ccc1O)C(=O)NCCO 240690a_100000210304_100000685612 [0,1,0,0,0,0|1,0,0]=2 2796 B14R1.941 Cc1cc(ccc1O)C(C)NCCO 269862a_100000210304_100000188726 [0,1,0,0,0,0|2,0,1]=4 2797 B14R1.941 Cc1cc(cnc1Cl)C(C)NCCO 269862a_100000210304_100009864263 [0,1,0,0,0,0|2,0,1]=4 2798 B14R1.941 Cc1ccc(cc1Br)C(=O)CCCF 1458a_100000186397_100011934791 [0,1,0,0,0,0|3,0,0]=4 2799 B14R1.941 Cc1ccc(cc1Br)C(=O)CCCO 1458a_100000186397_100011215043 [0,1,0,0,0,0|2,0,0]=3 2800 B14R1.941 Cc1ccc(cc1Br)C(=O)NCC#N 1626a_100000734998_100000186397 [0,1,0,0,0,0|2,0,1]=4 2801 B14R1.941 Cc1ccc(cc1Br)C(=O)NCC#N 527a_100000734998_100000186397 [0,1,0,0,0,0|2,0,1]=4 2802 B14R1.941 Cc1ccc(cc1Br)C(=O)NCCF 11a_100000724931_100000186397 [0,1,0,0,0,0|2,0,0]=3 2803 B14R1.941 Cc1ccc(cc1Br)C(=O)NCCF 1626a_100000724931_100000186397 [0,1,0,0,0,0|2,0,0]=3 2804 B14R1.941 Cc1ccc(cc1Br)C(=O)NCCF 240690a_100000724931_100000186397 [0,1,0,0,0,0|2,0,0]=3 2805 B14R1.941 Cc1ccc(cc1Br)C(=O)NCCF 527a_100000724931_100000186397 [0,1,0,0,0,0|2,0,0]=3 2806 B14R1.941 Cc1ccc(cc1Br)C(=O)NCCO 240690a_100000210304_100000186397 [0,1,0,0,0,0|1,0,0]=2 2807 B14R1.941 Cc1ccc(cc1Br)C(=O)NCCO 527a_100000210304_100000186397 [0,1,0,0,0,0|1,0,0]=2 2808 B14R1.941 Cc1ccc(cc1Br)C(C)NCCO 269862a_100000210304_100011934287 [0,1,0,0,0,0|2,0,1]=4 2809 B14R1.941 Cc1ccc(cc1C)C(=O)CCCF 1458a_100000210898_100011934791 [0,1,0,0,0,0|3,0,0]=4 2810 B14R1.941 Cc1ccc(cc1C)C(=O)CCCO 1458a_100000210898_100011215043 [0,1,0,0,0,0|2,0,0]=3 2811 B14R1.941 Cc1ccc(cc1C)C(=O)NCC#N 1626a_100000734998_100000210898 [0,1,0,0,0,0|2,0,1]=4 2812 B14R1.941 Cc1ccc(cc1C)C(=O)NCC#N 527a_100000734998_100000210898 [0,1,0,0,0,0|2,0,1]=4 2813 B14R1.941 Cc1ccc(cc1C)C(=O)NCCF 11a_100000724931_100000210898 [0,1,0,0,0,0|2,0,0]=3 2814 B14R1.941 Cc1ccc(cc1C)C(=O)NCCF 1626a_100000724931_100000210898 [0,1,0,0,0,0|2,0,0]=3 2815 B14R1.941 Cc1ccc(cc1C)C(=O)NCCF 240690a_100000724931_100000210898 [0,1,0,0,0,0|2,0,0]=3 2816 B14R1.941 Cc1ccc(cc1C)C(=O)NCCF 527a_100000724931_100000210898 [0,1,0,0,0,0|2,0,0]=3 2817 B14R1.941 Cc1ccc(cc1C)C(=O)NCCO 240690a_100000210304_100000210898 [0,1,0,0,0,0|1,0,0]=2 2818 B14R1.941 Cc1ccc(cc1C)C(=O)NCCO 527a_100000210304_100000210898 [0,1,0,0,0,0|1,0,0]=2 2819 B14R1.941 Cc1ccc(cc1C)C(C)NCCO 269862a_100000210304_100000210971 [0,1,0,0,0,0|2,0,1]=4 2820 B14R1.941 Cc1ccc(cc1C)[C@@H](C)NCCO 2230a_100015184928_100000211926 [0,1,0,0,0,0|2,0,1]=4 2821 B14R1.941 Cc1ccc(cc1C)[C@@H](C)NCCO 34a_100015184928_100000211926 [0,1,0,0,0,0|2,0,1]=4 2822 B14R1.941 Cc1ccc(cc1Cl)C(=O)CCCF 1458a_100000751740_100011934791 [0,1,0,0,0,0|3,0,0]=4 2823 B14R1.941 Cc1ccc(cc1Cl)C(=O)CCCO 1458a_100000751740_100011215043 [0,1,0,0,0,0|2,0,0]=3 2824 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCC#N 1626a_100000734998_100000751740 [0,1,0,0,0,0|2,0,1]=4 2825 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCC#N 527a_100000734998_100000751740 [0,1,0,0,0,0|2,0,1]=4 2826 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCCF 11a_100000724931_100000751740 [0,1,0,0,0,0|2,0,0]=3 2827 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCCF 1626a_100000724931_100000751740 [0,1,0,0,0,0|2,0,0]=3 2828 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCCF 240690a_100000724931_100000751740 [0,1,0,0,0,0|2,0,0]=3 2829 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCCF 527a_100000724931_100000751740 [0,1,0,0,0,0|2,0,0]=3 2830 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCCO 240690a_100000210304_100000751740 [0,1,0,0,0,0|1,0,0]=2 2831 B14R1.941 Cc1ccc(cc1Cl)C(=O)NCCO 527a_100000210304_100000751740 [0,1,0,0,0,0|1,0,0]=2 2832 B14R1.941 Cc1ccc(cc1Cl)C(C)NCCO 2230a_100012005020_100000211926 [0,1,0,0,0,0|2,0,1]=4 2833 B14R1.941 Cc1ccc(cc1Cl)C(C)NCCO 269862a_100000210304_100012002458 [0,1,0,0,0,0|2,0,1]=4 2834 B14R1.941 Cc1ccc(cc1Cl)C(C)NCCO 34a_100012005020_100000211926 [0,1,0,0,0,0|2,0,1]=4 2835 B14R1.941 Cc1ccc(cc1F)C(=O)CCCF 1458a_100000212313_100011934791 [0,1,0,0,0,0|3,0,0]=4 2836 B14R1.941 Cc1ccc(cc1F)C(=O)CCCO 1458a_100000212313_100011215043 [0,1,0,0,0,0|2,0,0]=3 2837 B14R1.941 Cc1ccc(cc1F)C(=O)NCC#N 1626a_100000734998_100000212313 [0,1,0,0,0,0|2,0,1]=4 2838 B14R1.941 Cc1ccc(cc1F)C(=O)NCC#N 527a_100000734998_100000212313 [0,1,0,0,0,0|2,0,1]=4 2839 B14R1.941 Cc1ccc(cc1F)C(=O)NCCF 11a_100000724931_100000212313 [0,1,0,0,0,0|2,0,0]=3 2840 B14R1.941 Cc1ccc(cc1F)C(=O)NCCF 1626a_100000724931_100000212313 [0,1,0,0,0,0|2,0,0]=3 2841 B14R1.941 Cc1ccc(cc1F)C(=O)NCCF 240690a_100000724931_100000212313 [0,1,0,0,0,0|2,0,0]=3 2842 B14R1.941 Cc1ccc(cc1F)C(=O)NCCF 527a_100000724931_100000212313 [0,1,0,0,0,0|2,0,0]=3 2843 B14R1.941 Cc1ccc(cc1F)C(=O)NCCO 240690a_100000210304_100000212313 [0,1,0,0,0,0|1,0,0]=2 2844 B14R1.941 Cc1ccc(cc1F)C(=O)NCCO 527a_100000210304_100000212313 [0,1,0,0,0,0|1,0,0]=2 2845 B14R1.941 Cc1ccc(cc1F)C(C)NCCO 269862a_100000210304_100000767010 [0,1,0,0,0,0|2,0,1]=4 2846 B14R1.941 Cc1ccc(cc1F)[C@H](C)NCCO 2230a_100011997884_100000211926 [0,1,0,0,0,0|2,0,1]=4 2847 B14R1.941 Cc1ccc(cc1F)[C@H](C)NCCO 34a_100011997884_100000211926 [0,1,0,0,0,0|2,0,1]=4 2848 B14R1.941 Cc1ccc(cc1I)C(=O)CCCF 1458a_100000751299_100011934791 [0,1,0,0,0,0|3,0,0]=4 2849 B14R1.941 Cc1ccc(cc1I)C(=O)CCCO 1458a_100000751299_100011215043 [0,1,0,0,0,0|2,0,0]=3 2850 B14R1.941 Cc1ccc(cc1I)C(=O)NCC#N 1626a_100000734998_100000751299 [0,1,0,0,0,0|2,0,1]=4 2851 B14R1.941 Cc1ccc(cc1I)C(=O)NCC#N 527a_100000734998_100000751299 [0,1,0,0,0,0|2,0,1]=4 2852 B14R1.941 Cc1ccc(cc1I)C(=O)NCCF 11a_100000724931_100000751299 [0,1,0,0,0,0|2,0,0]=3 2853 B14R1.941 Cc1ccc(cc1I)C(=O)NCCF 1626a_100000724931_100000751299 [0,1,0,0,0,0|2,0,0]=3 2854 B14R1.941 Cc1ccc(cc1I)C(=O)NCCF 240690a_100000724931_100000751299 [0,1,0,0,0,0|2,0,0]=3 2855 B14R1.941 Cc1ccc(cc1I)C(=O)NCCF 527a_100000724931_100000751299 [0,1,0,0,0,0|2,0,0]=3 2856 B14R1.941 Cc1ccc(cc1I)C(=O)NCCO 240690a_100000210304_100000751299 [0,1,0,0,0,0|1,0,0]=2 2857 B14R1.941 Cc1ccc(cc1I)C(=O)NCCO 527a_100000210304_100000751299 [0,1,0,0,0,0|1,0,0]=2 2858 B14R1.941 Cc1ccc(cc1O)C(=O)CCCF 1458a_100000233767_100011934791 [0,1,0,0,0,0|3,0,0]=4 2859 B14R1.941 Cc1ccc(cc1O)C(=O)CCCO 1458a_100000233767_100011215043 [0,1,0,0,0,0|2,0,0]=3 2860 B14R1.941 Cc1ccc(cc1O)C(=O)NCCF 240690a_100000724931_100000233767 [0,1,0,0,0,0|2,0,0]=3 2861 B14R1.941 Cc1ccc(cc1O)C(=O)NCCO 240690a_100000210304_100000233767 [0,1,0,0,0,0|1,0,0]=2 2862 B14R1.941 Cc1ccc(cc1O)C(C)NCCO 269862a_100000210304_100000084092 [0,1,0,0,0,0|2,0,1]=4 2863 B14R1.941 N#CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011215226 [0,1,0,0,0,0|2,0,1]=4 2864 B14R1.941 N#CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011215226 [0,1,0,0,0,0|2,0,1]=4 2865 B14R1.941 N#CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100011215226 [0,1,0,0,0,0|2,0,1]=4 2866 B14R1.941 N#CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100011215226 [0,1,0,0,0,0|2,0,1]=4 2867 B14R1.941 N#CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100011215226 [0,1,0,0,0,0|2,0,1]=4 2868 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)Br 1626a_100000734998_100012339404 [0,1,0,0,0,0|1,1,1]=4 2869 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)Br 527a_100000734998_100012339404 [0,1,0,0,0,0|1,1,1]=4 2870 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000734998_100000691181 [0,1,0,0,0,0|1,0,1]=3 2871 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000734998_100000691181 [0,1,0,0,0,0|1,0,1]=3 2872 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)F 1626a_100000734998_100000760357 [0,1,0,0,0,0|1,1,1]=4 2873 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)F 527a_100000734998_100000760357 [0,1,0,0,0,0|1,1,1]=4 2874 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)I 1626a_100000734998_100000739115 [0,1,0,0,0,0|1,1,1]=4 2875 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Br)I 527a_100000734998_100000739115 [0,1,0,0,0,0|1,1,1]=4 2876 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000734998_100000687082 [0,1,0,0,0,0|1,1,1]=4 2877 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)Br 527a_100000734998_100000687082 [0,1,0,0,0,0|1,1,1]=4 2878 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000734998_100000210401 [0,1,0,0,0,0|1,0,1]=3 2879 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000734998_100000210401 [0,1,0,0,0,0|1,0,1]=3 2880 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)F 1626a_100000734998_100000686462 [0,1,0,0,0,0|1,1,1]=4 2881 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)F 527a_100000734998_100000686462 [0,1,0,0,0,0|1,1,1]=4 2882 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)I 1626a_100000734998_100000684831 [0,1,0,0,0,0|1,1,1]=4 2883 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)I 527a_100000734998_100000684831 [0,1,0,0,0,0|1,1,1]=4 2884 B14R1.941 N#CCNC(=O)c1ccc(c(c1)Cl)O 527a_100000734998_100000212196 [0,1,0,0,0,0|2,0,1]=4 2885 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)Br 1626a_100000734998_100000743946 [0,1,0,0,0,0|1,1,1]=4 2886 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)Br 527a_100000734998_100000743946 [0,1,0,0,0,0|1,1,1]=4 2887 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000734998_100000743183 [0,1,0,0,0,0|1,0,1]=3 2888 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)Cl 527a_100000734998_100000743183 [0,1,0,0,0,0|1,0,1]=3 2889 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)F 1626a_100000734998_100000209822 [0,1,0,0,0,0|1,1,1]=4 2890 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)F 527a_100000734998_100000209822 [0,1,0,0,0,0|1,1,1]=4 2891 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)I 1626a_100000734998_100000062624 [0,1,0,0,0,0|1,1,1]=4 2892 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)I 527a_100000734998_100000062624 [0,1,0,0,0,0|1,1,1]=4 2893 B14R1.941 N#CCNC(=O)c1ccc(c(c1)F)O 527a_100000734998_100000185466 [0,1,0,0,0,0|2,0,1]=4 2894 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)Br 1626a_100000734998_100012343876 [0,1,0,0,0,0|1,1,1]=4 2895 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)Br 527a_100000734998_100012343876 [0,1,0,0,0,0|1,1,1]=4 2896 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000734998_100000739381 [0,1,0,0,0,0|1,0,1]=3 2897 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)Cl 527a_100000734998_100000739381 [0,1,0,0,0,0|1,0,1]=3 2898 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)F 1626a_100000734998_100000688015 [0,1,0,0,0,0|1,1,1]=4 2899 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)F 527a_100000734998_100000688015 [0,1,0,0,0,0|1,1,1]=4 2900 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)I 1626a_100000734998_100000725830 [0,1,0,0,0,0|1,1,1]=4 2901 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)I 527a_100000734998_100000725830 [0,1,0,0,0,0|1,1,1]=4 2902 B14R1.941 N#CCNC(=O)c1ccc(c(c1)I)O 1626a_100000734998_100000037485 [0,1,0,0,0,0|2,0,1]=4 2903 B14R1.941 N#CCNC(=O)c1ccc(c(c1)O)Br 527a_100000734998_100000689001 [0,1,0,0,0,0|1,1,1]=4 2904 B14R1.941 N#CCNC(=O)c1ccc(c(c1)O)Cl 527a_100000734998_100011933997 [0,1,0,0,0,0|1,0,1]=3 2905 B14R1.941 N#CCNC(=O)c1ccc(c(c1)O)F 527a_100000734998_100000035894 [0,1,0,0,0,0|1,1,1]=4 2906 B14R1.941 N#CCNC(=O)c1ccc(c(c1)O)I 1626a_100000734998_100000239334 [0,1,0,0,0,0|1,1,1]=4 2907 B14R1.941 N#CCNC(=O)c1ccc(c(c1)O)I 527a_100000734998_100000239334 [0,1,0,0,0,0|1,1,1]=4 2908 B14R1.941 O=C(CCCF)c1ccc(c(c1)Br)Br 1458a_100012339404_100011934791 [0,1,0,0,0,0|2,1,0]=4 2909 B14R1.941 O=C(CCCF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011934791 [0,1,0,0,0,0|2,0,0]=3 2910 B14R1.941 O=C(CCCF)c1ccc(c(c1)Br)F 1458a_100000760357_100011934791 [0,1,0,0,0,0|2,1,0]=4 2911 B14R1.941 O=C(CCCF)c1ccc(c(c1)Br)I 1458a_100000739115_100011934791 [0,1,0,0,0,0|2,1,0]=4 2912 B14R1.941 O=C(CCCF)c1ccc(c(c1)Br)O 1458a_100000189672_100011934791 [0,1,0,0,0,0|3,0,0]=4 2913 B14R1.941 O=C(CCCF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011934791 [0,1,0,0,0,0|2,1,0]=4 2914 B14R1.941 O=C(CCCF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011934791 [0,1,0,0,0,0|2,0,0]=3 2915 B14R1.941 O=C(CCCF)c1ccc(c(c1)Cl)F 1458a_100000686462_100011934791 [0,1,0,0,0,0|2,1,0]=4 2916 B14R1.941 O=C(CCCF)c1ccc(c(c1)Cl)I 1458a_100000684831_100011934791 [0,1,0,0,0,0|2,1,0]=4 2917 B14R1.941 O=C(CCCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100011934791 [0,1,0,0,0,0|3,0,0]=4 2918 B14R1.941 O=C(CCCF)c1ccc(c(c1)F)Br 1458a_100000743946_100011934791 [0,1,0,0,0,0|2,1,0]=4 2919 B14R1.941 O=C(CCCF)c1ccc(c(c1)F)Cl 1458a_100000743183_100011934791 [0,1,0,0,0,0|2,0,0]=3 2920 B14R1.941 O=C(CCCF)c1ccc(c(c1)F)F 1458a_100000209822_100011934791 [0,1,0,0,0,0|2,1,0]=4 2921 B14R1.941 O=C(CCCF)c1ccc(c(c1)F)I 1458a_100000062624_100011934791 [0,1,0,0,0,0|2,1,0]=4 2922 B14R1.941 O=C(CCCF)c1ccc(c(c1)F)O 1458a_100000185466_100011934791 [0,1,0,0,0,0|3,0,0]=4 2923 B14R1.941 O=C(CCCF)c1ccc(c(c1)I)Br 1458a_100012343876_100011934791 [0,1,0,0,0,0|2,1,0]=4 2924 B14R1.941 O=C(CCCF)c1ccc(c(c1)I)Cl 1458a_100000739381_100011934791 [0,1,0,0,0,0|2,0,0]=3 2925 B14R1.941 O=C(CCCF)c1ccc(c(c1)I)F 1458a_100000688015_100011934791 [0,1,0,0,0,0|2,1,0]=4 2926 B14R1.941 O=C(CCCF)c1ccc(c(c1)I)I 1458a_100000725830_100011934791 [0,1,0,0,0,0|2,1,0]=4 2927 B14R1.941 O=C(CCCF)c1ccc(c(c1)I)O 1458a_100000037485_100011934791 [0,1,0,0,0,0|3,0,0]=4 2928 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)Br 1458a_100000689001_100011934791 [0,1,0,0,0,0|2,1,0]=4 2929 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100011934791 [0,1,0,0,0,0|2,0,0]=3 2930 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)F 1458a_100000035894_100011934791 [0,1,0,0,0,0|2,1,0]=4 2931 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)I 1458a_100000239334_100011934791 [0,1,0,0,0,0|2,1,0]=4 2932 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)O 1458a_100000212155_100011934791 [0,1,0,0,0,0|3,0,0]=4 2933 B14R1.941 O=C(CCCO)c1ccc(c(c1)Br)Br 1458a_100012339404_100011215043 [0,1,0,0,0,0|1,1,0]=3 2934 B14R1.941 O=C(CCCO)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011215043 [0,1,0,0,0,0|1,0,0]=2 2935 B14R1.941 O=C(CCCO)c1ccc(c(c1)Br)F 1458a_100000760357_100011215043 [0,1,0,0,0,0|1,1,0]=3 2936 B14R1.941 O=C(CCCO)c1ccc(c(c1)Br)I 1458a_100000739115_100011215043 [0,1,0,0,0,0|1,1,0]=3 2937 B14R1.941 O=C(CCCO)c1ccc(c(c1)Br)O 1458a_100000189672_100011215043 [0,1,0,0,0,0|2,0,0]=3 2938 B14R1.941 O=C(CCCO)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011215043 [0,1,0,0,0,0|1,1,0]=3 2939 B14R1.941 O=C(CCCO)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011215043 [0,1,0,0,0,0|1,0,0]=2 2940 B14R1.941 O=C(CCCO)c1ccc(c(c1)Cl)F 1458a_100000686462_100011215043 [0,1,0,0,0,0|1,1,0]=3 2941 B14R1.941 O=C(CCCO)c1ccc(c(c1)Cl)I 1458a_100000684831_100011215043 [0,1,0,0,0,0|1,1,0]=3 2942 B14R1.941 O=C(CCCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100011215043 [0,1,0,0,0,0|2,0,0]=3 2943 B14R1.941 O=C(CCCO)c1ccc(c(c1)F)Br 1458a_100000743946_100011215043 [0,1,0,0,0,0|1,1,0]=3 2944 B14R1.941 O=C(CCCO)c1ccc(c(c1)F)Cl 1458a_100000743183_100011215043 [0,1,0,0,0,0|1,0,0]=2 2945 B14R1.941 O=C(CCCO)c1ccc(c(c1)F)F 1458a_100000209822_100011215043 [0,1,0,0,0,0|1,1,0]=3 2946 B14R1.941 O=C(CCCO)c1ccc(c(c1)F)I 1458a_100000062624_100011215043 [0,1,0,0,0,0|1,1,0]=3 2947 B14R1.941 O=C(CCCO)c1ccc(c(c1)F)O 1458a_100000185466_100011215043 [0,1,0,0,0,0|2,0,0]=3 2948 B14R1.941 O=C(CCCO)c1ccc(c(c1)I)Br 1458a_100012343876_100011215043 [0,1,0,0,0,0|1,1,0]=3 2949 B14R1.941 O=C(CCCO)c1ccc(c(c1)I)Cl 1458a_100000739381_100011215043 [0,1,0,0,0,0|1,0,0]=2 2950 B14R1.941 O=C(CCCO)c1ccc(c(c1)I)F 1458a_100000688015_100011215043 [0,1,0,0,0,0|1,1,0]=3 2951 B14R1.941 O=C(CCCO)c1ccc(c(c1)I)I 1458a_100000725830_100011215043 [0,1,0,0,0,0|1,1,0]=3 2952 B14R1.941 O=C(CCCO)c1ccc(c(c1)I)O 1458a_100000037485_100011215043 [0,1,0,0,0,0|2,0,0]=3 2953 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)Br 1458a_100000689001_100011215043 [0,1,0,0,0,0|1,1,0]=3 2954 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100011215043 [0,1,0,0,0,0|1,0,0]=2 2955 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)F 1458a_100000035894_100011215043 [0,1,0,0,0,0|1,1,0]=3 2956 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)I 1458a_100000239334_100011215043 [0,1,0,0,0,0|1,1,0]=3 2957 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)O 1458a_100000212155_100011215043 [0,1,0,0,0,0|2,0,0]=3 2958 B14R1.941 O=C(COCF)c1ccc(c(c1)Cl)Cl 7a_100000246375_100015361967 [0,1,0,0,0,0|3,0,0]=4 2959 B14R1.941 O=C(CSCF)c1ccc(c(c1)Cl)Cl 62a_100000211430_100015361967 [0,1,0,0,0,0|3,0,0]=4 2960 B14R1.941 O=C(CSCF)c1ccc(c(c1)Cl)Cl 62a_100015361967_100000211430 [0,1,0,0,0,0|3,0,0]=4 2961 B14R1.941 O=C(CSCF)c1ccc(c(c1)F)Cl 62a_100012351892_100015361967 [0,1,0,0,0,0|3,0,0]=4 2962 B14R1.941 O=C(CSCF)c1ccc(c(c1)F)Cl 62a_100015361967_100012351892 [0,1,0,0,0,0|3,0,0]=4 2963 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Br 11a_100000724931_100012339404 [0,1,0,0,0,0|1,1,0]=3 2964 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Br 1626a_100000724931_100012339404 [0,1,0,0,0,0|1,1,0]=3 2965 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Br 240690a_100000724931_100012339404 [0,1,0,0,0,0|1,1,0]=3 2966 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Br 527a_100000724931_100012339404 [0,1,0,0,0,0|1,1,0]=3 2967 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Cl 11a_100000724931_100000691181 [0,1,0,0,0,0|1,0,0]=2 2968 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Cl 1626a_100000724931_100000691181 [0,1,0,0,0,0|1,0,0]=2 2969 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Cl 240690a_100000724931_100000691181 [0,1,0,0,0,0|1,0,0]=2 2970 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)Cl 527a_100000724931_100000691181 [0,1,0,0,0,0|1,0,0]=2 2971 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)F 11a_100000724931_100000760357 [0,1,0,0,0,0|1,1,0]=3 2972 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)F 1626a_100000724931_100000760357 [0,1,0,0,0,0|1,1,0]=3 2973 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)F 240690a_100000724931_100000760357 [0,1,0,0,0,0|1,1,0]=3 2974 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)F 527a_100000724931_100000760357 [0,1,0,0,0,0|1,1,0]=3 2975 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)I 11a_100000724931_100000739115 [0,1,0,0,0,0|1,1,0]=3 2976 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)I 1626a_100000724931_100000739115 [0,1,0,0,0,0|1,1,0]=3 2977 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)I 240690a_100000724931_100000739115 [0,1,0,0,0,0|1,1,0]=3 2978 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)I 527a_100000724931_100000739115 [0,1,0,0,0,0|1,1,0]=3 2979 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)O 240690a_100000724931_100000189672 [0,1,0,0,0,0|2,0,0]=3 2980 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Br 11a_100000724931_100000687082 [0,1,0,0,0,0|1,1,0]=3 2981 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Br 1626a_100000724931_100000687082 [0,1,0,0,0,0|1,1,0]=3 2982 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Br 240690a_100000724931_100000687082 [0,1,0,0,0,0|1,1,0]=3 2983 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Br 527a_100000724931_100000687082 [0,1,0,0,0,0|1,1,0]=3 2984 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Cl 11a_100000724931_100000210401 [0,1,0,0,0,0|1,0,0]=2 2985 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Cl 1626a_100000724931_100000210401 [0,1,0,0,0,0|1,0,0]=2 2986 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Cl 240690a_100000724931_100000210401 [0,1,0,0,0,0|1,0,0]=2 2987 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)Cl 527a_100000724931_100000210401 [0,1,0,0,0,0|1,0,0]=2 2988 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)F 11a_100000724931_100000686462 [0,1,0,0,0,0|1,1,0]=3 2989 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)F 1626a_100000724931_100000686462 [0,1,0,0,0,0|1,1,0]=3 2990 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)F 240690a_100000724931_100000686462 [0,1,0,0,0,0|1,1,0]=3 2991 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)F 527a_100000724931_100000686462 [0,1,0,0,0,0|1,1,0]=3 2992 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)I 11a_100000724931_100000684831 [0,1,0,0,0,0|1,1,0]=3 2993 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)I 1626a_100000724931_100000684831 [0,1,0,0,0,0|1,1,0]=3 2994 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)I 240690a_100000724931_100000684831 [0,1,0,0,0,0|1,1,0]=3 2995 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)I 527a_100000724931_100000684831 [0,1,0,0,0,0|1,1,0]=3 2996 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)O 240690a_100000724931_100000212196 [0,1,0,0,0,0|2,0,0]=3 2997 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)O 527a_100000724931_100000212196 [0,1,0,0,0,0|2,0,0]=3 2998 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Br 11a_100000724931_100000743946 [0,1,0,0,0,0|1,1,0]=3 2999 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Br 1626a_100000724931_100000743946 [0,1,0,0,0,0|1,1,0]=3 3000 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Br 240690a_100000724931_100000743946 [0,1,0,0,0,0|1,1,0]=3 3001 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Br 527a_100000724931_100000743946 [0,1,0,0,0,0|1,1,0]=3 3002 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Cl 11a_100000724931_100000743183 [0,1,0,0,0,0|1,0,0]=2 3003 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Cl 1626a_100000724931_100000743183 [0,1,0,0,0,0|1,0,0]=2 3004 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Cl 240690a_100000724931_100000743183 [0,1,0,0,0,0|1,0,0]=2 3005 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)Cl 527a_100000724931_100000743183 [0,1,0,0,0,0|1,0,0]=2 3006 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)F 11a_100000724931_100000209822 [0,1,0,0,0,0|1,1,0]=3 3007 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)F 1626a_100000724931_100000209822 [0,1,0,0,0,0|1,1,0]=3 3008 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)F 240690a_100000724931_100000209822 [0,1,0,0,0,0|1,1,0]=3 3009 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)F 527a_100000724931_100000209822 [0,1,0,0,0,0|1,1,0]=3 3010 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)I 11a_100000724931_100000062624 [0,1,0,0,0,0|1,1,0]=3 3011 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)I 1626a_100000724931_100000062624 [0,1,0,0,0,0|1,1,0]=3 3012 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)I 240690a_100000724931_100000062624 [0,1,0,0,0,0|1,1,0]=3 3013 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)I 527a_100000724931_100000062624 [0,1,0,0,0,0|1,1,0]=3 3014 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)O 240690a_100000724931_100000185466 [0,1,0,0,0,0|2,0,0]=3 3015 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)O 527a_100000724931_100000185466 [0,1,0,0,0,0|2,0,0]=3 3016 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Br 11a_100000724931_100012343876 [0,1,0,0,0,0|1,1,0]=3 3017 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Br 1626a_100000724931_100012343876 [0,1,0,0,0,0|1,1,0]=3 3018 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Br 240690a_100000724931_100012343876 [0,1,0,0,0,0|1,1,0]=3 3019 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Br 527a_100000724931_100012343876 [0,1,0,0,0,0|1,1,0]=3 3020 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Cl 11a_100000724931_100000739381 [0,1,0,0,0,0|1,0,0]=2 3021 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Cl 1626a_100000724931_100000739381 [0,1,0,0,0,0|1,0,0]=2 3022 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Cl 240690a_100000724931_100000739381 [0,1,0,0,0,0|1,0,0]=2 3023 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)Cl 527a_100000724931_100000739381 [0,1,0,0,0,0|1,0,0]=2 3024 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)F 11a_100000724931_100000688015 [0,1,0,0,0,0|1,1,0]=3 3025 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)F 1626a_100000724931_100000688015 [0,1,0,0,0,0|1,1,0]=3 3026 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)F 240690a_100000724931_100000688015 [0,1,0,0,0,0|1,1,0]=3 3027 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)F 527a_100000724931_100000688015 [0,1,0,0,0,0|1,1,0]=3 3028 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)I 11a_100000724931_100000725830 [0,1,0,0,0,0|1,1,0]=3 3029 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)I 1626a_100000724931_100000725830 [0,1,0,0,0,0|1,1,0]=3 3030 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)I 240690a_100000724931_100000725830 [0,1,0,0,0,0|1,1,0]=3 3031 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)I 527a_100000724931_100000725830 [0,1,0,0,0,0|1,1,0]=3 3032 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)O 1626a_100000724931_100000037485 [0,1,0,0,0,0|2,0,0]=3 3033 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)O 240690a_100000724931_100000037485 [0,1,0,0,0,0|2,0,0]=3 3034 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Br 240690a_100000724931_100000689001 [0,1,0,0,0,0|1,1,0]=3 3035 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Br 527a_100000724931_100000689001 [0,1,0,0,0,0|1,1,0]=3 3036 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Cl 240690a_100000724931_100011933997 [0,1,0,0,0,0|1,0,0]=2 3037 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Cl 527a_100000724931_100011933997 [0,1,0,0,0,0|1,0,0]=2 3038 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)F 240690a_100000724931_100000035894 [0,1,0,0,0,0|1,1,0]=3 3039 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)F 527a_100000724931_100000035894 [0,1,0,0,0,0|1,1,0]=3 3040 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)I 1626a_100000724931_100000239334 [0,1,0,0,0,0|1,1,0]=3 3041 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)I 240690a_100000724931_100000239334 [0,1,0,0,0,0|1,1,0]=3 3042 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)I 527a_100000724931_100000239334 [0,1,0,0,0,0|1,1,0]=3 3043 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)Br 240690a_100000210304_100012339404 [0,1,0,0,0,0|0,1,0]=2 3044 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)Br 527a_100000210304_100012339404 [0,1,0,0,0,0|0,1,0]=2 3045 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)Cl 240690a_100000210304_100000691181 [0,1,0,0,0,0|0,0,0]=1 3046 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)Cl 527a_100000210304_100000691181 [0,1,0,0,0,0|0,0,0]=1 3047 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)F 240690a_100000210304_100000760357 [0,1,0,0,0,0|0,1,0]=2 3048 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)F 527a_100000210304_100000760357 [0,1,0,0,0,0|0,1,0]=2 3049 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)I 240690a_100000210304_100000739115 [0,1,0,0,0,0|0,1,0]=2 3050 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)I 527a_100000210304_100000739115 [0,1,0,0,0,0|0,1,0]=2 3051 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)O 240690a_100000210304_100000189672 [0,1,0,0,0,0|1,0,0]=2 3052 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)Br 240690a_100000210304_100000687082 [0,1,0,0,0,0|0,1,0]=2 3053 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)Br 527a_100000210304_100000687082 [0,1,0,0,0,0|0,1,0]=2 3054 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)Cl 240690a_100000210304_100000210401 [0,1,0,0,0,0|0,0,0]=1 3055 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)Cl 527a_100000210304_100000210401 [0,1,0,0,0,0|0,0,0]=1 3056 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)F 240690a_100000210304_100000686462 [0,1,0,0,0,0|0,1,0]=2 3057 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)F 527a_100000210304_100000686462 [0,1,0,0,0,0|0,1,0]=2 3058 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)I 240690a_100000210304_100000684831 [0,1,0,0,0,0|0,1,0]=2 3059 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)I 527a_100000210304_100000684831 [0,1,0,0,0,0|0,1,0]=2 3060 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)O 240690a_100000210304_100000212196 [0,1,0,0,0,0|1,0,0]=2 3061 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)O 527a_100000210304_100000212196 [0,1,0,0,0,0|1,0,0]=2 3062 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)Br 240690a_100000210304_100000743946 [0,1,0,0,0,0|0,1,0]=2 3063 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)Br 527a_100000210304_100000743946 [0,1,0,0,0,0|0,1,0]=2 3064 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)Cl 240690a_100000210304_100000743183 [0,1,0,0,0,0|0,0,0]=1 3065 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)Cl 527a_100000210304_100000743183 [0,1,0,0,0,0|0,0,0]=1 3066 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)F 240690a_100000210304_100000209822 [0,1,0,0,0,0|0,1,0]=2 3067 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)F 527a_100000210304_100000209822 [0,1,0,0,0,0|0,1,0]=2 3068 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)I 240690a_100000210304_100000062624 [0,1,0,0,0,0|0,1,0]=2 3069 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)I 527a_100000210304_100000062624 [0,1,0,0,0,0|0,1,0]=2 3070 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)O 240690a_100000210304_100000185466 [0,1,0,0,0,0|1,0,0]=2 3071 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)O 527a_100000210304_100000185466 [0,1,0,0,0,0|1,0,0]=2 3072 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)Br 240690a_100000210304_100012343876 [0,1,0,0,0,0|0,1,0]=2 3073 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)Br 527a_100000210304_100012343876 [0,1,0,0,0,0|0,1,0]=2 3074 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)Cl 240690a_100000210304_100000739381 [0,1,0,0,0,0|0,0,0]=1 3075 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)Cl 527a_100000210304_100000739381 [0,1,0,0,0,0|0,0,0]=1 3076 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)F 240690a_100000210304_100000688015 [0,1,0,0,0,0|0,1,0]=2 3077 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)F 527a_100000210304_100000688015 [0,1,0,0,0,0|0,1,0]=2 3078 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)I 240690a_100000210304_100000725830 [0,1,0,0,0,0|0,1,0]=2 3079 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)I 527a_100000210304_100000725830 [0,1,0,0,0,0|0,1,0]=2 3080 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)O 240690a_100000210304_100000037485 [0,1,0,0,0,0|1,0,0]=2 3081 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Br 240690a_100000210304_100000689001 [0,1,0,0,0,0|0,1,0]=2 3082 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Br 527a_100000210304_100000689001 [0,1,0,0,0,0|0,1,0]=2 3083 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Cl 240690a_100000210304_100011933997 [0,1,0,0,0,0|0,0,0]=1 3084 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Cl 527a_100000210304_100011933997 [0,1,0,0,0,0|0,0,0]=1 3085 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)F 240690a_100000210304_100000035894 [0,1,0,0,0,0|0,1,0]=2 3086 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)F 527a_100000210304_100000035894 [0,1,0,0,0,0|0,1,0]=2 3087 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)I 240690a_100000210304_100000239334 [0,1,0,0,0,0|0,1,0]=2 3088 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)I 527a_100000210304_100000239334 [0,1,0,0,0,0|0,1,0]=2 3089 B14R1.941 [13CH3]SCCC(=O)c1ccc(c(c1)Cl)Cl 62a_100012356702_200025704644 [0,1,0,0,0,0|3,0,0]=4 3090 B14R1.941 [13CH3]SCCC(=O)c1ccc(c(c1)Cl)Cl 62a_200025704644_100012356702 [0,1,0,0,0,0|3,0,0]=4 3091 B14R1.2523 C#CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000753159 [0,1,0,0,0,0|2,0,1]=4 3092 B14R1.2523 C#CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000753159 [0,1,0,0,0,0|2,0,1]=4 3093 B14R1.2523 C#CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000753159 [0,1,0,0,0,0|2,0,1]=4 3094 B14R1.2523 C#CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000753159 [0,1,0,0,0,0|2,0,1]=4 3095 B14R1.2523 C#CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000753159 [0,1,0,0,0,0|2,0,1]=4 3096 B14R1.2523 C#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000753159 [0,1,0,0,0,0|2,0,1]=4 3097 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Br 11a_100000212058_100000762965 [0,1,0,0,0,0|1,1,1]=4 3098 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Br 1626a_100000212058_100000762965 [0,1,0,0,0,0|1,1,1]=4 3099 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Br 240690a_100000212058_100000762965 [0,1,0,0,0,0|1,1,1]=4 3100 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Br 527a_100000212058_100000762965 [0,1,0,0,0,0|1,1,1]=4 3101 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)C 11a_100000212058_100000685072 [0,1,0,0,0,0|2,0,1]=4 3102 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)C 1626a_100000212058_100000685072 [0,1,0,0,0,0|2,0,1]=4 3103 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)C 240690a_100000212058_100000685072 [0,1,0,0,0,0|2,0,1]=4 3104 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)C 527a_100000212058_100000685072 [0,1,0,0,0,0|2,0,1]=4 3105 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Cl 11a_100000212058_100000766353 [0,1,0,0,0,0|1,0,1]=3 3106 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Cl 1626a_100000212058_100000766353 [0,1,0,0,0,0|1,0,1]=3 3107 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Cl 240690a_100000212058_100000766353 [0,1,0,0,0,0|1,0,1]=3 3108 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)Cl 527a_100000212058_100000766353 [0,1,0,0,0,0|1,0,1]=3 3109 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)F 11a_100000212058_100000212304 [0,1,0,0,0,0|1,1,1]=4 3110 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)F 1626a_100000212058_100000212304 [0,1,0,0,0,0|1,1,1]=4 3111 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)F 240690a_100000212058_100000212304 [0,1,0,0,0,0|1,1,1]=4 3112 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)F 527a_100000212058_100000212304 [0,1,0,0,0,0|1,1,1]=4 3113 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)I 11a_100000212058_100012360512 [0,1,0,0,0,0|1,1,1]=4 3114 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)I 1626a_100000212058_100012360512 [0,1,0,0,0,0|1,1,1]=4 3115 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)I 240690a_100000212058_100012360512 [0,1,0,0,0,0|1,1,1]=4 3116 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)I 527a_100000212058_100012360512 [0,1,0,0,0,0|1,1,1]=4 3117 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)O 240690a_100000212058_100012344906 [0,1,0,0,0,0|2,0,1]=4 3118 B14R1.2523 C#CCNC(=O)c1ccc(cc1Br)O 527a_100000212058_100012344906 [0,1,0,0,0,0|2,0,1]=4 3119 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Br 11a_100000212058_100000741311 [0,1,0,0,0,0|1,1,1]=4 3120 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Br 1626a_100000212058_100000741311 [0,1,0,0,0,0|1,1,1]=4 3121 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Br 240690a_100000212058_100000741311 [0,1,0,0,0,0|1,1,1]=4 3122 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Br 527a_100000212058_100000741311 [0,1,0,0,0,0|1,1,1]=4 3123 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)C 11a_100000212058_100000211164 [0,1,0,0,0,0|2,0,1]=4 3124 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)C 1626a_100000212058_100000211164 [0,1,0,0,0,0|2,0,1]=4 3125 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)C 240690a_100000212058_100000211164 [0,1,0,0,0,0|2,0,1]=4 3126 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)C 527a_100000212058_100000211164 [0,1,0,0,0,0|2,0,1]=4 3127 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Cl 11a_100000212058_100000688705 [0,1,0,0,0,0|1,0,1]=3 3128 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Cl 1626a_100000212058_100000688705 [0,1,0,0,0,0|1,0,1]=3 3129 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Cl 240690a_100000212058_100000688705 [0,1,0,0,0,0|1,0,1]=3 3130 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)Cl 527a_100000212058_100000688705 [0,1,0,0,0,0|1,0,1]=3 3131 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)F 11a_100000212058_100000686989 [0,1,0,0,0,0|1,1,1]=4 3132 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)F 1626a_100000212058_100000686989 [0,1,0,0,0,0|1,1,1]=4 3133 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)F 240690a_100000212058_100000686989 [0,1,0,0,0,0|1,1,1]=4 3134 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)F 527a_100000212058_100000686989 [0,1,0,0,0,0|1,1,1]=4 3135 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)I 11a_100000212058_100010189873 [0,1,0,0,0,0|1,1,1]=4 3136 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)I 1626a_100000212058_100010189873 [0,1,0,0,0,0|1,1,1]=4 3137 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)I 240690a_100000212058_100010189873 [0,1,0,0,0,0|1,1,1]=4 3138 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)I 527a_100000212058_100010189873 [0,1,0,0,0,0|1,1,1]=4 3139 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)O 240690a_100000212058_100000692822 [0,1,0,0,0,0|2,0,1]=4 3140 B14R1.2523 C#CCNC(=O)c1ccc(cc1C)O 527a_100000212058_100000692822 [0,1,0,0,0,0|2,0,1]=4 3141 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Br 11a_100000212058_100000741628 [0,1,0,0,0,0|1,1,1]=4 3142 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Br 1626a_100000212058_100000741628 [0,1,0,0,0,0|1,1,1]=4 3143 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Br 240690a_100000212058_100000741628 [0,1,0,0,0,0|1,1,1]=4 3144 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Br 527a_100000212058_100000741628 [0,1,0,0,0,0|1,1,1]=4 3145 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)C 11a_100000212058_100000766932 [0,1,0,0,0,0|2,0,1]=4 3146 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)C 1626a_100000212058_100000766932 [0,1,0,0,0,0|2,0,1]=4 3147 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)C 240690a_100000212058_100000766932 [0,1,0,0,0,0|2,0,1]=4 3148 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)C 527a_100000212058_100000766932 [0,1,0,0,0,0|2,0,1]=4 3149 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Cl 11a_100000212058_100000185840 [0,1,0,0,0,0|1,0,1]=3 3150 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000212058_100000185840 [0,1,0,0,0,0|1,0,1]=3 3151 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000212058_100000185840 [0,1,0,0,0,0|1,0,1]=3 3152 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)Cl 527a_100000212058_100000185840 [0,1,0,0,0,0|1,0,1]=3 3153 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)F 11a_100000212058_100000211397 [0,1,0,0,0,0|1,1,1]=4 3154 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)F 1626a_100000212058_100000211397 [0,1,0,0,0,0|1,1,1]=4 3155 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)F 240690a_100000212058_100000211397 [0,1,0,0,0,0|1,1,1]=4 3156 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)F 527a_100000212058_100000211397 [0,1,0,0,0,0|1,1,1]=4 3157 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)I 11a_100000212058_100000751301 [0,1,0,0,0,0|1,1,1]=4 3158 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)I 1626a_100000212058_100000751301 [0,1,0,0,0,0|1,1,1]=4 3159 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)I 240690a_100000212058_100000751301 [0,1,0,0,0,0|1,1,1]=4 3160 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)I 527a_100000212058_100000751301 [0,1,0,0,0,0|1,1,1]=4 3161 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)O 240690a_100000212058_100000702456 [0,1,0,0,0,0|2,0,1]=4 3162 B14R1.2523 C#CCNC(=O)c1ccc(cc1Cl)O 527a_100000212058_100000702456 [0,1,0,0,0,0|2,0,1]=4 3163 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Br 11a_100000212058_100000214689 [0,1,0,0,0,0|1,1,1]=4 3164 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Br 1626a_100000212058_100000214689 [0,1,0,0,0,0|1,1,1]=4 3165 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Br 240690a_100000212058_100000214689 [0,1,0,0,0,0|1,1,1]=4 3166 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Br 527a_100000212058_100000214689 [0,1,0,0,0,0|1,1,1]=4 3167 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)C 11a_100000212058_100000766033 [0,1,0,0,0,0|2,0,1]=4 3168 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)C 1626a_100000212058_100000766033 [0,1,0,0,0,0|2,0,1]=4 3169 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)C 240690a_100000212058_100000766033 [0,1,0,0,0,0|2,0,1]=4 3170 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)C 527a_100000212058_100000766033 [0,1,0,0,0,0|2,0,1]=4 3171 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Cl 11a_100000212058_100000212326 [0,1,0,0,0,0|1,0,1]=3 3172 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Cl 1626a_100000212058_100000212326 [0,1,0,0,0,0|1,0,1]=3 3173 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Cl 240690a_100000212058_100000212326 [0,1,0,0,0,0|1,0,1]=3 3174 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)Cl 527a_100000212058_100000212326 [0,1,0,0,0,0|1,0,1]=3 3175 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)F 11a_100000212058_100000211022 [0,1,0,0,0,0|1,1,1]=4 3176 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)F 1626a_100000212058_100000211022 [0,1,0,0,0,0|1,1,1]=4 3177 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)F 240690a_100000212058_100000211022 [0,1,0,0,0,0|1,1,1]=4 3178 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)F 527a_100000212058_100000211022 [0,1,0,0,0,0|1,1,1]=4 3179 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)I 11a_100000212058_100000037189 [0,1,0,0,0,0|1,1,1]=4 3180 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)I 1626a_100000212058_100000037189 [0,1,0,0,0,0|1,1,1]=4 3181 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)I 240690a_100000212058_100000037189 [0,1,0,0,0,0|1,1,1]=4 3182 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)I 527a_100000212058_100000037189 [0,1,0,0,0,0|1,1,1]=4 3183 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)O 240690a_100000212058_100000689029 [0,1,0,0,0,0|2,0,1]=4 3184 B14R1.2523 C#CCNC(=O)c1ccc(cc1F)O 527a_100000212058_100000689029 [0,1,0,0,0,0|2,0,1]=4 3185 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Br 11a_100000212058_100000751167 [0,1,0,0,0,0|1,1,1]=4 3186 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Br 1626a_100000212058_100000751167 [0,1,0,0,0,0|1,1,1]=4 3187 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Br 240690a_100000212058_100000751167 [0,1,0,0,0,0|1,1,1]=4 3188 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Br 527a_100000212058_100000751167 [0,1,0,0,0,0|1,1,1]=4 3189 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)C 11a_100000212058_100009999607 [0,1,0,0,0,0|2,0,1]=4 3190 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)C 1626a_100000212058_100009999607 [0,1,0,0,0,0|2,0,1]=4 3191 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)C 240690a_100000212058_100009999607 [0,1,0,0,0,0|2,0,1]=4 3192 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)C 527a_100000212058_100009999607 [0,1,0,0,0,0|2,0,1]=4 3193 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Cl 11a_100000212058_100000739380 [0,1,0,0,0,0|1,0,1]=3 3194 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Cl 1626a_100000212058_100000739380 [0,1,0,0,0,0|1,0,1]=3 3195 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Cl 240690a_100000212058_100000739380 [0,1,0,0,0,0|1,0,1]=3 3196 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)Cl 527a_100000212058_100000739380 [0,1,0,0,0,0|1,0,1]=3 3197 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)F 11a_100000212058_100000739341 [0,1,0,0,0,0|1,1,1]=4 3198 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)F 1626a_100000212058_100000739341 [0,1,0,0,0,0|1,1,1]=4 3199 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)F 240690a_100000212058_100000739341 [0,1,0,0,0,0|1,1,1]=4 3200 B14R1.2523 C#CCNC(=O)c1ccc(cc1I)F 527a_100000212058_100000739341 [0,1,0,0,0,0|1,1,1]=4 3201 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Br 240690a_100000212058_100000744433 [0,1,0,0,0,0|1,1,1]=4 3202 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Br 527a_100000212058_100000744433 [0,1,0,0,0,0|1,1,1]=4 3203 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)C 1626a_100000212058_100000212137 [0,1,0,0,0,0|2,0,1]=4 3204 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)C 240690a_100000212058_100000212137 [0,1,0,0,0,0|2,0,1]=4 3205 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)C 527a_100000212058_100000212137 [0,1,0,0,0,0|2,0,1]=4 3206 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Cl 11a_100000212058_100000188622 [0,1,0,0,0,0|1,0,1]=3 3207 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Cl 240690a_100000212058_100000188622 [0,1,0,0,0,0|1,0,1]=3 3208 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)Cl 527a_100000212058_100000188622 [0,1,0,0,0,0|1,0,1]=3 3209 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)F 240690a_100000212058_100000746061 [0,1,0,0,0,0|1,1,1]=4 3210 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)F 527a_100000212058_100000746061 [0,1,0,0,0,0|1,1,1]=4 3211 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)I 240690a_100000212058_100000091984 [0,1,0,0,0,0|1,1,1]=4 3212 B14R1.2523 C#CCNC(=O)c1ccc(cc1O)I 527a_100000212058_100000091984 [0,1,0,0,0,0|1,1,1]=4 3213 B14R1.2523 C=CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000754431 [0,1,0,0,0,0|2,0,1]=4 3214 B14R1.2523 C=CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000754431 [0,1,0,0,0,0|2,0,1]=4 3215 B14R1.2523 C=CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000754431 [0,1,0,0,0,0|2,0,1]=4 3216 B14R1.2523 C=CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000754431 [0,1,0,0,0,0|2,0,1]=4 3217 B14R1.2523 C=CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000754431 [0,1,0,0,0,0|2,0,1]=4 3218 B14R1.2523 C=CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000754431 [0,1,0,0,0,0|2,0,1]=4 3219 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)Br 1626a_100020586998_100000762965 [0,1,0,0,0,0|1,1,1]=4 3220 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)Br 240690a_100020586998_100000762965 [0,1,0,0,0,0|1,1,1]=4 3221 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)Br 527a_100020586998_100000762965 [0,1,0,0,0,0|1,1,1]=4 3222 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)C 1626a_100020586998_100000685072 [0,1,0,0,0,0|2,0,1]=4 3223 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)C 240690a_100020586998_100000685072 [0,1,0,0,0,0|2,0,1]=4 3224 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)C 527a_100020586998_100000685072 [0,1,0,0,0,0|2,0,1]=4 3225 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)Cl 1626a_100020586998_100000766353 [0,1,0,0,0,0|1,0,1]=3 3226 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)Cl 240690a_100020586998_100000766353 [0,1,0,0,0,0|1,0,1]=3 3227 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)Cl 527a_100020586998_100000766353 [0,1,0,0,0,0|1,0,1]=3 3228 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)F 1626a_100020586998_100000212304 [0,1,0,0,0,0|1,1,1]=4 3229 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)F 240690a_100020586998_100000212304 [0,1,0,0,0,0|1,1,1]=4 3230 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)F 527a_100020586998_100000212304 [0,1,0,0,0,0|1,1,1]=4 3231 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)I 1626a_100020586998_100012360512 [0,1,0,0,0,0|1,1,1]=4 3232 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)I 240690a_100020586998_100012360512 [0,1,0,0,0,0|1,1,1]=4 3233 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)I 527a_100020586998_100012360512 [0,1,0,0,0,0|1,1,1]=4 3234 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)O 240690a_100020586998_100012344906 [0,1,0,0,0,0|2,0,1]=4 3235 B14R1.2523 C=CCNC(=O)c1ccc(cc1Br)O 527a_100020586998_100012344906 [0,1,0,0,0,0|2,0,1]=4 3236 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)Br 1626a_100020586998_100000741311 [0,1,0,0,0,0|1,1,1]=4 3237 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)Br 240690a_100020586998_100000741311 [0,1,0,0,0,0|1,1,1]=4 3238 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)Br 527a_100020586998_100000741311 [0,1,0,0,0,0|1,1,1]=4 3239 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)C 1626a_100020586998_100000211164 [0,1,0,0,0,0|2,0,1]=4 3240 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)C 240690a_100020586998_100000211164 [0,1,0,0,0,0|2,0,1]=4 3241 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)C 527a_100020586998_100000211164 [0,1,0,0,0,0|2,0,1]=4 3242 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)Cl 1626a_100020586998_100000688705 [0,1,0,0,0,0|1,0,1]=3 3243 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)Cl 240690a_100020586998_100000688705 [0,1,0,0,0,0|1,0,1]=3 3244 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)Cl 527a_100020586998_100000688705 [0,1,0,0,0,0|1,0,1]=3 3245 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)F 1626a_100020586998_100000686989 [0,1,0,0,0,0|1,1,1]=4 3246 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)F 240690a_100020586998_100000686989 [0,1,0,0,0,0|1,1,1]=4 3247 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)F 527a_100020586998_100000686989 [0,1,0,0,0,0|1,1,1]=4 3248 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)I 1626a_100020586998_100010189873 [0,1,0,0,0,0|1,1,1]=4 3249 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)I 240690a_100020586998_100010189873 [0,1,0,0,0,0|1,1,1]=4 3250 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)I 527a_100020586998_100010189873 [0,1,0,0,0,0|1,1,1]=4 3251 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)O 240690a_100020586998_100000692822 [0,1,0,0,0,0|2,0,1]=4 3252 B14R1.2523 C=CCNC(=O)c1ccc(cc1C)O 527a_100020586998_100000692822 [0,1,0,0,0,0|2,0,1]=4 3253 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)Br 1626a_100020586998_100000741628 [0,1,0,0,0,0|1,1,1]=4 3254 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)Br 240690a_100020586998_100000741628 [0,1,0,0,0,0|1,1,1]=4 3255 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)Br 527a_100020586998_100000741628 [0,1,0,0,0,0|1,1,1]=4 3256 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)C 1626a_100020586998_100000766932 [0,1,0,0,0,0|2,0,1]=4 3257 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)C 240690a_100020586998_100000766932 [0,1,0,0,0,0|2,0,1]=4 3258 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)C 527a_100020586998_100000766932 [0,1,0,0,0,0|2,0,1]=4 3259 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)Cl 1626a_100020586998_100000185840 [0,1,0,0,0,0|1,0,1]=3 3260 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100020586998_100000185840 [0,1,0,0,0,0|1,0,1]=3 3261 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)Cl 527a_100020586998_100000185840 [0,1,0,0,0,0|1,0,1]=3 3262 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)F 1626a_100020586998_100000211397 [0,1,0,0,0,0|1,1,1]=4 3263 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)F 240690a_100020586998_100000211397 [0,1,0,0,0,0|1,1,1]=4 3264 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)F 527a_100020586998_100000211397 [0,1,0,0,0,0|1,1,1]=4 3265 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)I 1626a_100020586998_100000751301 [0,1,0,0,0,0|1,1,1]=4 3266 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)I 240690a_100020586998_100000751301 [0,1,0,0,0,0|1,1,1]=4 3267 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)I 527a_100020586998_100000751301 [0,1,0,0,0,0|1,1,1]=4 3268 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)O 240690a_100020586998_100000702456 [0,1,0,0,0,0|2,0,1]=4 3269 B14R1.2523 C=CCNC(=O)c1ccc(cc1Cl)O 527a_100020586998_100000702456 [0,1,0,0,0,0|2,0,1]=4 3270 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)Br 1626a_100020586998_100000214689 [0,1,0,0,0,0|1,1,1]=4 3271 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)Br 240690a_100020586998_100000214689 [0,1,0,0,0,0|1,1,1]=4 3272 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)Br 527a_100020586998_100000214689 [0,1,0,0,0,0|1,1,1]=4 3273 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)C 1626a_100020586998_100000766033 [0,1,0,0,0,0|2,0,1]=4 3274 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)C 240690a_100020586998_100000766033 [0,1,0,0,0,0|2,0,1]=4 3275 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)C 527a_100020586998_100000766033 [0,1,0,0,0,0|2,0,1]=4 3276 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)Cl 1626a_100020586998_100000212326 [0,1,0,0,0,0|1,0,1]=3 3277 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)Cl 240690a_100020586998_100000212326 [0,1,0,0,0,0|1,0,1]=3 3278 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)Cl 527a_100020586998_100000212326 [0,1,0,0,0,0|1,0,1]=3 3279 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)F 1626a_100020586998_100000211022 [0,1,0,0,0,0|1,1,1]=4 3280 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)F 240690a_100020586998_100000211022 [0,1,0,0,0,0|1,1,1]=4 3281 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)F 527a_100020586998_100000211022 [0,1,0,0,0,0|1,1,1]=4 3282 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)I 1626a_100020586998_100000037189 [0,1,0,0,0,0|1,1,1]=4 3283 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)I 240690a_100020586998_100000037189 [0,1,0,0,0,0|1,1,1]=4 3284 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)I 527a_100020586998_100000037189 [0,1,0,0,0,0|1,1,1]=4 3285 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)O 240690a_100020586998_100000689029 [0,1,0,0,0,0|2,0,1]=4 3286 B14R1.2523 C=CCNC(=O)c1ccc(cc1F)O 527a_100020586998_100000689029 [0,1,0,0,0,0|2,0,1]=4 3287 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)Br 1626a_100020586998_100000751167 [0,1,0,0,0,0|1,1,1]=4 3288 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)Br 240690a_100020586998_100000751167 [0,1,0,0,0,0|1,1,1]=4 3289 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)Br 527a_100020586998_100000751167 [0,1,0,0,0,0|1,1,1]=4 3290 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)C 1626a_100020586998_100009999607 [0,1,0,0,0,0|2,0,1]=4 3291 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)C 240690a_100020586998_100009999607 [0,1,0,0,0,0|2,0,1]=4 3292 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)C 527a_100020586998_100009999607 [0,1,0,0,0,0|2,0,1]=4 3293 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)Cl 1626a_100020586998_100000739380 [0,1,0,0,0,0|1,0,1]=3 3294 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)Cl 240690a_100020586998_100000739380 [0,1,0,0,0,0|1,0,1]=3 3295 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)Cl 527a_100020586998_100000739380 [0,1,0,0,0,0|1,0,1]=3 3296 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)F 1626a_100020586998_100000739341 [0,1,0,0,0,0|1,1,1]=4 3297 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)F 240690a_100020586998_100000739341 [0,1,0,0,0,0|1,1,1]=4 3298 B14R1.2523 C=CCNC(=O)c1ccc(cc1I)F 527a_100020586998_100000739341 [0,1,0,0,0,0|1,1,1]=4 3299 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Br 240690a_100020586998_100000744433 [0,1,0,0,0,0|1,1,1]=4 3300 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Br 527a_100020586998_100000744433 [0,1,0,0,0,0|1,1,1]=4 3301 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 1626a_100020586998_100000212137 [0,1,0,0,0,0|2,0,1]=4 3302 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 240690a_100020586998_100000212137 [0,1,0,0,0,0|2,0,1]=4 3303 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)C 527a_100020586998_100000212137 [0,1,0,0,0,0|2,0,1]=4 3304 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Cl 240690a_100020586998_100000188622 [0,1,0,0,0,0|1,0,1]=3 3305 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)Cl 527a_100020586998_100000188622 [0,1,0,0,0,0|1,0,1]=3 3306 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)F 240690a_100020586998_100000746061 [0,1,0,0,0,0|1,1,1]=4 3307 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)F 527a_100020586998_100000746061 [0,1,0,0,0,0|1,1,1]=4 3308 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)I 240690a_100020586998_100000091984 [0,1,0,0,0,0|1,1,1]=4 3309 B14R1.2523 C=CCNC(=O)c1ccc(cc1O)I 527a_100020586998_100000091984 [0,1,0,0,0,0|1,1,1]=4 3310 B14R1.2523 CC(NCCF)c1ccc(cc1Br)Cl 269862a_100000724931_100011934292 [0,1,0,0,0,0|2,0,1]=4 3311 B14R1.2523 CC(NCCF)c1ccc(cc1Cl)Cl 2230a_100000179772_100011217306 [0,1,0,0,0,0|2,0,1]=4 3312 B14R1.2523 CC(NCCF)c1ccc(cc1Cl)Cl 269862a_100000724931_100000210972 [0,1,0,0,0,0|2,0,1]=4 3313 B14R1.2523 CC(NCCF)c1ccc(cc1Cl)Cl 34a_100000179772_100011217306 [0,1,0,0,0,0|2,0,1]=4 3314 B14R1.2523 CC(NCCF)c1ccc(cc1F)Cl 269862a_100000724931_100011805184 [0,1,0,0,0,0|2,0,1]=4 3315 B14R1.2523 CC(NCCF)c1ccc(cc1O)Cl 269862a_100000724931_100000061402 [0,1,0,0,0,0|2,0,1]=4 3316 B14R1.2523 CC(NCCO)c1ccc(cc1Br)Br 269862a_100000210304_100000183147 [0,1,0,0,0,0|1,1,1]=4 3317 B14R1.2523 CC(NCCO)c1ccc(cc1Br)Cl 269862a_100000210304_100011934292 [0,1,0,0,0,0|1,0,1]=3 3318 B14R1.2523 CC(NCCO)c1ccc(cc1Br)F 269862a_100000210304_100000686192 [0,1,0,0,0,0|1,1,1]=4 3319 B14R1.2523 CC(NCCO)c1ccc(cc1Cl)Br 269862a_100000210304_100000693907 [0,1,0,0,0,0|1,1,1]=4 3320 B14R1.2523 CC(NCCO)c1ccc(cc1Cl)Cl 2230a_100000179772_100000211926 [0,1,0,0,0,0|1,0,1]=3 3321 B14R1.2523 CC(NCCO)c1ccc(cc1Cl)Cl 269862a_100000210304_100000210972 [0,1,0,0,0,0|1,0,1]=3 3322 B14R1.2523 CC(NCCO)c1ccc(cc1Cl)Cl 34a_100000179772_100000211926 [0,1,0,0,0,0|1,0,1]=3 3323 B14R1.2523 CC(NCCO)c1ccc(cc1Cl)F 269862a_100000210304_100000214953 [0,1,0,0,0,0|1,1,1]=4 3324 B14R1.2523 CC(NCCO)c1ccc(cc1F)Br 2230a_100000730447_100000211926 [0,1,0,0,0,0|1,1,1]=4 3325 B14R1.2523 CC(NCCO)c1ccc(cc1F)Br 269862a_100000210304_100000690205 [0,1,0,0,0,0|1,1,1]=4 3326 B14R1.2523 CC(NCCO)c1ccc(cc1F)Br 34a_100000730447_100000211926 [0,1,0,0,0,0|1,1,1]=4 3327 B14R1.2523 CC(NCCO)c1ccc(cc1F)Cl 269862a_100000210304_100011805184 [0,1,0,0,0,0|1,0,1]=3 3328 B14R1.2523 CC(NCCO)c1ccc(cc1F)F 2230a_100000181410_100000211926 [0,1,0,0,0,0|1,1,1]=4 3329 B14R1.2523 CC(NCCO)c1ccc(cc1F)F 269862a_100000210304_100000185200 [0,1,0,0,0,0|1,1,1]=4 3330 B14R1.2523 CC(NCCO)c1ccc(cc1F)F 34a_100000181410_100000211926 [0,1,0,0,0,0|1,1,1]=4 3331 B14R1.2523 CC(NCCO)c1ccc(cc1O)Br 269862a_100000210304_100000188348 [0,1,0,0,0,0|1,1,1]=4 3332 B14R1.2523 CC(NCCO)c1ccc(cc1O)Cl 269862a_100000210304_100000061402 [0,1,0,0,0,0|1,0,1]=3 3333 B14R1.2523 CC(NCCO)c1ccc(cc1O)F 269862a_100000210304_100011215782 [0,1,0,0,0,0|1,1,1]=4 3334 B14R1.2523 CC(NCCO)c1cnc(cc1Cl)Cl 269862a_100000210304_100000699909 [0,1,0,0,0,0|2,0,1]=4 3335 B14R1.2523 CC(NCCO)c1ncc(cc1Br)Cl 269862a_100000210304_100010135484 [0,1,0,0,0,0|2,0,1]=4 3336 B14R1.2523 CC(NCCO)c1ncc(cc1Br)Cl 270004a_100000210304_100010135484 [0,1,0,0,0,0|2,0,1]=4 3337 B14R1.2523 CC(NCCO)c1ncc(cc1Cl)Cl 269862a_100000210304_100012184579 [0,1,0,0,0,0|2,0,1]=4 3338 B14R1.2523 CC(NCCO)c1ncc(cc1Cl)Cl 270004a_100000210304_100012184579 [0,1,0,0,0,0|2,0,1]=4 3339 B14R1.2523 CC(NCCO)c1ncc(cc1F)Cl 269862a_100000210304_100009855508 [0,1,0,0,0,0|2,0,1]=4 3340 B14R1.2523 CC(OCCO)c1ccc(cc1Cl)Cl 34a_100000743050_100000211926 [0,1,0,0,0,0|2,0,1]=4 3341 B14R1.2523 CC(OCCO)c1ccc(cc1Cl)Cl 7a_100000743050_100000211926 [0,1,0,0,0,0|2,0,1]=4 3342 B14R1.2523 CC(OCCO)c1ccc(cc1F)Cl 34a_200011805215_100000211926 [0,1,0,0,0,0|2,0,1]=4 3343 B14R1.2523 CC(OCCO)c1ccc(cc1F)Cl 7a_200011805215_100000211926 [0,1,0,0,0,0|2,0,1]=4 3344 B14R1.2523 CC=NNC(=O)c1ccc(cc1Br)Cl 4a_200012340523_200000210099 [0,1,0,0,0,0|2,0,1]=4 3345 B14R1.2523 CC=NNC(=O)c1ccc(cc1C)Cl 4a_200011996896_200000210099 [0,1,0,0,0,0|2,0,1]=4 3346 B14R1.2523 CC=NNC(=O)c1ccc(cc1Cl)Cl 4a_100000184908_200000210099 [0,1,0,0,0,0|2,0,1]=4 3347 B14R1.2523 CC=NNC(=O)c1ccc(cc1F)Cl 4a_100000215448_200000210099 [0,1,0,0,0,0|2,0,1]=4 3348 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210211 [0,1,0,0,0,0|2,1,0]=4 3349 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210211 [0,1,0,0,0,0|3,0,0]=4 3350 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210211 [0,1,0,0,0,0|2,0,0]=3 3351 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210211 [0,1,0,0,0,0|2,1,0]=4 3352 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210211 [0,1,0,0,0,0|2,1,0]=4 3353 B14R1.2523 CCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210211 [0,1,0,0,0,0|3,0,0]=4 3354 B14R1.2523 CCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210211 [0,1,0,0,0,0|2,1,0]=4 3355 B14R1.2523 CCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210211 [0,1,0,0,0,0|3,0,0]=4 3356 B14R1.2523 CCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210211 [0,1,0,0,0,0|2,0,0]=3 3357 B14R1.2523 CCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210211 [0,1,0,0,0,0|2,1,0]=4 3358 B14R1.2523 CCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210211 [0,1,0,0,0,0|2,1,0]=4 3359 B14R1.2523 CCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210211 [0,1,0,0,0,0|3,0,0]=4 3360 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210211 [0,1,0,0,0,0|2,1,0]=4 3361 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210211 [0,1,0,0,0,0|3,0,0]=4 3362 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210211 [0,1,0,0,0,0|2,0,0]=3 3363 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210211 [0,1,0,0,0,0|2,1,0]=4 3364 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210211 [0,1,0,0,0,0|2,1,0]=4 3365 B14R1.2523 CCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210211 [0,1,0,0,0,0|3,0,0]=4 3366 B14R1.2523 CCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210211 [0,1,0,0,0,0|2,1,0]=4 3367 B14R1.2523 CCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210211 [0,1,0,0,0,0|3,0,0]=4 3368 B14R1.2523 CCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210211 [0,1,0,0,0,0|2,0,0]=3 3369 B14R1.2523 CCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210211 [0,1,0,0,0,0|2,1,0]=4 3370 B14R1.2523 CCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210211 [0,1,0,0,0,0|2,1,0]=4 3371 B14R1.2523 CCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210211 [0,1,0,0,0,0|3,0,0]=4 3372 B14R1.2523 CCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210211 [0,1,0,0,0,0|2,1,0]=4 3373 B14R1.2523 CCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210211 [0,1,0,0,0,0|3,0,0]=4 3374 B14R1.2523 CCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210211 [0,1,0,0,0,0|2,0,0]=3 3375 B14R1.2523 CCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210211 [0,1,0,0,0,0|2,1,0]=4 3376 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210211 [0,1,0,0,0,0|2,1,0]=4 3377 B14R1.2523 CCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210211 [0,1,0,0,0,0|3,0,0]=4 3378 B14R1.2523 CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210211 [0,1,0,0,0,0|2,0,0]=3 3379 B14R1.2523 CCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210211 [0,1,0,0,0,0|2,1,0]=4 3380 B14R1.2523 CCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210211 [0,1,0,0,0,0|2,1,0]=4 3381 B14R1.2523 CCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210211 [0,1,0,0,0,0|3,0,0]=4 3382 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 11a_100020643023_100000762965 [0,1,0,0,0,0|1,1,0]=3 3383 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 1626a_100020643023_100000762965 [0,1,0,0,0,0|1,1,0]=3 3384 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 240690a_100020643023_100000762965 [0,1,0,0,0,0|1,1,0]=3 3385 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Br 527a_100020643023_100000762965 [0,1,0,0,0,0|1,1,0]=3 3386 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 11a_100020643023_100000685072 [0,1,0,0,0,0|2,0,0]=3 3387 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 1626a_100020643023_100000685072 [0,1,0,0,0,0|2,0,0]=3 3388 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 240690a_100020643023_100000685072 [0,1,0,0,0,0|2,0,0]=3 3389 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)C 527a_100020643023_100000685072 [0,1,0,0,0,0|2,0,0]=3 3390 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 11a_100020643023_100000766353 [0,1,0,0,0,0|1,0,0]=2 3391 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 1626a_100020643023_100000766353 [0,1,0,0,0,0|1,0,0]=2 3392 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 240690a_100020643023_100000766353 [0,1,0,0,0,0|1,0,0]=2 3393 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)Cl 527a_100020643023_100000766353 [0,1,0,0,0,0|1,0,0]=2 3394 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 11a_100020643023_100000212304 [0,1,0,0,0,0|1,1,0]=3 3395 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 1626a_100020643023_100000212304 [0,1,0,0,0,0|1,1,0]=3 3396 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 240690a_100020643023_100000212304 [0,1,0,0,0,0|1,1,0]=3 3397 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)F 527a_100020643023_100000212304 [0,1,0,0,0,0|1,1,0]=3 3398 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 11a_100020643023_100012360512 [0,1,0,0,0,0|1,1,0]=3 3399 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 1626a_100020643023_100012360512 [0,1,0,0,0,0|1,1,0]=3 3400 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 240690a_100020643023_100012360512 [0,1,0,0,0,0|1,1,0]=3 3401 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)I 527a_100020643023_100012360512 [0,1,0,0,0,0|1,1,0]=3 3402 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)O 240690a_100020643023_100012344906 [0,1,0,0,0,0|2,0,0]=3 3403 B14R1.2523 CCCNC(=O)c1ccc(cc1Br)O 527a_100020643023_100012344906 [0,1,0,0,0,0|2,0,0]=3 3404 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 11a_100020643023_100000741311 [0,1,0,0,0,0|1,1,0]=3 3405 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 1626a_100020643023_100000741311 [0,1,0,0,0,0|1,1,0]=3 3406 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 240690a_100020643023_100000741311 [0,1,0,0,0,0|1,1,0]=3 3407 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Br 527a_100020643023_100000741311 [0,1,0,0,0,0|1,1,0]=3 3408 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 11a_100020643023_100000211164 [0,1,0,0,0,0|2,0,0]=3 3409 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 1626a_100020643023_100000211164 [0,1,0,0,0,0|2,0,0]=3 3410 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 240690a_100020643023_100000211164 [0,1,0,0,0,0|2,0,0]=3 3411 B14R1.2523 CCCNC(=O)c1ccc(cc1C)C 527a_100020643023_100000211164 [0,1,0,0,0,0|2,0,0]=3 3412 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 11a_100020643023_100000688705 [0,1,0,0,0,0|1,0,0]=2 3413 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 1626a_100020643023_100000688705 [0,1,0,0,0,0|1,0,0]=2 3414 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 240690a_100020643023_100000688705 [0,1,0,0,0,0|1,0,0]=2 3415 B14R1.2523 CCCNC(=O)c1ccc(cc1C)Cl 527a_100020643023_100000688705 [0,1,0,0,0,0|1,0,0]=2 3416 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 11a_100020643023_100000686989 [0,1,0,0,0,0|1,1,0]=3 3417 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 1626a_100020643023_100000686989 [0,1,0,0,0,0|1,1,0]=3 3418 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 240690a_100020643023_100000686989 [0,1,0,0,0,0|1,1,0]=3 3419 B14R1.2523 CCCNC(=O)c1ccc(cc1C)F 527a_100020643023_100000686989 [0,1,0,0,0,0|1,1,0]=3 3420 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 11a_100020643023_100010189873 [0,1,0,0,0,0|1,1,0]=3 3421 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 1626a_100020643023_100010189873 [0,1,0,0,0,0|1,1,0]=3 3422 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 240690a_100020643023_100010189873 [0,1,0,0,0,0|1,1,0]=3 3423 B14R1.2523 CCCNC(=O)c1ccc(cc1C)I 527a_100020643023_100010189873 [0,1,0,0,0,0|1,1,0]=3 3424 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O 240690a_100020643023_100000692822 [0,1,0,0,0,0|2,0,0]=3 3425 B14R1.2523 CCCNC(=O)c1ccc(cc1C)O 527a_100020643023_100000692822 [0,1,0,0,0,0|2,0,0]=3 3426 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 11a_100020643023_100000741628 [0,1,0,0,0,0|1,1,0]=3 3427 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 1626a_100020643023_100000741628 [0,1,0,0,0,0|1,1,0]=3 3428 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 240690a_100020643023_100000741628 [0,1,0,0,0,0|1,1,0]=3 3429 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Br 527a_100020643023_100000741628 [0,1,0,0,0,0|1,1,0]=3 3430 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 11a_100020643023_100000766932 [0,1,0,0,0,0|2,0,0]=3 3431 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 1626a_100020643023_100000766932 [0,1,0,0,0,0|2,0,0]=3 3432 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 240690a_100020643023_100000766932 [0,1,0,0,0,0|2,0,0]=3 3433 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)C 527a_100020643023_100000766932 [0,1,0,0,0,0|2,0,0]=3 3434 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 11a_100020643023_100000185840 [0,1,0,0,0,0|1,0,0]=2 3435 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100020643023_100000185840 [0,1,0,0,0,0|1,0,0]=2 3436 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100020643023_100000185840 [0,1,0,0,0,0|1,0,0]=2 3437 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)Cl 527a_100020643023_100000185840 [0,1,0,0,0,0|1,0,0]=2 3438 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 11a_100020643023_100000211397 [0,1,0,0,0,0|1,1,0]=3 3439 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 1626a_100020643023_100000211397 [0,1,0,0,0,0|1,1,0]=3 3440 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 240690a_100020643023_100000211397 [0,1,0,0,0,0|1,1,0]=3 3441 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)F 527a_100020643023_100000211397 [0,1,0,0,0,0|1,1,0]=3 3442 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 11a_100020643023_100000751301 [0,1,0,0,0,0|1,1,0]=3 3443 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 1626a_100020643023_100000751301 [0,1,0,0,0,0|1,1,0]=3 3444 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 240690a_100020643023_100000751301 [0,1,0,0,0,0|1,1,0]=3 3445 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)I 527a_100020643023_100000751301 [0,1,0,0,0,0|1,1,0]=3 3446 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)O 240690a_100020643023_100000702456 [0,1,0,0,0,0|2,0,0]=3 3447 B14R1.2523 CCCNC(=O)c1ccc(cc1Cl)O 527a_100020643023_100000702456 [0,1,0,0,0,0|2,0,0]=3 3448 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 11a_100020643023_100000214689 [0,1,0,0,0,0|1,1,0]=3 3449 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 1626a_100020643023_100000214689 [0,1,0,0,0,0|1,1,0]=3 3450 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 240690a_100020643023_100000214689 [0,1,0,0,0,0|1,1,0]=3 3451 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Br 527a_100020643023_100000214689 [0,1,0,0,0,0|1,1,0]=3 3452 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 11a_100020643023_100000766033 [0,1,0,0,0,0|2,0,0]=3 3453 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 1626a_100020643023_100000766033 [0,1,0,0,0,0|2,0,0]=3 3454 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 240690a_100020643023_100000766033 [0,1,0,0,0,0|2,0,0]=3 3455 B14R1.2523 CCCNC(=O)c1ccc(cc1F)C 527a_100020643023_100000766033 [0,1,0,0,0,0|2,0,0]=3 3456 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 11a_100020643023_100000212326 [0,1,0,0,0,0|1,0,0]=2 3457 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 1626a_100020643023_100000212326 [0,1,0,0,0,0|1,0,0]=2 3458 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 240690a_100020643023_100000212326 [0,1,0,0,0,0|1,0,0]=2 3459 B14R1.2523 CCCNC(=O)c1ccc(cc1F)Cl 527a_100020643023_100000212326 [0,1,0,0,0,0|1,0,0]=2 3460 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 11a_100020643023_100000211022 [0,1,0,0,0,0|1,1,0]=3 3461 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 1626a_100020643023_100000211022 [0,1,0,0,0,0|1,1,0]=3 3462 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 240690a_100020643023_100000211022 [0,1,0,0,0,0|1,1,0]=3 3463 B14R1.2523 CCCNC(=O)c1ccc(cc1F)F 527a_100020643023_100000211022 [0,1,0,0,0,0|1,1,0]=3 3464 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 11a_100020643023_100000037189 [0,1,0,0,0,0|1,1,0]=3 3465 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 1626a_100020643023_100000037189 [0,1,0,0,0,0|1,1,0]=3 3466 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 240690a_100020643023_100000037189 [0,1,0,0,0,0|1,1,0]=3 3467 B14R1.2523 CCCNC(=O)c1ccc(cc1F)I 527a_100020643023_100000037189 [0,1,0,0,0,0|1,1,0]=3 3468 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 240690a_100020643023_100000689029 [0,1,0,0,0,0|2,0,0]=3 3469 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215516 [0,1,0,0,0,0|2,0,0]=3 3470 B14R1.2523 CCCNC(=O)c1ccc(cc1F)O 527a_100020643023_100000689029 [0,1,0,0,0,0|2,0,0]=3 3471 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 11a_100020643023_100000751167 [0,1,0,0,0,0|1,1,0]=3 3472 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 1626a_100020643023_100000751167 [0,1,0,0,0,0|1,1,0]=3 3473 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 240690a_100020643023_100000751167 [0,1,0,0,0,0|1,1,0]=3 3474 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Br 527a_100020643023_100000751167 [0,1,0,0,0,0|1,1,0]=3 3475 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 11a_100020643023_100009999607 [0,1,0,0,0,0|2,0,0]=3 3476 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 1626a_100020643023_100009999607 [0,1,0,0,0,0|2,0,0]=3 3477 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 240690a_100020643023_100009999607 [0,1,0,0,0,0|2,0,0]=3 3478 B14R1.2523 CCCNC(=O)c1ccc(cc1I)C 527a_100020643023_100009999607 [0,1,0,0,0,0|2,0,0]=3 3479 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 11a_100020643023_100000739380 [0,1,0,0,0,0|1,0,0]=2 3480 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 1626a_100020643023_100000739380 [0,1,0,0,0,0|1,0,0]=2 3481 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 240690a_100020643023_100000739380 [0,1,0,0,0,0|1,0,0]=2 3482 B14R1.2523 CCCNC(=O)c1ccc(cc1I)Cl 527a_100020643023_100000739380 [0,1,0,0,0,0|1,0,0]=2 3483 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 11a_100020643023_100000739341 [0,1,0,0,0,0|1,1,0]=3 3484 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 1626a_100020643023_100000739341 [0,1,0,0,0,0|1,1,0]=3 3485 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 240690a_100020643023_100000739341 [0,1,0,0,0,0|1,1,0]=3 3486 B14R1.2523 CCCNC(=O)c1ccc(cc1I)F 527a_100020643023_100000739341 [0,1,0,0,0,0|1,1,0]=3 3487 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br 240690a_100020643023_100000744433 [0,1,0,0,0,0|1,1,0]=3 3488 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Br 527a_100020643023_100000744433 [0,1,0,0,0,0|1,1,0]=3 3489 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 1626a_100020643023_100000212137 [0,1,0,0,0,0|2,0,0]=3 3490 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 240690a_100020643023_100000212137 [0,1,0,0,0,0|2,0,0]=3 3491 B14R1.2523 CCCNC(=O)c1ccc(cc1O)C 527a_100020643023_100000212137 [0,1,0,0,0,0|2,0,0]=3 3492 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 11a_100020643023_100000188622 [0,1,0,0,0,0|1,0,0]=2 3493 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 240690a_100020643023_100000188622 [0,1,0,0,0,0|1,0,0]=2 3494 B14R1.2523 CCCNC(=O)c1ccc(cc1O)Cl 527a_100020643023_100000188622 [0,1,0,0,0,0|1,0,0]=2 3495 B14R1.2523 CCCNC(=O)c1ccc(cc1O)F 240690a_100020643023_100000746061 [0,1,0,0,0,0|1,1,0]=3 3496 B14R1.2523 CCCNC(=O)c1ccc(cc1O)F 527a_100020643023_100000746061 [0,1,0,0,0,0|1,1,0]=3 3497 B14R1.2523 CCCNC(=O)c1ccc(cc1O)I 240690a_100020643023_100000091984 [0,1,0,0,0,0|1,1,0]=3 3498 B14R1.2523 CCCNC(=O)c1ccc(cc1O)I 527a_100020643023_100000091984 [0,1,0,0,0,0|1,1,0]=3 3499 B14R1.2523 CCCNC(C)c1ccc(cc1Br)Cl 269862a_100020643023_100011934292 [0,1,0,0,0,0|2,0,1]=4 3500 B14R1.2523 CCCNC(C)c1ccc(cc1C)Cl 269862a_100020643023_100011998434 [0,1,0,0,0,0|2,0,1]=4 3501 B14R1.2523 CCCNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_100000210303 [0,1,0,0,0,0|2,0,1]=4 3502 B14R1.2523 CCCNC(C)c1ccc(cc1Cl)Cl 269862a_100020643023_100000210972 [0,1,0,0,0,0|2,0,1]=4 3503 B14R1.2523 CCCNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_100000210303 [0,1,0,0,0,0|2,0,1]=4 3504 B14R1.2523 CCCNC(C)c1ccc(cc1F)Cl 269862a_100020643023_100011805184 [0,1,0,0,0,0|2,0,1]=4 3505 B14R1.2523 CCCNC(C)c1ccc(cc1O)Cl 269862a_100020643023_100000061402 [0,1,0,0,0,0|2,0,1]=4 3506 B14R1.2523 CCCN[C@@H](C)c1ccc(cc1C)Cl 2230a_100020633667_100000210303 [0,1,0,0,0,0|2,0,1]=4 3507 B14R1.2523 CCCN[C@@H](C)c1ccc(cc1C)Cl 34a_100020633667_100000210303 [0,1,0,0,0,0|2,0,1]=4 3508 B14R1.2523 CCNCC(=O)c1ccc(cc1Cl)Cl 2230a_100015525214_100011218845 [0,1,0,0,0,0|3,0,0]=4 3509 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)Br 22a_100000756455_100000762965 [0,1,0,0,0,0|2,1,0]=4 3510 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)C 22a_100000756455_100000685072 [0,1,0,0,0,0|3,0,0]=4 3511 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)Cl 22a_100000756455_100000766353 [0,1,0,0,0,0|2,0,0]=3 3512 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)F 22a_100000756455_100000212304 [0,1,0,0,0,0|2,1,0]=4 3513 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)I 22a_100000756455_100012360512 [0,1,0,0,0,0|2,1,0]=4 3514 B14R1.2523 CCNNC(=O)c1ccc(cc1Br)O 22a_100000756455_100012344906 [0,1,0,0,0,0|3,0,0]=4 3515 B14R1.2523 CCNNC(=O)c1ccc(cc1C)Br 22a_100000756455_100000741311 [0,1,0,0,0,0|2,1,0]=4 3516 B14R1.2523 CCNNC(=O)c1ccc(cc1C)C 22a_100000756455_100000211164 [0,1,0,0,0,0|3,0,0]=4 3517 B14R1.2523 CCNNC(=O)c1ccc(cc1C)Cl 22a_100000756455_100000688705 [0,1,0,0,0,0|2,0,0]=3 3518 B14R1.2523 CCNNC(=O)c1ccc(cc1C)F 22a_100000756455_100000686989 [0,1,0,0,0,0|2,1,0]=4 3519 B14R1.2523 CCNNC(=O)c1ccc(cc1C)I 22a_100000756455_100010189873 [0,1,0,0,0,0|2,1,0]=4 3520 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)Br 22a_100000756455_100000741628 [0,1,0,0,0,0|2,1,0]=4 3521 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)C 22a_100000756455_100000766932 [0,1,0,0,0,0|3,0,0]=4 3522 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)Cl 22a_100000756455_100000185840 [0,1,0,0,0,0|2,0,0]=3 3523 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)F 22a_100000756455_100000211397 [0,1,0,0,0,0|2,1,0]=4 3524 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)I 22a_100000756455_100000751301 [0,1,0,0,0,0|2,1,0]=4 3525 B14R1.2523 CCNNC(=O)c1ccc(cc1Cl)O 22a_100000756455_100000702456 [0,1,0,0,0,0|3,0,0]=4 3526 B14R1.2523 CCNNC(=O)c1ccc(cc1F)Br 22a_100000756455_100000214689 [0,1,0,0,0,0|2,1,0]=4 3527 B14R1.2523 CCNNC(=O)c1ccc(cc1F)C 22a_100000756455_100000766033 [0,1,0,0,0,0|3,0,0]=4 3528 B14R1.2523 CCNNC(=O)c1ccc(cc1F)Cl 22a_100000756455_100000212326 [0,1,0,0,0,0|2,0,0]=3 3529 B14R1.2523 CCNNC(=O)c1ccc(cc1F)F 22a_100000756455_100000211022 [0,1,0,0,0,0|2,1,0]=4 3530 B14R1.2523 CCNNC(=O)c1ccc(cc1F)I 22a_100000756455_100000037189 [0,1,0,0,0,0|2,1,0]=4 3531 B14R1.2523 CCNNC(=O)c1ccc(cc1F)O 22a_100000756455_100000689029 [0,1,0,0,0,0|3,0,0]=4 3532 B14R1.2523 CCNNC(=O)c1ccc(cc1I)Br 22a_100000756455_100000751167 [0,1,0,0,0,0|2,1,0]=4 3533 B14R1.2523 CCNNC(=O)c1ccc(cc1I)C 22a_100000756455_100009999607 [0,1,0,0,0,0|3,0,0]=4 3534 B14R1.2523 CCNNC(=O)c1ccc(cc1I)Cl 22a_100000756455_100000739380 [0,1,0,0,0,0|2,0,0]=3 3535 B14R1.2523 CCNNC(=O)c1ccc(cc1I)F 22a_100000756455_100000739341 [0,1,0,0,0,0|2,1,0]=4 3536 B14R1.2523 CCNNC(=O)c1ccc(cc1O)Br 22a_100000756455_100000744433 [0,1,0,0,0,0|2,1,0]=4 3537 B14R1.2523 CCNNC(=O)c1ccc(cc1O)C 22a_100000756455_100000212137 [0,1,0,0,0,0|3,0,0]=4 3538 B14R1.2523 CCNNC(=O)c1ccc(cc1O)Cl 22a_100000756455_100000188622 [0,1,0,0,0,0|2,0,0]=3 3539 B14R1.2523 CCNNC(=O)c1ccc(cc1O)F 22a_100000756455_100000746061 [0,1,0,0,0,0|2,1,0]=4 3540 B14R1.2523 CCNNC(=O)c1ccc(cc1O)I 22a_100000756455_100000091984 [0,1,0,0,0,0|2,1,0]=4 3541 B14R1.2523 CCNNC(=O)c1ccc(cc1O)O 22a_100000756455_100000212172 [0,1,0,0,0,0|3,0,0]=4 3542 B14R1.2523 CCOCC(=O)c1ccc(cc1F)Cl 34a_100121572206_100012351891 [0,1,0,0,0,0|3,0,0]=4 3543 B14R1.2523 CCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210202 [0,1,0,0,0,0|3,0,0]=4 3544 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Cl 62a_100000210202_100012351891 [0,1,0,0,0,0|3,0,0]=4 3545 B14R1.2523 CCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210202 [0,1,0,0,0,0|3,0,0]=4 3546 B14R1.2523 CN(CCCO)c1ccc(cc1Br)Cl 269982a_100020633009_100011215043 [0,1,0,0,0,0|3,0,0]=4 3547 B14R1.2523 CN(CCCO)c1ccc(cc1Br)Cl 34a_100020633009_100000230001 [0,1,0,0,0,0|3,0,0]=4 3548 B14R1.2523 CN(CCCO)c1ccc(cc1Cl)Cl 269982a_114849113696_100011215043 [0,1,0,0,0,0|3,0,0]=4 3549 B14R1.2523 CN(CCCO)c1ccc(cc1Cl)Cl 34a_114849113696_100000230001 [0,1,0,0,0,0|3,0,0]=4 3550 B14R1.2523 CNCOC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100010978946 [0,1,0,0,0,0|3,0,0]=4 3551 B14R1.2523 COCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000233755 [0,1,0,0,0,0|3,0,0]=4 3552 B14R1.2523 COCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000233755 [0,1,0,0,0,0|3,0,0]=4 3553 B14R1.2523 COCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000233755 [0,1,0,0,0,0|3,0,0]=4 3554 B14R1.2523 COCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000233755 [0,1,0,0,0,0|3,0,0]=4 3555 B14R1.2523 COCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000233755 [0,1,0,0,0,0|3,0,0]=4 3556 B14R1.2523 COCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000233755 [0,1,0,0,0,0|3,0,0]=4 3557 B14R1.2523 CSCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000751147 [0,1,0,0,0,0|3,0,0]=4 3558 B14R1.2523 CSCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000751147 [0,1,0,0,0,0|3,0,0]=4 3559 B14R1.2523 CSCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000751147 [0,1,0,0,0,0|3,0,0]=4 3560 B14R1.2523 CSCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000751147 [0,1,0,0,0,0|3,0,0]=4 3561 B14R1.2523 CSCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000751147 [0,1,0,0,0,0|3,0,0]=4 3562 B14R1.2523 CSCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000751147 [0,1,0,0,0,0|3,0,0]=4 3563 B14R1.2523 CSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_200000210301 [0,1,0,0,0,0|3,0,0]=4 3564 B14R1.2523 C[C@@H](NCCO)c1ccc(cc1Br)F 2230a_100025704064_100000211926 [0,1,0,0,0,0|1,1,1]=4 3565 B14R1.2523 C[C@@H](NCCO)c1ccc(cc1Br)F 34a_100025704064_100000211926 [0,1,0,0,0,0|1,1,1]=4 3566 B14R1.2523 C[C@@H](NCCO)c1ccc(cc1Cl)F 2230a_100015196781_100000211926 [0,1,0,0,0,0|1,1,1]=4 3567 B14R1.2523 C[C@@H](NCCO)c1ccc(cc1Cl)F 34a_100015196781_100000211926 [0,1,0,0,0,0|1,1,1]=4 3568 B14R1.2523 C[C@@H](NCCO)c1ncc(cc1Cl)Cl 2230a_100012001814_100000211926 [0,1,0,0,0,0|2,0,1]=4 3569 B14R1.2523 Cc1cc(ccc1C(=O)CCC#N)Cl 1458a_100000688705_100011215226 [0,1,0,0,0,0|2,0,1]=4 3570 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)Br 1458a_100000741311_100011934791 [0,1,0,0,0,0|2,1,0]=4 3571 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)Cl 1458a_100000688705_100011934791 [0,1,0,0,0,0|2,0,0]=3 3572 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)F 1458a_100000686989_100011934791 [0,1,0,0,0,0|2,1,0]=4 3573 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)I 1458a_100010189873_100011934791 [0,1,0,0,0,0|2,1,0]=4 3574 B14R1.2523 Cc1cc(ccc1C(=O)CCCF)O 1458a_100000692822_100011934791 [0,1,0,0,0,0|3,0,0]=4 3575 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Br 1458a_100000741311_100011215043 [0,1,0,0,0,0|1,1,0]=3 3576 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)Cl 1458a_100000688705_100011215043 [0,1,0,0,0,0|1,0,0]=2 3577 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)F 1458a_100000686989_100011215043 [0,1,0,0,0,0|1,1,0]=3 3578 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)I 1458a_100010189873_100011215043 [0,1,0,0,0,0|1,1,0]=3 3579 B14R1.2523 Cc1cc(ccc1C(=O)CCCO)O 1458a_100000692822_100011215043 [0,1,0,0,0,0|2,0,0]=3 3580 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)Br 1626a_100000734998_100000741311 [0,1,0,0,0,0|1,1,1]=4 3581 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)Br 527a_100000734998_100000741311 [0,1,0,0,0,0|1,1,1]=4 3582 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)Cl 1626a_100000734998_100000688705 [0,1,0,0,0,0|1,0,1]=3 3583 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)Cl 527a_100000734998_100000688705 [0,1,0,0,0,0|1,0,1]=3 3584 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)F 1626a_100000734998_100000686989 [0,1,0,0,0,0|1,1,1]=4 3585 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)F 527a_100000734998_100000686989 [0,1,0,0,0,0|1,1,1]=4 3586 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)I 1626a_100000734998_100010189873 [0,1,0,0,0,0|1,1,1]=4 3587 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)I 527a_100000734998_100010189873 [0,1,0,0,0,0|1,1,1]=4 3588 B14R1.2523 Cc1cc(ccc1C(=O)NCC#N)O 527a_100000734998_100000692822 [0,1,0,0,0,0|2,0,1]=4 3589 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 11a_100000724931_100000741311 [0,1,0,0,0,0|1,1,0]=3 3590 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 1626a_100000724931_100000741311 [0,1,0,0,0,0|1,1,0]=3 3591 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 240690a_100000724931_100000741311 [0,1,0,0,0,0|1,1,0]=3 3592 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Br 527a_100000724931_100000741311 [0,1,0,0,0,0|1,1,0]=3 3593 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 11a_100000724931_100000688705 [0,1,0,0,0,0|1,0,0]=2 3594 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 1626a_100000724931_100000688705 [0,1,0,0,0,0|1,0,0]=2 3595 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 240690a_100000724931_100000688705 [0,1,0,0,0,0|1,0,0]=2 3596 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)Cl 527a_100000724931_100000688705 [0,1,0,0,0,0|1,0,0]=2 3597 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 11a_100000724931_100000686989 [0,1,0,0,0,0|1,1,0]=3 3598 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 1626a_100000724931_100000686989 [0,1,0,0,0,0|1,1,0]=3 3599 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 240690a_100000724931_100000686989 [0,1,0,0,0,0|1,1,0]=3 3600 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)F 527a_100000724931_100000686989 [0,1,0,0,0,0|1,1,0]=3 3601 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 11a_100000724931_100010189873 [0,1,0,0,0,0|1,1,0]=3 3602 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 1626a_100000724931_100010189873 [0,1,0,0,0,0|1,1,0]=3 3603 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 240690a_100000724931_100010189873 [0,1,0,0,0,0|1,1,0]=3 3604 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)I 527a_100000724931_100010189873 [0,1,0,0,0,0|1,1,0]=3 3605 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)O 240690a_100000724931_100000692822 [0,1,0,0,0,0|2,0,0]=3 3606 B14R1.2523 Cc1cc(ccc1C(=O)NCCF)O 527a_100000724931_100000692822 [0,1,0,0,0,0|2,0,0]=3 3607 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Br 240690a_100000210304_100000741311 [0,1,0,0,0,0|0,1,0]=2 3608 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Br 527a_100000210304_100000741311 [0,1,0,0,0,0|0,1,0]=2 3609 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Cl 240690a_100000210304_100000688705 [0,1,0,0,0,0|0,0,0]=1 3610 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)Cl 527a_100000210304_100000688705 [0,1,0,0,0,0|0,0,0]=1 3611 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)F 240690a_100000210304_100000686989 [0,1,0,0,0,0|0,1,0]=2 3612 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)F 527a_100000210304_100000686989 [0,1,0,0,0,0|0,1,0]=2 3613 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)I 240690a_100000210304_100010189873 [0,1,0,0,0,0|0,1,0]=2 3614 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)I 527a_100000210304_100010189873 [0,1,0,0,0,0|0,1,0]=2 3615 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)O 240690a_100000210304_100000692822 [0,1,0,0,0,0|1,0,0]=2 3616 B14R1.2523 Cc1cc(ccc1C(=O)NCCO)O 527a_100000210304_100000692822 [0,1,0,0,0,0|1,0,0]=2 3617 B14R1.2523 Cc1cc(ccc1C(C)NCCF)Cl 269862a_100000724931_100011998434 [0,1,0,0,0,0|2,0,1]=4 3618 B14R1.2523 Cc1cc(ccc1C(C)NCCO)Br 269862a_100000210304_100012360112 [0,1,0,0,0,0|1,1,1]=4 3619 B14R1.2523 Cc1cc(ccc1C(C)NCCO)Cl 269862a_100000210304_100011998434 [0,1,0,0,0,0|1,0,1]=3 3620 B14R1.2523 Cc1cc(ccc1C(C)NCCO)F 269862a_100000210304_100000753884 [0,1,0,0,0,0|1,1,1]=4 3621 B14R1.2523 Cc1cc(ccc1N(C)CCCO)Cl 2230a_114849113698_100000230001 [0,1,0,0,0,0|3,0,0]=4 3622 B14R1.2523 Cc1cc(ccc1N(C)CCCO)Cl 269982a_114849113698_100011215043 [0,1,0,0,0,0|3,0,0]=4 3623 B14R1.2523 Cc1cc(ccc1N(C)CCCO)Cl 34a_114849113698_100000230001 [0,1,0,0,0,0|3,0,0]=4 3624 B14R1.2523 Cc1cc(ccc1[C@H](C)NCCF)Cl 2230a_100020633667_100011217306 [0,1,0,0,0,0|2,0,1]=4 3625 B14R1.2523 Cc1cc(ccc1[C@H](C)NCCF)Cl 34a_100020633667_100011217306 [0,1,0,0,0,0|2,0,1]=4 3626 B14R1.2523 Cc1cc(ccc1[C@H](C)NCCO)Cl 2230a_100020633667_100000211926 [0,1,0,0,0,0|1,0,1]=3 3627 B14R1.2523 Cc1cc(ccc1[C@H](C)NCCO)Cl 34a_100020633667_100000211926 [0,1,0,0,0,0|1,0,1]=3 3628 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCF 1458a_100000685072_100011934791 [0,1,0,0,0,0|3,0,0]=4 3629 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)CCCO 1458a_100000685072_100011215043 [0,1,0,0,0,0|2,0,0]=3 3630 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCC#N 1626a_100000734998_100000685072 [0,1,0,0,0,0|2,0,1]=4 3631 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCC#N 527a_100000734998_100000685072 [0,1,0,0,0,0|2,0,1]=4 3632 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 11a_100000724931_100000685072 [0,1,0,0,0,0|2,0,0]=3 3633 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 1626a_100000724931_100000685072 [0,1,0,0,0,0|2,0,0]=3 3634 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 240690a_100000724931_100000685072 [0,1,0,0,0,0|2,0,0]=3 3635 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCF 527a_100000724931_100000685072 [0,1,0,0,0,0|2,0,0]=3 3636 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCO 240690a_100000210304_100000685072 [0,1,0,0,0,0|1,0,0]=2 3637 B14R1.2523 Cc1ccc(c(c1)Br)C(=O)NCCO 527a_100000210304_100000685072 [0,1,0,0,0,0|1,0,0]=2 3638 B14R1.2523 Cc1ccc(c(c1)Br)C(C)NCCO 269862a_100000210304_100012353930 [0,1,0,0,0,0|2,0,1]=4 3639 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCF 1458a_100000211164_100011934791 [0,1,0,0,0,0|3,0,0]=4 3640 B14R1.2523 Cc1ccc(c(c1)C)C(=O)CCCO 1458a_100000211164_100011215043 [0,1,0,0,0,0|2,0,0]=3 3641 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCC#N 1626a_100000734998_100000211164 [0,1,0,0,0,0|2,0,1]=4 3642 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCC#N 527a_100000734998_100000211164 [0,1,0,0,0,0|2,0,1]=4 3643 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 11a_100000724931_100000211164 [0,1,0,0,0,0|2,0,0]=3 3644 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 1626a_100000724931_100000211164 [0,1,0,0,0,0|2,0,0]=3 3645 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 240690a_100000724931_100000211164 [0,1,0,0,0,0|2,0,0]=3 3646 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCF 527a_100000724931_100000211164 [0,1,0,0,0,0|2,0,0]=3 3647 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCO 240690a_100000210304_100000211164 [0,1,0,0,0,0|1,0,0]=2 3648 B14R1.2523 Cc1ccc(c(c1)C)C(=O)NCCO 527a_100000210304_100000211164 [0,1,0,0,0,0|1,0,0]=2 3649 B14R1.2523 Cc1ccc(c(c1)C)C(C)NCCO 269862a_100000210304_100000211561 [0,1,0,0,0,0|2,0,1]=4 3650 B14R1.2523 Cc1ccc(c(c1)C)[C@H](C)NCCO 2230a_100000745882_100000211926 [0,1,0,0,0,0|2,0,1]=4 3651 B14R1.2523 Cc1ccc(c(c1)C)[C@H](C)NCCO 34a_100000745882_100000211926 [0,1,0,0,0,0|2,0,1]=4 3652 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCF 1458a_100000766932_100011934791 [0,1,0,0,0,0|3,0,0]=4 3653 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100000766932_100011215043 [0,1,0,0,0,0|2,0,0]=3 3654 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCC#N 1626a_100000734998_100000766932 [0,1,0,0,0,0|2,0,1]=4 3655 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCC#N 527a_100000734998_100000766932 [0,1,0,0,0,0|2,0,1]=4 3656 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 11a_100000724931_100000766932 [0,1,0,0,0,0|2,0,0]=3 3657 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 1626a_100000724931_100000766932 [0,1,0,0,0,0|2,0,0]=3 3658 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 240690a_100000724931_100000766932 [0,1,0,0,0,0|2,0,0]=3 3659 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCF 527a_100000724931_100000766932 [0,1,0,0,0,0|2,0,0]=3 3660 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCO 240690a_100000210304_100000766932 [0,1,0,0,0,0|1,0,0]=2 3661 B14R1.2523 Cc1ccc(c(c1)Cl)C(=O)NCCO 527a_100000210304_100000766932 [0,1,0,0,0,0|1,0,0]=2 3662 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCF 1458a_100000766033_100011934791 [0,1,0,0,0,0|3,0,0]=4 3663 B14R1.2523 Cc1ccc(c(c1)F)C(=O)CCCO 1458a_100000766033_100011215043 [0,1,0,0,0,0|2,0,0]=3 3664 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCC#N 1626a_100000734998_100000766033 [0,1,0,0,0,0|2,0,1]=4 3665 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCC#N 527a_100000734998_100000766033 [0,1,0,0,0,0|2,0,1]=4 3666 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 11a_100000724931_100000766033 [0,1,0,0,0,0|2,0,0]=3 3667 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 1626a_100000724931_100000766033 [0,1,0,0,0,0|2,0,0]=3 3668 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 240690a_100000724931_100000766033 [0,1,0,0,0,0|2,0,0]=3 3669 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCF 527a_100000724931_100000766033 [0,1,0,0,0,0|2,0,0]=3 3670 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCO 240690a_100000210304_100000766033 [0,1,0,0,0,0|1,0,0]=2 3671 B14R1.2523 Cc1ccc(c(c1)F)C(=O)NCCO 527a_100000210304_100000766033 [0,1,0,0,0,0|1,0,0]=2 3672 B14R1.2523 Cc1ccc(c(c1)F)C(C)NCCO 269862a_100000210304_100011216410 [0,1,0,0,0,0|2,0,1]=4 3673 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCF 1458a_100009999607_100011934791 [0,1,0,0,0,0|3,0,0]=4 3674 B14R1.2523 Cc1ccc(c(c1)I)C(=O)CCCO 1458a_100009999607_100011215043 [0,1,0,0,0,0|2,0,0]=3 3675 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCC#N 1626a_100000734998_100009999607 [0,1,0,0,0,0|2,0,1]=4 3676 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCC#N 527a_100000734998_100009999607 [0,1,0,0,0,0|2,0,1]=4 3677 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 11a_100000724931_100009999607 [0,1,0,0,0,0|2,0,0]=3 3678 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 1626a_100000724931_100009999607 [0,1,0,0,0,0|2,0,0]=3 3679 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 240690a_100000724931_100009999607 [0,1,0,0,0,0|2,0,0]=3 3680 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCF 527a_100000724931_100009999607 [0,1,0,0,0,0|2,0,0]=3 3681 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCO 240690a_100000210304_100009999607 [0,1,0,0,0,0|1,0,0]=2 3682 B14R1.2523 Cc1ccc(c(c1)I)C(=O)NCCO 527a_100000210304_100009999607 [0,1,0,0,0,0|1,0,0]=2 3683 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCF 1458a_100000212137_100011934791 [0,1,0,0,0,0|3,0,0]=4 3684 B14R1.2523 Cc1ccc(c(c1)O)C(=O)CCCO 1458a_100000212137_100011215043 [0,1,0,0,0,0|2,0,0]=3 3685 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCC#N 1626a_100000734998_100000212137 [0,1,0,0,0,0|2,0,1]=4 3686 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCC#N 527a_100000734998_100000212137 [0,1,0,0,0,0|2,0,1]=4 3687 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 1626a_100000724931_100000212137 [0,1,0,0,0,0|2,0,0]=3 3688 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 240690a_100000724931_100000212137 [0,1,0,0,0,0|2,0,0]=3 3689 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCF 527a_100000724931_100000212137 [0,1,0,0,0,0|2,0,0]=3 3690 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 240690a_100000210304_100000212137 [0,1,0,0,0,0|1,0,0]=2 3691 B14R1.2523 Cc1ccc(c(c1)O)C(=O)NCCO 527a_100000210304_100000212137 [0,1,0,0,0,0|1,0,0]=2 3692 B14R1.2523 Cc1ccc(c(c1)O)C(C)NCCO 269862a_100000210304_100000234885 [0,1,0,0,0,0|2,0,1]=4 3693 B14R1.2523 N#CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011215226 [0,1,0,0,0,0|2,0,1]=4 3694 B14R1.2523 N#CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215226 [0,1,0,0,0,0|2,0,1]=4 3695 B14R1.2523 N#CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011215226 [0,1,0,0,0,0|2,0,1]=4 3696 B14R1.2523 N#CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011215226 [0,1,0,0,0,0|2,0,1]=4 3697 B14R1.2523 N#CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215226 [0,1,0,0,0,0|2,0,1]=4 3698 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)Br 1626a_100000734998_100000762965 [0,1,0,0,0,0|1,1,1]=4 3699 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)Br 527a_100000734998_100000762965 [0,1,0,0,0,0|1,1,1]=4 3700 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)Cl 1626a_100000734998_100000766353 [0,1,0,0,0,0|1,0,1]=3 3701 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)Cl 527a_100000734998_100000766353 [0,1,0,0,0,0|1,0,1]=3 3702 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)F 1626a_100000734998_100000212304 [0,1,0,0,0,0|1,1,1]=4 3703 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)F 527a_100000734998_100000212304 [0,1,0,0,0,0|1,1,1]=4 3704 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)I 1626a_100000734998_100012360512 [0,1,0,0,0,0|1,1,1]=4 3705 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)I 527a_100000734998_100012360512 [0,1,0,0,0,0|1,1,1]=4 3706 B14R1.2523 N#CCNC(=O)c1ccc(cc1Br)O 527a_100000734998_100012344906 [0,1,0,0,0,0|2,0,1]=4 3707 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)Br 1626a_100000734998_100000741628 [0,1,0,0,0,0|1,1,1]=4 3708 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)Br 527a_100000734998_100000741628 [0,1,0,0,0,0|1,1,1]=4 3709 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000734998_100000185840 [0,1,0,0,0,0|1,0,1]=3 3710 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)Cl 527a_100000734998_100000185840 [0,1,0,0,0,0|1,0,1]=3 3711 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)F 1626a_100000734998_100000211397 [0,1,0,0,0,0|1,1,1]=4 3712 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)F 527a_100000734998_100000211397 [0,1,0,0,0,0|1,1,1]=4 3713 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)I 1626a_100000734998_100000751301 [0,1,0,0,0,0|1,1,1]=4 3714 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)I 527a_100000734998_100000751301 [0,1,0,0,0,0|1,1,1]=4 3715 B14R1.2523 N#CCNC(=O)c1ccc(cc1Cl)O 527a_100000734998_100000702456 [0,1,0,0,0,0|2,0,1]=4 3716 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)Br 1626a_100000734998_100000214689 [0,1,0,0,0,0|1,1,1]=4 3717 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)Br 527a_100000734998_100000214689 [0,1,0,0,0,0|1,1,1]=4 3718 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)Cl 1626a_100000734998_100000212326 [0,1,0,0,0,0|1,0,1]=3 3719 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)Cl 527a_100000734998_100000212326 [0,1,0,0,0,0|1,0,1]=3 3720 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)F 1626a_100000734998_100000211022 [0,1,0,0,0,0|1,1,1]=4 3721 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)F 527a_100000734998_100000211022 [0,1,0,0,0,0|1,1,1]=4 3722 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)I 1626a_100000734998_100000037189 [0,1,0,0,0,0|1,1,1]=4 3723 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)I 527a_100000734998_100000037189 [0,1,0,0,0,0|1,1,1]=4 3724 B14R1.2523 N#CCNC(=O)c1ccc(cc1F)O 527a_100000734998_100000689029 [0,1,0,0,0,0|2,0,1]=4 3725 B14R1.2523 N#CCNC(=O)c1ccc(cc1I)Br 1626a_100000734998_100000751167 [0,1,0,0,0,0|1,1,1]=4 3726 B14R1.2523 N#CCNC(=O)c1ccc(cc1I)Br 527a_100000734998_100000751167 [0,1,0,0,0,0|1,1,1]=4 3727 B14R1.2523 N#CCNC(=O)c1ccc(cc1I)Cl 1626a_100000734998_100000739380 [0,1,0,0,0,0|1,0,1]=3 3728 B14R1.2523 N#CCNC(=O)c1ccc(cc1I)Cl 527a_100000734998_100000739380 [0,1,0,0,0,0|1,0,1]=3 3729 B14R1.2523 N#CCNC(=O)c1ccc(cc1I)F 1626a_100000734998_100000739341 [0,1,0,0,0,0|1,1,1]=4 3730 B14R1.2523 N#CCNC(=O)c1ccc(cc1I)F 527a_100000734998_100000739341 [0,1,0,0,0,0|1,1,1]=4 3731 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)Br 527a_100000734998_100000744433 [0,1,0,0,0,0|1,1,1]=4 3732 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)Cl 527a_100000734998_100000188622 [0,1,0,0,0,0|1,0,1]=3 3733 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)F 527a_100000734998_100000746061 [0,1,0,0,0,0|1,1,1]=4 3734 B14R1.2523 N#CCNC(=O)c1ccc(cc1O)I 527a_100000734998_100000091984 [0,1,0,0,0,0|1,1,1]=4 3735 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)Br 1458a_100000762965_100011934791 [0,1,0,0,0,0|2,1,0]=4 3736 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011934791 [0,1,0,0,0,0|2,0,0]=3 3737 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)F 1458a_100000212304_100011934791 [0,1,0,0,0,0|2,1,0]=4 3738 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)I 1458a_100012360512_100011934791 [0,1,0,0,0,0|2,1,0]=4 3739 B14R1.2523 O=C(CCCF)c1ccc(cc1Br)O 1458a_100012344906_100011934791 [0,1,0,0,0,0|3,0,0]=4 3740 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011934791 [0,1,0,0,0,0|2,1,0]=4 3741 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011934791 [0,1,0,0,0,0|2,0,0]=3 3742 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)F 1458a_100000211397_100011934791 [0,1,0,0,0,0|2,1,0]=4 3743 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)I 1458a_100000751301_100011934791 [0,1,0,0,0,0|2,1,0]=4 3744 B14R1.2523 O=C(CCCF)c1ccc(cc1Cl)O 1458a_100000702456_100011934791 [0,1,0,0,0,0|3,0,0]=4 3745 B14R1.2523 O=C(CCCF)c1ccc(cc1F)Br 1458a_100000214689_100011934791 [0,1,0,0,0,0|2,1,0]=4 3746 B14R1.2523 O=C(CCCF)c1ccc(cc1F)Cl 1458a_100000212326_100011934791 [0,1,0,0,0,0|2,0,0]=3 3747 B14R1.2523 O=C(CCCF)c1ccc(cc1F)F 1458a_100000211022_100011934791 [0,1,0,0,0,0|2,1,0]=4 3748 B14R1.2523 O=C(CCCF)c1ccc(cc1F)I 1458a_100000037189_100011934791 [0,1,0,0,0,0|2,1,0]=4 3749 B14R1.2523 O=C(CCCF)c1ccc(cc1F)O 1458a_100000689029_100011934791 [0,1,0,0,0,0|3,0,0]=4 3750 B14R1.2523 O=C(CCCF)c1ccc(cc1I)Br 1458a_100000751167_100011934791 [0,1,0,0,0,0|2,1,0]=4 3751 B14R1.2523 O=C(CCCF)c1ccc(cc1I)Cl 1458a_100000739380_100011934791 [0,1,0,0,0,0|2,0,0]=3 3752 B14R1.2523 O=C(CCCF)c1ccc(cc1I)F 1458a_100000739341_100011934791 [0,1,0,0,0,0|2,1,0]=4 3753 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Br 1458a_100000744433_100011934791 [0,1,0,0,0,0|2,1,0]=4 3754 B14R1.2523 O=C(CCCF)c1ccc(cc1O)Cl 1458a_100000188622_100011934791 [0,1,0,0,0,0|2,0,0]=3 3755 B14R1.2523 O=C(CCCF)c1ccc(cc1O)F 1458a_100000746061_100011934791 [0,1,0,0,0,0|2,1,0]=4 3756 B14R1.2523 O=C(CCCF)c1ccc(cc1O)I 1458a_100000091984_100011934791 [0,1,0,0,0,0|2,1,0]=4 3757 B14R1.2523 O=C(CCCF)c1ccc(cc1O)O 1458a_100000212172_100011934791 [0,1,0,0,0,0|3,0,0]=4 3758 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Br 1458a_100000762965_100011215043 [0,1,0,0,0,0|1,1,0]=3 3759 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100011215043 [0,1,0,0,0,0|1,0,0]=2 3760 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)F 1458a_100000212304_100011215043 [0,1,0,0,0,0|1,1,0]=3 3761 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)I 1458a_100012360512_100011215043 [0,1,0,0,0,0|1,1,0]=3 3762 B14R1.2523 O=C(CCCO)c1ccc(cc1Br)O 1458a_100012344906_100011215043 [0,1,0,0,0,0|2,0,0]=3 3763 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100011215043 [0,1,0,0,0,0|1,1,0]=3 3764 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215043 [0,1,0,0,0,0|1,0,0]=2 3765 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)F 1458a_100000211397_100011215043 [0,1,0,0,0,0|1,1,0]=3 3766 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)I 1458a_100000751301_100011215043 [0,1,0,0,0,0|1,1,0]=3 3767 B14R1.2523 O=C(CCCO)c1ccc(cc1Cl)O 1458a_100000702456_100011215043 [0,1,0,0,0,0|2,0,0]=3 3768 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Br 1458a_100000214689_100011215043 [0,1,0,0,0,0|1,1,0]=3 3769 B14R1.2523 O=C(CCCO)c1ccc(cc1F)Cl 1458a_100000212326_100011215043 [0,1,0,0,0,0|1,0,0]=2 3770 B14R1.2523 O=C(CCCO)c1ccc(cc1F)F 1458a_100000211022_100011215043 [0,1,0,0,0,0|1,1,0]=3 3771 B14R1.2523 O=C(CCCO)c1ccc(cc1F)I 1458a_100000037189_100011215043 [0,1,0,0,0,0|1,1,0]=3 3772 B14R1.2523 O=C(CCCO)c1ccc(cc1F)O 1458a_100000689029_100011215043 [0,1,0,0,0,0|2,0,0]=3 3773 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Br 1458a_100000751167_100011215043 [0,1,0,0,0,0|1,1,0]=3 3774 B14R1.2523 O=C(CCCO)c1ccc(cc1I)Cl 1458a_100000739380_100011215043 [0,1,0,0,0,0|1,0,0]=2 3775 B14R1.2523 O=C(CCCO)c1ccc(cc1I)F 1458a_100000739341_100011215043 [0,1,0,0,0,0|1,1,0]=3 3776 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Br 1458a_100000744433_100011215043 [0,1,0,0,0,0|1,1,0]=3 3777 B14R1.2523 O=C(CCCO)c1ccc(cc1O)Cl 1458a_100000188622_100011215043 [0,1,0,0,0,0|1,0,0]=2 3778 B14R1.2523 O=C(CCCO)c1ccc(cc1O)F 1458a_100000746061_100011215043 [0,1,0,0,0,0|1,1,0]=3 3779 B14R1.2523 O=C(CCCO)c1ccc(cc1O)I 1458a_100000091984_100011215043 [0,1,0,0,0,0|1,1,0]=3 3780 B14R1.2523 O=C(CCCO)c1ccc(cc1O)O 1458a_100000212172_100011215043 [0,1,0,0,0,0|2,0,0]=3 3781 B14R1.2523 O=C(CSCF)c1ccc(cc1Cl)Cl 62a_100011218845_100015361967 [0,1,0,0,0,0|3,0,0]=4 3782 B14R1.2523 O=C(CSCF)c1ccc(cc1F)Cl 62a_100012351891_100015361967 [0,1,0,0,0,0|3,0,0]=4 3783 B14R1.2523 O=C(CSCF)c1ccc(cc1F)Cl 62a_100015361967_100012351891 [0,1,0,0,0,0|3,0,0]=4 3784 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 11a_100000724931_100000762965 [0,1,0,0,0,0|1,1,0]=3 3785 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 1626a_100000724931_100000762965 [0,1,0,0,0,0|1,1,0]=3 3786 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 240690a_100000724931_100000762965 [0,1,0,0,0,0|1,1,0]=3 3787 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Br 527a_100000724931_100000762965 [0,1,0,0,0,0|1,1,0]=3 3788 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 11a_100000724931_100000766353 [0,1,0,0,0,0|1,0,0]=2 3789 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 1626a_100000724931_100000766353 [0,1,0,0,0,0|1,0,0]=2 3790 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 240690a_100000724931_100000766353 [0,1,0,0,0,0|1,0,0]=2 3791 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)Cl 527a_100000724931_100000766353 [0,1,0,0,0,0|1,0,0]=2 3792 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 11a_100000724931_100000212304 [0,1,0,0,0,0|1,1,0]=3 3793 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 1626a_100000724931_100000212304 [0,1,0,0,0,0|1,1,0]=3 3794 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 240690a_100000724931_100000212304 [0,1,0,0,0,0|1,1,0]=3 3795 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)F 527a_100000724931_100000212304 [0,1,0,0,0,0|1,1,0]=3 3796 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 11a_100000724931_100012360512 [0,1,0,0,0,0|1,1,0]=3 3797 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 1626a_100000724931_100012360512 [0,1,0,0,0,0|1,1,0]=3 3798 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 240690a_100000724931_100012360512 [0,1,0,0,0,0|1,1,0]=3 3799 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)I 527a_100000724931_100012360512 [0,1,0,0,0,0|1,1,0]=3 3800 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)O 240690a_100000724931_100012344906 [0,1,0,0,0,0|2,0,0]=3 3801 B14R1.2523 O=C(NCCF)c1ccc(cc1Br)O 527a_100000724931_100012344906 [0,1,0,0,0,0|2,0,0]=3 3802 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 11a_100000724931_100000741628 [0,1,0,0,0,0|1,1,0]=3 3803 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 1626a_100000724931_100000741628 [0,1,0,0,0,0|1,1,0]=3 3804 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 240690a_100000724931_100000741628 [0,1,0,0,0,0|1,1,0]=3 3805 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Br 527a_100000724931_100000741628 [0,1,0,0,0,0|1,1,0]=3 3806 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 11a_100000724931_100000185840 [0,1,0,0,0,0|1,0,0]=2 3807 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 1626a_100000724931_100000185840 [0,1,0,0,0,0|1,0,0]=2 3808 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 240690a_100000724931_100000185840 [0,1,0,0,0,0|1,0,0]=2 3809 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)Cl 527a_100000724931_100000185840 [0,1,0,0,0,0|1,0,0]=2 3810 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 11a_100000724931_100000211397 [0,1,0,0,0,0|1,1,0]=3 3811 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 1626a_100000724931_100000211397 [0,1,0,0,0,0|1,1,0]=3 3812 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 240690a_100000724931_100000211397 [0,1,0,0,0,0|1,1,0]=3 3813 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)F 527a_100000724931_100000211397 [0,1,0,0,0,0|1,1,0]=3 3814 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 11a_100000724931_100000751301 [0,1,0,0,0,0|1,1,0]=3 3815 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 1626a_100000724931_100000751301 [0,1,0,0,0,0|1,1,0]=3 3816 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 240690a_100000724931_100000751301 [0,1,0,0,0,0|1,1,0]=3 3817 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)I 527a_100000724931_100000751301 [0,1,0,0,0,0|1,1,0]=3 3818 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)O 240690a_100000724931_100000702456 [0,1,0,0,0,0|2,0,0]=3 3819 B14R1.2523 O=C(NCCF)c1ccc(cc1Cl)O 527a_100000724931_100000702456 [0,1,0,0,0,0|2,0,0]=3 3820 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 11a_100000724931_100000214689 [0,1,0,0,0,0|1,1,0]=3 3821 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 1626a_100000724931_100000214689 [0,1,0,0,0,0|1,1,0]=3 3822 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 240690a_100000724931_100000214689 [0,1,0,0,0,0|1,1,0]=3 3823 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Br 527a_100000724931_100000214689 [0,1,0,0,0,0|1,1,0]=3 3824 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 11a_100000724931_100000212326 [0,1,0,0,0,0|1,0,0]=2 3825 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 1626a_100000724931_100000212326 [0,1,0,0,0,0|1,0,0]=2 3826 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 240690a_100000724931_100000212326 [0,1,0,0,0,0|1,0,0]=2 3827 B14R1.2523 O=C(NCCF)c1ccc(cc1F)Cl 527a_100000724931_100000212326 [0,1,0,0,0,0|1,0,0]=2 3828 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 11a_100000724931_100000211022 [0,1,0,0,0,0|1,1,0]=3 3829 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 1626a_100000724931_100000211022 [0,1,0,0,0,0|1,1,0]=3 3830 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 240690a_100000724931_100000211022 [0,1,0,0,0,0|1,1,0]=3 3831 B14R1.2523 O=C(NCCF)c1ccc(cc1F)F 527a_100000724931_100000211022 [0,1,0,0,0,0|1,1,0]=3 3832 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 11a_100000724931_100000037189 [0,1,0,0,0,0|1,1,0]=3 3833 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 1626a_100000724931_100000037189 [0,1,0,0,0,0|1,1,0]=3 3834 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 240690a_100000724931_100000037189 [0,1,0,0,0,0|1,1,0]=3 3835 B14R1.2523 O=C(NCCF)c1ccc(cc1F)I 527a_100000724931_100000037189 [0,1,0,0,0,0|1,1,0]=3 3836 B14R1.2523 O=C(NCCF)c1ccc(cc1F)O 240690a_100000724931_100000689029 [0,1,0,0,0,0|2,0,0]=3 3837 B14R1.2523 O=C(NCCF)c1ccc(cc1F)O 527a_100000724931_100000689029 [0,1,0,0,0,0|2,0,0]=3 3838 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 11a_100000724931_100000751167 [0,1,0,0,0,0|1,1,0]=3 3839 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 1626a_100000724931_100000751167 [0,1,0,0,0,0|1,1,0]=3 3840 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 240690a_100000724931_100000751167 [0,1,0,0,0,0|1,1,0]=3 3841 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Br 527a_100000724931_100000751167 [0,1,0,0,0,0|1,1,0]=3 3842 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 11a_100000724931_100000739380 [0,1,0,0,0,0|1,0,0]=2 3843 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 1626a_100000724931_100000739380 [0,1,0,0,0,0|1,0,0]=2 3844 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 240690a_100000724931_100000739380 [0,1,0,0,0,0|1,0,0]=2 3845 B14R1.2523 O=C(NCCF)c1ccc(cc1I)Cl 527a_100000724931_100000739380 [0,1,0,0,0,0|1,0,0]=2 3846 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 11a_100000724931_100000739341 [0,1,0,0,0,0|1,1,0]=3 3847 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 1626a_100000724931_100000739341 [0,1,0,0,0,0|1,1,0]=3 3848 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 240690a_100000724931_100000739341 [0,1,0,0,0,0|1,1,0]=3 3849 B14R1.2523 O=C(NCCF)c1ccc(cc1I)F 527a_100000724931_100000739341 [0,1,0,0,0,0|1,1,0]=3 3850 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Br 240690a_100000724931_100000744433 [0,1,0,0,0,0|1,1,0]=3 3851 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Br 527a_100000724931_100000744433 [0,1,0,0,0,0|1,1,0]=3 3852 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 11a_100000724931_100000188622 [0,1,0,0,0,0|1,0,0]=2 3853 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 240690a_100000724931_100000188622 [0,1,0,0,0,0|1,0,0]=2 3854 B14R1.2523 O=C(NCCF)c1ccc(cc1O)Cl 527a_100000724931_100000188622 [0,1,0,0,0,0|1,0,0]=2 3855 B14R1.2523 O=C(NCCF)c1ccc(cc1O)F 240690a_100000724931_100000746061 [0,1,0,0,0,0|1,1,0]=3 3856 B14R1.2523 O=C(NCCF)c1ccc(cc1O)F 527a_100000724931_100000746061 [0,1,0,0,0,0|1,1,0]=3 3857 B14R1.2523 O=C(NCCF)c1ccc(cc1O)I 240690a_100000724931_100000091984 [0,1,0,0,0,0|1,1,0]=3 3858 B14R1.2523 O=C(NCCF)c1ccc(cc1O)I 527a_100000724931_100000091984 [0,1,0,0,0,0|1,1,0]=3 3859 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Br 240690a_100000210304_100000762965 [0,1,0,0,0,0|0,1,0]=2 3860 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Br 527a_100000210304_100000762965 [0,1,0,0,0,0|0,1,0]=2 3861 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Cl 240690a_100000210304_100000766353 [0,1,0,0,0,0|0,0,0]=1 3862 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)Cl 527a_100000210304_100000766353 [0,1,0,0,0,0|0,0,0]=1 3863 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)F 240690a_100000210304_100000212304 [0,1,0,0,0,0|0,1,0]=2 3864 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)F 527a_100000210304_100000212304 [0,1,0,0,0,0|0,1,0]=2 3865 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)I 240690a_100000210304_100012360512 [0,1,0,0,0,0|0,1,0]=2 3866 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)I 527a_100000210304_100012360512 [0,1,0,0,0,0|0,1,0]=2 3867 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)O 240690a_100000210304_100012344906 [0,1,0,0,0,0|1,0,0]=2 3868 B14R1.2523 O=C(NCCO)c1ccc(cc1Br)O 527a_100000210304_100012344906 [0,1,0,0,0,0|1,0,0]=2 3869 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Br 240690a_100000210304_100000741628 [0,1,0,0,0,0|0,1,0]=2 3870 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Br 527a_100000210304_100000741628 [0,1,0,0,0,0|0,1,0]=2 3871 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Cl 240690a_100000210304_100000185840 [0,1,0,0,0,0|0,0,0]=1 3872 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)Cl 527a_100000210304_100000185840 [0,1,0,0,0,0|0,0,0]=1 3873 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)F 240690a_100000210304_100000211397 [0,1,0,0,0,0|0,1,0]=2 3874 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)F 527a_100000210304_100000211397 [0,1,0,0,0,0|0,1,0]=2 3875 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)I 240690a_100000210304_100000751301 [0,1,0,0,0,0|0,1,0]=2 3876 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)I 527a_100000210304_100000751301 [0,1,0,0,0,0|0,1,0]=2 3877 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)O 240690a_100000210304_100000702456 [0,1,0,0,0,0|1,0,0]=2 3878 B14R1.2523 O=C(NCCO)c1ccc(cc1Cl)O 527a_100000210304_100000702456 [0,1,0,0,0,0|1,0,0]=2 3879 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Br 240690a_100000210304_100000214689 [0,1,0,0,0,0|0,1,0]=2 3880 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Br 527a_100000210304_100000214689 [0,1,0,0,0,0|0,1,0]=2 3881 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Cl 240690a_100000210304_100000212326 [0,1,0,0,0,0|0,0,0]=1 3882 B14R1.2523 O=C(NCCO)c1ccc(cc1F)Cl 527a_100000210304_100000212326 [0,1,0,0,0,0|0,0,0]=1 3883 B14R1.2523 O=C(NCCO)c1ccc(cc1F)F 240690a_100000210304_100000211022 [0,1,0,0,0,0|0,1,0]=2 3884 B14R1.2523 O=C(NCCO)c1ccc(cc1F)F 527a_100000210304_100000211022 [0,1,0,0,0,0|0,1,0]=2 3885 B14R1.2523 O=C(NCCO)c1ccc(cc1F)I 240690a_100000210304_100000037189 [0,1,0,0,0,0|0,1,0]=2 3886 B14R1.2523 O=C(NCCO)c1ccc(cc1F)I 527a_100000210304_100000037189 [0,1,0,0,0,0|0,1,0]=2 3887 B14R1.2523 O=C(NCCO)c1ccc(cc1F)O 240690a_100000210304_100000689029 [0,1,0,0,0,0|1,0,0]=2 3888 B14R1.2523 O=C(NCCO)c1ccc(cc1F)O 527a_100000210304_100000689029 [0,1,0,0,0,0|1,0,0]=2 3889 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Br 240690a_100000210304_100000751167 [0,1,0,0,0,0|0,1,0]=2 3890 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Br 527a_100000210304_100000751167 [0,1,0,0,0,0|0,1,0]=2 3891 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Cl 240690a_100000210304_100000739380 [0,1,0,0,0,0|0,0,0]=1 3892 B14R1.2523 O=C(NCCO)c1ccc(cc1I)Cl 527a_100000210304_100000739380 [0,1,0,0,0,0|0,0,0]=1 3893 B14R1.2523 O=C(NCCO)c1ccc(cc1I)F 240690a_100000210304_100000739341 [0,1,0,0,0,0|0,1,0]=2 3894 B14R1.2523 O=C(NCCO)c1ccc(cc1I)F 527a_100000210304_100000739341 [0,1,0,0,0,0|0,1,0]=2 3895 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 240690a_100000210304_100000744433 [0,1,0,0,0,0|0,1,0]=2 3896 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Br 527a_100000210304_100000744433 [0,1,0,0,0,0|0,1,0]=2 3897 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 240690a_100000210304_100000188622 [0,1,0,0,0,0|0,0,0]=1 3898 B14R1.2523 O=C(NCCO)c1ccc(cc1O)Cl 527a_100000210304_100000188622 [0,1,0,0,0,0|0,0,0]=1 3899 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 240690a_100000210304_100000746061 [0,1,0,0,0,0|0,1,0]=2 3900 B14R1.2523 O=C(NCCO)c1ccc(cc1O)F 527a_100000210304_100000746061 [0,1,0,0,0,0|0,1,0]=2 3901 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 240690a_100000210304_100000091984 [0,1,0,0,0,0|0,1,0]=2 3902 B14R1.2523 O=C(NCCO)c1ccc(cc1O)I 527a_100000210304_100000091984 [0,1,0,0,0,0|0,1,0]=2 3903 B14R1.2523 [13CH3]SCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_200025704644 [0,1,0,0,0,0|3,0,0]=4 3904 B14R2.68 Brc1ccc(cc1)C2=COCCC2 271570a_100010175576_100000752885 [0,0,0,1,0,0|2,1,0]=4 3905 B14R2.68 Cc1ccc(cc1)C2=COCCC2 271570a_100010175576_100000186775 [0,0,0,1,0,0|3,0,0]=4 3906 B14R2.68 Clc1ccc(cc1)C2=CCCCC2 271570a_100000062251_100000755918 [0,0,0,1,0,0|3,0,0]=4 3907 B14R2.68 Clc1ccc(cc1)C2=CCCCO2 271570a_100010177797_100000755918 [0,0,0,1,0,0|2,0,1]=4 3908 B14R2.68 Clc1ccc(cc1)C2=COCCC2 271570a_100010175576_100000755918 [0,0,0,1,0,0|2,0,0]=3 3909 B14R2.68 Clc1ccc(cn1)C2=COCCC2 271570a_100010175576_100000034144 [0,0,0,1,0,0|3,0,0]=4 3910 B14R2.68 Clc1ccc(nc1)C2=COCCC2 271570a_100010175576_100011356976 [0,0,0,1,0,0|3,0,0]=4 3911 B14R2.68 Fc1ccc(cc1)C2=COCCC2 271570a_100010175576_100000211213 [0,0,0,1,0,0|2,1,0]=4 3912 B14R2.68 Nc1ccc(cc1)C2=COCCC2 271570a_100010175576_100000185761 [0,0,0,1,0,0|3,0,0]=4 3913 B14R2.68 Oc1ccc(cc1)C2=COCCC2 271570a_100010175576_100000185759 [0,0,0,1,0,0|3,0,0]=4 3914 B14R2.933 CN(CC1CO1)c2ccc(cc2)Cl 2230a_100020629279_100011216344 [0,0,0,1,0,0|3,0,0]=4 3915 B14R2.933 CN(CC1CO1)c2ccc(cc2)Cl 269982a_100020629279_102125554688 [0,0,0,1,0,0|3,0,0]=4 3916 B14R2.933 CN(CC1CO1)c2ccc(cc2)Cl 34a_100020629279_102125554688 [0,0,0,1,0,0|3,0,0]=4 3917 B14R2.933 CN(C[C@@H]1CO1)c2ccc(cc2)Cl 269982a_100020629279_100000745022 [0,0,0,1,0,0|3,0,0]=4 3918 B14R2.933 C[C@@H](NC1CC1)c2ccc(cc2)Cl 34a_100015205461_100000211595 [0,0,0,1,0,0|2,0,1]=4 3919 B14R2.933 Cc1ccc(cc1)C(=O)CC2CC2 1458a_100000188618_100000742324 [0,0,0,1,0,0|3,0,0]=4 3920 B14R2.933 Cc1ccc(cc1)C(=O)CC2CO2 1458a_100000188618_100011216344 [0,0,0,1,0,0|2,0,0]=3 3921 B14R2.933 Cc1ccc(cc1)C(=O)CC2CS2 1458a_100000188618_100000031435 [0,0,0,1,0,0|2,1,0]=4 3922 B14R2.933 Cc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100000188618_100000745022 [0,0,0,1,0,0|2,0,0]=3 3923 B14R2.933 Cc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100000188618 [0,0,0,1,0,0|2,0,0]=3 3924 B14R2.933 Cc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100000188618 [0,0,0,1,0,0|2,0,0]=3 3925 B14R2.933 Cc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100000188618 [0,0,0,1,0,0|2,0,0]=3 3926 B14R2.933 O=C(CC1CC1)c2ccc(cc2)Br 1458a_100000185839_100000742324 [0,0,0,1,0,0|2,1,0]=4 3927 B14R2.933 O=C(CC1CC1)c2ccc(cc2)Cl 1458a_100000210187_100000742324 [0,0,0,1,0,0|2,0,0]=3 3928 B14R2.933 O=C(CC1CC1)c2ccc(cc2)F 1458a_100000187176_100000742324 [0,0,0,1,0,0|2,1,0]=4 3929 B14R2.933 O=C(CC1CC1)c2ccc(cc2)I 1458a_100000187904_100000742324 [0,0,0,1,0,0|2,1,0]=4 3930 B14R2.933 O=C(CC1CC1)c2ccc(cc2)O 1458a_100000212099_100000742324 [0,0,0,1,0,0|3,0,0]=4 3931 B14R2.933 O=C(CC1CO1)c2ccc(cc2)Br 1458a_100000185839_100011216344 [0,0,0,1,0,0|1,1,0]=3 3932 B14R2.933 O=C(CC1CO1)c2ccc(cc2)Cl 1458a_100000210187_100011216344 [0,0,0,1,0,0|1,0,0]=2 3933 B14R2.933 O=C(CC1CO1)c2ccc(cc2)F 1458a_100000187176_100011216344 [0,0,0,1,0,0|1,1,0]=3 3934 B14R2.933 O=C(CC1CO1)c2ccc(cc2)I 1458a_100000187904_100011216344 [0,0,0,1,0,0|1,1,0]=3 3935 B14R2.933 O=C(CC1CO1)c2ccc(cc2)O 1458a_100000212099_100011216344 [0,0,0,1,0,0|2,0,0]=3 3936 B14R2.933 O=C(CC1CS1)c2ccc(cc2)Br 1458a_100000185839_100000031435 [0,0,0,1,0,0|1,2,0]=4 3937 B14R2.933 O=C(CC1CS1)c2ccc(cc2)Cl 1458a_100000210187_100000031435 [0,0,0,1,0,0|1,1,0]=3 3938 B14R2.933 O=C(CC1CS1)c2ccc(cc2)F 1458a_100000187176_100000031435 [0,0,0,1,0,0|1,2,0]=4 3939 B14R2.933 O=C(CC1CS1)c2ccc(cc2)I 1458a_100000187904_100000031435 [0,0,0,1,0,0|1,2,0]=4 3940 B14R2.933 O=C(CC1CS1)c2ccc(cc2)O 1458a_100000212099_100000031435 [0,0,0,1,0,0|2,1,0]=4 3941 B14R2.933 O=C(C[C@@H]1CO1)c2ccc(cc2)Br 1458a_100000185839_100000745022 [0,0,0,1,0,0|1,1,0]=3 3942 B14R2.933 O=C(C[C@@H]1CO1)c2ccc(cc2)Cl 1458a_100000210187_100000745022 [0,0,0,1,0,0|1,0,0]=2 3943 B14R2.933 O=C(C[C@@H]1CO1)c2ccc(cc2)F 1458a_100000187176_100000745022 [0,0,0,1,0,0|1,1,0]=3 3944 B14R2.933 O=C(C[C@@H]1CO1)c2ccc(cc2)I 1458a_100000187904_100000745022 [0,0,0,1,0,0|1,1,0]=3 3945 B14R2.933 O=C(C[C@@H]1CO1)c2ccc(cc2)O 1458a_100000212099_100000745022 [0,0,0,1,0,0|2,0,0]=3 3946 B14R2.933 O=C(NC1CC1)c2ccc(cc2)Br 1626a_100000212008_100000185839 [0,0,0,1,0,0|1,1,0]=3 3947 B14R2.933 O=C(NC1CC1)c2ccc(cc2)Br 240690a_100000212008_100000185839 [0,0,0,1,0,0|1,1,0]=3 3948 B14R2.933 O=C(NC1CC1)c2ccc(cc2)Br 527a_100000212008_100000185839 [0,0,0,1,0,0|1,1,0]=3 3949 B14R2.933 O=C(NC1CC1)c2ccc(cc2)Cl 1626a_100000212008_100000210187 [0,0,0,1,0,0|1,0,0]=2 3950 B14R2.933 O=C(NC1CC1)c2ccc(cc2)Cl 240690a_100000212008_100000210187 [0,0,0,1,0,0|1,0,0]=2 3951 B14R2.933 O=C(NC1CC1)c2ccc(cc2)Cl 527a_100000212008_100000210187 [0,0,0,1,0,0|1,0,0]=2 3952 B14R2.933 O=C(NC1CC1)c2ccc(cc2)F 1626a_100000212008_100000187176 [0,0,0,1,0,0|1,1,0]=3 3953 B14R2.933 O=C(NC1CC1)c2ccc(cc2)F 240690a_100000212008_100000187176 [0,0,0,1,0,0|1,1,0]=3 3954 B14R2.933 O=C(NC1CC1)c2ccc(cc2)F 527a_100000212008_100000187176 [0,0,0,1,0,0|1,1,0]=3 3955 B14R2.933 O=C(NC1CC1)c2ccc(cc2)I 1626a_100000212008_100000187904 [0,0,0,1,0,0|1,1,0]=3 3956 B14R2.933 O=C(NC1CC1)c2ccc(cc2)I 240690a_100000212008_100000187904 [0,0,0,1,0,0|1,1,0]=3 3957 B14R2.933 O=C(NC1CC1)c2ccc(cc2)I 527a_100000212008_100000187904 [0,0,0,1,0,0|1,1,0]=3 3958 B14R2.933 O=C(NC1CC1)c2ccc(cc2)O 240690a_100000212008_100000212099 [0,0,0,1,0,0|2,0,0]=3 3959 B14R2.933 O=C(NC1CC1)c2ccc(cc2)O 271570a_203496583355_100000155670 [0,0,0,1,0,0|2,0,0]=3 3960 B14R2.933 O=C(NC1CC1)c2ccc(cc2)O 527a_100000212008_100000212099 [0,0,0,1,0,0|2,0,0]=3 3961 B14R2.933 O=C(NC1CC1)c2ccc(cn2)O 271570a_203496583355_200011781258 [0,0,0,1,0,0|3,0,0]=4 3962 B14R2.933 O=C(NC1CC1)c2ccc(nc2)O 271570a_203496583355_100000160656 [0,0,0,1,0,0|3,0,0]=4 3963 B14R2.8719 O=C1CCCOc2c1ccc(c2)O 271570a_203496583355_100000735630 [0,0,0,1,0,0|2,0,0]=3 3964 B14R2.8719 O=C1NCCNc2c1ccc(c2)O 271570a_203496583355_200000725643 [0,0,0,1,0,0|2,0,0]=3 3965 B14R2.8719 O=C1NCCOc2c1ccc(c2)O 271570a_203496583355_200013358270 [0,0,0,1,0,0|1,0,0]=2 3966 B14R2.8751 O=c1[nH]cc(c2c1ccc(c2)F)O 271570a_203496583355_100010191626 [0,0,0,1,0,0|0,1,2]=4 3967 B14R2.10606 CC(c1ccc(cc1)Cl)N2CCC2 269982a_100000754969_100000684792 [0,0,0,1,0,0|2,0,1]=4 3968 B14R2.10606 Cc1ccc(cc1)C(=O)C2CCC2 1458a_100000188618_100000749161 [0,0,0,1,0,0|3,0,0]=4 3969 B14R2.10606 Cc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100000188618 [0,0,0,1,0,0|2,0,0]=3 3970 B14R2.10606 Cc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100000188618 [0,0,0,1,0,0|2,0,0]=3 3971 B14R2.10606 Cc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100000188618 [0,0,0,1,0,0|2,0,0]=3 3972 B14R2.10606 O=C(c1ccc(cc1)Br)C2CCC2 1458a_100000185839_100000749161 [0,0,0,1,0,0|2,1,0]=4 3973 B14R2.10606 O=C(c1ccc(cc1)Br)N2CCC2 11a_100000754969_100000185839 [0,0,0,1,0,0|1,1,0]=3 3974 B14R2.10606 O=C(c1ccc(cc1)Br)N2CCC2 240690a_100000754969_100000185839 [0,0,0,1,0,0|1,1,0]=3 3975 B14R2.10606 O=C(c1ccc(cc1)Br)N2CCC2 527a_100000754969_100000185839 [0,0,0,1,0,0|1,1,0]=3 3976 B14R2.10606 O=C(c1ccc(cc1)Cl)C2CCC2 1458a_100000210187_100000749161 [0,0,0,1,0,0|2,0,0]=3 3977 B14R2.10606 O=C(c1ccc(cc1)Cl)C2COC2 1458a_100000210187_100000687716 [0,0,0,1,0,0|3,0,0]=4 3978 B14R2.10606 O=C(c1ccc(cc1)Cl)N2CCC2 11a_100000754969_100000210187 [0,0,0,1,0,0|1,0,0]=2 3979 B14R2.10606 O=C(c1ccc(cc1)Cl)N2CCC2 240690a_100000754969_100000210187 [0,0,0,1,0,0|1,0,0]=2 3980 B14R2.10606 O=C(c1ccc(cc1)Cl)N2CCC2 527a_100000754969_100000210187 [0,0,0,1,0,0|1,0,0]=2 3981 B14R2.10606 O=C(c1ccc(cc1)F)C2CCC2 1458a_100000187176_100000749161 [0,0,0,1,0,0|2,1,0]=4 3982 B14R2.10606 O=C(c1ccc(cc1)F)N2CCC2 11a_100000754969_100000187176 [0,0,0,1,0,0|1,1,0]=3 3983 B14R2.10606 O=C(c1ccc(cc1)F)N2CCC2 240690a_100000754969_100000187176 [0,0,0,1,0,0|1,1,0]=3 3984 B14R2.10606 O=C(c1ccc(cc1)F)N2CCC2 527a_100000754969_100000187176 [0,0,0,1,0,0|1,1,0]=3 3985 B14R2.10606 O=C(c1ccc(cc1)I)C2CCC2 1458a_100000187904_100000749161 [0,0,0,1,0,0|2,1,0]=4 3986 B14R2.10606 O=C(c1ccc(cc1)I)N2CCC2 11a_100000754969_100000187904 [0,0,0,1,0,0|1,1,0]=3 3987 B14R2.10606 O=C(c1ccc(cc1)I)N2CCC2 240690a_100000754969_100000187904 [0,0,0,1,0,0|1,1,0]=3 3988 B14R2.10606 O=C(c1ccc(cc1)I)N2CCC2 527a_100000754969_100000187904 [0,0,0,1,0,0|1,1,0]=3 3989 B14R2.10606 O=C(c1ccc(cc1)O)C2CCC2 1458a_100000212099_100000749161 [0,0,0,1,0,0|3,0,0]=4 3990 B14R2.10606 O=C(c1ccc(cc1)O)C2CCC2 271570a_203496583355_100011267736 [0,0,0,1,0,0|3,0,0]=4 3991 B14R2.10606 O=C(c1ccc(cc1)O)N2CCC2 240690a_100000754969_100000212099 [0,0,0,1,0,0|2,0,0]=3 3992 B14R2.10606 O=C(c1ccc(cc1)O)N2CCC2 527a_100000754969_100000212099 [0,0,0,1,0,0|2,0,0]=3 3993 B12R1.29 CC(NCCO)c1cc(cs1)Cl 269862a_100000210304_100000061699 [0,0,0,0,1,0|2,0,1]=4 3994 B12R1.29 CC(NCCO)c1ccc(s1)Cl 2230a_100102723459_100000211926 [0,0,0,0,1,0|2,0,1]=4 3995 B12R1.29 CC(NCCO)c1ccc(s1)Cl 269862a_100000210304_100000182421 [0,0,0,0,1,0|2,0,1]=4 3996 B12R1.29 CC(NCCO)c1csc(c1)Cl 269862a_100000210304_100000074698 [0,0,0,0,1,0|2,0,1]=4 3997 B12R1.29 CCCNC(=O)c1ccc(o1)O 271570a_203496583355_200000161738 [0,0,0,0,1,0|3,0,0]=4 3998 B12R1.29 CCCNC(=O)c1ccc(s1)O 271570a_203496583355_200000152264 [0,0,0,0,1,0|3,0,0]=4 3999 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000753159 [0,0,0,0,0,1|2,0,1]=4 4000 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000692101_100000694040 [0,0,0,0,0,1|2,0,1]=4 4001 B14R1.33 C#CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000692101 [0,0,0,0,0,1|2,0,1]=4 4002 B14R1.33 C#CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000692101 [0,0,0,0,0,1|2,0,1]=4 4003 B14R1.33 C#CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000692101 [0,0,0,0,0,1|2,0,1]=4 4004 B14R1.33 C#CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000692101 [0,0,0,0,0,1|2,0,1]=4 4005 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Br 11a_100000212058_100000198978 [0,0,0,0,0,1|1,1,1]=4 4006 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Br 240690a_100000212058_100000198978 [0,0,0,0,0,1|1,1,1]=4 4007 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Br 527a_100000212058_100000198978 [0,0,0,0,0,1|1,1,1]=4 4008 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)C 11a_100000212058_100000212244 [0,0,0,0,0,1|2,0,1]=4 4009 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)C 240690a_100000212058_100000212244 [0,0,0,0,0,1|2,0,1]=4 4010 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)C 527a_100000212058_100000212244 [0,0,0,0,0,1|2,0,1]=4 4011 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Cl 11a_100000212058_100000211027 [0,0,0,0,0,1|1,0,1]=3 4012 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Cl 240690a_100000212058_100000211027 [0,0,0,0,0,1|1,0,1]=3 4013 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Cl 527a_100000212058_100000211027 [0,0,0,0,0,1|1,0,1]=3 4014 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)F 11a_100000212058_100000210951 [0,0,0,0,0,1|1,1,1]=4 4015 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)F 1626a_100000212058_100000210951 [0,0,0,0,0,1|1,1,1]=4 4016 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)F 240690a_100000212058_100000210951 [0,0,0,0,0,1|1,1,1]=4 4017 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)F 527a_100000212058_100000210951 [0,0,0,0,0,1|1,1,1]=4 4018 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)I 11a_100000212058_100000688869 [0,0,0,0,0,1|1,1,1]=4 4019 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)I 1626a_100000212058_100000688869 [0,0,0,0,0,1|1,1,1]=4 4020 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)I 240690a_100000212058_100000688869 [0,0,0,0,0,1|1,1,1]=4 4021 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)I 527a_100000212058_100000688869 [0,0,0,0,0,1|1,1,1]=4 4022 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)O 1626a_100000212058_100000198540 [0,0,0,0,0,1|2,0,1]=4 4023 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)O 240690a_100000212058_100000198540 [0,0,0,0,0,1|2,0,1]=4 4024 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)O 527a_100000212058_100000198540 [0,0,0,0,0,1|2,0,1]=4 4025 B14R1.33 C#CCNC(=O)Cc1ccc(cn1)Cl 11a_100000212058_100000728320 [0,0,0,0,0,1|2,0,1]=4 4026 B14R1.33 C#CCNC(=O)Cc1ccc(cn1)Cl 1626a_100000212058_100000728320 [0,0,0,0,0,1|2,0,1]=4 4027 B14R1.33 C#CCNC(=O)Cc1ccc(cn1)Cl 240690a_100000212058_100000728320 [0,0,0,0,0,1|2,0,1]=4 4028 B14R1.33 C#CCNC(=O)Cc1ccc(cn1)Cl 527a_100000212058_100000728320 [0,0,0,0,0,1|2,0,1]=4 4029 B14R1.33 C#CCNC(=O)Cc1ccc(nc1)Cl 11a_100000212058_100000061944 [0,0,0,0,0,1|2,0,1]=4 4030 B14R1.33 C#CCNC(=O)Cc1ccc(nc1)Cl 1626a_100000212058_100000061944 [0,0,0,0,0,1|2,0,1]=4 4031 B14R1.33 C#CCNC(=O)Cc1ccc(nc1)Cl 240690a_100000212058_100000061944 [0,0,0,0,0,1|2,0,1]=4 4032 B14R1.33 C#CCNC(=O)Cc1ccc(nc1)Cl 527a_100000212058_100000061944 [0,0,0,0,0,1|2,0,1]=4 4033 B14R1.33 C#CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000212058 [0,0,0,0,0,1|1,1,1]=4 4034 B14R1.33 C#CCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000212058 [0,0,0,0,0,1|2,0,1]=4 4035 B14R1.33 C#CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000212058 [0,0,0,0,0,1|1,0,1]=3 4036 B14R1.33 C#CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000212058 [0,0,0,0,0,1|1,1,1]=4 4037 B14R1.33 C#CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000212058 [0,0,0,0,0,1|1,1,1]=4 4038 B14R1.33 C#CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000212058 [0,0,0,0,0,1|2,0,1]=4 4039 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000754431 [0,0,0,0,0,1|2,0,1]=4 4040 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749702_100000694040 [0,0,0,0,0,1|2,0,1]=4 4041 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749702 [0,0,0,0,0,1|2,0,1]=4 4042 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749702 [0,0,0,0,0,1|2,0,1]=4 4043 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749702 [0,0,0,0,0,1|2,0,1]=4 4044 B14R1.33 C=CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749702 [0,0,0,0,0,1|2,0,1]=4 4045 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Br 240690a_100020586998_100000198978 [0,0,0,0,0,1|1,1,1]=4 4046 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Br 527a_100020586998_100000198978 [0,0,0,0,0,1|1,1,1]=4 4047 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)C 240690a_100020586998_100000212244 [0,0,0,0,0,1|2,0,1]=4 4048 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)C 527a_100020586998_100000212244 [0,0,0,0,0,1|2,0,1]=4 4049 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Cl 240690a_100020586998_100000211027 [0,0,0,0,0,1|1,0,1]=3 4050 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)Cl 527a_100020586998_100000211027 [0,0,0,0,0,1|1,0,1]=3 4051 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F 1626a_100020586998_100000210951 [0,0,0,0,0,1|1,1,1]=4 4052 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F 240690a_100020586998_100000210951 [0,0,0,0,0,1|1,1,1]=4 4053 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)F 527a_100020586998_100000210951 [0,0,0,0,0,1|1,1,1]=4 4054 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)I 1626a_100020586998_100000688869 [0,0,0,0,0,1|1,1,1]=4 4055 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)I 240690a_100020586998_100000688869 [0,0,0,0,0,1|1,1,1]=4 4056 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)I 527a_100020586998_100000688869 [0,0,0,0,0,1|1,1,1]=4 4057 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O 1626a_100020586998_100000198540 [0,0,0,0,0,1|2,0,1]=4 4058 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O 240690a_100020586998_100000198540 [0,0,0,0,0,1|2,0,1]=4 4059 B14R1.33 C=CCNC(=O)Cc1ccc(cc1)O 527a_100020586998_100000198540 [0,0,0,0,0,1|2,0,1]=4 4060 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Cl 1626a_100020586998_100000728320 [0,0,0,0,0,1|2,0,1]=4 4061 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Cl 240690a_100020586998_100000728320 [0,0,0,0,0,1|2,0,1]=4 4062 B14R1.33 C=CCNC(=O)Cc1ccc(cn1)Cl 527a_100020586998_100000728320 [0,0,0,0,0,1|2,0,1]=4 4063 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Cl 1626a_100020586998_100000061944 [0,0,0,0,0,1|2,0,1]=4 4064 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Cl 240690a_100020586998_100000061944 [0,0,0,0,0,1|2,0,1]=4 4065 B14R1.33 C=CCNC(=O)Cc1ccc(nc1)Cl 527a_100020586998_100000061944 [0,0,0,0,0,1|2,0,1]=4 4066 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020586998 [0,0,0,0,0,1|1,1,1]=4 4067 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020586998 [0,0,0,0,0,1|2,0,1]=4 4068 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020586998 [0,0,0,0,0,1|1,0,1]=3 4069 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020586998 [0,0,0,0,0,1|1,1,1]=4 4070 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020586998 [0,0,0,0,0,1|1,1,1]=4 4071 B14R1.33 C=CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020586998 [0,0,0,0,0,1|2,0,1]=4 4072 B14R1.33 CC(Cc1ccc(cc1)Br)NCCO 270004a_100000210304_100000691760 [0,0,0,0,0,1|1,1,1]=4 4073 B14R1.33 CC(Cc1ccc(cc1)Cl)NCCO 270004a_100000210304_100000747806 [0,0,0,0,0,1|1,0,1]=3 4074 B14R1.33 CC(Cc1ccc(cc1)F)NCCO 270004a_100000210304_100000745281 [0,0,0,0,0,1|1,1,1]=4 4075 B14R1.33 CC(Cc1ccc(cc1)O)NCCO 2230a_100102634573_100000211926 [0,0,0,0,0,1|2,0,1]=4 4076 B14R1.33 CC(Cc1ccc(cc1)O)NCCO 270004a_100000210304_100011218180 [0,0,0,0,0,1|2,0,1]=4 4077 B14R1.33 CC(Cc1ccc(cc1)O)NCCO 34a_100102634573_100000211926 [0,0,0,0,0,1|2,0,1]=4 4078 B14R1.33 CC=NNC(=O)Cc1ccc(cc1)Cl 4a_100000181177_200000210099 [0,0,0,0,0,1|2,0,1]=4 4079 B14R1.33 CCC#CC(=O)Cc1ccc(cc1)Cl 1458a_100011827653_100000694040 [0,0,0,0,0,1|2,0,1]=4 4080 B14R1.33 CCC#CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011827653 [0,0,0,0,0,1|2,0,1]=4 4081 B14R1.33 CCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000212282_100000694040 [0,0,0,0,0,1|2,0,1]=4 4082 B14R1.33 CCC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000212282 [0,0,0,0,0,1|2,0,1]=4 4083 B14R1.33 CCC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000212282 [0,0,0,0,0,1|2,0,1]=4 4084 B14R1.33 CCC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000212282 [0,0,0,0,0,1|2,0,1]=4 4085 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210211 [0,0,0,0,0,1|2,1,0]=4 4086 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000210183_100000189115 [0,0,0,0,0,1|2,1,0]=4 4087 B14R1.33 CCCCC(=O)Cc1ccc(cc1)C 1458a_100000210183_100000210814 [0,0,0,0,0,1|3,0,0]=4 4088 B14R1.33 CCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210211 [0,0,0,0,0,1|3,0,0]=4 4089 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000210183_100000694040 [0,0,0,0,0,1|2,0,0]=3 4090 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210211 [0,0,0,0,0,1|2,0,0]=3 4091 B14R1.33 CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210183_100000198546 [0,0,0,0,0,1|2,1,0]=4 4092 B14R1.33 CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210211 [0,0,0,0,0,1|2,1,0]=4 4093 B14R1.33 CCCCC(=O)Cc1ccc(cc1)I 1458a_100000210183_100000189116 [0,0,0,0,0,1|2,1,0]=4 4094 B14R1.33 CCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210211 [0,0,0,0,0,1|2,1,0]=4 4095 B14R1.33 CCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210211 [0,0,0,0,0,1|3,0,0]=4 4096 B14R1.33 CCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000210183_100012066911 [0,0,0,0,0,1|3,0,0]=4 4097 B14R1.33 CCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210211 [0,0,0,0,0,1|3,0,0]=4 4098 B14R1.33 CCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210211 [0,0,0,0,0,1|3,0,0]=4 4099 B14R1.33 CCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000210183_100000735431 [0,0,0,0,0,1|3,0,0]=4 4100 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210183 [0,0,0,0,0,1|2,1,0]=4 4101 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210183 [0,0,0,0,0,1|2,1,0]=4 4102 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210183 [0,0,0,0,0,1|2,1,0]=4 4103 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210183 [0,0,0,0,0,1|2,1,0]=4 4104 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210183 [0,0,0,0,0,1|3,0,0]=4 4105 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210183 [0,0,0,0,0,1|3,0,0]=4 4106 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210183 [0,0,0,0,0,1|3,0,0]=4 4107 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210183 [0,0,0,0,0,1|3,0,0]=4 4108 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210183 [0,0,0,0,0,1|2,0,0]=3 4109 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210183 [0,0,0,0,0,1|2,0,0]=3 4110 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210183 [0,0,0,0,0,1|2,0,0]=3 4111 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210183 [0,0,0,0,0,1|2,0,0]=3 4112 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210183 [0,0,0,0,0,1|2,1,0]=4 4113 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210183 [0,0,0,0,0,1|2,1,0]=4 4114 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210183 [0,0,0,0,0,1|2,1,0]=4 4115 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210183 [0,0,0,0,0,1|2,1,0]=4 4116 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210183 [0,0,0,0,0,1|2,1,0]=4 4117 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210183 [0,0,0,0,0,1|2,1,0]=4 4118 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210183 [0,0,0,0,0,1|2,1,0]=4 4119 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210183 [0,0,0,0,0,1|2,1,0]=4 4120 B14R1.33 CCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210183 [0,0,0,0,0,1|3,0,0]=4 4121 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br 11a_100020643023_100000198978 [0,0,0,0,0,1|1,1,0]=3 4122 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br 240690a_100020643023_100000198978 [0,0,0,0,0,1|1,1,0]=3 4123 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br 527a_100020643023_100000198978 [0,0,0,0,0,1|1,1,0]=3 4124 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C 11a_100020643023_100000212244 [0,0,0,0,0,1|2,0,0]=3 4125 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C 240690a_100020643023_100000212244 [0,0,0,0,0,1|2,0,0]=3 4126 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C 527a_100020643023_100000212244 [0,0,0,0,0,1|2,0,0]=3 4127 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl 11a_100020643023_100000211027 [0,0,0,0,0,1|1,0,0]=2 4128 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100020643023_100000211027 [0,0,0,0,0,1|1,0,0]=2 4129 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl 527a_100020643023_100000211027 [0,0,0,0,0,1|1,0,0]=2 4130 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 11a_100020643023_100000210951 [0,0,0,0,0,1|1,1,0]=3 4131 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 1626a_100020643023_100000210951 [0,0,0,0,0,1|1,1,0]=3 4132 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 240690a_100020643023_100000210951 [0,0,0,0,0,1|1,1,0]=3 4133 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 527a_100020643023_100000210951 [0,0,0,0,0,1|1,1,0]=3 4134 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 11a_100020643023_100000688869 [0,0,0,0,0,1|1,1,0]=3 4135 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 1626a_100020643023_100000688869 [0,0,0,0,0,1|1,1,0]=3 4136 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 240690a_100020643023_100000688869 [0,0,0,0,0,1|1,1,0]=3 4137 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 527a_100020643023_100000688869 [0,0,0,0,0,1|1,1,0]=3 4138 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 1626a_100020643023_100000198540 [0,0,0,0,0,1|2,0,0]=3 4139 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 240690a_100020643023_100000198540 [0,0,0,0,0,1|2,0,0]=3 4140 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 271570a_203496583355_200000152284 [0,0,0,0,0,1|2,0,0]=3 4141 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 527a_100020643023_100000198540 [0,0,0,0,0,1|2,0,0]=3 4142 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Br 11a_100020643023_100020629044 [0,0,0,0,0,1|2,1,0]=4 4143 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Br 240690a_100020643023_100020629044 [0,0,0,0,0,1|2,1,0]=4 4144 B14R1.33 CCCNC(=O)Cc1ccc(cn1)C 11a_100020643023_100025705728 [0,0,0,0,0,1|3,0,0]=4 4145 B14R1.33 CCCNC(=O)Cc1ccc(cn1)C 1626a_100020643023_100025705728 [0,0,0,0,0,1|3,0,0]=4 4146 B14R1.33 CCCNC(=O)Cc1ccc(cn1)C 240690a_100020643023_100025705728 [0,0,0,0,0,1|3,0,0]=4 4147 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 11a_100020643023_100000728320 [0,0,0,0,0,1|2,0,0]=3 4148 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 1626a_100020643023_100000728320 [0,0,0,0,0,1|2,0,0]=3 4149 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 240690a_100020643023_100000728320 [0,0,0,0,0,1|2,0,0]=3 4150 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 527a_100020643023_100000728320 [0,0,0,0,0,1|2,0,0]=3 4151 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br 11a_100020643023_100010067268 [0,0,0,0,0,1|2,1,0]=4 4152 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br 240690a_100020643023_100010067268 [0,0,0,0,0,1|2,1,0]=4 4153 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br 527a_100020643023_100010067268 [0,0,0,0,0,1|2,1,0]=4 4154 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 11a_100020643023_100000740413 [0,0,0,0,0,1|3,0,0]=4 4155 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 1626a_100020643023_100000740413 [0,0,0,0,0,1|3,0,0]=4 4156 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 240690a_100020643023_100000740413 [0,0,0,0,0,1|3,0,0]=4 4157 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 527a_100020643023_100000740413 [0,0,0,0,0,1|3,0,0]=4 4158 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 11a_100020643023_100000061944 [0,0,0,0,0,1|2,0,0]=3 4159 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 1626a_100020643023_100000061944 [0,0,0,0,0,1|2,0,0]=3 4160 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 240690a_100020643023_100000061944 [0,0,0,0,0,1|2,0,0]=3 4161 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 527a_100020643023_100000061944 [0,0,0,0,0,1|2,0,0]=3 4162 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 11a_100020643023_200000238563 [0,0,0,0,0,1|3,0,0]=4 4163 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 1626a_100020643023_200000238563 [0,0,0,0,0,1|3,0,0]=4 4164 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 240690a_100020643023_200000238563 [0,0,0,0,0,1|3,0,0]=4 4165 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 527a_100020643023_200000238563 [0,0,0,0,0,1|3,0,0]=4 4166 B14R1.33 CCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020643023 [0,0,0,0,0,1|1,1,0]=3 4167 B14R1.33 CCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020643023 [0,0,0,0,0,1|2,0,0]=3 4168 B14R1.33 CCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020643023 [0,0,0,0,0,1|1,0,0]=2 4169 B14R1.33 CCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020643023 [0,0,0,0,0,1|1,1,0]=3 4170 B14R1.33 CCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020643023 [0,0,0,0,0,1|1,1,0]=3 4171 B14R1.33 CCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020643023 [0,0,0,0,0,1|2,0,0]=3 4172 B14R1.33 CCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200000163292 [0,0,0,0,0,1|2,0,0]=3 4173 B14R1.33 CCCNC(C)Cc1ccc(cc1)Cl 270004a_100020643023_100000747806 [0,0,0,0,0,1|2,0,1]=4 4174 B14R1.33 CCNCC(=O)Nc1ccc(cc1)Cl 2230a_100015525214_100000182960 [0,0,0,0,0,1|3,0,0]=4 4175 B14R1.33 CCNNC(=O)Cc1ccc(cc1)Br 22a_100000756455_100000198978 [0,0,0,0,0,1|2,1,0]=4 4176 B14R1.33 CCNNC(=O)Cc1ccc(cc1)C 22a_100000756455_100000212244 [0,0,0,0,0,1|3,0,0]=4 4177 B14R1.33 CCNNC(=O)Cc1ccc(cc1)Cl 22a_100000756455_100000211027 [0,0,0,0,0,1|2,0,0]=3 4178 B14R1.33 CCNNC(=O)Cc1ccc(cc1)F 22a_100000756455_100000210951 [0,0,0,0,0,1|2,1,0]=4 4179 B14R1.33 CCNNC(=O)Cc1ccc(cc1)I 22a_100000756455_100000688869 [0,0,0,0,0,1|2,1,0]=4 4180 B14R1.33 CCNNC(=O)Cc1ccc(cc1)O 22a_100000756455_100000198540 [0,0,0,0,0,1|3,0,0]=4 4181 B14R1.33 CCNNC(=O)Cc1ccc(cn1)Cl 22a_100000756455_100000728320 [0,0,0,0,0,1|3,0,0]=4 4182 B14R1.33 CCNNC(=O)Cc1ccc(nc1)Cl 22a_100000756455_100000061944 [0,0,0,0,0,1|3,0,0]=4 4183 B14R1.33 CCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000211967_100000694040 [0,0,0,0,0,1|3,0,0]=4 4184 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000211967 [0,0,0,0,0,1|3,0,0]=4 4185 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000211967 [0,0,0,0,0,1|3,0,0]=4 4186 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000211967 [0,0,0,0,0,1|3,0,0]=4 4187 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 34a_100121572206_100000182960 [0,0,0,0,0,1|3,0,0]=4 4188 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000211967 [0,0,0,0,0,1|3,0,0]=4 4189 B14R1.33 CCSCC(=O)Cc1ccc(cc1)Cl 1458a_100000230394_100000694040 [0,0,0,0,0,1|3,0,0]=4 4190 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000230394 [0,0,0,0,0,1|3,0,0]=4 4191 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000230394 [0,0,0,0,0,1|3,0,0]=4 4192 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000230394 [0,0,0,0,0,1|3,0,0]=4 4193 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000230394 [0,0,0,0,0,1|3,0,0]=4 4194 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 62a_100000210202_100000182960 [0,0,0,0,0,1|3,0,0]=4 4195 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210202 [0,0,0,0,0,1|3,0,0]=4 4196 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 2230a_100000184517_100000230001 [0,0,0,0,0,1|3,0,0]=4 4197 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 2230a_100000213112_100000694040 [0,0,0,0,0,1|3,0,0]=4 4198 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 2230a_100015186341_200000210301 [0,0,0,0,0,1|3,0,0]=4 4199 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 269982a_100000184517_100011215043 [0,0,0,0,0,1|3,0,0]=4 4200 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 269982a_100000213112_100000187161 [0,0,0,0,0,1|3,0,0]=4 4201 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 269982a_100015186341_200000210301 [0,0,0,0,0,1|3,0,0]=4 4202 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 270004a_100000213112_100000189385 [0,0,0,0,0,1|3,0,0]=4 4203 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 34a_100000184517_100000230001 [0,0,0,0,0,1|3,0,0]=4 4204 B14R1.33 CN(CCCO)Cc1ccc(cc1)Cl 34a_100015186341_200000210301 [0,0,0,0,0,1|3,0,0]=4 4205 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Cl 2230a_106832991635_100000188356 [0,0,0,0,0,1|3,0,0]=4 4206 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Cl 7a_106832991635_100000188356 [0,0,0,0,0,1|3,0,0]=4 4207 B14R1.33 COCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000233755 [0,0,0,0,0,1|3,0,0]=4 4208 B14R1.33 COCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749529_100000694040 [0,0,0,0,0,1|3,0,0]=4 4209 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749529 [0,0,0,0,0,1|3,0,0]=4 4210 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749529 [0,0,0,0,0,1|3,0,0]=4 4211 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749529 [0,0,0,0,0,1|3,0,0]=4 4212 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749529 [0,0,0,0,0,1|3,0,0]=4 4213 B14R1.33 CSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000174002_100000694040 [0,0,0,0,0,1|3,0,0]=4 4214 B14R1.33 CSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000751147 [0,0,0,0,0,1|3,0,0]=4 4215 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000174002 [0,0,0,0,0,1|3,0,0]=4 4216 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000174002 [0,0,0,0,0,1|3,0,0]=4 4217 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000174002 [0,0,0,0,0,1|3,0,0]=4 4218 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000174002 [0,0,0,0,0,1|3,0,0]=4 4219 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 62a_200000210301_100000188356 [0,0,0,0,0,1|3,0,0]=4 4220 B14R1.33 Cc1ccc(cc1)CC(=O)C#CCO 1458a_100000049017_100000210814 [0,0,0,0,0,1|2,0,1]=4 4221 B14R1.33 Cc1ccc(cc1)CC(=O)CCCF 1458a_100000212244_100011934791 [0,0,0,0,0,1|3,0,0]=4 4222 B14R1.33 Cc1ccc(cc1)CC(=O)CCCO 1458a_100000212244_100011215043 [0,0,0,0,0,1|2,0,0]=3 4223 B14R1.33 Cc1ccc(cc1)CC(=O)NCC#N 527a_100000734998_100000212244 [0,0,0,0,0,1|2,0,1]=4 4224 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF 11a_100000724931_100000212244 [0,0,0,0,0,1|2,0,0]=3 4225 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_100000212244 [0,0,0,0,0,1|2,0,0]=3 4226 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF 527a_100000724931_100000212244 [0,0,0,0,0,1|2,0,0]=3 4227 B14R1.33 Cc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_100000212244 [0,0,0,0,0,1|1,0,0]=2 4228 B14R1.33 Cc1ccc(cc1)CC(=O)NCCO 527a_100000210304_100000212244 [0,0,0,0,0,1|1,0,0]=2 4229 B14R1.33 Cc1ccc(cc1)CC(C)NCCO 270004a_100000210304_100000751045 [0,0,0,0,0,1|2,0,1]=4 4230 B14R1.33 Cc1ccc(cc1)NC(=O)NCC#N 2430a_100000124888_100000734998 [0,0,0,0,0,1|2,0,1]=4 4231 B14R1.33 Cc1ccc(cc1)NC(=O)NCCF 2430a_100000124888_100000724931 [0,0,0,0,0,1|2,0,0]=3 4232 B14R1.33 Cc1ccc(cc1)NC(=O)NCCO 2430a_100000124888_100000210304 [0,0,0,0,0,1|1,0,0]=2 4233 B14R1.33 Cc1ccc(cn1)CC(=O)CCCO 1458a_100000740413_100011215043 [0,0,0,0,0,1|3,0,0]=4 4234 B14R1.33 Cc1ccc(cn1)CC(=O)NCCF 11a_100000724931_100000740413 [0,0,0,0,0,1|3,0,0]=4 4235 B14R1.33 Cc1ccc(cn1)CC(=O)NCCF 1626a_100000724931_100000740413 [0,0,0,0,0,1|3,0,0]=4 4236 B14R1.33 Cc1ccc(cn1)CC(=O)NCCF 240690a_100000724931_100000740413 [0,0,0,0,0,1|3,0,0]=4 4237 B14R1.33 Cc1ccc(cn1)CC(=O)NCCF 527a_100000724931_100000740413 [0,0,0,0,0,1|3,0,0]=4 4238 B14R1.33 Cc1ccc(cn1)CC(=O)NCCO 240690a_100000210304_100000740413 [0,0,0,0,0,1|2,0,0]=3 4239 B14R1.33 Cc1ccc(cn1)CC(=O)NCCO 527a_100000210304_100000740413 [0,0,0,0,0,1|2,0,0]=3 4240 B14R1.33 Cc1ccc(nc1)CC(=O)CCCO 1458a_100025705728_100011215043 [0,0,0,0,0,1|3,0,0]=4 4241 B14R1.33 Cc1ccc(nc1)CC(=O)NCCF 11a_100000724931_100025705728 [0,0,0,0,0,1|3,0,0]=4 4242 B14R1.33 Cc1ccc(nc1)CC(=O)NCCF 1626a_100000724931_100025705728 [0,0,0,0,0,1|3,0,0]=4 4243 B14R1.33 Cc1ccc(nc1)CC(=O)NCCF 240690a_100000724931_100025705728 [0,0,0,0,0,1|3,0,0]=4 4244 B14R1.33 Cc1ccc(nc1)CC(=O)NCCO 240690a_100000210304_100025705728 [0,0,0,0,0,1|2,0,0]=3 4245 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215226 [0,0,0,0,0,1|2,0,1]=4 4246 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100011934036_100000694040 [0,0,0,0,0,1|2,0,1]=4 4247 B14R1.33 N#CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100011934036 [0,0,0,0,0,1|2,0,1]=4 4248 B14R1.33 N#CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100011934036 [0,0,0,0,0,1|2,0,1]=4 4249 B14R1.33 N#CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011934036 [0,0,0,0,0,1|2,0,1]=4 4250 B14R1.33 N#CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100011934036 [0,0,0,0,0,1|2,0,1]=4 4251 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)Br 527a_100000734998_100000198978 [0,0,0,0,0,1|1,1,1]=4 4252 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)Cl 527a_100000734998_100000211027 [0,0,0,0,0,1|1,0,1]=3 4253 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)F 1626a_100000734998_100000210951 [0,0,0,0,0,1|1,1,1]=4 4254 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)F 527a_100000734998_100000210951 [0,0,0,0,0,1|1,1,1]=4 4255 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)I 1626a_100000734998_100000688869 [0,0,0,0,0,1|1,1,1]=4 4256 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)I 527a_100000734998_100000688869 [0,0,0,0,0,1|1,1,1]=4 4257 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)O 1626a_100000734998_100000198540 [0,0,0,0,0,1|2,0,1]=4 4258 B14R1.33 N#CCNC(=O)Cc1ccc(cc1)O 527a_100000734998_100000198540 [0,0,0,0,0,1|2,0,1]=4 4259 B14R1.33 N#CCNC(=O)Cc1ccc(cn1)Cl 1626a_100000734998_100000728320 [0,0,0,0,0,1|2,0,1]=4 4260 B14R1.33 N#CCNC(=O)Cc1ccc(cn1)Cl 527a_100000734998_100000728320 [0,0,0,0,0,1|2,0,1]=4 4261 B14R1.33 N#CCNC(=O)Cc1ccc(nc1)Cl 1626a_100000734998_100000061944 [0,0,0,0,0,1|2,0,1]=4 4262 B14R1.33 N#CCNC(=O)Cc1ccc(nc1)Cl 527a_100000734998_100000061944 [0,0,0,0,0,1|2,0,1]=4 4263 B14R1.33 N#CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000734998 [0,0,0,0,0,1|1,1,1]=4 4264 B14R1.33 N#CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000734998 [0,0,0,0,0,1|1,0,1]=3 4265 B14R1.33 N#CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000734998 [0,0,0,0,0,1|1,1,1]=4 4266 B14R1.33 N#CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000734998 [0,0,0,0,0,1|1,1,1]=4 4267 B14R1.33 N#CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000734998 [0,0,0,0,0,1|2,0,1]=4 4268 B14R1.33 O=C(C#CCO)Cc1ccc(cc1)Br 1458a_100000049017_100000189115 [0,0,0,0,0,1|1,1,1]=4 4269 B14R1.33 O=C(C#CCO)Cc1ccc(cc1)Cl 1458a_100000049017_100000694040 [0,0,0,0,0,1|1,0,1]=3 4270 B14R1.33 O=C(C#CCO)Cc1ccc(cc1)F 1458a_100000049017_100000198546 [0,0,0,0,0,1|1,1,1]=4 4271 B14R1.33 O=C(C#CCO)Cc1ccc(cc1)I 1458a_100000049017_100000189116 [0,0,0,0,0,1|1,1,1]=4 4272 B14R1.33 O=C(C#CCO)Cc1ccc(cn1)Cl 1458a_100000049017_100012066911 [0,0,0,0,0,1|2,0,1]=4 4273 B14R1.33 O=C(C#CCO)Cc1ccc(nc1)Cl 1458a_100000049017_100000735431 [0,0,0,0,0,1|2,0,1]=4 4274 B14R1.33 O=C(CCCF)Cc1ccc(cc1)Br 1458a_100000198978_100011934791 [0,0,0,0,0,1|2,1,0]=4 4275 B14R1.33 O=C(CCCF)Cc1ccc(cc1)Cl 1458a_100000211027_100011934791 [0,0,0,0,0,1|2,0,0]=3 4276 B14R1.33 O=C(CCCF)Cc1ccc(cc1)F 1458a_100000210951_100011934791 [0,0,0,0,0,1|2,1,0]=4 4277 B14R1.33 O=C(CCCF)Cc1ccc(cc1)I 1458a_100000688869_100011934791 [0,0,0,0,0,1|2,1,0]=4 4278 B14R1.33 O=C(CCCF)Cc1ccc(cc1)O 1458a_100000198540_100011934791 [0,0,0,0,0,1|3,0,0]=4 4279 B14R1.33 O=C(CCCF)Cc1ccc(cn1)Cl 1458a_100000728320_100011934791 [0,0,0,0,0,1|3,0,0]=4 4280 B14R1.33 O=C(CCCF)Cc1ccc(nc1)Cl 1458a_100000061944_100011934791 [0,0,0,0,0,1|3,0,0]=4 4281 B14R1.33 O=C(CCCO)Cc1ccc(cc1)Br 1458a_100000198978_100011215043 [0,0,0,0,0,1|1,1,0]=3 4282 B14R1.33 O=C(CCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100011215043 [0,0,0,0,0,1|1,0,0]=2 4283 B14R1.33 O=C(CCCO)Cc1ccc(cc1)F 1458a_100000210951_100011215043 [0,0,0,0,0,1|1,1,0]=3 4284 B14R1.33 O=C(CCCO)Cc1ccc(cc1)I 1458a_100000688869_100011215043 [0,0,0,0,0,1|1,1,0]=3 4285 B14R1.33 O=C(CCCO)Cc1ccc(cc1)O 1458a_100000198540_100011215043 [0,0,0,0,0,1|2,0,0]=3 4286 B14R1.33 O=C(CCCO)Cc1ccc(cn1)Br 1458a_100020629044_100011215043 [0,0,0,0,0,1|2,1,0]=4 4287 B14R1.33 O=C(CCCO)Cc1ccc(cn1)Cl 1458a_100000728320_100011215043 [0,0,0,0,0,1|2,0,0]=3 4288 B14R1.33 O=C(CCCO)Cc1ccc(nc1)Br 1458a_100010067268_100011215043 [0,0,0,0,0,1|2,1,0]=4 4289 B14R1.33 O=C(CCCO)Cc1ccc(nc1)Cl 1458a_100000061944_100011215043 [0,0,0,0,0,1|2,0,0]=3 4290 B14R1.33 O=C(CCCO)Cn1ccc(=O)cc1 1458a_200000238563_100011215043 [0,0,0,0,0,1|3,0,0]=4 4291 B14R1.33 O=C(CSCF)Nc1ccc(cc1)Cl 62a_100015361967_100000182960 [0,0,0,0,0,1|3,0,0]=4 4292 B14R1.33 O=C(CSCF)Nc1ccc(cc1)Cl 62a_200011202288_100015361967 [0,0,0,0,0,1|3,0,0]=4 4293 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF 11a_100000724931_100000198978 [0,0,0,0,0,1|1,1,0]=3 4294 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF 240690a_100000724931_100000198978 [0,0,0,0,0,1|1,1,0]=3 4295 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF 527a_100000724931_100000198978 [0,0,0,0,0,1|1,1,0]=3 4296 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCO 240690a_100000210304_100000198978 [0,0,0,0,0,1|0,1,0]=2 4297 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCO 527a_100000210304_100000198978 [0,0,0,0,0,1|0,1,0]=2 4298 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF 11a_100000724931_100000211027 [0,0,0,0,0,1|1,0,0]=2 4299 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF 240690a_100000724931_100000211027 [0,0,0,0,0,1|1,0,0]=2 4300 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF 527a_100000724931_100000211027 [0,0,0,0,0,1|1,0,0]=2 4301 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCO 240690a_100000210304_100000211027 [0,0,0,0,0,1|0,0,0]=1 4302 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCO 527a_100000210304_100000211027 [0,0,0,0,0,1|0,0,0]=1 4303 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 11a_100000724931_100000210951 [0,0,0,0,0,1|1,1,0]=3 4304 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 1626a_100000724931_100000210951 [0,0,0,0,0,1|1,1,0]=3 4305 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 240690a_100000724931_100000210951 [0,0,0,0,0,1|1,1,0]=3 4306 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 527a_100000724931_100000210951 [0,0,0,0,0,1|1,1,0]=3 4307 B14R1.33 O=C(Cc1ccc(cc1)F)NCCO 240690a_100000210304_100000210951 [0,0,0,0,0,1|0,1,0]=2 4308 B14R1.33 O=C(Cc1ccc(cc1)F)NCCO 527a_100000210304_100000210951 [0,0,0,0,0,1|0,1,0]=2 4309 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 11a_100000724931_100000688869 [0,0,0,0,0,1|1,1,0]=3 4310 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 1626a_100000724931_100000688869 [0,0,0,0,0,1|1,1,0]=3 4311 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 240690a_100000724931_100000688869 [0,0,0,0,0,1|1,1,0]=3 4312 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 527a_100000724931_100000688869 [0,0,0,0,0,1|1,1,0]=3 4313 B14R1.33 O=C(Cc1ccc(cc1)I)NCCO 240690a_100000210304_100000688869 [0,0,0,0,0,1|0,1,0]=2 4314 B14R1.33 O=C(Cc1ccc(cc1)I)NCCO 527a_100000210304_100000688869 [0,0,0,0,0,1|0,1,0]=2 4315 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF 1626a_100000724931_100000198540 [0,0,0,0,0,1|2,0,0]=3 4316 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF 240690a_100000724931_100000198540 [0,0,0,0,0,1|2,0,0]=3 4317 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF 527a_100000724931_100000198540 [0,0,0,0,0,1|2,0,0]=3 4318 B14R1.33 O=C(Cc1ccc(cc1)O)NCCO 240690a_100000210304_100000198540 [0,0,0,0,0,1|1,0,0]=2 4319 B14R1.33 O=C(Cc1ccc(cc1)O)NCCO 527a_100000210304_100000198540 [0,0,0,0,0,1|1,0,0]=2 4320 B14R1.33 O=C(Cc1ccc(cn1)Br)NCCF 11a_100000724931_100020629044 [0,0,0,0,0,1|2,1,0]=4 4321 B14R1.33 O=C(Cc1ccc(cn1)Br)NCCF 240690a_100000724931_100020629044 [0,0,0,0,0,1|2,1,0]=4 4322 B14R1.33 O=C(Cc1ccc(cn1)Br)NCCO 240690a_100000210304_100020629044 [0,0,0,0,0,1|1,1,0]=3 4323 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCF 11a_100000724931_100000728320 [0,0,0,0,0,1|2,0,0]=3 4324 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCF 1626a_100000724931_100000728320 [0,0,0,0,0,1|2,0,0]=3 4325 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCF 240690a_100000724931_100000728320 [0,0,0,0,0,1|2,0,0]=3 4326 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCF 527a_100000724931_100000728320 [0,0,0,0,0,1|2,0,0]=3 4327 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCO 240690a_100000210304_100000728320 [0,0,0,0,0,1|1,0,0]=2 4328 B14R1.33 O=C(Cc1ccc(cn1)Cl)NCCO 527a_100000210304_100000728320 [0,0,0,0,0,1|1,0,0]=2 4329 B14R1.33 O=C(Cc1ccc(nc1)Br)NCCF 11a_100000724931_100010067268 [0,0,0,0,0,1|2,1,0]=4 4330 B14R1.33 O=C(Cc1ccc(nc1)Br)NCCF 240690a_100000724931_100010067268 [0,0,0,0,0,1|2,1,0]=4 4331 B14R1.33 O=C(Cc1ccc(nc1)Br)NCCF 527a_100000724931_100010067268 [0,0,0,0,0,1|2,1,0]=4 4332 B14R1.33 O=C(Cc1ccc(nc1)Br)NCCO 240690a_100000210304_100010067268 [0,0,0,0,0,1|1,1,0]=3 4333 B14R1.33 O=C(Cc1ccc(nc1)Br)NCCO 527a_100000210304_100010067268 [0,0,0,0,0,1|1,1,0]=3 4334 B14R1.33 O=C(Cc1ccc(nc1)Cl)NCCF 11a_100000724931_100000061944 [0,0,0,0,0,1|2,0,0]=3 4335 B14R1.33 O=C(Cc1ccc(nc1)Cl)NCCF 1626a_100000724931_100000061944 [0,0,0,0,0,1|2,0,0]=3 4336 B14R1.33 O=C(Cc1ccc(nc1)Cl)NCCF 240690a_100000724931_100000061944 [0,0,0,0,0,1|2,0,0]=3 4337 B14R1.33 O=C(Cc1ccc(nc1)Cl)NCCF 527a_100000724931_100000061944 [0,0,0,0,0,1|2,0,0]=3 4338 B14R1.33 O=C(Cc1ccc(nc1)Cl)NCCO 240690a_100000210304_100000061944 [0,0,0,0,0,1|1,0,0]=2 4339 B14R1.33 O=C(Cc1ccc(nc1)Cl)NCCO 527a_100000210304_100000061944 [0,0,0,0,0,1|1,0,0]=2 4340 B14R1.33 O=C(Cc1ncc(cn1)Br)NCCO 240690a_100000210304_100012357043 [0,0,0,0,0,1|2,1,0]=4 4341 B14R1.33 O=C(Cn1ccc(=O)cc1)NCCF 11a_100000724931_200000238563 [0,0,0,0,0,1|3,0,0]=4 4342 B14R1.33 O=C(Cn1ccc(=O)cc1)NCCF 1626a_100000724931_200000238563 [0,0,0,0,0,1|3,0,0]=4 4343 B14R1.33 O=C(Cn1ccc(=O)cc1)NCCF 240690a_100000724931_200000238563 [0,0,0,0,0,1|3,0,0]=4 4344 B14R1.33 O=C(Cn1ccc(=O)cc1)NCCF 527a_100000724931_200000238563 [0,0,0,0,0,1|3,0,0]=4 4345 B14R1.33 O=C(Cn1ccc(=O)cc1)NCCO 240690a_100000210304_200000238563 [0,0,0,0,0,1|2,0,0]=3 4346 B14R1.33 O=C(Cn1ccc(=O)cc1)NCCO 527a_100000210304_200000238563 [0,0,0,0,0,1|2,0,0]=3 4347 B14R1.33 O=C(NCCF)Nc1ccc(cc1)Br 2430a_100000210018_100000724931 [0,0,0,0,0,1|1,1,0]=3 4348 B14R1.33 O=C(NCCF)Nc1ccc(cc1)Cl 2430a_100000210052_100000724931 [0,0,0,0,0,1|1,0,0]=2 4349 B14R1.33 O=C(NCCF)Nc1ccc(cc1)F 2430a_100000185862_100000724931 [0,0,0,0,0,1|1,1,0]=3 4350 B14R1.33 O=C(NCCF)Nc1ccc(cc1)I 2430a_100000185761_100000724931 [0,0,0,0,0,1|1,1,0]=3 4351 B14R1.33 O=C(NCCF)Nc1ccc(cc1)O 2430a_100000185829_100000724931 [0,0,0,0,0,1|2,0,0]=3 4352 B14R1.33 O=C(NCCO)Nc1ccc(cc1)Br 2430a_100000210018_100000210304 [0,0,0,0,0,1|0,1,0]=2 4353 B14R1.33 O=C(NCCO)Nc1ccc(cc1)Cl 2430a_100000210052_100000210304 [0,0,0,0,0,1|0,0,0]=1 4354 B14R1.33 O=C(NCCO)Nc1ccc(cc1)F 2430a_100000185862_100000210304 [0,0,0,0,0,1|0,1,0]=2 4355 B14R1.33 O=C(NCCO)Nc1ccc(cc1)I 2430a_100000185761_100000210304 [0,0,0,0,0,1|0,1,0]=2 4356 B14R1.33 O=C(NCCO)Nc1ccc(cc1)O 2430a_100000185829_100000210304 [0,0,0,0,0,1|1,0,0]=2 4357 B14R1.33 [13CH3]N(CCCO)Cc1ccc(cc1)Cl 2230a_100015186341_200025704644 [0,0,0,0,0,1|3,0,0]=4 4358 B14R1.33 [13CH3]N(CCCO)Cc1ccc(cc1)Cl 269982a_100015186341_200025704644 [0,0,0,0,0,1|3,0,0]=4 4359 B14R1.33 [13CH3]N(CCCO)Cc1ccc(cc1)Cl 34a_100015186341_200025704644 [0,0,0,0,0,1|3,0,0]=4 4360 B14R1.33 [13CH3]SCCC(=O)Nc1ccc(cc1)Cl 62a_200025704644_100000188356 [0,0,0,0,0,1|3,0,0]=4 4361 B11R1.1 C#CCNc1ccc(cc1)Cl 2230a_100000210052_100000038162 [2,0,0,0,0,0|1,0,1]=4 4362 B11R1.1 C#CCNc1ccc(cc1)Cl 34a_100000210052_100000184674 [2,0,0,0,0,0|1,0,1]=4 4363 B11R1.1 C=CCNc1ccc(cc1)Cl 2230a_100000210052_100000210623 [2,0,0,0,0,0|1,0,1]=4 4364 B11R1.1 C=CCNc1ccc(cc1)Cl 34a_100000210052_100015514636 [2,0,0,0,0,0|1,0,1]=4 4365 B11R1.1 CCCCc1ccc(cc1)Cl 271570a_100020621405_100000755918 [2,0,0,0,0,0|1,0,1]=4 4366 B11R1.1 CCCNc1ccc(cc1)Br 2230a_100000210018_100000210303 [2,0,0,0,0,0|1,1,0]=4 4367 B11R1.1 CCCNc1ccc(cc1)Br 34a_100000210018_100000210303 [2,0,0,0,0,0|1,1,0]=4 4368 B11R1.1 CCCNc1ccc(cc1)C 34a_100000124888_100000210303 [2,0,0,0,0,0|2,0,0]=4 4369 B11R1.1 CCCNc1ccc(cc1)Cl 2230a_100000210052_100000210303 [2,0,0,0,0,0|1,0,0]=3 4370 B11R1.1 CCCNc1ccc(cc1)Cl 34a_100000210052_100000210303 [2,0,0,0,0,0|1,0,0]=3 4371 B11R1.1 CCCNc1ccc(cc1)F 34a_100000185862_100000210303 [2,0,0,0,0,0|1,1,0]=4 4372 B11R1.1 CCCNc1ccc(cc1)I 34a_100000185761_100000210303 [2,0,0,0,0,0|1,1,0]=4 4373 B11R1.1 CCCNc1ccc(cc1)O 34a_100000185829_100000210303 [2,0,0,0,0,0|2,0,0]=4 4374 B11R1.1 CCCOc1ccc(cc1)Cl 34a_100000210216_100000210303 [2,0,0,0,0,0|2,0,0]=4 4375 B11R1.1 CCCOc1ccc(cc1)Cl 7a_100000210216_100000210303 [2,0,0,0,0,0|2,0,0]=4 4376 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000210303_100000755918 [2,0,0,0,0,0|2,0,0]=4 4377 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000755918_100000210303 [2,0,0,0,0,0|2,0,0]=4 4378 B11R1.1 CCNCc1ccc(cc1)Br 207a_100015525214_100000186029 [2,0,0,0,0,0|0,1,1]=4 4379 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100000174875_100000210202 [2,0,0,0,0,0|0,1,1]=4 4380 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100015525214_100011217064 [2,0,0,0,0,0|0,1,1]=4 4381 B11R1.1 CCNCc1ccc(cc1)Br 270004a_100015525214_100000186029 [2,0,0,0,0,0|0,1,1]=4 4382 B11R1.1 CCNCc1ccc(cc1)Br 34a_100000174875_100000210202 [2,0,0,0,0,0|0,1,1]=4 4383 B11R1.1 CCNCc1ccc(cc1)C 207a_100015525214_100000211033 [2,0,0,0,0,0|1,0,1]=4 4384 B11R1.1 CCNCc1ccc(cc1)C 2230a_100000174908_100000210202 [2,0,0,0,0,0|1,0,1]=4 4385 B11R1.1 CCNCc1ccc(cc1)C 2230a_100015525214_100000210814 [2,0,0,0,0,0|1,0,1]=4 4386 B11R1.1 CCNCc1ccc(cc1)C 270004a_100015525214_100000211033 [2,0,0,0,0,0|1,0,1]=4 4387 B11R1.1 CCNCc1ccc(cc1)C 34a_100000174908_100000210202 [2,0,0,0,0,0|1,0,1]=4 4388 B11R1.1 CCNCc1ccc(cc1)Cl 207a_100015525214_100000189385 [2,0,0,0,0,0|0,0,1]=3 4389 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210202 [2,0,0,0,0,0|0,0,1]=3 4390 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100015525214_100000694040 [2,0,0,0,0,0|0,0,1]=3 4391 B11R1.1 CCNCc1ccc(cc1)Cl 270004a_100015525214_100000189385 [2,0,0,0,0,0|0,0,1]=3 4392 B11R1.1 CCNCc1ccc(cc1)Cl 34a_100000174871_100000210202 [2,0,0,0,0,0|0,0,1]=3 4393 B11R1.1 CCNCc1ccc(cc1)F 207a_100015525214_100000210084 [2,0,0,0,0,0|0,1,1]=4 4394 B11R1.1 CCNCc1ccc(cc1)F 2230a_100000174882_100000210202 [2,0,0,0,0,0|0,1,1]=4 4395 B11R1.1 CCNCc1ccc(cc1)F 2230a_100015525214_100000198546 [2,0,0,0,0,0|0,1,1]=4 4396 B11R1.1 CCNCc1ccc(cc1)F 270004a_100015525214_100000210084 [2,0,0,0,0,0|0,1,1]=4 4397 B11R1.1 CCNCc1ccc(cc1)F 34a_100000174882_100000210202 [2,0,0,0,0,0|0,1,1]=4 4398 B11R1.1 CCNCc1ccc(cc1)I 207a_100015525214_100000188517 [2,0,0,0,0,0|0,1,1]=4 4399 B11R1.1 CCNCc1ccc(cc1)I 2230a_100015525214_100000189116 [2,0,0,0,0,0|0,1,1]=4 4400 B11R1.1 CCNCc1ccc(cc1)I 2230a_100016989417_100000210202 [2,0,0,0,0,0|0,1,1]=4 4401 B11R1.1 CCNCc1ccc(cc1)I 34a_100016989417_100000210202 [2,0,0,0,0,0|0,1,1]=4 4402 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [2,0,0,0,0,0|1,0,1]=4 4403 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [2,0,0,0,0,0|1,0,1]=4 4404 B11R1.1 CCNCc1ccc(cn1)Cl 207a_100015525214_100011361569 [2,0,0,0,0,0|1,0,1]=4 4405 B11R1.1 CCNCc1ccc(cn1)Cl 2230a_100015525214_100012066911 [2,0,0,0,0,0|1,0,1]=4 4406 B11R1.1 CCNCc1ccc(cn1)Cl 270004a_100015525214_100011361569 [2,0,0,0,0,0|1,0,1]=4 4407 B11R1.1 CCNCc1ccc(cn1)Cl 34a_100000697193_100000210202 [2,0,0,0,0,0|1,0,1]=4 4408 B11R1.1 CCNCc1ccc(nc1)Cl 2230a_100000735879_100000210202 [2,0,0,0,0,0|1,0,1]=4 4409 B11R1.1 CCNCc1ccc(nc1)Cl 2230a_100015525214_100000735431 [2,0,0,0,0,0|1,0,1]=4 4410 B11R1.1 CCNCc1ccc(nc1)Cl 34a_100000735879_100000210202 [2,0,0,0,0,0|1,0,1]=4 4411 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [2,0,0,0,0,0|1,0,1]=4 4412 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [2,0,0,0,0,0|1,0,1]=4 4413 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [2,0,0,0,0,0|1,0,1]=4 4414 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000187161_100000210202 [2,0,0,0,0,0|1,0,1]=4 4415 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000210202_100000187161 [2,0,0,0,0,0|1,0,1]=4 4416 B11R1.1 COCNc1ccc(cc1)Cl 2230a_100000210052_100000766300 [2,0,0,0,0,0|2,0,0]=4 4417 B11R1.1 CSCNc1ccc(cc1)Cl 2230a_100000210052_100011218213 [2,0,0,0,0,0|2,0,0]=4 4418 B11R1.1 CSCNc1ccc(cc1)Cl 34a_100000210052_100011218213 [2,0,0,0,0,0|2,0,0]=4 4419 B11R1.1 Cc1ccc(cc1)NCCF 34a_100000124888_100011217306 [2,0,0,0,0,0|2,0,0]=4 4420 B11R1.1 Cc1ccc(cc1)NCCO 34a_100000124888_100000211926 [2,0,0,0,0,0|1,0,0]=3 4421 B11R1.1 Cc1ccc(cc1)OCCO 34a_100000210336_100000211926 [2,0,0,0,0,0|2,0,0]=4 4422 B11R1.1 Cc1ccc(cc1)OCCO 7a_100000210336_100000211926 [2,0,0,0,0,0|2,0,0]=4 4423 B11R1.1 Cc1ccc(cc1)SCCO 62a_100000186775_100000211926 [2,0,0,0,0,0|2,0,0]=4 4424 B11R1.1 Cc1ccc(cc1)SCCO 62a_100000211926_100000186775 [2,0,0,0,0,0|2,0,0]=4 4425 B11R1.1 FCCNc1ccc(cc1)Br 2230a_100000210018_100011217306 [2,0,0,0,0,0|1,1,0]=4 4426 B11R1.1 FCCNc1ccc(cc1)Br 34a_100000210018_100011217306 [2,0,0,0,0,0|1,1,0]=4 4427 B11R1.1 FCCNc1ccc(cc1)Cl 2230a_100000210052_100011217306 [2,0,0,0,0,0|1,0,0]=3 4428 B11R1.1 FCCNc1ccc(cc1)Cl 34a_100000210052_100011217306 [2,0,0,0,0,0|1,0,0]=3 4429 B11R1.1 FCCNc1ccc(cc1)F 34a_100000185862_100011217306 [2,0,0,0,0,0|1,1,0]=4 4430 B11R1.1 FCCNc1ccc(cc1)I 34a_100000185761_100011217306 [2,0,0,0,0,0|1,1,0]=4 4431 B11R1.1 FCCOc1ccc(cc1)Cl 34a_100000210216_100011217306 [2,0,0,0,0,0|2,0,0]=4 4432 B11R1.1 FCCOc1ccc(cc1)Cl 7a_100000210216_100011217306 [2,0,0,0,0,0|2,0,0]=4 4433 B11R1.1 FCCSc1ccc(cc1)Cl 62a_100000755918_100011217306 [2,0,0,0,0,0|2,0,0]=4 4434 B11R1.1 FCCSc1ccc(cc1)Cl 62a_100011217306_100000755918 [2,0,0,0,0,0|2,0,0]=4 4435 B11R1.1 FCNCc1ccc(cc1)Cl 34a_100000174871_100015361967 [2,0,0,0,0,0|1,0,1]=4 4436 B11R1.1 N#CCNc1ccc(cc1)Cl 2230a_100000210052_100011215382 [2,0,0,0,0,0|1,0,1]=4 4437 B11R1.1 Nc1ccc(cc1)OCCO 34a_100000185829_100000211926 [2,0,0,0,0,0|2,0,0]=4 4438 B11R1.1 Nc1ccc(cc1)SCCO 62a_100000185761_100000211926 [2,0,0,0,0,0|2,0,0]=4 4439 B11R1.1 Nc1ccc(cc1)SCCO 62a_100000211926_100000185761 [2,0,0,0,0,0|2,0,0]=4 4440 B11R1.1 O=CCNc1ccc(cc1)Cl 2230a_100000210052_200015260668 [2,0,0,0,0,0|0,0,2]=4 4441 B11R1.1 O=CCNc1ccc(cc1)Cl 34a_100000210052_200009817547 [2,0,0,0,0,0|0,0,2]=4 4442 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [2,0,0,0,0,0|1,0,1]=4 4443 B11R1.1 OCCNc1ccc(cc1)Br 2230a_100000210018_100000211926 [2,0,0,0,0,0|0,1,0]=3 4444 B11R1.1 OCCNc1ccc(cc1)Br 34a_100000210018_100000211926 [2,0,0,0,0,0|0,1,0]=3 4445 B11R1.1 OCCNc1ccc(cc1)Cl 2230a_100000210052_100000211926 [2,0,0,0,0,0|0,0,0]=2 4446 B11R1.1 OCCNc1ccc(cc1)Cl 34a_100000210052_100000211926 [2,0,0,0,0,0|0,0,0]=2 4447 B11R1.1 OCCNc1ccc(cc1)F 34a_100000185862_100000211926 [2,0,0,0,0,0|0,1,0]=3 4448 B11R1.1 OCCNc1ccc(cc1)I 34a_100000185761_100000211926 [2,0,0,0,0,0|0,1,0]=3 4449 B11R1.1 OCCNc1ccc(cc1)O 34a_100000185829_100000211926 [2,0,0,0,0,0|1,0,0]=3 4450 B11R1.1 OCCNc1ccc(cn1)Br 27a_100000210304_100000686858 [2,0,0,0,0,0|1,1,0]=4 4451 B11R1.1 OCCNc1ncc(cn1)Cl 27a_100000210304_100011356929 [2,0,0,0,0,0|2,0,0]=4 4452 B11R1.1 OCCOc1ccc(cc1)Br 34a_100000185759_100000211926 [2,0,0,0,0,0|1,1,0]=4 4453 B11R1.1 OCCOc1ccc(cc1)Br 7a_100000185759_100000211926 [2,0,0,0,0,0|1,1,0]=4 4454 B11R1.1 OCCOc1ccc(cc1)Cl 34a_100000210216_100000211926 [2,0,0,0,0,0|1,0,0]=3 4455 B11R1.1 OCCOc1ccc(cc1)Cl 7a_100000210216_100000211926 [2,0,0,0,0,0|1,0,0]=3 4456 B11R1.1 OCCOc1ccc(cc1)F 34a_100000210339_100000211926 [2,0,0,0,0,0|1,1,0]=4 4457 B11R1.1 OCCOc1ccc(cc1)I 34a_100000212066_100000211926 [2,0,0,0,0,0|1,1,0]=4 4458 B11R1.1 OCCOc1ccc(cc1)I 7a_100000212066_100000211926 [2,0,0,0,0,0|1,1,0]=4 4459 B11R1.1 OCCOc1ccc(cc1)O 271570a_203496583355_100000686261 [2,0,0,0,0,0|2,0,0]=4 4460 B11R1.1 OCCOc1ccc(cn1)Cl 34a_100011215309_100000211926 [2,0,0,0,0,0|2,0,0]=4 4461 B11R1.1 OCCOc1ccc(nc1)Cl 34a_100000744096_100000211926 [2,0,0,0,0,0|2,0,0]=4 4462 B11R1.1 OCCOc1ccc(nc1)Cl 7a_100000744096_100000211926 [2,0,0,0,0,0|2,0,0]=4 4463 B11R1.1 OCCSc1ccc(cc1)Br 62a_100000211926_100000752885 [2,0,0,0,0,0|1,1,0]=4 4464 B11R1.1 OCCSc1ccc(cc1)Br 62a_100000752885_100000211926 [2,0,0,0,0,0|1,1,0]=4 4465 B11R1.1 OCCSc1ccc(cc1)Cl 62a_100000211926_100000755918 [2,0,0,0,0,0|1,0,0]=3 4466 B11R1.1 OCCSc1ccc(cc1)Cl 62a_100000755918_100000211926 [2,0,0,0,0,0|1,0,0]=3 4467 B11R1.1 OCCSc1ccc(cc1)F 62a_100000211213_100000211926 [2,0,0,0,0,0|1,1,0]=4 4468 B11R1.1 OCCSc1ccc(cc1)F 62a_100000211926_100000211213 [2,0,0,0,0,0|1,1,0]=4 4469 B11R1.1 OCCSc1ccc(cc1)O 62a_100000211926_100000185759 [2,0,0,0,0,0|2,0,0]=4 4470 B11R1.1 OCCSc1ccc(cn1)Cl 62a_100000211926_100011356976 [2,0,0,0,0,0|2,0,0]=4 4471 B11R1.1 OCCSc1ccc(cn1)Cl 62a_100011356976_100000211926 [2,0,0,0,0,0|2,0,0]=4 4472 B11R1.1 OCCSc1ccc(nc1)Cl 62a_100000034144_100000211926 [2,0,0,0,0,0|2,0,0]=4 4473 B11R1.1 OCCSc1ccc(nc1)Cl 62a_100000211926_100000034144 [2,0,0,0,0,0|2,0,0]=4 4474 B11R1.1 Oc1ccc(cc1)NCCF 34a_100000185829_100011217306 [2,0,0,0,0,0|2,0,0]=4 4475 B11R1.28 CCCC=Cc1ccccc1 271570a_100016258520_100000210277 [2,0,0,0,0,0|2,0,0]=4 4476 B11R1.28 CCCNCc1ccccc1 207a_100020643023_100015611070 [2,0,0,0,0,0|1,0,1]=4 4477 B11R1.28 CCCNCc1ccccc1 2230a_100015324214_100000210303 [2,0,0,0,0,0|1,0,1]=4 4478 B11R1.28 CCCNCc1ccccc1 270004a_100020643023_100015611070 [2,0,0,0,0,0|1,0,1]=4 4479 B11R1.28 CCCNCc1ccccc1 34a_100015324214_100000210303 [2,0,0,0,0,0|1,0,1]=4 4480 B11R1.28 FCCNCc1ccccc1 2230a_100015324214_100011217306 [2,0,0,0,0,0|1,0,1]=4 4481 B11R1.28 FCCNCc1ccccc1 34a_100000724931_100015291786 [2,0,0,0,0,0|1,0,1]=4 4482 B11R1.28 FCCNCc1ccccc1 34a_100015324214_100011217306 [2,0,0,0,0,0|1,0,1]=4 4483 B11R1.28 OCCCNc1ccccc1 34a_100000106764_100000230001 [2,0,0,0,0,0|2,0,0]=4 4484 B11R1.28 OCCCOc1ccccc1 34a_100000210340_100000230001 [2,0,0,0,0,0|2,0,0]=4 4485 B11R1.28 OCCCOc1ccccc1 7a_100000210340_100011215043 [2,0,0,0,0,0|2,0,0]=4 4486 B11R1.28 OCCCSc1ccccc1 62a_100000719477_100011215043 [2,0,0,0,0,0|2,0,0]=4 4487 B11R1.28 OCCCSc1ccccc1 62a_100011215043_100000041952 [2,0,0,0,0,0|2,0,0]=4 4488 B11R1.28 OCCNCc1ccccc1 207a_100000210304_100015611070 [2,0,0,0,0,0|0,0,1]=3 4489 B11R1.28 OCCNCc1ccccc1 2230a_100015324214_100000211926 [2,0,0,0,0,0|0,0,1]=3 4490 B11R1.28 OCCNCc1ccccc1 2230a_100016997473_100015291786 [2,0,0,0,0,0|0,0,1]=3 4491 B11R1.28 OCCNCc1ccccc1 270004a_100000210304_100015611070 [2,0,0,0,0,0|0,0,1]=3 4492 B11R1.28 OCCNCc1ccccc1 34a_100015324214_100000211926 [2,0,0,0,0,0|0,0,1]=3 4493 B11R1.28 OCCNCc1ccccc1 34a_100016990907_100015291786 [2,0,0,0,0,0|0,0,1]=3 4494 B11R1.28 OCCNCc1ccccn1 207a_100000210304_100000209966 [2,0,0,0,0,0|1,0,1]=4 4495 B11R1.28 OCCNCc1ccccn1 2230a_100016997473_100000721315 [2,0,0,0,0,0|1,0,1]=4 4496 B11R1.28 OCCNCc1ccccn1 270004a_100000210304_100000209966 [2,0,0,0,0,0|1,0,1]=4 4497 B11R1.28 OCCNCc1ccccn1 34a_100016990907_100000721315 [2,0,0,0,0,0|1,0,1]=4 4498 B11R1.28 OCCNCc1cccnc1 207a_100000210304_100000209961 [2,0,0,0,0,0|1,0,1]=4 4499 B11R1.28 OCCNCc1cccnc1 2230a_100016997473_100000741622 [2,0,0,0,0,0|1,0,1]=4 4500 B11R1.28 OCCNCc1cccnc1 270004a_100000210304_100000209961 [2,0,0,0,0,0|1,0,1]=4 4501 B11R1.28 OCCNCc1cccnc1 34a_100016990907_100000733263 [2,0,0,0,0,0|1,0,1]=4 4502 B11R1.28 OCCNCc1ccncc1 207a_100000210304_100000186114 [2,0,0,0,0,0|1,0,1]=4 4503 B11R1.28 OCCNCc1ccncc1 2230a_100016997473_100015193705 [2,0,0,0,0,0|1,0,1]=4 4504 B11R1.28 OCCOCc1ccccc1 34a_100000210790_100000211926 [2,0,0,0,0,0|1,0,1]=4 4505 B11R1.28 OCCOCc1ccccc1 7a_100000210790_100000211926 [2,0,0,0,0,0|1,0,1]=4 4506 B11R1.28 OCCSCc1ccccc1 62a_100000211182_100000211926 [2,0,0,0,0,0|1,0,1]=4 4507 B11R1.28 OCCSCc1ccccc1 62a_100000211926_100015291786 [2,0,0,0,0,0|1,0,1]=4 4508 B11R1.16 C#CCC(=O)c1ccccc1 1458a_100000185807_100000184674 [2,0,0,0,0,0|1,0,1]=4 4509 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [2,0,0,0,0,0|1,0,1]=4 4510 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [2,0,0,0,0,0|1,0,0]=3 4511 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [2,0,0,0,0,0|0,0,0]=2 4512 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [2,0,0,0,0,0|0,0,0]=2 4513 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [2,0,0,0,0,0|0,0,0]=2 4514 B11R1.16 CCNC(C)c1ccccc1 2230a_100015525214_100000230085 [2,0,0,0,0,0|1,0,1]=4 4515 B11R1.16 CCNC(C)c1ccccc1 269862a_100015525214_100000185851 [2,0,0,0,0,0|1,0,1]=4 4516 B11R1.16 CCN[C@H](C)c1ccccc1 2230a_100000751104_100000210202 [2,0,0,0,0,0|1,0,1]=4 4517 B11R1.16 CN(CCO)c1ccccc1 2230a_100000210012_100000211926 [2,0,0,0,0,0|2,0,0]=4 4518 B11R1.16 CN(CCO)c1ccccc1 2230a_100000211345_200000210301 [2,0,0,0,0,0|2,0,0]=4 4519 B11R1.16 CN(CCO)c1ccccc1 269982a_100000210012_100000211926 [2,0,0,0,0,0|2,0,0]=4 4520 B11R1.16 CN(CCO)c1ccccc1 269982a_100000211345_200000210301 [2,0,0,0,0,0|2,0,0]=4 4521 B11R1.16 CN(CCO)c1ccccc1 34a_100000210012_100000211926 [2,0,0,0,0,0|2,0,0]=4 4522 B11R1.16 CN(CCO)c1ccccc1 34a_100000211345_200000210301 [2,0,0,0,0,0|2,0,0]=4 4523 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [2,0,0,0,0,0|2,0,0]=4 4524 B11R1.16 CNNC(=O)c1ccccc1 22a_100016993582_100000185807 [2,0,0,0,0,0|1,0,0]=3 4525 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [2,0,0,0,0,0|2,0,0]=4 4526 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [2,0,0,0,0,0|2,0,0]=4 4527 B11R1.16 N#CCC(=O)c1ccccc1 1458a_100000185807_100011214920 [2,0,0,0,0,0|1,0,1]=4 4528 B11R1.16 O=C(CCF)c1ccccc1 1458a_100000185807_100011217306 [2,0,0,0,0,0|1,0,0]=3 4529 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [2,0,0,0,0,0|0,0,0]=2 4530 B11R1.16 [13CH3]N(CCO)c1ccccc1 2230a_100000211345_200025704644 [2,0,0,0,0,0|2,0,0]=4 4531 B11R1.16 [13CH3]N(CCO)c1ccccc1 269982a_100000211345_200025704644 [2,0,0,0,0,0|2,0,0]=4 4532 B11R1.16 [13CH3]N(CCO)c1ccccc1 34a_100000211345_200025704644 [2,0,0,0,0,0|2,0,0]=4 4533 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [2,0,0,0,0,0|2,0,0]=4 4534 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [2,0,0,0,0,0|2,0,0]=4 4535 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [2,0,0,0,0,0|0,1,0]=3 4536 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [2,0,0,0,0,0|1,0,0]=3 4537 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [2,0,0,0,0,0|0,0,0]=2 4538 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [2,0,0,0,0,0|0,1,0]=3 4539 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [2,0,0,0,0,0|0,1,0]=3 4540 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [2,0,0,0,0,0|1,0,0]=3 4541 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [2,0,0,0,0,0|1,0,0]=3 4542 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [2,0,0,0,0,0|2,0,0]=4 4543 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [2,0,0,0,0,0|2,0,0]=4 4544 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [2,0,0,0,0,0|2,0,0]=4 4545 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [2,0,0,0,0,0|2,0,0]=4 4546 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [2,0,0,0,0,0|2,0,0]=4 4547 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [2,0,0,0,0,0|2,0,0]=4 4548 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [2,0,0,0,0,0|2,0,0]=4 4549 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [2,0,0,0,0,0|2,0,0]=4 4550 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [2,0,0,0,0,0|2,0,0]=4 4551 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [2,0,0,0,0,0|2,0,0]=4 4552 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [2,0,0,0,0,0|0,1,0]=3 4553 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [2,0,0,0,0,0|0,1,0]=3 4554 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [2,0,0,0,0,0|0,1,0]=3 4555 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [2,0,0,0,0,0|0,1,0]=3 4556 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [2,0,0,0,0,0|1,0,0]=3 4557 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [2,0,0,0,0,0|1,0,0]=3 4558 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [2,0,0,0,0,0|1,0,0]=3 4559 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [2,0,0,0,0,0|1,0,0]=3 4560 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [2,0,0,0,0,0|0,0,0]=2 4561 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [2,0,0,0,0,0|0,0,0]=2 4562 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [2,0,0,0,0,0|0,0,0]=2 4563 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [2,0,0,0,0,0|0,0,0]=2 4564 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [2,0,0,0,0,0|0,1,0]=3 4565 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [2,0,0,0,0,0|0,1,0]=3 4566 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [2,0,0,0,0,0|0,1,0]=3 4567 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [2,0,0,0,0,0|0,1,0]=3 4568 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [2,0,0,0,0,0|0,1,0]=3 4569 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [2,0,0,0,0,0|0,1,0]=3 4570 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [2,0,0,0,0,0|0,1,0]=3 4571 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [2,0,0,0,0,0|0,1,0]=3 4572 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [2,0,0,0,0,0|1,0,0]=3 4573 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [2,0,0,0,0,0|1,0,0]=3 4574 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [2,0,0,0,0,0|1,0,0]=3 4575 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [2,0,0,0,0,0|2,0,0]=4 4576 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [2,0,0,0,0,0|2,0,0]=4 4577 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [2,0,0,0,0,0|1,0,1]=4 4578 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [2,0,0,0,0,0|1,0,1]=4 4579 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [2,0,0,0,0,0|1,0,1]=4 4580 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [2,0,0,0,0,0|1,0,1]=4 4581 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [2,0,0,0,0,0|1,0,1]=4 4582 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [2,0,0,0,0,0|2,0,0]=4 4583 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [2,0,0,0,0,0|1,0,1]=4 4584 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [2,0,0,0,0,0|1,0,1]=4 4585 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [2,0,0,0,0,0|2,0,0]=4 4586 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [2,0,0,0,0,0|2,0,0]=4 4587 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [2,0,0,0,0,0|2,0,0]=4 4588 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [2,0,0,0,0,0|1,1,0]=4 4589 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [2,0,0,0,0,0|1,0,0]=3 4590 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [2,0,0,0,0,0|1,1,0]=4 4591 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [2,0,0,0,0,0|1,1,0]=4 4592 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [2,0,0,0,0,0|2,0,0]=4 4593 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [2,0,0,0,0,0|1,0,0]=3 4594 B13R1.9 C#CCCNCc1ccc(cc1)Cl 2230a_100000174871_100000688953 [1,1,0,0,0,0|1,0,1]=4 4595 B13R1.9 C#CCCNCc1ccc(cc1)Cl 34a_100000174871_100000688953 [1,1,0,0,0,0|1,0,1]=4 4596 B13R1.9 C#CCCNCc1ccc(cc1)Cl 34a_100000755551_100000694040 [1,1,0,0,0,0|1,0,1]=4 4597 B13R1.9 C=CCCNCc1ccc(cc1)Cl 207a_100015191253_100000189385 [1,1,0,0,0,0|1,0,1]=4 4598 B13R1.9 C=CCCNCc1ccc(cc1)Cl 2230a_100000174871_100000754431 [1,1,0,0,0,0|1,0,1]=4 4599 B13R1.9 C=CCCNCc1ccc(cc1)Cl 2230a_100015191253_100000694040 [1,1,0,0,0,0|1,0,1]=4 4600 B13R1.9 C=CCCNCc1ccc(cc1)Cl 270004a_100015191253_100000189385 [1,1,0,0,0,0|1,0,1]=4 4601 B13R1.9 C=CCCNCc1ccc(cc1)Cl 34a_100000174871_100000754431 [1,1,0,0,0,0|1,0,1]=4 4602 B13R1.9 CCCCC=Cc1ccc(cc1)Cl 271570a_100016275911_100000755918 [1,1,0,0,0,0|2,0,0]=4 4603 B13R1.9 CCCCNCc1ccc(cc1)Cl 207a_100000102301_100000189385 [1,1,0,0,0,0|1,0,1]=4 4604 B13R1.9 CCCCNCc1ccc(cc1)Cl 2230a_100000102301_100000694040 [1,1,0,0,0,0|1,0,1]=4 4605 B13R1.9 CCCCNCc1ccc(cc1)Cl 2230a_100000174871_100000210211 [1,1,0,0,0,0|1,0,1]=4 4606 B13R1.9 CCCCNCc1ccc(cc1)Cl 270004a_100000102301_100000189385 [1,1,0,0,0,0|1,0,1]=4 4607 B13R1.9 CCCCNCc1ccc(cc1)Cl 34a_100000174871_100000210210 [1,1,0,0,0,0|1,0,1]=4 4608 B13R1.9 CCCCNCc1ccc(cc1)Cl 7a_106832991798_100000187161 [1,1,0,0,0,0|1,0,1]=4 4609 B13R1.9 CCCNCCc1ccc(cc1)Cl 2230a_100000185265_100000210303 [1,1,0,0,0,0|1,0,1]=4 4610 B13R1.9 CCCNCCc1ccc(cc1)Cl 34a_100000185265_100000210303 [1,1,0,0,0,0|1,0,1]=4 4611 B13R1.9 CCCNN=Cc1ccc(cc1)Br 4a_100000740057_100000186029 [1,1,0,0,0,0|1,1,0]=4 4612 B13R1.9 CCCNN=Cc1ccc(cc1)C 4a_100000740057_100000211033 [1,1,0,0,0,0|2,0,0]=4 4613 B13R1.9 CCCNN=Cc1ccc(cc1)Cl 4a_100000740057_100000189385 [1,1,0,0,0,0|1,0,0]=3 4614 B13R1.9 CCCNN=Cc1ccc(cc1)F 4a_100000740057_100000210084 [1,1,0,0,0,0|1,1,0]=4 4615 B13R1.9 CCCNN=Cc1ccc(cc1)I 4a_100000740057_100000188517 [1,1,0,0,0,0|1,1,0]=4 4616 B13R1.9 CCCNN=Cc1ccc(cc1)O 4a_100000740057_100000185832 [1,1,0,0,0,0|2,0,0]=4 4617 B13R1.9 CCCNN=Cc1ccc(cn1)Cl 4a_100000740057_100011361569 [1,1,0,0,0,0|2,0,0]=4 4618 B13R1.9 CCCNN=Cc1ccc(nc1)Cl 4a_100000740057_100000766901 [1,1,0,0,0,0|2,0,0]=4 4619 B13R1.9 CCNCC=Cc1ccc(cc1)Cl 270004a_100015525214_100102525842 [1,1,0,0,0,0|2,0,0]=4 4620 B13R1.9 COCCCNc1ccc(cc1)Cl 2230a_100000210052_100000740836 [1,1,0,0,0,0|2,0,0]=4 4621 B13R1.9 COCCCNc1ccc(cc1)Cl 34a_100000210052_100000740836 [1,1,0,0,0,0|2,0,0]=4 4622 B13R1.9 COCCCOc1ccc(cc1)Cl 34a_100000210216_100000740836 [1,1,0,0,0,0|2,0,0]=4 4623 B13R1.9 COCCCOc1ccc(cc1)Cl 7a_100000210216_100000740836 [1,1,0,0,0,0|2,0,0]=4 4624 B13R1.9 COCCCSc1ccc(cc1)Cl 62a_100000709357_100000755918 [1,1,0,0,0,0|2,0,0]=4 4625 B13R1.9 COCCCSc1ccc(cc1)Cl 62a_100000755918_100000709357 [1,1,0,0,0,0|2,0,0]=4 4626 B13R1.9 COCCNCc1ccc(cc1)Br 207a_100000209980_100000186029 [1,1,0,0,0,0|0,1,1]=4 4627 B13R1.9 COCCNCc1ccc(cc1)Br 2230a_100000174875_100011201679 [1,1,0,0,0,0|0,1,1]=4 4628 B13R1.9 COCCNCc1ccc(cc1)Br 2230a_100000209980_100011217064 [1,1,0,0,0,0|0,1,1]=4 4629 B13R1.9 COCCNCc1ccc(cc1)Br 270004a_100000209980_100000186029 [1,1,0,0,0,0|0,1,1]=4 4630 B13R1.9 COCCNCc1ccc(cc1)Br 34a_100000174875_100011201679 [1,1,0,0,0,0|0,1,1]=4 4631 B13R1.9 COCCNCc1ccc(cc1)Br 34a_100000186819_200000210301 [1,1,0,0,0,0|0,1,1]=4 4632 B13R1.9 COCCNCc1ccc(cc1)C 207a_100000209980_100000211033 [1,1,0,0,0,0|1,0,1]=4 4633 B13R1.9 COCCNCc1ccc(cc1)C 2230a_100000174908_100011201679 [1,1,0,0,0,0|1,0,1]=4 4634 B13R1.9 COCCNCc1ccc(cc1)C 2230a_100000209980_100000210814 [1,1,0,0,0,0|1,0,1]=4 4635 B13R1.9 COCCNCc1ccc(cc1)C 270004a_100000209980_100000211033 [1,1,0,0,0,0|1,0,1]=4 4636 B13R1.9 COCCNCc1ccc(cc1)C 34a_100000174908_100011201679 [1,1,0,0,0,0|1,0,1]=4 4637 B13R1.9 COCCNCc1ccc(cc1)C 34a_100000186992_200000210301 [1,1,0,0,0,0|1,0,1]=4 4638 B13R1.9 COCCNCc1ccc(cc1)Cl 207a_100000209980_100000189385 [1,1,0,0,0,0|0,0,1]=3 4639 B13R1.9 COCCNCc1ccc(cc1)Cl 2230a_100000174871_100011201679 [1,1,0,0,0,0|0,0,1]=3 4640 B13R1.9 COCCNCc1ccc(cc1)Cl 2230a_100000209980_100000694040 [1,1,0,0,0,0|0,0,1]=3 4641 B13R1.9 COCCNCc1ccc(cc1)Cl 270004a_100000209980_100000189385 [1,1,0,0,0,0|0,0,1]=3 4642 B13R1.9 COCCNCc1ccc(cc1)Cl 34a_100000174871_100011201679 [1,1,0,0,0,0|0,0,1]=3 4643 B13R1.9 COCCNCc1ccc(cc1)F 207a_100000209980_100000210084 [1,1,0,0,0,0|0,1,1]=4 4644 B13R1.9 COCCNCc1ccc(cc1)F 2230a_100000174882_100011201679 [1,1,0,0,0,0|0,1,1]=4 4645 B13R1.9 COCCNCc1ccc(cc1)F 2230a_100000209980_100000198546 [1,1,0,0,0,0|0,1,1]=4 4646 B13R1.9 COCCNCc1ccc(cc1)F 270004a_100000209980_100000210084 [1,1,0,0,0,0|0,1,1]=4 4647 B13R1.9 COCCNCc1ccc(cc1)F 34a_100000174882_100011201679 [1,1,0,0,0,0|0,1,1]=4 4648 B13R1.9 COCCNCc1ccc(cc1)F 34a_100015183715_200000210301 [1,1,0,0,0,0|0,1,1]=4 4649 B13R1.9 COCCNCc1ccc(cc1)I 207a_100000209980_100000188517 [1,1,0,0,0,0|0,1,1]=4 4650 B13R1.9 COCCNCc1ccc(cc1)I 2230a_100000209980_100000189116 [1,1,0,0,0,0|0,1,1]=4 4651 B13R1.9 COCCNCc1ccc(cc1)I 2230a_100016989417_100011201679 [1,1,0,0,0,0|0,1,1]=4 4652 B13R1.9 COCCNCc1ccc(cc1)I 34a_100016989417_100011201679 [1,1,0,0,0,0|0,1,1]=4 4653 B13R1.9 COCCNCc1ccc(cc1)O 271570a_203496583355_100015187160 [1,1,0,0,0,0|1,0,1]=4 4654 B13R1.9 COCCNCc1ccc(cc1)O 34a_100000185549_100011201679 [1,1,0,0,0,0|1,0,1]=4 4655 B13R1.9 COCCNCc1ccc(cn1)Cl 207a_100000209980_100011361569 [1,1,0,0,0,0|1,0,1]=4 4656 B13R1.9 COCCNCc1ccc(cn1)Cl 2230a_100000209980_100012066911 [1,1,0,0,0,0|1,0,1]=4 4657 B13R1.9 COCCNCc1ccc(cn1)Cl 270004a_100000209980_100011361569 [1,1,0,0,0,0|1,0,1]=4 4658 B13R1.9 COCCNCc1ccc(cn1)Cl 34a_100000697193_100011201679 [1,1,0,0,0,0|1,0,1]=4 4659 B13R1.9 COCCNCc1ccc(nc1)Cl 2230a_100000209980_100000735431 [1,1,0,0,0,0|1,0,1]=4 4660 B13R1.9 COCCNCc1ccc(nc1)Cl 2230a_100000735879_100011201679 [1,1,0,0,0,0|1,0,1]=4 4661 B13R1.9 COCCNCc1ccc(nc1)Cl 34a_100000735879_100011201679 [1,1,0,0,0,0|1,0,1]=4 4662 B13R1.9 COCCOCc1ccc(cc1)Cl 34a_100000210237_100000694040 [1,1,0,0,0,0|1,0,1]=4 4663 B13R1.9 COCCOCc1ccc(cc1)Cl 34a_100000211118_100011201679 [1,1,0,0,0,0|1,0,1]=4 4664 B13R1.9 COCCOCc1ccc(cc1)Cl 7a_100000211118_100000233755 [1,1,0,0,0,0|1,0,1]=4 4665 B13R1.9 COCCSCc1ccc(cc1)Cl 34a_200000186141_200000210301 [1,1,0,0,0,0|1,0,1]=4 4666 B13R1.9 COCCSCc1ccc(cc1)Cl 62a_100000187161_100000233755 [1,1,0,0,0,0|1,0,1]=4 4667 B13R1.9 COCCSCc1ccc(cc1)Cl 62a_100000233755_100000187161 [1,1,0,0,0,0|1,0,1]=4 4668 B13R1.9 COCCSCc1ccc(cc1)Cl 7a_200000186141_200000210301 [1,1,0,0,0,0|1,0,1]=4 4669 B13R1.9 CSCCNCc1ccc(cc1)Cl 207a_100020590264_100000189385 [1,1,0,0,0,0|0,1,1]=4 4670 B13R1.9 CSCCNCc1ccc(cc1)Cl 2230a_100000174871_100000751147 [1,1,0,0,0,0|0,1,1]=4 4671 B13R1.9 CSCCNCc1ccc(cc1)Cl 2230a_100020590264_100000694040 [1,1,0,0,0,0|0,1,1]=4 4672 B13R1.9 CSCCNCc1ccc(cc1)Cl 270004a_100020590264_100000189385 [1,1,0,0,0,0|0,1,1]=4 4673 B13R1.9 CSCCNCc1ccc(cc1)Cl 34a_100000174871_100000212216 [1,1,0,0,0,0|0,1,1]=4 4674 B13R1.9 C[n+]1ccc(cc1)C=NNCCO 4a_100000210001_100020646442 [1,1,0,0,0,0|2,0,0]=4 4675 B13R1.9 Cc1ccc(cc1)C=NNCCO 4a_100000210001_100000211033 [1,1,0,0,0,0|1,0,0]=3 4676 B13R1.9 Cc1ccc(cc1)CCNCCO 2230a_100000705350_100000211926 [1,1,0,0,0,0|1,0,1]=4 4677 B13R1.9 Cc1ccc(cc1)CCNCCO 2230a_100016997473_100011713686 [1,1,0,0,0,0|1,0,1]=4 4678 B13R1.9 Cc1ccc(cc1)CCNCCO 34a_100000705350_100000211926 [1,1,0,0,0,0|1,0,1]=4 4679 B13R1.9 Cc1ccc(cc1)CCNCCO 34a_100016990907_100011713686 [1,1,0,0,0,0|1,0,1]=4 4680 B13R1.9 Cc1ccc(cc1)CNCCCO 207a_100000182051_100000211033 [1,1,0,0,0,0|1,0,1]=4 4681 B13R1.9 Cc1ccc(cc1)CNCCCO 2230a_100000174908_100000230001 [1,1,0,0,0,0|1,0,1]=4 4682 B13R1.9 Cc1ccc(cc1)CNCCCO 270004a_100000182051_100000211033 [1,1,0,0,0,0|1,0,1]=4 4683 B13R1.9 Cc1ccc(cc1)CNCCCO 34a_100000174908_100000230001 [1,1,0,0,0,0|1,0,1]=4 4684 B13R1.9 Cc1ccc(cc1)CNCCO[13CH3] 34a_100000186992_200025704644 [1,1,0,0,0,0|1,0,1]=4 4685 B13R1.9 Cc1ccc(cn1)C=NNCCO 4a_100000210001_100000743784 [1,1,0,0,0,0|2,0,0]=4 4686 B13R1.9 Cc1ccc(nc1)C=NNCCO 4a_100000210001_100000050478 [1,1,0,0,0,0|2,0,0]=4 4687 B13R1.9 FCCCNCc1ccc(cc1)Cl 207a_100015189416_100000189385 [1,1,0,0,0,0|1,0,1]=4 4688 B13R1.9 FCCCNCc1ccc(cc1)Cl 2230a_100000174871_100011934791 [1,1,0,0,0,0|1,0,1]=4 4689 B13R1.9 FCCCNCc1ccc(cc1)Cl 2230a_100015189416_100000694040 [1,1,0,0,0,0|1,0,1]=4 4690 B13R1.9 FCCCNCc1ccc(cc1)Cl 270004a_100015189416_100000189385 [1,1,0,0,0,0|1,0,1]=4 4691 B13R1.9 FCCCNCc1ccc(cc1)Cl 34a_100000174871_100011934791 [1,1,0,0,0,0|1,0,1]=4 4692 B13R1.9 FCCCNCc1ccc(cc1)Cl 34a_100015189416_100000694040 [1,1,0,0,0,0|1,0,1]=4 4693 B13R1.9 FCCNCCc1ccc(cc1)Cl 2230a_100000185265_100011217306 [1,1,0,0,0,0|1,0,1]=4 4694 B13R1.9 FCCNCCc1ccc(cc1)Cl 34a_100000185265_100011217306 [1,1,0,0,0,0|1,0,1]=4 4695 B13R1.9 FCCNCCc1ccc(cc1)Cl 34a_100000724931_100011713675 [1,1,0,0,0,0|1,0,1]=4 4696 B13R1.9 N#CCCNCc1ccc(cc1)Cl 2230a_100000174871_100011215226 [1,1,0,0,0,0|1,0,1]=4 4697 B13R1.9 N#CCCNCc1ccc(cc1)Cl 270004a_100000720768_100000189385 [1,1,0,0,0,0|1,0,1]=4 4698 B13R1.9 NOCCOCc1ccc(cc1)Cl 34a_100000700252_100000694040 [1,1,0,0,0,0|1,0,1]=4 4699 B13R1.9 OCCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210776 [1,1,0,0,0,0|1,0,1]=4 4700 B13R1.9 OCCCCNc1ccc(cc1)Cl 34a_100000210052_100011216708 [1,1,0,0,0,0|1,0,1]=4 4701 B13R1.9 OCCCCOc1ccc(cc1)Cl 34a_100000210216_100011216708 [1,1,0,0,0,0|1,0,1]=4 4702 B13R1.9 OCCCCOc1ccc(cc1)Cl 7a_100000210216_100000210776 [1,1,0,0,0,0|1,0,1]=4 4703 B13R1.9 OCCCCSc1ccc(cc1)Cl 62a_100000210776_100000755918 [1,1,0,0,0,0|1,0,1]=4 4704 B13R1.9 OCCCCSc1ccc(cc1)Cl 62a_100000755918_100000210776 [1,1,0,0,0,0|1,0,1]=4 4705 B13R1.9 OCCCNCc1ccc(cc1)Br 207a_100000182051_100000186029 [1,1,0,0,0,0|0,1,1]=4 4706 B13R1.9 OCCCNCc1ccc(cc1)Br 2230a_100000174875_100000230001 [1,1,0,0,0,0|0,1,1]=4 4707 B13R1.9 OCCCNCc1ccc(cc1)Br 270004a_100000182051_100000186029 [1,1,0,0,0,0|0,1,1]=4 4708 B13R1.9 OCCCNCc1ccc(cc1)Br 34a_100000174875_100000230001 [1,1,0,0,0,0|0,1,1]=4 4709 B13R1.9 OCCCNCc1ccc(cc1)Cl 207a_100000182051_100000189385 [1,1,0,0,0,0|0,0,1]=3 4710 B13R1.9 OCCCNCc1ccc(cc1)Cl 2230a_100000174871_100000230001 [1,1,0,0,0,0|0,0,1]=3 4711 B13R1.9 OCCCNCc1ccc(cc1)Cl 270004a_100000182051_100000189385 [1,1,0,0,0,0|0,0,1]=3 4712 B13R1.9 OCCCNCc1ccc(cc1)Cl 34a_100000174871_100000230001 [1,1,0,0,0,0|0,0,1]=3 4713 B13R1.9 OCCCNCc1ccc(cc1)F 207a_100000182051_100000210084 [1,1,0,0,0,0|0,1,1]=4 4714 B13R1.9 OCCCNCc1ccc(cc1)F 2230a_100000174882_100000230001 [1,1,0,0,0,0|0,1,1]=4 4715 B13R1.9 OCCCNCc1ccc(cc1)F 270004a_100000182051_100000210084 [1,1,0,0,0,0|0,1,1]=4 4716 B13R1.9 OCCCNCc1ccc(cc1)F 34a_100000174882_100000230001 [1,1,0,0,0,0|0,1,1]=4 4717 B13R1.9 OCCCNCc1ccc(cc1)I 207a_100000182051_100000188517 [1,1,0,0,0,0|0,1,1]=4 4718 B13R1.9 OCCCNCc1ccc(cc1)I 2230a_100016989417_100000230001 [1,1,0,0,0,0|0,1,1]=4 4719 B13R1.9 OCCCNCc1ccc(cc1)I 34a_100016989417_100000230001 [1,1,0,0,0,0|0,1,1]=4 4720 B13R1.9 OCCCNCc1ccc(cc1)O 34a_100000185549_100000230001 [1,1,0,0,0,0|1,0,1]=4 4721 B13R1.9 OCCCNCc1ccc(cn1)Cl 207a_100000182051_100011361569 [1,1,0,0,0,0|1,0,1]=4 4722 B13R1.9 OCCCNCc1ccc(cn1)Cl 270004a_100000182051_100011361569 [1,1,0,0,0,0|1,0,1]=4 4723 B13R1.9 OCCCNCc1ccc(cn1)Cl 34a_100000697193_100000230001 [1,1,0,0,0,0|1,0,1]=4 4724 B13R1.9 OCCCNCc1ccc(nc1)Cl 2230a_100000735879_100000230001 [1,1,0,0,0,0|1,0,1]=4 4725 B13R1.9 OCCCNCc1ccc(nc1)Cl 34a_100000735879_100000230001 [1,1,0,0,0,0|1,0,1]=4 4726 B13R1.9 OCCCOCc1ccc(cc1)Cl 34a_100000211118_100000230001 [1,1,0,0,0,0|1,0,1]=4 4727 B13R1.9 OCCCOCc1ccc(cc1)Cl 7a_100000211118_100011215043 [1,1,0,0,0,0|1,0,1]=4 4728 B13R1.9 OCCCSCc1ccc(cc1)Cl 62a_100000187161_100011215043 [1,1,0,0,0,0|1,0,1]=4 4729 B13R1.9 OCCCSCc1ccc(cc1)Cl 62a_100011215043_100000187161 [1,1,0,0,0,0|1,0,1]=4 4730 B13R1.9 OCCNCCc1ccc(cc1)Br 2230a_100000755846_100000211926 [1,1,0,0,0,0|0,1,1]=4 4731 B13R1.9 OCCNCCc1ccc(cc1)Br 2230a_100016997473_100011740612 [1,1,0,0,0,0|0,1,1]=4 4732 B13R1.9 OCCNCCc1ccc(cc1)Br 34a_100000755846_100000211926 [1,1,0,0,0,0|0,1,1]=4 4733 B13R1.9 OCCNCCc1ccc(cc1)Br 34a_100016990907_100011740612 [1,1,0,0,0,0|0,1,1]=4 4734 B13R1.9 OCCNCCc1ccc(cc1)Cl 2230a_100000185265_100000211926 [1,1,0,0,0,0|0,0,1]=3 4735 B13R1.9 OCCNCCc1ccc(cc1)Cl 2230a_100016997473_100011713675 [1,1,0,0,0,0|0,0,1]=3 4736 B13R1.9 OCCNCCc1ccc(cc1)Cl 34a_100000185265_100000211926 [1,1,0,0,0,0|0,0,1]=3 4737 B13R1.9 OCCNCCc1ccc(cc1)Cl 34a_100016990907_100011713675 [1,1,0,0,0,0|0,0,1]=3 4738 B13R1.9 OCCNCCc1ccc(cc1)F 2230a_100000199005_100000211926 [1,1,0,0,0,0|0,1,1]=4 4739 B13R1.9 OCCNCCc1ccc(cc1)F 2230a_100016997473_100011217392 [1,1,0,0,0,0|0,1,1]=4 4740 B13R1.9 OCCNCCc1ccc(cc1)F 34a_100000199005_100000211926 [1,1,0,0,0,0|0,1,1]=4 4741 B13R1.9 OCCNCCc1ccc(cc1)F 34a_100016990907_100011217392 [1,1,0,0,0,0|0,1,1]=4 4742 B13R1.9 OCCNCCc1ccc(cc1)O 2230a_100016997473_100009816426 [1,1,0,0,0,0|1,0,1]=4 4743 B13R1.9 OCCNCCc1ccc(cc1)O 34a_100000743037_100000211926 [1,1,0,0,0,0|1,0,1]=4 4744 B13R1.9 OCCNN=Cc1ccc(cc1)Br 4a_100000210001_100000186029 [1,1,0,0,0,0|0,1,0]=3 4745 B13R1.9 OCCNN=Cc1ccc(cc1)Cl 4a_100000210001_100000189385 [1,1,0,0,0,0|0,0,0]=2 4746 B13R1.9 OCCNN=Cc1ccc(cc1)F 4a_100000210001_100000210084 [1,1,0,0,0,0|0,1,0]=3 4747 B13R1.9 OCCNN=Cc1ccc(cc1)I 4a_100000210001_100000188517 [1,1,0,0,0,0|0,1,0]=3 4748 B13R1.9 OCCNN=Cc1ccc(cc1)O 4a_100000210001_100000185832 [1,1,0,0,0,0|1,0,0]=3 4749 B13R1.9 OCCNN=Cc1ccc(cn1)Br 4a_100000210001_100000754260 [1,1,0,0,0,0|1,1,0]=4 4750 B13R1.9 OCCNN=Cc1ccc(cn1)Cl 4a_100000210001_100011361569 [1,1,0,0,0,0|1,0,0]=3 4751 B13R1.9 OCCNN=Cc1ccc(cn1)F 4a_100000210001_100011934744 [1,1,0,0,0,0|1,1,0]=4 4752 B13R1.9 OCCNN=Cc1ccc(cn1)O 4a_100000210001_100000059846 [1,1,0,0,0,0|2,0,0]=4 4753 B13R1.9 OCCNN=Cc1ccc(nc1)Br 4a_100000210001_100000763085 [1,1,0,0,0,0|1,1,0]=4 4754 B13R1.9 OCCNN=Cc1ccc(nc1)Cl 4a_100000210001_100000766901 [1,1,0,0,0,0|1,0,0]=3 4755 B13R1.9 OCCNN=Cc1ccc(nc1)F 4a_100000210001_100000068566 [1,1,0,0,0,0|1,1,0]=4 4756 B13R1.9 OCCNN=Cc1ccc(nc1)O 4a_100000210001_100011361521 [1,1,0,0,0,0|2,0,0]=4 4757 B13R1.9 OCCNN=Cc1ccc(nn1)Cl 4a_100000210001_100000044651 [1,1,0,0,0,0|2,0,0]=4 4758 B13R1.9 OCCNN=Cc1cnc(cn1)Cl 4a_100000210001_100012001714 [1,1,0,0,0,0|2,0,0]=4 4759 B13R1.9 OCCOCCc1ccc(cc1)Cl 34a_100011219627_100000211926 [1,1,0,0,0,0|1,0,1]=4 4760 B13R1.9 OCCOCCc1ccc(cc1)Cl 7a_100011219627_100000211926 [1,1,0,0,0,0|1,0,1]=4 4761 B13R1.9 OCCSCCc1ccc(cc1)Cl 62a_100000211926_100011713675 [1,1,0,0,0,0|1,0,1]=4 4762 B13R1.9 OCCSCCc1ccc(cc1)Cl 62a_100011713675_100000211926 [1,1,0,0,0,0|1,0,1]=4 4763 B13R1.9 [13CH3]OCCNCc1ccc(cc1)Br 34a_100000186819_200025704644 [1,1,0,0,0,0|0,1,1]=4 4764 B13R1.9 [13CH3]OCCNCc1ccc(cc1)F 34a_100015183715_200025704644 [1,1,0,0,0,0|0,1,1]=4 4765 B13R1.9 [13CH3]OCCSCc1ccc(cc1)Cl 34a_200000186141_200025704644 [1,1,0,0,0,0|1,0,1]=4 4766 B13R1.9 [13CH3]OCCSCc1ccc(cc1)Cl 7a_200000186141_200025704644 [1,1,0,0,0,0|1,0,1]=4 4767 B13R1.14 CC(CO)NCc1ccc(cc1)Br 2230a_100000174875_100012180447 [1,1,0,0,0,0|0,1,1]=4 4768 B13R1.14 CC(CO)NCc1ccc(cc1)Br 34a_100000174875_100012180447 [1,1,0,0,0,0|0,1,1]=4 4769 B13R1.14 CC(CO)NCc1ccc(cc1)Cl 2230a_100000174871_100012180447 [1,1,0,0,0,0|0,0,1]=3 4770 B13R1.14 CC(CO)NCc1ccc(cc1)Cl 34a_100000174871_100012180447 [1,1,0,0,0,0|0,0,1]=3 4771 B13R1.14 CC(CO)NCc1ccc(cc1)F 2230a_100000174882_100012180447 [1,1,0,0,0,0|0,1,1]=4 4772 B13R1.14 CC(CO)NCc1ccc(cc1)F 34a_100000174882_100012180447 [1,1,0,0,0,0|0,1,1]=4 4773 B13R1.14 CC(CO)NCc1ccc(cc1)I 2230a_100016989417_100012180447 [1,1,0,0,0,0|0,1,1]=4 4774 B13R1.14 CC(CO)NCc1ccc(cc1)I 34a_100016989417_100012180447 [1,1,0,0,0,0|0,1,1]=4 4775 B13R1.14 CC(CO)NCc1ccc(cc1)O 34a_100000185549_100012180447 [1,1,0,0,0,0|1,0,1]=4 4776 B13R1.14 CC(CO)NCc1ccc(cn1)Cl 34a_100000697193_100012180447 [1,1,0,0,0,0|1,0,1]=4 4777 B13R1.14 CC(CO)NCc1ccc(nc1)Cl 2230a_100000735879_100012180447 [1,1,0,0,0,0|1,0,1]=4 4778 B13R1.14 CC(CO)NCc1ccc(nc1)Cl 34a_100000735879_100012180447 [1,1,0,0,0,0|1,0,1]=4 4779 B13R1.14 CC(CO)OCc1ccc(cc1)Cl 34a_100000211118_100012180447 [1,1,0,0,0,0|1,0,1]=4 4780 B13R1.14 CC(CO)OCc1ccc(cc1)Cl 7a_100000211118_100012180447 [1,1,0,0,0,0|1,0,1]=4 4781 B13R1.14 CC(CO)SCc1ccc(cc1)Cl 62a_100012180447_100000187161 [1,1,0,0,0,0|1,0,1]=4 4782 B13R1.14 CCC(C)NCc1ccc(cc1)Cl 207a_100000209981_100000189385 [1,1,0,0,0,0|1,0,1]=4 4783 B13R1.14 CCC(C)NCc1ccc(cc1)Cl 2230a_100000174871_100000758301 [1,1,0,0,0,0|1,0,1]=4 4784 B13R1.14 CCC(C)NCc1ccc(cc1)Cl 2230a_100000209981_100000694040 [1,1,0,0,0,0|1,0,1]=4 4785 B13R1.14 CCC(C)NCc1ccc(cc1)Cl 270004a_100000209981_100000189385 [1,1,0,0,0,0|1,0,1]=4 4786 B13R1.14 CCC(C)NCc1ccc(cc1)Cl 34a_100000174871_100011215416 [1,1,0,0,0,0|1,0,1]=4 4787 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)Cl 2230a_100000210052_100000059175 [1,1,0,0,0,0|2,0,0]=4 4788 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)Cl 34a_100000210052_100000059175 [1,1,0,0,0,0|2,0,0]=4 4789 B13R1.14 C[C@@H](CO)COc1ccc(cc1)Cl 34a_100000210216_100000059175 [1,1,0,0,0,0|2,0,0]=4 4790 B13R1.14 C[C@@H](CO)COc1ccc(cc1)Cl 7a_100000210216_100000059175 [1,1,0,0,0,0|2,0,0]=4 4791 B13R1.14 C[C@@H](CO)CSc1ccc(cc1)Cl 62a_100000059175_100000755918 [1,1,0,0,0,0|2,0,0]=4 4792 B13R1.14 C[C@@H](CO)CSc1ccc(cc1)Cl 62a_100000755918_100000059175 [1,1,0,0,0,0|2,0,0]=4 4793 B13R1.14 C[C@H](CF)NCc1ccc(cc1)Cl 207a_100102880703_100000189385 [1,1,0,0,0,0|1,0,1]=4 4794 B13R1.14 C[C@H](CF)NCc1ccc(cc1)Cl 270004a_100102880703_100000189385 [1,1,0,0,0,0|1,0,1]=4 4795 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Br 207a_100000737577_100000186029 [1,1,0,0,0,0|0,1,1]=4 4796 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Br 2230a_100000737577_100011217064 [1,1,0,0,0,0|0,1,1]=4 4797 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Br 270004a_100000737577_100000186029 [1,1,0,0,0,0|0,1,1]=4 4798 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Cl 207a_100000737577_100000189385 [1,1,0,0,0,0|0,0,1]=3 4799 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Cl 2230a_100000737577_100000694040 [1,1,0,0,0,0|0,0,1]=3 4800 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Cl 270004a_100000737577_100000189385 [1,1,0,0,0,0|0,0,1]=3 4801 B13R1.14 C[C@H](CO)NCc1ccc(cc1)F 207a_100000737577_100000210084 [1,1,0,0,0,0|0,1,1]=4 4802 B13R1.14 C[C@H](CO)NCc1ccc(cc1)F 2230a_100000737577_100000198546 [1,1,0,0,0,0|0,1,1]=4 4803 B13R1.14 C[C@H](CO)NCc1ccc(cc1)F 270004a_100000737577_100000210084 [1,1,0,0,0,0|0,1,1]=4 4804 B13R1.14 C[C@H](CO)NCc1ccc(cc1)I 207a_100000737577_100000188517 [1,1,0,0,0,0|0,1,1]=4 4805 B13R1.14 C[C@H](CO)NCc1ccc(cc1)I 2230a_100000737577_100000189116 [1,1,0,0,0,0|0,1,1]=4 4806 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Cl 207a_100000737577_100011361569 [1,1,0,0,0,0|1,0,1]=4 4807 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Cl 2230a_100000737577_100012066911 [1,1,0,0,0,0|1,0,1]=4 4808 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Cl 270004a_100000737577_100011361569 [1,1,0,0,0,0|1,0,1]=4 4809 B13R1.14 C[C@H](CO)NCc1ccc(nc1)Cl 2230a_100000737577_100000735431 [1,1,0,0,0,0|1,0,1]=4 4810 B13R1.14 C[C@H](CO)SCc1ccc(cc1)Cl 62a_100000187161_100016084084 [1,1,0,0,0,0|1,0,1]=4 4811 B13R1.14 C[C@H](CO)SCc1ccc(cc1)Cl 62a_100016084084_100000187161 [1,1,0,0,0,0|1,0,1]=4 4812 B13R1.14 Cc1ccc(cc1)CNC(C)CO 2230a_100000174908_100012180447 [1,1,0,0,0,0|1,0,1]=4 4813 B13R1.14 Cc1ccc(cc1)CNC(C)CO 34a_100000174908_100012180447 [1,1,0,0,0,0|1,0,1]=4 4814 B13R1.14 Cc1ccc(cc1)CN[C@H](C)CO 207a_100000737577_100000211033 [1,1,0,0,0,0|1,0,1]=4 4815 B13R1.14 Cc1ccc(cc1)CN[C@H](C)CO 2230a_100000737577_100000210814 [1,1,0,0,0,0|1,0,1]=4 4816 B13R1.14 Cc1ccc(cc1)CN[C@H](C)CO 270004a_100000737577_100000211033 [1,1,0,0,0,0|1,0,1]=4 4817 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl 240690a_100000174871_100000210174 [1,1,0,0,0,0|0,0,2]=4 4818 B13R1.14 O=C(CO)NCc1ccc(cc1)Cl 527a_100000174871_100000210174 [1,1,0,0,0,0|0,0,2]=4 4819 B13R1.14 O=C(CO)NNc1ccc(cc1)Cl 22a_100000683521_100000210174 [1,1,0,0,0,0|1,0,1]=4 4820 B13R1.14 OCC(O)CNc1ccc(cc1)Cl 2230a_100000210052_100011219619 [1,1,0,0,0,0|2,0,0]=4 4821 B13R1.14 OCC(O)CNc1ccc(cc1)Cl 34a_100000210052_100011219619 [1,1,0,0,0,0|2,0,0]=4 4822 B13R1.14 OCC(O)COc1ccc(cc1)Cl 34a_100000210216_100011219619 [1,1,0,0,0,0|2,0,0]=4 4823 B13R1.14 OCC(O)COc1ccc(cc1)Cl 7a_100000210216_100011219619 [1,1,0,0,0,0|2,0,0]=4 4824 B13R1.14 OCC(O)CSc1ccc(cc1)Cl 62a_100000755918_100011219619 [1,1,0,0,0,0|2,0,0]=4 4825 B13R1.14 OCC(O)CSc1ccc(cc1)Cl 62a_100011219619_100000755918 [1,1,0,0,0,0|2,0,0]=4 4826 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Cl 2230a_100000210052_100009815848 [1,1,0,0,0,0|2,0,0]=4 4827 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Cl 34a_100000210052_100009815848 [1,1,0,0,0,0|2,0,0]=4 4828 B13R1.14 OC[C@H](O)COc1ccc(cc1)Cl 34a_100000210216_100009815848 [1,1,0,0,0,0|2,0,0]=4 4829 B13R1.14 OC[C@H](O)COc1ccc(cc1)Cl 7a_100000210216_100009815848 [1,1,0,0,0,0|2,0,0]=4 4830 B13R1.14 OC[C@H](O)CSc1ccc(cc1)Cl 62a_100000755918_100009815848 [1,1,0,0,0,0|2,0,0]=4 4831 B13R1.14 OC[C@H](O)CSc1ccc(cc1)Cl 62a_100009815848_100000755918 [1,1,0,0,0,0|2,0,0]=4 4832 B13R1.19 CC(CCO)Nc1ccc(cc1)Cl 2230a_100000210052_100009893172 [1,1,0,0,0,0|2,0,0]=4 4833 B13R1.19 CC(CCO)Nc1ccc(cc1)Cl 34a_100000210052_100009893172 [1,1,0,0,0,0|2,0,0]=4 4834 B13R1.19 CC(CCO)Oc1ccc(cc1)Cl 34a_100000210216_100009893172 [1,1,0,0,0,0|2,0,0]=4 4835 B13R1.19 CC(CCO)Oc1ccc(cc1)Cl 7a_100000210216_100009893172 [1,1,0,0,0,0|2,0,0]=4 4836 B13R1.19 CC(CCO)Sc1ccc(cc1)Cl 62a_100000755918_100009893172 [1,1,0,0,0,0|2,0,0]=4 4837 B13R1.19 CC(CCO)Sc1ccc(cc1)Cl 62a_100009893172_100000755918 [1,1,0,0,0,0|2,0,0]=4 4838 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210303 [1,1,0,0,0,0|1,0,1]=4 4839 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 2230a_100000747261_100000694040 [1,1,0,0,0,0|1,0,1]=4 4840 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 2230a_100020603295_200000210301 [1,1,0,0,0,0|1,0,1]=4 4841 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000210303 [1,1,0,0,0,0|1,0,1]=4 4842 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 269982a_100000747261_100000187161 [1,1,0,0,0,0|1,0,1]=4 4843 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 269982a_100020603295_200000210301 [1,1,0,0,0,0|1,0,1]=4 4844 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 270004a_100000747261_100000189385 [1,1,0,0,0,0|1,0,1]=4 4845 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100000210303 [1,1,0,0,0,0|1,0,1]=4 4846 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl 34a_100020603295_200000210301 [1,1,0,0,0,0|1,0,1]=4 4847 B13R1.19 CCCN([13CH3])Cc1ccc(cc1)Cl 2230a_100020603295_200025704644 [1,1,0,0,0,0|1,0,1]=4 4848 B13R1.19 CCCN([13CH3])Cc1ccc(cc1)Cl 269982a_100020603295_200025704644 [1,1,0,0,0,0|1,0,1]=4 4849 B13R1.19 CCCN([13CH3])Cc1ccc(cc1)Cl 34a_100020603295_200025704644 [1,1,0,0,0,0|1,0,1]=4 4850 B13R1.19 CN(CCF)Cc1ccc(cc1)Cl 2230a_100000184517_100011217306 [1,1,0,0,0,0|1,0,1]=4 4851 B13R1.19 CN(CCF)Cc1ccc(cc1)Cl 269982a_100000184517_100011217306 [1,1,0,0,0,0|1,0,1]=4 4852 B13R1.19 CN(CCF)Cc1ccc(cc1)Cl 34a_100000184517_100011217306 [1,1,0,0,0,0|1,0,1]=4 4853 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 2230a_100000180866_100000211926 [1,1,0,0,0,0|0,1,1]=4 4854 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 2230a_100000186819_200000210301 [1,1,0,0,0,0|0,1,1]=4 4855 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 2230a_100000210263_100011217064 [1,1,0,0,0,0|0,1,1]=4 4856 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 269982a_100000180866_100000211926 [1,1,0,0,0,0|0,1,1]=4 4857 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 269982a_100000186819_200000210301 [1,1,0,0,0,0|0,1,1]=4 4858 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 269982a_100000210263_100011217064 [1,1,0,0,0,0|0,1,1]=4 4859 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 26a_100000210263_100000185759 [1,1,0,0,0,0|0,1,1]=4 4860 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 270004a_100000210263_100000186029 [1,1,0,0,0,0|0,1,1]=4 4861 B13R1.19 CN(CCO)Cc1ccc(cc1)Br 34a_100000186819_200000210301 [1,1,0,0,0,0|0,1,1]=4 4862 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 2230a_100000184517_100000211926 [1,1,0,0,0,0|0,0,1]=3 4863 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 2230a_100000210263_100000694040 [1,1,0,0,0,0|0,0,1]=3 4864 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 269982a_100000184517_100000211926 [1,1,0,0,0,0|0,0,1]=3 4865 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 269982a_100000210263_100000187161 [1,1,0,0,0,0|0,0,1]=3 4866 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 270004a_100000210263_100000189385 [1,1,0,0,0,0|0,0,1]=3 4867 B13R1.19 CN(CCO)Cc1ccc(cc1)Cl 34a_100000184517_100000211926 [1,1,0,0,0,0|0,0,1]=3 4868 B13R1.19 CN(CCO)Cc1ccc(cc1)F 2230a_100000184576_100000211926 [1,1,0,0,0,0|0,1,1]=4 4869 B13R1.19 CN(CCO)Cc1ccc(cc1)F 2230a_100000210263_100000198546 [1,1,0,0,0,0|0,1,1]=4 4870 B13R1.19 CN(CCO)Cc1ccc(cc1)F 2230a_100015183715_200000210301 [1,1,0,0,0,0|0,1,1]=4 4871 B13R1.19 CN(CCO)Cc1ccc(cc1)F 269982a_100000184576_100000211926 [1,1,0,0,0,0|0,1,1]=4 4872 B13R1.19 CN(CCO)Cc1ccc(cc1)F 269982a_100000210263_100000198546 [1,1,0,0,0,0|0,1,1]=4 4873 B13R1.19 CN(CCO)Cc1ccc(cc1)F 269982a_100015183715_200000210301 [1,1,0,0,0,0|0,1,1]=4 4874 B13R1.19 CN(CCO)Cc1ccc(cc1)F 270004a_100000210263_100000210084 [1,1,0,0,0,0|0,1,1]=4 4875 B13R1.19 CN(CCO)Cc1ccc(cc1)F 34a_100000184576_100000211926 [1,1,0,0,0,0|0,1,1]=4 4876 B13R1.19 CN(CCO)Cc1ccc(cc1)F 34a_100015183715_200000210301 [1,1,0,0,0,0|0,1,1]=4 4877 B13R1.19 CN(CCO)Cc1ccc(cc1)I 2230a_100000210263_100000189116 [1,1,0,0,0,0|0,1,1]=4 4878 B13R1.19 CN(CCO)Cc1ccc(cc1)I 269982a_100000210263_100000189116 [1,1,0,0,0,0|0,1,1]=4 4879 B13R1.19 CN(CCO)Cc1ccc(cc1)O 2230a_100000207500_100000211926 [1,1,0,0,0,0|1,0,1]=4 4880 B13R1.19 CN(CCO)Cc1ccc(cc1)O 269982a_100000207500_100000211926 [1,1,0,0,0,0|1,0,1]=4 4881 B13R1.19 CN(CCO)Cc1ccc(cn1)Cl 2230a_100000210263_100012066911 [1,1,0,0,0,0|1,0,1]=4 4882 B13R1.19 CN(CCO)Cc1ccc(cn1)Cl 269982a_100000210263_100000697101 [1,1,0,0,0,0|1,0,1]=4 4883 B13R1.19 CN(CCO)Cc1ccc(cn1)Cl 270004a_100000210263_100011361569 [1,1,0,0,0,0|1,0,1]=4 4884 B13R1.19 CN(CCO)Cc1ccc(nc1)Cl 2230a_100000026953_100000211926 [1,1,0,0,0,0|1,0,1]=4 4885 B13R1.19 CN(CCO)Cc1ccc(nc1)Cl 2230a_100000210263_100000735431 [1,1,0,0,0,0|1,0,1]=4 4886 B13R1.19 CN(CCO)Cc1ccc(nc1)Cl 269982a_100000026953_100000211926 [1,1,0,0,0,0|1,0,1]=4 4887 B13R1.19 CN(CCO)Cc1ccc(nc1)Cl 269982a_100000210263_100000735431 [1,1,0,0,0,0|1,0,1]=4 4888 B13R1.19 CN(CCO)Cc1ccc(nc1)Cl 34a_100000026953_100000211926 [1,1,0,0,0,0|1,0,1]=4 4889 B13R1.19 Cc1ccc(cc1)CN(C)CCO 2230a_100000186992_200000210301 [1,1,0,0,0,0|1,0,1]=4 4890 B13R1.19 Cc1ccc(cc1)CN(C)CCO 2230a_100000210263_100000210814 [1,1,0,0,0,0|1,0,1]=4 4891 B13R1.19 Cc1ccc(cc1)CN(C)CCO 2230a_100000744650_100000211926 [1,1,0,0,0,0|1,0,1]=4 4892 B13R1.19 Cc1ccc(cc1)CN(C)CCO 269982a_100000186992_200000210301 [1,1,0,0,0,0|1,0,1]=4 4893 B13R1.19 Cc1ccc(cc1)CN(C)CCO 269982a_100000210263_100000210814 [1,1,0,0,0,0|1,0,1]=4 4894 B13R1.19 Cc1ccc(cc1)CN(C)CCO 269982a_100000744650_100000211926 [1,1,0,0,0,0|1,0,1]=4 4895 B13R1.19 Cc1ccc(cc1)CN(C)CCO 26a_100000210263_200020625495 [1,1,0,0,0,0|1,0,1]=4 4896 B13R1.19 Cc1ccc(cc1)CN(C)CCO 270004a_100000210263_100000211033 [1,1,0,0,0,0|1,0,1]=4 4897 B13R1.19 Cc1ccc(cc1)CN(C)CCO 34a_100000186992_200000210301 [1,1,0,0,0,0|1,0,1]=4 4898 B13R1.19 Cc1ccc(cc1)CN(C)CCO 34a_100000744650_100000211926 [1,1,0,0,0,0|1,0,1]=4 4899 B13R1.19 Cc1ccc(cc1)CN([13CH3])CCO 2230a_100000186992_200025704644 [1,1,0,0,0,0|1,0,1]=4 4900 B13R1.19 Cc1ccc(cc1)CN([13CH3])CCO 269982a_100000186992_200025704644 [1,1,0,0,0,0|1,0,1]=4 4901 B13R1.19 Cc1ccc(cc1)CN([13CH3])CCO 34a_100000186992_200025704644 [1,1,0,0,0,0|1,0,1]=4 4902 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000211926 [1,1,0,0,0,0|1,0,1]=4 4903 B13R1.19 O=C(CCO)Cc1ccc(cc1)Cl 1458a_100011216618_100000694040 [1,1,0,0,0,0|1,0,1]=4 4904 B13R1.19 O=C(CCO)Nc1ccc(cc1)Cl 22a_100000210052_100011216618 [1,1,0,0,0,0|2,0,0]=4 4905 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)Br 2230a_100000186819_200025704644 [1,1,0,0,0,0|0,1,1]=4 4906 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)Br 269982a_100000186819_200025704644 [1,1,0,0,0,0|0,1,1]=4 4907 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)Br 34a_100000186819_200025704644 [1,1,0,0,0,0|0,1,1]=4 4908 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)F 2230a_100015183715_200025704644 [1,1,0,0,0,0|0,1,1]=4 4909 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)F 269982a_100015183715_200025704644 [1,1,0,0,0,0|0,1,1]=4 4910 B13R1.19 [13CH3]N(CCO)Cc1ccc(cc1)F 34a_100015183715_200025704644 [1,1,0,0,0,0|0,1,1]=4 4911 B13R1.369 CCCC=Cc1ccc(cc1Br)Cl 271570a_100016258520_100011219703 [1,1,0,0,0,0|2,0,0]=4 4912 B13R1.369 CCCC=Cc1ccc(cc1C)Cl 271570a_100016258520_100011219607 [1,1,0,0,0,0|2,0,0]=4 4913 B13R1.369 CCCC=Cc1ccc(cc1Cl)Cl 271570a_100016258520_100000699841 [1,1,0,0,0,0|2,0,0]=4 4914 B13R1.369 CCCC=Cc1ccc(cc1F)Cl 271570a_100016258520_100011216042 [1,1,0,0,0,0|2,0,0]=4 4915 B13R1.369 CCCC=Cc1ccc(cc1N)Cl 271570a_100016258520_100000761886 [1,1,0,0,0,0|2,0,0]=4 4916 B13R1.369 CCCC=Cc1ccc(cc1O)Cl 271570a_100016258520_100000050036 [1,1,0,0,0,0|2,0,0]=4 4917 B13R1.369 CCCNCc1ccc(cc1Br)Cl 207a_100020643023_100000687667 [1,1,0,0,0,0|1,0,1]=4 4918 B13R1.369 CCCNCc1ccc(cc1Br)Cl 270004a_100020643023_100000687667 [1,1,0,0,0,0|1,0,1]=4 4919 B13R1.369 CCCNCc1ccc(cc1Br)Cl 34a_100102692131_100000210303 [1,1,0,0,0,0|1,0,1]=4 4920 B13R1.369 CCCNCc1ccc(cc1C)Cl 207a_100020643023_100000766358 [1,1,0,0,0,0|1,0,1]=4 4921 B13R1.369 CCCNCc1ccc(cc1C)Cl 270004a_100020643023_100000766358 [1,1,0,0,0,0|1,0,1]=4 4922 B13R1.369 CCCNCc1ccc(cc1C)Cl 34a_103436540063_100000210303 [1,1,0,0,0,0|1,0,1]=4 4923 B13R1.369 CCCNCc1ccc(cc1Cl)Cl 207a_100020643023_100000188887 [1,1,0,0,0,0|1,0,1]=4 4924 B13R1.369 CCCNCc1ccc(cc1Cl)Cl 270004a_100020643023_100000188887 [1,1,0,0,0,0|1,0,1]=4 4925 B13R1.369 CCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100000210303 [1,1,0,0,0,0|1,0,1]=4 4926 B13R1.369 CCCNCc1ccc(cc1F)Cl 207a_100020643023_100000697372 [1,1,0,0,0,0|1,0,1]=4 4927 B13R1.369 CCCNCc1ccc(cc1F)Cl 270004a_100020643023_100000697372 [1,1,0,0,0,0|1,0,1]=4 4928 B13R1.369 CCCNCc1ccc(cc1F)Cl 34a_100000708496_100000210303 [1,1,0,0,0,0|1,0,1]=4 4929 B13R1.369 Cc1cc(ccc1CNCCF)Cl 34a_100000724931_100012361307 [1,1,0,0,0,0|1,0,1]=4 4930 B13R1.369 Cc1cc(ccc1CNCCF)Cl 34a_103436540063_100011217306 [1,1,0,0,0,0|1,0,1]=4 4931 B13R1.369 Cc1cc(ccc1CNCCO)Br 207a_100000210304_100000687586 [1,1,0,0,0,0|0,1,1]=4 4932 B13R1.369 Cc1cc(ccc1CNCCO)Br 2230a_100016997473_100000708836 [1,1,0,0,0,0|0,1,1]=4 4933 B13R1.369 Cc1cc(ccc1CNCCO)Br 270004a_100000210304_100000687586 [1,1,0,0,0,0|0,1,1]=4 4934 B13R1.369 Cc1cc(ccc1CNCCO)Br 34a_100000753881_100000211926 [1,1,0,0,0,0|0,1,1]=4 4935 B13R1.369 Cc1cc(ccc1CNCCO)Br 34a_100016990907_100000708836 [1,1,0,0,0,0|0,1,1]=4 4936 B13R1.369 Cc1cc(ccc1CNCCO)Cl 207a_100000210304_100000766358 [1,1,0,0,0,0|0,0,1]=3 4937 B13R1.369 Cc1cc(ccc1CNCCO)Cl 2230a_100016997473_100012361307 [1,1,0,0,0,0|0,0,1]=3 4938 B13R1.369 Cc1cc(ccc1CNCCO)Cl 270004a_100000210304_100000766358 [1,1,0,0,0,0|0,0,1]=3 4939 B13R1.369 Cc1cc(ccc1CNCCO)Cl 34a_100016990907_100012361307 [1,1,0,0,0,0|0,0,1]=3 4940 B13R1.369 Cc1cc(ccc1CNCCO)Cl 34a_103436540063_100000211926 [1,1,0,0,0,0|0,0,1]=3 4941 B13R1.369 Cc1cc(ccc1CNCCO)F 207a_100000210304_100000745986 [1,1,0,0,0,0|0,1,1]=4 4942 B13R1.369 Cc1cc(ccc1CNCCO)F 2230a_100016997473_100000700533 [1,1,0,0,0,0|0,1,1]=4 4943 B13R1.369 Cc1cc(ccc1CNCCO)F 270004a_100000210304_100000745986 [1,1,0,0,0,0|0,1,1]=4 4944 B13R1.369 Cc1cc(ccc1CNCCO)F 34a_100016990907_100000700533 [1,1,0,0,0,0|0,1,1]=4 4945 B13R1.369 Cc1cc(ccc1CNCCO)F 34a_100137329023_100000211926 [1,1,0,0,0,0|0,1,1]=4 4946 B13R1.369 Cc1cc(ccc1COCCO)Cl 34a_100000702939_100000211926 [1,1,0,0,0,0|1,0,1]=4 4947 B13R1.369 Cc1cc(ccc1COCCO)Cl 7a_100000702939_100000211926 [1,1,0,0,0,0|1,0,1]=4 4948 B13R1.369 Cc1cc(ccc1CSCCO)Cl 62a_100000211926_100012361307 [1,1,0,0,0,0|1,0,1]=4 4949 B13R1.369 Cc1cc(ccc1CSCCO)Cl 62a_100012361307_100000211926 [1,1,0,0,0,0|1,0,1]=4 4950 B13R1.369 Cc1cc(ccc1NCCCO)Cl 34a_100000210418_100000230001 [1,1,0,0,0,0|2,0,0]=4 4951 B13R1.369 Cc1cc(ccc1NCCCO)Cl 7a_100000210418_100011215043 [1,1,0,0,0,0|2,0,0]=4 4952 B13R1.369 Cc1cc(ccc1OCCCO)Cl 34a_100000211091_100000230001 [1,1,0,0,0,0|2,0,0]=4 4953 B13R1.369 Cc1cc(ccc1OCCCO)Cl 7a_100000211091_100011215043 [1,1,0,0,0,0|2,0,0]=4 4954 B13R1.369 Cc1cc(ccc1SCCCO)Cl 62a_100011215043_100011219607 [1,1,0,0,0,0|2,0,0]=4 4955 B13R1.369 Cc1cc(ccc1SCCCO)Cl 62a_100011219607_100011215043 [1,1,0,0,0,0|2,0,0]=4 4956 B13R1.369 Cc1cc(cnc1CNCCO)Cl 207a_100000210304_200009887756 [1,1,0,0,0,0|1,0,1]=4 4957 B13R1.369 Cc1cc(cnc1CNCCO)Cl 270004a_100000210304_200009887756 [1,1,0,0,0,0|1,0,1]=4 4958 B13R1.369 Cc1ccc(c(c1)Br)CNCCO 207a_100000210304_100000692596 [1,1,0,0,0,0|1,0,1]=4 4959 B13R1.369 Cc1ccc(c(c1)Br)CNCCO 270004a_100000210304_100000692596 [1,1,0,0,0,0|1,0,1]=4 4960 B13R1.369 Cc1ccc(c(c1)C)CNCCO 207a_100000210304_100000211342 [1,1,0,0,0,0|1,0,1]=4 4961 B13R1.369 Cc1ccc(c(c1)C)CNCCO 2230a_100016997473_100011219618 [1,1,0,0,0,0|1,0,1]=4 4962 B13R1.369 Cc1ccc(c(c1)C)CNCCO 270004a_100000210304_100000211342 [1,1,0,0,0,0|1,0,1]=4 4963 B13R1.369 Cc1ccc(c(c1)C)CNCCO 34a_100000737523_100000211926 [1,1,0,0,0,0|1,0,1]=4 4964 B13R1.369 Cc1ccc(c(c1)C)CNCCO 34a_100016990907_100011219618 [1,1,0,0,0,0|1,0,1]=4 4965 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 207a_100000210304_100011935181 [1,1,0,0,0,0|1,0,1]=4 4966 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 2230a_100016997473_100012349684 [1,1,0,0,0,0|1,0,1]=4 4967 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 270004a_100000210304_100011935181 [1,1,0,0,0,0|1,0,1]=4 4968 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 34a_100011997539_100000211926 [1,1,0,0,0,0|1,0,1]=4 4969 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 34a_100016990907_100012349684 [1,1,0,0,0,0|1,0,1]=4 4970 B13R1.369 Cc1ccc(c(c1)F)CNCCO 207a_100000210304_100011217368 [1,1,0,0,0,0|1,0,1]=4 4971 B13R1.369 Cc1ccc(c(c1)F)CNCCO 2230a_100016997473_100011217900 [1,1,0,0,0,0|1,0,1]=4 4972 B13R1.369 Cc1ccc(c(c1)F)CNCCO 270004a_100000210304_100011217368 [1,1,0,0,0,0|1,0,1]=4 4973 B13R1.369 Cc1ccc(c(c1)F)CNCCO 34a_100016990907_100012002367 [1,1,0,0,0,0|1,0,1]=4 4974 B13R1.369 Cc1ccc(c(c1)F)CNCCO 34a_100102887089_100000211926 [1,1,0,0,0,0|1,0,1]=4 4975 B13R1.369 Cc1ccc(c(c1)I)CNCCO 207a_100000210304_100010150104 [1,1,0,0,0,0|1,0,1]=4 4976 B13R1.369 Cc1ccc(c(c1)I)CNCCO 270004a_100000210304_100010150104 [1,1,0,0,0,0|1,0,1]=4 4977 B13R1.369 FCCNCc1ccc(cc1Br)Cl 34a_100000724931_100000755608 [1,1,0,0,0,0|1,0,1]=4 4978 B13R1.369 FCCNCc1ccc(cc1Br)Cl 34a_100102692131_100011217306 [1,1,0,0,0,0|1,0,1]=4 4979 B13R1.369 FCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100011217306 [1,1,0,0,0,0|1,0,1]=4 4980 B13R1.369 FCCNCc1ccc(cc1Cl)Cl 34a_100000724931_100000188473 [1,1,0,0,0,0|1,0,1]=4 4981 B13R1.369 FCCNCc1ccc(cc1F)Cl 34a_100000708496_100011217306 [1,1,0,0,0,0|1,0,1]=4 4982 B13R1.369 FCCNCc1ccc(cc1F)Cl 34a_100000724931_100000709361 [1,1,0,0,0,0|1,0,1]=4 4983 B13R1.369 FCCNCc1ccc(cc1I)Cl 34a_100000724931_100010254388 [1,1,0,0,0,0|1,0,1]=4 4984 B13R1.369 Nc1cc(ccc1COCCO)Cl 34a_100000238622_100000211926 [1,1,0,0,0,0|1,0,1]=4 4985 B13R1.369 Nc1cc(ccc1COCCO)Cl 7a_100000238622_100000211926 [1,1,0,0,0,0|1,0,1]=4 4986 B13R1.369 Nc1cc(ccc1OCCCO)Cl 34a_100000210500_100000230001 [1,1,0,0,0,0|2,0,0]=4 4987 B13R1.369 Nc1cc(ccc1OCCCO)Cl 7a_100000210500_100011215043 [1,1,0,0,0,0|2,0,0]=4 4988 B13R1.369 Nc1cc(ccc1SCCCO)Cl 62a_100000761886_100011215043 [1,1,0,0,0,0|2,0,0]=4 4989 B13R1.369 Nc1cc(ccc1SCCCO)Cl 62a_100011215043_100000761886 [1,1,0,0,0,0|2,0,0]=4 4990 B13R1.369 OCCCNc1ccc(cc1Br)Cl 34a_100000752454_100000230001 [1,1,0,0,0,0|2,0,0]=4 4991 B13R1.369 OCCCNc1ccc(cc1Cl)Cl 34a_100000185861_100000230001 [1,1,0,0,0,0|2,0,0]=4 4992 B13R1.369 OCCCNc1ccc(cc1F)Cl 34a_100000211020_100000230001 [1,1,0,0,0,0|2,0,0]=4 4993 B13R1.369 OCCCNc1ccc(cc1I)Cl 34a_100000761889_100000230001 [1,1,0,0,0,0|2,0,0]=4 4994 B13R1.369 OCCCNc1ccc(cc1O)Cl 34a_100000185728_100000230001 [1,1,0,0,0,0|2,0,0]=4 4995 B13R1.369 OCCCOc1ccc(cc1Br)Cl 34a_100000211998_100000230001 [1,1,0,0,0,0|2,0,0]=4 4996 B13R1.369 OCCCOc1ccc(cc1Br)Cl 7a_100000211998_100011215043 [1,1,0,0,0,0|2,0,0]=4 4997 B13R1.369 OCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000230001 [1,1,0,0,0,0|2,0,0]=4 4998 B13R1.369 OCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011215043 [1,1,0,0,0,0|2,0,0]=4 4999 B13R1.369 OCCCOc1ccc(cc1F)Cl 34a_100000230166_100000230001 [1,1,0,0,0,0|2,0,0]=4 5000 B13R1.369 OCCCOc1ccc(cc1F)Cl 7a_100000230166_100011215043 [1,1,0,0,0,0|2,0,0]=4 5001 B13R1.369 OCCCOc1ccc(cc1I)Cl 34a_100011356953_100000230001 [1,1,0,0,0,0|2,0,0]=4 5002 B13R1.369 OCCCOc1ccc(cc1I)Cl 7a_100011356953_100011215043 [1,1,0,0,0,0|2,0,0]=4 5003 B13R1.369 OCCCSc1ccc(cc1Br)Cl 62a_100011215043_100011219703 [1,1,0,0,0,0|2,0,0]=4 5004 B13R1.369 OCCCSc1ccc(cc1Br)Cl 62a_100011219703_100011215043 [1,1,0,0,0,0|2,0,0]=4 5005 B13R1.369 OCCCSc1ccc(cc1Cl)Cl 62a_100000699841_100011215043 [1,1,0,0,0,0|2,0,0]=4 5006 B13R1.369 OCCCSc1ccc(cc1Cl)Cl 62a_100011215043_100000699841 [1,1,0,0,0,0|2,0,0]=4 5007 B13R1.369 OCCCSc1ccc(cc1F)Cl 62a_100011215043_100011216042 [1,1,0,0,0,0|2,0,0]=4 5008 B13R1.369 OCCCSc1ccc(cc1F)Cl 62a_100011216042_100011215043 [1,1,0,0,0,0|2,0,0]=4 5009 B13R1.369 OCCCSc1ccc(cc1O)Cl 62a_100000050036_100011215043 [1,1,0,0,0,0|2,0,0]=4 5010 B13R1.369 OCCCSc1ccc(cc1O)Cl 62a_100011215043_100000050036 [1,1,0,0,0,0|2,0,0]=4 5011 B13R1.369 OCCNCc1ccc(cc1Br)Br 207a_100000210304_100012351556 [1,1,0,0,0,0|0,1,1]=4 5012 B13R1.369 OCCNCc1ccc(cc1Br)Br 2230a_100016997473_200012351560 [1,1,0,0,0,0|0,1,1]=4 5013 B13R1.369 OCCNCc1ccc(cc1Br)Br 270004a_100000210304_100012351556 [1,1,0,0,0,0|0,1,1]=4 5014 B13R1.369 OCCNCc1ccc(cc1Br)Br 34a_100016990907_200012351560 [1,1,0,0,0,0|0,1,1]=4 5015 B13R1.369 OCCNCc1ccc(cc1Br)Cl 207a_100000210304_100000687667 [1,1,0,0,0,0|0,0,1]=3 5016 B13R1.369 OCCNCc1ccc(cc1Br)Cl 2230a_100016997473_100000755608 [1,1,0,0,0,0|0,0,1]=3 5017 B13R1.369 OCCNCc1ccc(cc1Br)Cl 270004a_100000210304_100000687667 [1,1,0,0,0,0|0,0,1]=3 5018 B13R1.369 OCCNCc1ccc(cc1Br)Cl 34a_100016990907_100000755608 [1,1,0,0,0,0|0,0,1]=3 5019 B13R1.369 OCCNCc1ccc(cc1Br)Cl 34a_100102692131_100000211926 [1,1,0,0,0,0|0,0,1]=3 5020 B13R1.369 OCCNCc1ccc(cc1Br)F 207a_100000210304_100000685661 [1,1,0,0,0,0|0,1,1]=4 5021 B13R1.369 OCCNCc1ccc(cc1Br)F 2230a_100016997473_100000243222 [1,1,0,0,0,0|0,1,1]=4 5022 B13R1.369 OCCNCc1ccc(cc1Br)F 270004a_100000210304_100000685661 [1,1,0,0,0,0|0,1,1]=4 5023 B13R1.369 OCCNCc1ccc(cc1Br)F 34a_100000708791_100000211926 [1,1,0,0,0,0|0,1,1]=4 5024 B13R1.369 OCCNCc1ccc(cc1Br)F 34a_100016990907_100000243222 [1,1,0,0,0,0|0,1,1]=4 5025 B13R1.369 OCCNCc1ccc(cc1Br)I 207a_100000210304_100010185650 [1,1,0,0,0,0|0,1,1]=4 5026 B13R1.369 OCCNCc1ccc(cc1Br)I 2230a_100016997473_100010146610 [1,1,0,0,0,0|0,1,1]=4 5027 B13R1.369 OCCNCc1ccc(cc1Br)I 34a_100016990907_100010146610 [1,1,0,0,0,0|0,1,1]=4 5028 B13R1.369 OCCNCc1ccc(cc1Cl)Br 207a_100000210304_100000764164 [1,1,0,0,0,0|0,1,1]=4 5029 B13R1.369 OCCNCc1ccc(cc1Cl)Br 2230a_100016997473_100011740631 [1,1,0,0,0,0|0,1,1]=4 5030 B13R1.369 OCCNCc1ccc(cc1Cl)Br 270004a_100000210304_100000764164 [1,1,0,0,0,0|0,1,1]=4 5031 B13R1.369 OCCNCc1ccc(cc1Cl)Br 34a_100016990907_100011740631 [1,1,0,0,0,0|0,1,1]=4 5032 B13R1.369 OCCNCc1ccc(cc1Cl)Br 34a_100020628970_100000211926 [1,1,0,0,0,0|0,1,1]=4 5033 B13R1.369 OCCNCc1ccc(cc1Cl)Cl 207a_100000210304_100000188887 [1,1,0,0,0,0|0,0,1]=3 5034 B13R1.369 OCCNCc1ccc(cc1Cl)Cl 2230a_100016997473_100000188473 [1,1,0,0,0,0|0,0,1]=3 5035 B13R1.369 OCCNCc1ccc(cc1Cl)Cl 270004a_100000210304_100000188887 [1,1,0,0,0,0|0,0,1]=3 5036 B13R1.369 OCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100000211926 [1,1,0,0,0,0|0,0,1]=3 5037 B13R1.369 OCCNCc1ccc(cc1Cl)Cl 34a_100016990907_100000188473 [1,1,0,0,0,0|0,0,1]=3 5038 B13R1.369 OCCNCc1ccc(cc1Cl)F 207a_100000210304_100000752949 [1,1,0,0,0,0|0,1,1]=4 5039 B13R1.369 OCCNCc1ccc(cc1Cl)F 2230a_100016997473_100011216360 [1,1,0,0,0,0|0,1,1]=4 5040 B13R1.369 OCCNCc1ccc(cc1Cl)F 270004a_100000210304_100000752949 [1,1,0,0,0,0|0,1,1]=4 5041 B13R1.369 OCCNCc1ccc(cc1Cl)F 34a_100000174946_100000211926 [1,1,0,0,0,0|0,1,1]=4 5042 B13R1.369 OCCNCc1ccc(cc1Cl)F 34a_100016990907_100011216360 [1,1,0,0,0,0|0,1,1]=4 5043 B13R1.369 OCCNCc1ccc(cc1Cl)I 207a_100000210304_100000727542 [1,1,0,0,0,0|0,1,1]=4 5044 B13R1.369 OCCNCc1ccc(cc1Cl)O 34a_200161156549_100000211926 [1,1,0,0,0,0|1,0,1]=4 5045 B13R1.369 OCCNCc1ccc(cc1F)Br 207a_100000210304_100000211676 [1,1,0,0,0,0|0,1,1]=4 5046 B13R1.369 OCCNCc1ccc(cc1F)Br 2230a_100016997473_100000211606 [1,1,0,0,0,0|0,1,1]=4 5047 B13R1.369 OCCNCc1ccc(cc1F)Br 270004a_100000210304_100000211676 [1,1,0,0,0,0|0,1,1]=4 5048 B13R1.369 OCCNCc1ccc(cc1F)Br 34a_100000754580_100000211926 [1,1,0,0,0,0|0,1,1]=4 5049 B13R1.369 OCCNCc1ccc(cc1F)Br 34a_100016990907_100000211606 [1,1,0,0,0,0|0,1,1]=4 5050 B13R1.369 OCCNCc1ccc(cc1F)Cl 207a_100000210304_100000697372 [1,1,0,0,0,0|0,0,1]=3 5051 B13R1.369 OCCNCc1ccc(cc1F)Cl 2230a_100016997473_100000709361 [1,1,0,0,0,0|0,0,1]=3 5052 B13R1.369 OCCNCc1ccc(cc1F)Cl 270004a_100000210304_100000697372 [1,1,0,0,0,0|0,0,1]=3 5053 B13R1.369 OCCNCc1ccc(cc1F)Cl 34a_100000708496_100000211926 [1,1,0,0,0,0|0,0,1]=3 5054 B13R1.369 OCCNCc1ccc(cc1F)Cl 34a_100016990907_100000709361 [1,1,0,0,0,0|0,0,1]=3 5055 B13R1.369 OCCNCc1ccc(cc1F)F 207a_100000210304_100000211964 [1,1,0,0,0,0|0,1,1]=4 5056 B13R1.369 OCCNCc1ccc(cc1F)F 2230a_100016997473_100000748237 [1,1,0,0,0,0|0,1,1]=4 5057 B13R1.369 OCCNCc1ccc(cc1F)F 270004a_100000210304_100000211964 [1,1,0,0,0,0|0,1,1]=4 5058 B13R1.369 OCCNCc1ccc(cc1F)F 34a_100000737868_100000211926 [1,1,0,0,0,0|0,1,1]=4 5059 B13R1.369 OCCNCc1ccc(cc1F)F 34a_100016990907_100000748237 [1,1,0,0,0,0|0,1,1]=4 5060 B13R1.369 OCCNCc1ccc(cc1F)I 207a_100000210304_100000050965 [1,1,0,0,0,0|0,1,1]=4 5061 B13R1.369 OCCNCc1ccc(cc1F)I 2230a_100016997473_100010244991 [1,1,0,0,0,0|0,1,1]=4 5062 B13R1.369 OCCNCc1ccc(cc1F)I 34a_100016990907_100010244991 [1,1,0,0,0,0|0,1,1]=4 5063 B13R1.369 OCCNCc1ccc(cc1I)Br 207a_100000210304_100010146562 [1,1,0,0,0,0|0,1,1]=4 5064 B13R1.369 OCCNCc1ccc(cc1I)Br 2230a_100016997473_100010146615 [1,1,0,0,0,0|0,1,1]=4 5065 B13R1.369 OCCNCc1ccc(cc1I)Br 270004a_100000210304_100010146562 [1,1,0,0,0,0|0,1,1]=4 5066 B13R1.369 OCCNCc1ccc(cc1I)Br 34a_100016990907_100010146615 [1,1,0,0,0,0|0,1,1]=4 5067 B13R1.369 OCCNCc1ccc(cc1I)Cl 2230a_100016997473_100010254388 [1,1,0,0,0,0|0,0,1]=3 5068 B13R1.369 OCCNCc1ccc(cc1I)Cl 34a_100016990907_100010254388 [1,1,0,0,0,0|0,0,1]=3 5069 B13R1.369 OCCNCc1ccc(cc1I)F 207a_100000210304_100010254405 [1,1,0,0,0,0|0,1,1]=4 5070 B13R1.369 OCCNCc1ccc(cc1I)F 2230a_100016997473_100012354799 [1,1,0,0,0,0|0,1,1]=4 5071 B13R1.369 OCCNCc1ccc(cc1I)F 34a_100016990907_100012354799 [1,1,0,0,0,0|0,1,1]=4 5072 B13R1.369 OCCNCc1ccc(nc1Cl)Cl 2230a_100016997473_100000722033 [1,1,0,0,0,0|1,0,1]=4 5073 B13R1.369 OCCNCc1ccc(nc1Cl)Cl 34a_100016990907_100000722033 [1,1,0,0,0,0|1,0,1]=4 5074 B13R1.369 OCCNCc1cnc(cc1Br)Cl 270004a_100000210304_100009892795 [1,1,0,0,0,0|1,0,1]=4 5075 B13R1.369 OCCNCc1cnc(cc1Cl)Cl 2230a_100016997473_100011997056 [1,1,0,0,0,0|1,0,1]=4 5076 B13R1.369 OCCNCc1cnc(cc1Cl)Cl 34a_100016990907_100011997056 [1,1,0,0,0,0|1,0,1]=4 5077 B13R1.369 OCCNCc1ncc(cc1Br)Cl 207a_100000210304_100010064872 [1,1,0,0,0,0|1,0,1]=4 5078 B13R1.369 OCCNCc1ncc(cc1Br)Cl 270004a_100000210304_100010064872 [1,1,0,0,0,0|1,0,1]=4 5079 B13R1.369 OCCNCc1ncc(cc1Cl)Cl 207a_100000210304_100011361609 [1,1,0,0,0,0|1,0,1]=4 5080 B13R1.369 OCCNCc1ncc(cc1Cl)Cl 270004a_100000210304_100011361609 [1,1,0,0,0,0|1,0,1]=4 5081 B13R1.369 OCCNCc1ncc(cc1F)Cl 207a_100000210304_100009858488 [1,1,0,0,0,0|1,0,1]=4 5082 B13R1.369 OCCNCc1ncc(cc1F)Cl 2230a_100016997473_200009879301 [1,1,0,0,0,0|1,0,1]=4 5083 B13R1.369 OCCNCc1ncc(cc1F)Cl 270004a_100000210304_100009858488 [1,1,0,0,0,0|1,0,1]=4 5084 B13R1.369 OCCNCc1ncc(cc1F)Cl 34a_100016990907_200009879301 [1,1,0,0,0,0|1,0,1]=4 5085 B13R1.369 OCCOCc1ccc(cc1Br)Cl 34a_100000707881_100000211926 [1,1,0,0,0,0|1,0,1]=4 5086 B13R1.369 OCCOCc1ccc(cc1Br)Cl 7a_100000707881_100000211926 [1,1,0,0,0,0|1,0,1]=4 5087 B13R1.369 OCCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000211926 [1,1,0,0,0,0|1,0,1]=4 5088 B13R1.369 OCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000211926 [1,1,0,0,0,0|1,0,1]=4 5089 B13R1.369 OCCOCc1ccc(cc1F)Cl 34a_100011217562_100000211926 [1,1,0,0,0,0|1,0,1]=4 5090 B13R1.369 OCCOCc1ccc(cc1F)Cl 7a_100011217562_100000211926 [1,1,0,0,0,0|1,0,1]=4 5091 B13R1.369 OCCOCc1ccc(cc1I)Cl 34a_100000722340_100000211926 [1,1,0,0,0,0|1,0,1]=4 5092 B13R1.369 OCCOCc1ccc(cc1I)Cl 7a_100000722340_100000211926 [1,1,0,0,0,0|1,0,1]=4 5093 B13R1.369 OCCSCc1ccc(cc1Br)Cl 62a_100000211926_100000755608 [1,1,0,0,0,0|1,0,1]=4 5094 B13R1.369 OCCSCc1ccc(cc1Br)Cl 62a_100000755608_100000211926 [1,1,0,0,0,0|1,0,1]=4 5095 B13R1.369 OCCSCc1ccc(cc1Cl)Cl 62a_100000188473_100000211926 [1,1,0,0,0,0|1,0,1]=4 5096 B13R1.369 OCCSCc1ccc(cc1Cl)Cl 62a_100000211926_100000188473 [1,1,0,0,0,0|1,0,1]=4 5097 B13R1.369 OCCSCc1ccc(cc1F)Cl 62a_100000211926_100000709361 [1,1,0,0,0,0|1,0,1]=4 5098 B13R1.369 OCCSCc1ccc(cc1F)Cl 62a_100000709361_100000211926 [1,1,0,0,0,0|1,0,1]=4 5099 B13R1.369 OCCSCc1ccc(cc1I)Cl 62a_100000211926_100010254388 [1,1,0,0,0,0|1,0,1]=4 5100 B13R1.369 OCCSCc1ccc(cc1I)Cl 62a_100010254388_100000211926 [1,1,0,0,0,0|1,0,1]=4 5101 B13R1.371 C#Cc1ccc(cc1)CNCCO 207a_100000210304_100011361452 [1,1,0,0,0,0|1,0,1]=4 5102 B13R1.371 C#Cc1ccc(cc1)CNCCO 2230a_100015199678_100000211926 [1,1,0,0,0,0|1,0,1]=4 5103 B13R1.371 C#Cc1ccc(cc1)CNCCO 2230a_100016997473_100000140223 [1,1,0,0,0,0|1,0,1]=4 5104 B13R1.371 C#Cc1ccc(cc1)CNCCO 270004a_100000210304_100011361452 [1,1,0,0,0,0|1,0,1]=4 5105 B13R1.371 C#Cc1ccc(cc1)CNCCO 34a_100015199678_100000211926 [1,1,0,0,0,0|1,0,1]=4 5106 B13R1.371 C#Cc1ccc(cc1)CNCCO 34a_100016990907_100000140223 [1,1,0,0,0,0|1,0,1]=4 5107 B13R1.371 C=Cc1ccc(cc1)CNCCO 2230a_100016997473_100000034074 [1,1,0,0,0,0|1,0,1]=4 5108 B13R1.371 C=Cc1ccc(cc1)CNCCO 270004a_100000210304_100011361436 [1,1,0,0,0,0|1,0,1]=4 5109 B13R1.371 C=Cc1ccc(cc1)CNCCO 271570a_100011290941_100000186819 [1,1,0,0,0,0|1,0,1]=4 5110 B13R1.371 C=Cc1ccc(cc1)CNCCO 34a_100016990907_100000034074 [1,1,0,0,0,0|1,0,1]=4 5111 B13R1.371 C=Cc1ccc(cc1)CNCCO 34a_200011934891_100000211926 [1,1,0,0,0,0|1,0,1]=4 5112 B13R1.371 CCCNN=C1C=CC(=NCl)C=C1 4a_100000740057_100000088476 [1,1,0,0,0,0|2,0,0]=4 5113 B13R1.371 CCc1ccc(cc1)CNCCO 207a_100000210304_100000211036 [1,1,0,0,0,0|1,0,1]=4 5114 B13R1.371 CCc1ccc(cc1)CNCCO 2230a_100000721222_100000211926 [1,1,0,0,0,0|1,0,1]=4 5115 B13R1.371 CCc1ccc(cc1)CNCCO 2230a_100016997473_100000747183 [1,1,0,0,0,0|1,0,1]=4 5116 B13R1.371 CCc1ccc(cc1)CNCCO 270004a_100000210304_100000211036 [1,1,0,0,0,0|1,0,1]=4 5117 B13R1.371 CCc1ccc(cc1)CNCCO 34a_100000721222_100000211926 [1,1,0,0,0,0|1,0,1]=4 5118 B13R1.371 CCc1ccc(cc1)CNCCO 34a_100016990907_100000747183 [1,1,0,0,0,0|1,0,1]=4 5119 B13R1.371 COc1ccc(cc1)CNCCO 207a_100000210304_100000169835 [1,1,0,0,0,0|1,0,1]=4 5120 B13R1.371 COc1ccc(cc1)CNCCO 2230a_100016997473_100000742318 [1,1,0,0,0,0|1,0,1]=4 5121 B13R1.371 COc1ccc(cc1)CNCCO 270004a_100000210304_100000169835 [1,1,0,0,0,0|1,0,1]=4 5122 B13R1.371 COc1ccc(cc1)CNCCO 34a_100000185587_100000211926 [1,1,0,0,0,0|1,0,1]=4 5123 B13R1.371 COc1ccc(cc1)CNCCO 34a_100016990907_100000742318 [1,1,0,0,0,0|1,0,1]=4 5124 B13R1.371 CSc1ccc(cc1)CNCCO 207a_100000210304_100000211154 [1,1,0,0,0,0|1,0,1]=4 5125 B13R1.371 CSc1ccc(cc1)CNCCO 2230a_100000174980_100000211926 [1,1,0,0,0,0|1,0,1]=4 5126 B13R1.371 CSc1ccc(cc1)CNCCO 2230a_100016997473_100000181263 [1,1,0,0,0,0|1,0,1]=4 5127 B13R1.371 CSc1ccc(cc1)CNCCO 270004a_100000210304_100000211154 [1,1,0,0,0,0|1,0,1]=4 5128 B13R1.371 CSc1ccc(cc1)CNCCO 34a_100000174980_100000211926 [1,1,0,0,0,0|1,0,1]=4 5129 B13R1.371 CSc1ccc(cc1)CNCCO 34a_100016990907_100000181263 [1,1,0,0,0,0|1,0,1]=4 5130 B13R1.371 CSc1ccc(cc1)CNCCO 62a_100000186819_200000210301 [1,1,0,0,0,0|1,0,1]=4 5131 B13R1.371 CSc1ccc(cc1)CNCCO 62a_200000210301_100000186819 [1,1,0,0,0,0|1,0,1]=4 5132 B13R1.371 N#Cc1ccc(cc1)CNCCO 207a_100000210304_100000211122 [1,1,0,0,0,0|1,0,1]=4 5133 B13R1.371 N#Cc1ccc(cc1)CNCCO 2230a_100016997473_100000184898 [1,1,0,0,0,0|1,0,1]=4 5134 B13R1.371 N#Cc1ccc(cc1)CNCCO 270004a_100000210304_100000211122 [1,1,0,0,0,0|1,0,1]=4 5135 B13R1.371 N#Cc1ccc(cc1)CNCCO 34a_100015207190_100000211926 [1,1,0,0,0,0|1,0,1]=4 5136 B13R1.371 N#Cc1ccc(cc1)CNCCO 34a_100016990907_100000184898 [1,1,0,0,0,0|1,0,1]=4 5137 B13R1.371 O=Cc1ccc(cc1)CNCCO 2230a_100016997473_100009816848 [1,1,0,0,0,0|1,0,1]=4 5138 B13R1.371 O=Cc1ccc(cc1)CNCCO 34a_100016990907_100009816848 [1,1,0,0,0,0|1,0,1]=4 5139 B13R1.371 OCCNCc1ccc(cc1)CO 207a_100000210304_100009832023 [1,1,0,0,0,0|1,0,1]=4 5140 B13R1.371 OCCNCc1ccc(cc1)CO 2230a_100015189231_100000211926 [1,1,0,0,0,0|1,0,1]=4 5141 B13R1.371 OCCNCc1ccc(cc1)CO 2230a_100016997473_100000067286 [1,1,0,0,0,0|1,0,1]=4 5142 B13R1.371 OCCNCc1ccc(cc1)CO 270004a_100000210304_100009832023 [1,1,0,0,0,0|1,0,1]=4 5143 B13R1.371 OCCNCc1ccc(cc1)CO 34a_100015189231_100000211926 [1,1,0,0,0,0|1,0,1]=4 5144 B13R1.371 OCCNCc1ccc(cc1)CO 34a_100016990907_100000067286 [1,1,0,0,0,0|1,0,1]=4 5145 B13R1.371 OCCNN=C1C=CC(=NCl)C=C1 4a_100000210001_100000088476 [1,1,0,0,0,0|1,0,0]=3 5146 B13R1.371 OCCNN=C1C=CC(=NO)C=C1 4a_100000210001_200000095120 [1,1,0,0,0,0|2,0,0]=4 5147 B13R1.371 OCCOCc1ccc(cc1)CCl 34a_100000067286_100000211926 [1,1,0,0,0,0|1,0,1]=4 5148 B13R1.371 OCCOCc1ccc(cc1)CCl 7a_100000067286_100000211926 [1,1,0,0,0,0|1,0,1]=4 5149 B13R1.371 [13CH3]Sc1ccc(cc1)CNCCO 62a_100000186819_200025704644 [1,1,0,0,0,0|1,0,1]=4 5150 B13R1.371 [13CH3]Sc1ccc(cc1)CNCCO 62a_200025704644_100000186819 [1,1,0,0,0,0|1,0,1]=4 5151 B13R1.513 CC(C)CC=Cc1ccc(cc1)Cl 271570a_100016259101_100000755918 [1,1,0,0,0,0|2,0,0]=4 5152 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 207a_100000210953_100000189385 [1,1,0,0,0,0|1,0,1]=4 5153 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 2230a_100000174871_100000210760 [1,1,0,0,0,0|1,0,1]=4 5154 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 2230a_100000210953_100000694040 [1,1,0,0,0,0|1,0,1]=4 5155 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 270004a_100000174871_100000210432 [1,1,0,0,0,0|1,0,1]=4 5156 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 270004a_100000210953_100000189385 [1,1,0,0,0,0|1,0,1]=4 5157 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 34a_100000174871_100000210624 [1,1,0,0,0,0|1,0,1]=4 5158 B13R1.513 CC(C)CNCc1ccc(cc1)Cl 34a_100000210953_100000694040 [1,1,0,0,0,0|1,0,1]=4 5159 B13R1.513 CC(O)CCNc1ccc(cc1)Cl 2230a_100000210052_100012276601 [1,1,0,0,0,0|2,0,0]=4 5160 B13R1.513 CC(O)CCNc1ccc(cc1)Cl 34a_100000210052_100012276601 [1,1,0,0,0,0|2,0,0]=4 5161 B13R1.513 CC(O)CCOc1ccc(cc1)Cl 34a_100000210216_100012276601 [1,1,0,0,0,0|2,0,0]=4 5162 B13R1.513 CC(O)CCOc1ccc(cc1)Cl 7a_100000210216_100012276601 [1,1,0,0,0,0|2,0,0]=4 5163 B13R1.513 CC(O)CCSc1ccc(cc1)Cl 62a_100000755918_100012276601 [1,1,0,0,0,0|2,0,0]=4 5164 B13R1.513 CC(O)CCSc1ccc(cc1)Cl 62a_100012276601_100000755918 [1,1,0,0,0,0|2,0,0]=4 5165 B13R1.513 CC(O)CNCc1ccc(cc1)Br 207a_100000210904_100000186029 [1,1,0,0,0,0|0,1,1]=4 5166 B13R1.513 CC(O)CNCc1ccc(cc1)Br 2230a_100000174875_100011218427 [1,1,0,0,0,0|0,1,1]=4 5167 B13R1.513 CC(O)CNCc1ccc(cc1)Br 2230a_100000210904_100011217064 [1,1,0,0,0,0|0,1,1]=4 5168 B13R1.513 CC(O)CNCc1ccc(cc1)Br 270004a_100000210904_100000186029 [1,1,0,0,0,0|0,1,1]=4 5169 B13R1.513 CC(O)CNCc1ccc(cc1)Br 34a_100000174875_100011218427 [1,1,0,0,0,0|0,1,1]=4 5170 B13R1.513 CC(O)CNCc1ccc(cc1)Br 34a_100000210904_100000189115 [1,1,0,0,0,0|0,1,1]=4 5171 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 207a_100000210904_100000189385 [1,1,0,0,0,0|0,0,1]=3 5172 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 2230a_100000174871_100011218427 [1,1,0,0,0,0|0,0,1]=3 5173 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 2230a_100000210904_100000694040 [1,1,0,0,0,0|0,0,1]=3 5174 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 270004a_100000210904_100000189385 [1,1,0,0,0,0|0,0,1]=3 5175 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 34a_100000174871_100011218427 [1,1,0,0,0,0|0,0,1]=3 5176 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 34a_100000210904_100000694040 [1,1,0,0,0,0|0,0,1]=3 5177 B13R1.513 CC(O)CNCc1ccc(cc1)F 207a_100000210904_100000210084 [1,1,0,0,0,0|0,1,1]=4 5178 B13R1.513 CC(O)CNCc1ccc(cc1)F 2230a_100000174882_100011218427 [1,1,0,0,0,0|0,1,1]=4 5179 B13R1.513 CC(O)CNCc1ccc(cc1)F 2230a_100000210904_100000198546 [1,1,0,0,0,0|0,1,1]=4 5180 B13R1.513 CC(O)CNCc1ccc(cc1)F 270004a_100000210904_100000210084 [1,1,0,0,0,0|0,1,1]=4 5181 B13R1.513 CC(O)CNCc1ccc(cc1)F 34a_100000174882_100011218427 [1,1,0,0,0,0|0,1,1]=4 5182 B13R1.513 CC(O)CNCc1ccc(cc1)F 34a_100000210904_100000198546 [1,1,0,0,0,0|0,1,1]=4 5183 B13R1.513 CC(O)CNCc1ccc(cc1)I 207a_100000210904_100000188517 [1,1,0,0,0,0|0,1,1]=4 5184 B13R1.513 CC(O)CNCc1ccc(cc1)I 2230a_100000210904_100000189116 [1,1,0,0,0,0|0,1,1]=4 5185 B13R1.513 CC(O)CNCc1ccc(cc1)I 2230a_100016989417_100011218427 [1,1,0,0,0,0|0,1,1]=4 5186 B13R1.513 CC(O)CNCc1ccc(cc1)I 34a_100000210904_100000189116 [1,1,0,0,0,0|0,1,1]=4 5187 B13R1.513 CC(O)CNCc1ccc(cc1)I 34a_100016989417_100011218427 [1,1,0,0,0,0|0,1,1]=4 5188 B13R1.513 CC(O)CNCc1ccc(cc1)O 34a_100000185549_100011218427 [1,1,0,0,0,0|1,0,1]=4 5189 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 207a_100000210904_100011361569 [1,1,0,0,0,0|1,0,1]=4 5190 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 2230a_100000210904_100012066911 [1,1,0,0,0,0|1,0,1]=4 5191 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 270004a_100000210904_100011361569 [1,1,0,0,0,0|1,0,1]=4 5192 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 34a_100000210904_100012066911 [1,1,0,0,0,0|1,0,1]=4 5193 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 34a_100000697193_100011218427 [1,1,0,0,0,0|1,0,1]=4 5194 B13R1.513 CC(O)CNCc1ccc(nc1)Cl 2230a_100000210904_100000735431 [1,1,0,0,0,0|1,0,1]=4 5195 B13R1.513 CC(O)CNCc1ccc(nc1)Cl 2230a_100000735879_100011218427 [1,1,0,0,0,0|1,0,1]=4 5196 B13R1.513 CC(O)CNCc1ccc(nc1)Cl 34a_100000210904_100000735431 [1,1,0,0,0,0|1,0,1]=4 5197 B13R1.513 CC(O)CNCc1ccc(nc1)Cl 34a_100000735879_100011218427 [1,1,0,0,0,0|1,0,1]=4 5198 B13R1.513 CC(O)COCc1ccc(cc1)Cl 34a_100000211118_100011218427 [1,1,0,0,0,0|1,0,1]=4 5199 B13R1.513 CC(O)COCc1ccc(cc1)Cl 7a_100000211118_100011218427 [1,1,0,0,0,0|1,0,1]=4 5200 B13R1.513 CC(O)CSCc1ccc(cc1)Cl 62a_100000187161_100011218427 [1,1,0,0,0,0|1,0,1]=4 5201 B13R1.513 CC(O)CSCc1ccc(cc1)Cl 62a_100011218427_100000187161 [1,1,0,0,0,0|1,0,1]=4 5202 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Br 2230a_100000174875_100009817552 [1,1,0,0,0,0|0,1,1]=4 5203 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Br 34a_100000174875_100009817552 [1,1,0,0,0,0|0,1,1]=4 5204 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Cl 2230a_100000174871_100009817552 [1,1,0,0,0,0|0,0,1]=3 5205 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Cl 34a_100000174871_100009817552 [1,1,0,0,0,0|0,0,1]=3 5206 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)F 2230a_100000174882_100009817552 [1,1,0,0,0,0|0,1,1]=4 5207 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)F 34a_100000174882_100009817552 [1,1,0,0,0,0|0,1,1]=4 5208 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)I 2230a_100016989417_100009817552 [1,1,0,0,0,0|0,1,1]=4 5209 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)I 34a_100016989417_100009817552 [1,1,0,0,0,0|0,1,1]=4 5210 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)O 34a_100000185549_100009817552 [1,1,0,0,0,0|1,0,1]=4 5211 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Cl 34a_100000697193_100009817552 [1,1,0,0,0,0|1,0,1]=4 5212 B13R1.513 C[C@@H](O)CNCc1ccc(nc1)Cl 2230a_100000735879_100009817552 [1,1,0,0,0,0|1,0,1]=4 5213 B13R1.513 C[C@@H](O)CNCc1ccc(nc1)Cl 34a_100000735879_100009817552 [1,1,0,0,0,0|1,0,1]=4 5214 B13R1.513 C[C@@H](O)COCc1ccc(cc1)Cl 34a_100000211118_100009817552 [1,1,0,0,0,0|1,0,1]=4 5215 B13R1.513 C[C@@H](O)COCc1ccc(cc1)Cl 7a_100000211118_100009817552 [1,1,0,0,0,0|1,0,1]=4 5216 B13R1.513 C[C@@H](O)CSCc1ccc(cc1)Cl 62a_100000187161_100009817552 [1,1,0,0,0,0|1,0,1]=4 5217 B13R1.513 C[C@@H](O)CSCc1ccc(cc1)Cl 62a_100009817552_100000187161 [1,1,0,0,0,0|1,0,1]=4 5218 B13R1.513 Cc1ccc(cc1)CNCC(C)O 207a_100000210904_100000211033 [1,1,0,0,0,0|1,0,1]=4 5219 B13R1.513 Cc1ccc(cc1)CNCC(C)O 2230a_100000174908_100011218427 [1,1,0,0,0,0|1,0,1]=4 5220 B13R1.513 Cc1ccc(cc1)CNCC(C)O 2230a_100000210904_100000210814 [1,1,0,0,0,0|1,0,1]=4 5221 B13R1.513 Cc1ccc(cc1)CNCC(C)O 270004a_100000210904_100000211033 [1,1,0,0,0,0|1,0,1]=4 5222 B13R1.513 Cc1ccc(cc1)CNCC(C)O 34a_100000174908_100011218427 [1,1,0,0,0,0|1,0,1]=4 5223 B13R1.513 Cc1ccc(cc1)CNCC(C)O 34a_100000210904_100000210814 [1,1,0,0,0,0|1,0,1]=4 5224 B13R1.513 Cc1ccc(cc1)CNC[C@@H](C)O 2230a_100000174908_100009817552 [1,1,0,0,0,0|1,0,1]=4 5225 B13R1.513 Cc1ccc(cc1)CNC[C@@H](C)O 34a_100000174908_100009817552 [1,1,0,0,0,0|1,0,1]=4 5226 B13R1.513 FC(F)CNCc1ccc(cc1)Cl 207a_100000765723_100000189385 [1,1,0,0,0,0|1,0,1]=4 5227 B13R1.513 FC(F)CNCc1ccc(cc1)Cl 2230a_100000174871_100011934356 [1,1,0,0,0,0|1,0,1]=4 5228 B13R1.513 FC(F)CNCc1ccc(cc1)Cl 270004a_100000765723_100000189385 [1,1,0,0,0,0|1,0,1]=4 5229 B13R1.513 FC(F)CNCc1ccc(cc1)Cl 34a_100000174871_100011934356 [1,1,0,0,0,0|1,0,1]=4 5230 B13R1.513 FC(F)CNCc1ccc(cc1)Cl 34a_100000765723_100000694040 [1,1,0,0,0,0|1,0,1]=4 5231 B13R1.513 O=C(O)CNCc1ccc(cc1)Cl 269956a_100016091260_100000187161 [1,1,0,0,0,0|0,0,2]=4 5232 B13R1.669 CCCC=Cc1ccc(c(c1)Br)Cl 271570a_100016258520_100012353702 [1,1,0,0,0,0|2,0,0]=4 5233 B13R1.669 CCCC=Cc1ccc(c(c1)C)Cl 271570a_100016258520_100000049509 [1,1,0,0,0,0|2,0,0]=4 5234 B13R1.669 CCCC=Cc1ccc(c(c1)Cl)Cl 271570a_100016258520_100011214914 [1,1,0,0,0,0|2,0,0]=4 5235 B13R1.669 CCCC=Cc1ccc(c(c1)F)Cl 271570a_100016258520_100011216805 [1,1,0,0,0,0|2,0,0]=4 5236 B13R1.669 CCCC=Cc1ccc(c(c1)N)Cl 271570a_100016258520_200000761891 [1,1,0,0,0,0|2,0,0]=4 5237 B13R1.669 CCCC=Cc1ccc(c(c1)O)Cl 271570a_100016258520_100011356854 [1,1,0,0,0,0|2,0,0]=4 5238 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 207a_100020643023_100000693810 [1,1,0,0,0,0|1,0,1]=4 5239 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000210303 [1,1,0,0,0,0|1,0,1]=4 5240 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 270004a_100020643023_100000693810 [1,1,0,0,0,0|1,0,1]=4 5241 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000210303 [1,1,0,0,0,0|1,0,1]=4 5242 B13R1.669 CCCNCc1ccc(c(c1)C)Cl 207a_100020643023_100000698814 [1,1,0,0,0,0|1,0,1]=4 5243 B13R1.669 CCCNCc1ccc(c(c1)C)Cl 270004a_100020643023_100000698814 [1,1,0,0,0,0|1,0,1]=4 5244 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 207a_100020643023_100000188533 [1,1,0,0,0,0|1,0,1]=4 5245 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000210303 [1,1,0,0,0,0|1,0,1]=4 5246 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 270004a_100020643023_100000188533 [1,1,0,0,0,0|1,0,1]=4 5247 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000210303 [1,1,0,0,0,0|1,0,1]=4 5248 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 207a_100020643023_100000745630 [1,1,0,0,0,0|1,0,1]=4 5249 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000210303 [1,1,0,0,0,0|1,0,1]=4 5250 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 270004a_100020643023_100000745630 [1,1,0,0,0,0|1,0,1]=4 5251 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000210303 [1,1,0,0,0,0|1,0,1]=4 5252 B13R1.669 CCCNCc1ccc(c(c1)I)Cl 207a_100020643023_100010209939 [1,1,0,0,0,0|1,0,1]=4 5253 B13R1.669 CCCNCc1ccc(c(c1)I)Cl 270004a_100020643023_100010209939 [1,1,0,0,0,0|1,0,1]=4 5254 B13R1.669 CCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210303 [1,1,0,0,0,0|1,0,1]=4 5255 B13R1.669 Cc1cc(ccc1Br)CNCCO 207a_100000210304_100000765772 [1,1,0,0,0,0|0,1,1]=4 5256 B13R1.669 Cc1cc(ccc1Br)CNCCO 2230a_100015205234_100000211926 [1,1,0,0,0,0|0,1,1]=4 5257 B13R1.669 Cc1cc(ccc1Br)CNCCO 2230a_100016997473_100000727479 [1,1,0,0,0,0|0,1,1]=4 5258 B13R1.669 Cc1cc(ccc1Br)CNCCO 270004a_100000210304_100000765772 [1,1,0,0,0,0|0,1,1]=4 5259 B13R1.669 Cc1cc(ccc1Br)CNCCO 34a_100015205234_100000211926 [1,1,0,0,0,0|0,1,1]=4 5260 B13R1.669 Cc1cc(ccc1Br)CNCCO 34a_100016990907_100000727479 [1,1,0,0,0,0|0,1,1]=4 5261 B13R1.669 Cc1cc(ccc1Cl)CNCCF 34a_100000724931_100012184735 [1,1,0,0,0,0|1,0,1]=4 5262 B13R1.669 Cc1cc(ccc1Cl)CNCCO 207a_100000210304_100000698814 [1,1,0,0,0,0|0,0,1]=3 5263 B13R1.669 Cc1cc(ccc1Cl)CNCCO 2230a_100016997473_100012184735 [1,1,0,0,0,0|0,0,1]=3 5264 B13R1.669 Cc1cc(ccc1Cl)CNCCO 270004a_100000210304_100000698814 [1,1,0,0,0,0|0,0,1]=3 5265 B13R1.669 Cc1cc(ccc1Cl)CNCCO 34a_100016990907_100012184735 [1,1,0,0,0,0|0,0,1]=3 5266 B13R1.669 Cc1cc(ccc1Cl)CSCCO 62a_100000211926_100012184735 [1,1,0,0,0,0|1,0,1]=4 5267 B13R1.669 Cc1cc(ccc1Cl)CSCCO 62a_100012184735_100000211926 [1,1,0,0,0,0|1,0,1]=4 5268 B13R1.669 Cc1cc(ccc1Cl)NCCCO 2230a_100000187808_100000230001 [1,1,0,0,0,0|2,0,0]=4 5269 B13R1.669 Cc1cc(ccc1Cl)NCCCO 34a_100000187808_100000230001 [1,1,0,0,0,0|2,0,0]=4 5270 B13R1.669 Cc1cc(ccc1Cl)NCCCO 7a_100000187808_100011215043 [1,1,0,0,0,0|2,0,0]=4 5271 B13R1.669 Cc1cc(ccc1Cl)OCCCO 34a_100000211092_100000230001 [1,1,0,0,0,0|2,0,0]=4 5272 B13R1.669 Cc1cc(ccc1Cl)OCCCO 7a_100000211092_100011215043 [1,1,0,0,0,0|2,0,0]=4 5273 B13R1.669 Cc1cc(ccc1Cl)SCCCO 62a_100000049509_100011215043 [1,1,0,0,0,0|2,0,0]=4 5274 B13R1.669 Cc1cc(ccc1Cl)SCCCO 62a_100011215043_100000049509 [1,1,0,0,0,0|2,0,0]=4 5275 B13R1.669 Cc1cc(ccc1F)CNCCO 207a_100000210304_100000748208 [1,1,0,0,0,0|0,1,1]=4 5276 B13R1.669 Cc1cc(ccc1F)CNCCO 2230a_100000239911_100000211926 [1,1,0,0,0,0|0,1,1]=4 5277 B13R1.669 Cc1cc(ccc1F)CNCCO 2230a_100016997473_100011216667 [1,1,0,0,0,0|0,1,1]=4 5278 B13R1.669 Cc1cc(ccc1F)CNCCO 270004a_100000210304_100000748208 [1,1,0,0,0,0|0,1,1]=4 5279 B13R1.669 Cc1cc(ccc1F)CNCCO 34a_100000239911_100000211926 [1,1,0,0,0,0|0,1,1]=4 5280 B13R1.669 Cc1cc(ccc1F)CNCCO 34a_100016990907_100011216667 [1,1,0,0,0,0|0,1,1]=4 5281 B13R1.669 Cc1cc(cnc1Cl)CNCCO 207a_100000210304_100000070293 [1,1,0,0,0,0|1,0,1]=4 5282 B13R1.669 Cc1cc(cnc1Cl)CNCCO 270004a_100000210304_100000070293 [1,1,0,0,0,0|1,0,1]=4 5283 B13R1.669 Cc1ccc(cc1Br)CNCCO 207a_100000210304_100000695567 [1,1,0,0,0,0|1,0,1]=4 5284 B13R1.669 Cc1ccc(cc1Br)CNCCO 2230a_100016997473_100012232412 [1,1,0,0,0,0|1,0,1]=4 5285 B13R1.669 Cc1ccc(cc1Br)CNCCO 270004a_100000210304_100000695567 [1,1,0,0,0,0|1,0,1]=4 5286 B13R1.669 Cc1ccc(cc1Br)CNCCO 34a_100016990907_100012232412 [1,1,0,0,0,0|1,0,1]=4 5287 B13R1.669 Cc1ccc(cc1C)CNCCO 207a_100000210304_100000229942 [1,1,0,0,0,0|1,0,1]=4 5288 B13R1.669 Cc1ccc(cc1C)CNCCO 2230a_100016997473_100000742320 [1,1,0,0,0,0|1,0,1]=4 5289 B13R1.669 Cc1ccc(cc1C)CNCCO 2230a_100025706692_100000211926 [1,1,0,0,0,0|1,0,1]=4 5290 B13R1.669 Cc1ccc(cc1C)CNCCO 270004a_100000210304_100000229942 [1,1,0,0,0,0|1,0,1]=4 5291 B13R1.669 Cc1ccc(cc1C)CNCCO 34a_100016990907_100000742320 [1,1,0,0,0,0|1,0,1]=4 5292 B13R1.669 Cc1ccc(cc1C)CNCCO 34a_100025706692_100000211926 [1,1,0,0,0,0|1,0,1]=4 5293 B13R1.669 Cc1ccc(cc1Cl)CNCCO 207a_100000210304_100000760539 [1,1,0,0,0,0|1,0,1]=4 5294 B13R1.669 Cc1ccc(cc1Cl)CNCCO 2230a_100016997473_100011823929 [1,1,0,0,0,0|1,0,1]=4 5295 B13R1.669 Cc1ccc(cc1Cl)CNCCO 2230a_102495364989_100000211926 [1,1,0,0,0,0|1,0,1]=4 5296 B13R1.669 Cc1ccc(cc1Cl)CNCCO 270004a_100000210304_100000760539 [1,1,0,0,0,0|1,0,1]=4 5297 B13R1.669 Cc1ccc(cc1Cl)CNCCO 34a_100016990907_100011823929 [1,1,0,0,0,0|1,0,1]=4 5298 B13R1.669 Cc1ccc(cc1Cl)CNCCO 34a_102495364989_100000211926 [1,1,0,0,0,0|1,0,1]=4 5299 B13R1.669 Cc1ccc(cc1F)CNCCO 207a_100000210304_100000753222 [1,1,0,0,0,0|1,0,1]=4 5300 B13R1.669 Cc1ccc(cc1F)CNCCO 2230a_100016997473_100011217369 [1,1,0,0,0,0|1,0,1]=4 5301 B13R1.669 Cc1ccc(cc1F)CNCCO 2230a_100102708794_100000211926 [1,1,0,0,0,0|1,0,1]=4 5302 B13R1.669 Cc1ccc(cc1F)CNCCO 270004a_100000210304_100000753222 [1,1,0,0,0,0|1,0,1]=4 5303 B13R1.669 Cc1ccc(cc1F)CNCCO 34a_100016990907_100011217369 [1,1,0,0,0,0|1,0,1]=4 5304 B13R1.669 Cc1ccc(cc1F)CNCCO 34a_100102708794_100000211926 [1,1,0,0,0,0|1,0,1]=4 5305 B13R1.669 Cc1ccc(cc1I)CNCCO 207a_100000210304_100010197721 [1,1,0,0,0,0|1,0,1]=4 5306 B13R1.669 Cc1ccc(cc1I)CNCCO 2230a_100016997473_100010206137 [1,1,0,0,0,0|1,0,1]=4 5307 B13R1.669 Cc1ccc(cc1I)CNCCO 270004a_100000210304_100010197721 [1,1,0,0,0,0|1,0,1]=4 5308 B13R1.669 Cc1ccc(cc1I)CNCCO 34a_100016990907_100010206137 [1,1,0,0,0,0|1,0,1]=4 5309 B13R1.669 FCCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100011217306 [1,1,0,0,0,0|1,0,1]=4 5310 B13R1.669 FCCNCc1ccc(c(c1)Br)Cl 34a_100000724931_100012353894 [1,1,0,0,0,0|1,0,1]=4 5311 B13R1.669 FCCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100011217306 [1,1,0,0,0,0|1,0,1]=4 5312 B13R1.669 FCCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100011217306 [1,1,0,0,0,0|1,0,1]=4 5313 B13R1.669 FCCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100011217306 [1,1,0,0,0,0|1,0,1]=4 5314 B13R1.669 FCCNCc1ccc(c(c1)Cl)Cl 34a_100000724931_100000184707 [1,1,0,0,0,0|1,0,1]=4 5315 B13R1.669 FCCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100011217306 [1,1,0,0,0,0|1,0,1]=4 5316 B13R1.669 FCCNCc1ccc(c(c1)F)Cl 34a_100000724931_100011519011 [1,1,0,0,0,0|1,0,1]=4 5317 B13R1.669 FCCNCc1ccc(c(c1)F)Cl 34a_100011219866_100011217306 [1,1,0,0,0,0|1,0,1]=4 5318 B13R1.669 Nc1cc(ccc1Cl)COCCO 34a_106256033963_100000211926 [1,1,0,0,0,0|1,0,1]=4 5319 B13R1.669 Nc1cc(ccc1Cl)OCCCO 34a_100011934297_100000230001 [1,1,0,0,0,0|2,0,0]=4 5320 B13R1.669 Nc1cc(ccc1Cl)SCCCO 62a_100011215043_200000761891 [1,1,0,0,0,0|2,0,0]=4 5321 B13R1.669 Nc1cc(ccc1Cl)SCCCO 62a_200000761891_100011215043 [1,1,0,0,0,0|2,0,0]=4 5322 B13R1.669 OCCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000230001 [1,1,0,0,0,0|2,0,0]=4 5323 B13R1.669 OCCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000230001 [1,1,0,0,0,0|2,0,0]=4 5324 B13R1.669 OCCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000230001 [1,1,0,0,0,0|2,0,0]=4 5325 B13R1.669 OCCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000230001 [1,1,0,0,0,0|2,0,0]=4 5326 B13R1.669 OCCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000230001 [1,1,0,0,0,0|2,0,0]=4 5327 B13R1.669 OCCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000230001 [1,1,0,0,0,0|2,0,0]=4 5328 B13R1.669 OCCCNc1ccc(c(c1)F)Cl 7a_100000739366_100011215043 [1,1,0,0,0,0|2,0,0]=4 5329 B13R1.669 OCCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000230001 [1,1,0,0,0,0|2,0,0]=4 5330 B13R1.669 OCCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000230001 [1,1,0,0,0,0|2,0,0]=4 5331 B13R1.669 OCCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000230001 [1,1,0,0,0,0|2,0,0]=4 5332 B13R1.669 OCCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100011215043 [1,1,0,0,0,0|2,0,0]=4 5333 B13R1.669 OCCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000230001 [1,1,0,0,0,0|2,0,0]=4 5334 B13R1.669 OCCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100011215043 [1,1,0,0,0,0|2,0,0]=4 5335 B13R1.669 OCCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000230001 [1,1,0,0,0,0|2,0,0]=4 5336 B13R1.669 OCCCOc1ccc(c(c1)F)Cl 7a_100000691581_100011215043 [1,1,0,0,0,0|2,0,0]=4 5337 B13R1.669 OCCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000230001 [1,1,0,0,0,0|2,0,0]=4 5338 B13R1.669 OCCCOc1ccc(c(c1)I)Cl 7a_100000049588_100011215043 [1,1,0,0,0,0|2,0,0]=4 5339 B13R1.669 OCCCSc1ccc(c(c1)Br)Cl 62a_100011215043_100012353702 [1,1,0,0,0,0|2,0,0]=4 5340 B13R1.669 OCCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100011215043 [1,1,0,0,0,0|2,0,0]=4 5341 B13R1.669 OCCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100011215043 [1,1,0,0,0,0|2,0,0]=4 5342 B13R1.669 OCCCSc1ccc(c(c1)Cl)Cl 62a_100011215043_100011214914 [1,1,0,0,0,0|2,0,0]=4 5343 B13R1.669 OCCCSc1ccc(c(c1)F)Cl 62a_100011215043_100011216805 [1,1,0,0,0,0|2,0,0]=4 5344 B13R1.669 OCCCSc1ccc(c(c1)F)Cl 62a_100011216805_100011215043 [1,1,0,0,0,0|2,0,0]=4 5345 B13R1.669 OCCCSc1ccc(c(c1)O)Cl 62a_100011215043_100011356854 [1,1,0,0,0,0|2,0,0]=4 5346 B13R1.669 OCCCSc1ccc(c(c1)O)Cl 62a_100011356854_100011215043 [1,1,0,0,0,0|2,0,0]=4 5347 B13R1.669 OCCNCc1ccc(c(c1)Br)Br 207a_100000210304_100011215943 [1,1,0,0,0,0|0,1,1]=4 5348 B13R1.669 OCCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000211926 [1,1,0,0,0,0|0,1,1]=4 5349 B13R1.669 OCCNCc1ccc(c(c1)Br)Br 2230a_100016997473_100012353900 [1,1,0,0,0,0|0,1,1]=4 5350 B13R1.669 OCCNCc1ccc(c(c1)Br)Br 270004a_100000210304_100011215943 [1,1,0,0,0,0|0,1,1]=4 5351 B13R1.669 OCCNCc1ccc(c(c1)Br)Br 34a_100012351559_100000211926 [1,1,0,0,0,0|0,1,1]=4 5352 B13R1.669 OCCNCc1ccc(c(c1)Br)Br 34a_100016990907_100012353900 [1,1,0,0,0,0|0,1,1]=4 5353 B13R1.669 OCCNCc1ccc(c(c1)Br)Cl 207a_100000210304_100000693810 [1,1,0,0,0,0|0,0,1]=3 5354 B13R1.669 OCCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000211926 [1,1,0,0,0,0|0,0,1]=3 5355 B13R1.669 OCCNCc1ccc(c(c1)Br)Cl 2230a_100016997473_100012353894 [1,1,0,0,0,0|0,0,1]=3 5356 B13R1.669 OCCNCc1ccc(c(c1)Br)Cl 270004a_100000210304_100000693810 [1,1,0,0,0,0|0,0,1]=3 5357 B13R1.669 OCCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000211926 [1,1,0,0,0,0|0,0,1]=3 5358 B13R1.669 OCCNCc1ccc(c(c1)Br)Cl 34a_100016990907_100012353894 [1,1,0,0,0,0|0,0,1]=3 5359 B13R1.669 OCCNCc1ccc(c(c1)Br)F 207a_100000210304_100000211747 [1,1,0,0,0,0|0,1,1]=4 5360 B13R1.669 OCCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000211926 [1,1,0,0,0,0|0,1,1]=4 5361 B13R1.669 OCCNCc1ccc(c(c1)Br)F 2230a_100016997473_100011206884 [1,1,0,0,0,0|0,1,1]=4 5362 B13R1.669 OCCNCc1ccc(c(c1)Br)F 270004a_100000210304_100000211747 [1,1,0,0,0,0|0,1,1]=4 5363 B13R1.669 OCCNCc1ccc(c(c1)Br)F 34a_100015193890_100000211926 [1,1,0,0,0,0|0,1,1]=4 5364 B13R1.669 OCCNCc1ccc(c(c1)Br)F 34a_100016990907_100011206884 [1,1,0,0,0,0|0,1,1]=4 5365 B13R1.669 OCCNCc1ccc(c(c1)Cl)Br 207a_100000210304_100000690054 [1,1,0,0,0,0|0,1,1]=4 5366 B13R1.669 OCCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000211926 [1,1,0,0,0,0|0,1,1]=4 5367 B13R1.669 OCCNCc1ccc(c(c1)Cl)Br 2230a_100016997473_100012353895 [1,1,0,0,0,0|0,1,1]=4 5368 B13R1.669 OCCNCc1ccc(c(c1)Cl)Br 270004a_100000210304_100000690054 [1,1,0,0,0,0|0,1,1]=4 5369 B13R1.669 OCCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100000211926 [1,1,0,0,0,0|0,1,1]=4 5370 B13R1.669 OCCNCc1ccc(c(c1)Cl)Br 34a_100016990907_100012353895 [1,1,0,0,0,0|0,1,1]=4 5371 B13R1.669 OCCNCc1ccc(c(c1)Cl)Cl 207a_100000210304_100000188533 [1,1,0,0,0,0|0,0,1]=3 5372 B13R1.669 OCCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000211926 [1,1,0,0,0,0|0,0,1]=3 5373 B13R1.669 OCCNCc1ccc(c(c1)Cl)Cl 2230a_100016997473_100000184707 [1,1,0,0,0,0|0,0,1]=3 5374 B13R1.669 OCCNCc1ccc(c(c1)Cl)Cl 270004a_100000210304_100000188533 [1,1,0,0,0,0|0,0,1]=3 5375 B13R1.669 OCCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000211926 [1,1,0,0,0,0|0,0,1]=3 5376 B13R1.669 OCCNCc1ccc(c(c1)Cl)Cl 34a_100016990907_100000184707 [1,1,0,0,0,0|0,0,1]=3 5377 B13R1.669 OCCNCc1ccc(c(c1)Cl)F 207a_100000210304_100000742290 [1,1,0,0,0,0|0,1,1]=4 5378 B13R1.669 OCCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000211926 [1,1,0,0,0,0|0,1,1]=4 5379 B13R1.669 OCCNCc1ccc(c(c1)Cl)F 2230a_100016997473_100000717365 [1,1,0,0,0,0|0,1,1]=4 5380 B13R1.669 OCCNCc1ccc(c(c1)Cl)F 270004a_100000210304_100000742290 [1,1,0,0,0,0|0,1,1]=4 5381 B13R1.669 OCCNCc1ccc(c(c1)Cl)F 34a_100000749334_100000211926 [1,1,0,0,0,0|0,1,1]=4 5382 B13R1.669 OCCNCc1ccc(c(c1)Cl)F 34a_100016990907_100011934319 [1,1,0,0,0,0|0,1,1]=4 5383 B13R1.669 OCCNCc1ccc(c(c1)Cl)I 2230a_100016997473_100012349665 [1,1,0,0,0,0|0,1,1]=4 5384 B13R1.669 OCCNCc1ccc(c(c1)Cl)I 34a_100016990907_100012349665 [1,1,0,0,0,0|0,1,1]=4 5385 B13R1.669 OCCNCc1ccc(c(c1)F)Br 207a_100000210304_100000686674 [1,1,0,0,0,0|0,1,1]=4 5386 B13R1.669 OCCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000211926 [1,1,0,0,0,0|0,1,1]=4 5387 B13R1.669 OCCNCc1ccc(c(c1)F)Br 2230a_100016997473_100000767054 [1,1,0,0,0,0|0,1,1]=4 5388 B13R1.669 OCCNCc1ccc(c(c1)F)Br 270004a_100000210304_100000686674 [1,1,0,0,0,0|0,1,1]=4 5389 B13R1.669 OCCNCc1ccc(c(c1)F)Br 34a_100000755036_100000211926 [1,1,0,0,0,0|0,1,1]=4 5390 B13R1.669 OCCNCc1ccc(c(c1)F)Br 34a_100016990907_100000767054 [1,1,0,0,0,0|0,1,1]=4 5391 B13R1.669 OCCNCc1ccc(c(c1)F)Cl 207a_100000210304_100000745630 [1,1,0,0,0,0|0,0,1]=3 5392 B13R1.669 OCCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000211926 [1,1,0,0,0,0|0,0,1]=3 5393 B13R1.669 OCCNCc1ccc(c(c1)F)Cl 2230a_100016997473_100000716492 [1,1,0,0,0,0|0,0,1]=3 5394 B13R1.669 OCCNCc1ccc(c(c1)F)Cl 270004a_100000210304_100000745630 [1,1,0,0,0,0|0,0,1]=3 5395 B13R1.669 OCCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000211926 [1,1,0,0,0,0|0,0,1]=3 5396 B13R1.669 OCCNCc1ccc(c(c1)F)Cl 34a_100016990907_100011519011 [1,1,0,0,0,0|0,0,1]=3 5397 B13R1.669 OCCNCc1ccc(c(c1)F)F 207a_100000210304_100000211062 [1,1,0,0,0,0|0,1,1]=4 5398 B13R1.669 OCCNCc1ccc(c(c1)F)F 2230a_100000737897_100000211926 [1,1,0,0,0,0|0,1,1]=4 5399 B13R1.669 OCCNCc1ccc(c(c1)F)F 2230a_100016997473_100000757363 [1,1,0,0,0,0|0,1,1]=4 5400 B13R1.669 OCCNCc1ccc(c(c1)F)F 270004a_100000210304_100000211062 [1,1,0,0,0,0|0,1,1]=4 5401 B13R1.669 OCCNCc1ccc(c(c1)F)F 34a_100000737897_100000211926 [1,1,0,0,0,0|0,1,1]=4 5402 B13R1.669 OCCNCc1ccc(c(c1)F)F 34a_100016990907_100000757363 [1,1,0,0,0,0|0,1,1]=4 5403 B13R1.669 OCCNCc1ccc(c(c1)F)I 207a_100000210304_100000050832 [1,1,0,0,0,0|0,1,1]=4 5404 B13R1.669 OCCNCc1ccc(c(c1)F)I 2230a_100016997473_100010149604 [1,1,0,0,0,0|0,1,1]=4 5405 B13R1.669 OCCNCc1ccc(c(c1)F)I 270004a_100000210304_100000050832 [1,1,0,0,0,0|0,1,1]=4 5406 B13R1.669 OCCNCc1ccc(c(c1)F)I 34a_100016990907_100010149604 [1,1,0,0,0,0|0,1,1]=4 5407 B13R1.669 OCCNCc1ccc(c(c1)F)O 34a_100000758358_100000211926 [1,1,0,0,0,0|1,0,1]=4 5408 B13R1.669 OCCNCc1ccc(c(c1)I)Br 207a_100000210304_100010146563 [1,1,0,0,0,0|0,1,1]=4 5409 B13R1.669 OCCNCc1ccc(c(c1)I)Br 2230a_100016997473_100010146616 [1,1,0,0,0,0|0,1,1]=4 5410 B13R1.669 OCCNCc1ccc(c(c1)I)Br 270004a_100000210304_100010146563 [1,1,0,0,0,0|0,1,1]=4 5411 B13R1.669 OCCNCc1ccc(c(c1)I)Br 34a_100016990907_100010146616 [1,1,0,0,0,0|0,1,1]=4 5412 B13R1.669 OCCNCc1ccc(c(c1)I)Cl 207a_100000210304_100010209939 [1,1,0,0,0,0|0,0,1]=3 5413 B13R1.669 OCCNCc1ccc(c(c1)I)Cl 270004a_100000210304_100010209939 [1,1,0,0,0,0|0,0,1]=3 5414 B13R1.669 OCCNCc1ccc(c(c1)I)F 207a_100000210304_100010188209 [1,1,0,0,0,0|0,1,1]=4 5415 B13R1.669 OCCNCc1ccc(c(c1)I)F 2230a_100016997473_100010188208 [1,1,0,0,0,0|0,1,1]=4 5416 B13R1.669 OCCNCc1ccc(c(c1)I)F 270004a_100000210304_100010188209 [1,1,0,0,0,0|0,1,1]=4 5417 B13R1.669 OCCNCc1ccc(c(c1)I)F 34a_100016990907_100010188208 [1,1,0,0,0,0|0,1,1]=4 5418 B13R1.669 OCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000211926 [1,1,0,0,0,0|0,0,1]=3 5419 B13R1.669 OCCNCc1ccc(c(c1)O)F 34a_100160469508_100000211926 [1,1,0,0,0,0|0,1,1]=4 5420 B13R1.669 OCCNCc1ccc(c(c1)O)O 34a_100000010075_100000211926 [1,1,0,0,0,0|1,0,1]=4 5421 B13R1.669 OCCNCc1ccc(c(n1)Cl)Cl 2230a_100009887527_100000211926 [1,1,0,0,0,0|1,0,1]=4 5422 B13R1.669 OCCNCc1ccc(c(n1)Cl)Cl 34a_100009887527_100000211926 [1,1,0,0,0,0|1,0,1]=4 5423 B13R1.669 OCCNCc1cnc(c(c1)Br)Cl 207a_100000210304_100010244460 [1,1,0,0,0,0|1,0,1]=4 5424 B13R1.669 OCCNCc1cnc(c(c1)Cl)Cl 2230a_100016997473_100009843750 [1,1,0,0,0,0|1,0,1]=4 5425 B13R1.669 OCCNCc1cnc(c(c1)Cl)Cl 34a_100016990907_100009843750 [1,1,0,0,0,0|1,0,1]=4 5426 B13R1.669 OCCNCc1cnc(c(c1)F)Cl 270004a_100000210304_100009866847 [1,1,0,0,0,0|1,0,1]=4 5427 B13R1.669 OCCNCc1cnc(c(c1)I)Cl 2230a_100016997473_100011072623 [1,1,0,0,0,0|1,0,1]=4 5428 B13R1.669 OCCNCc1cnc(c(c1)I)Cl 34a_100016990907_100011072623 [1,1,0,0,0,0|1,0,1]=4 5429 B13R1.669 OCCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100000211926 [1,1,0,0,0,0|1,0,1]=4 5430 B13R1.669 OCCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000211926 [1,1,0,0,0,0|1,0,1]=4 5431 B13R1.669 OCCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100000211926 [1,1,0,0,0,0|1,0,1]=4 5432 B13R1.669 OCCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000211926 [1,1,0,0,0,0|1,0,1]=4 5433 B13R1.669 OCCOCc1ccc(c(c1)F)Cl 34a_100011218299_100000211926 [1,1,0,0,0,0|1,0,1]=4 5434 B13R1.669 OCCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000211926 [1,1,0,0,0,0|1,0,1]=4 5435 B13R1.669 OCCSCc1ccc(c(c1)Br)Cl 62a_100000211926_100012353894 [1,1,0,0,0,0|1,0,1]=4 5436 B13R1.669 OCCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000211926 [1,1,0,0,0,0|1,0,1]=4 5437 B13R1.669 OCCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000211926 [1,1,0,0,0,0|1,0,1]=4 5438 B13R1.669 OCCSCc1ccc(c(c1)Cl)Cl 62a_100000211926_100000184707 [1,1,0,0,0,0|1,0,1]=4 5439 B13R1.669 OCCSCc1ccc(c(c1)F)Cl 62a_100000211926_100000716492 [1,1,0,0,0,0|1,0,1]=4 5440 B13R1.669 OCCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000211926 [1,1,0,0,0,0|1,0,1]=4 5441 B13R1.669 Oc1cc(ccc1Cl)CNCCF 34a_100020636435_100011217306 [1,1,0,0,0,0|1,0,1]=4 5442 B13R1.1 CCN(CCO)c1ccc(cc1)Cl 2230a_100000220165_100000211926 [1,1,0,0,0,0|2,0,0]=4 5443 B13R1.1 CCN(CCO)c1ccc(cc1)Cl 269982a_100000220165_100000211926 [1,1,0,0,0,0|2,0,0]=4 5444 B13R1.1 CCN(CCO)c1ccc(cc1)Cl 34a_100000220165_100000211926 [1,1,0,0,0,0|2,0,0]=4 5445 B13R1.1 CCNC(C#N)c1ccc(cc1)Cl 2230a_100000747793_100000210202 [1,1,0,0,0,0|1,0,1]=4 5446 B13R1.1 CCNC(CC)c1ccc(cc1)Cl 269862a_100015525214_100000210983 [1,1,0,0,0,0|1,0,1]=4 5447 B13R1.1 CCN[C@@H](CC)c1ccc(cc1)Cl 2230a_100015186824_100000210202 [1,1,0,0,0,0|1,0,1]=4 5448 B13R1.1 CCN[C@@H](CC)c1ccc(cc1)Cl 34a_100015186824_100000210202 [1,1,0,0,0,0|1,0,1]=4 5449 B13R1.1 CCN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100000210202 [1,1,0,0,0,0|0,0,2]=4 5450 B13R1.1 CCN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000210202 [1,1,0,0,0,0|0,0,2]=4 5451 B13R1.1 CNC(CCO)c1ccc(cc1)Cl 2230a_100000730317_200000210301 [1,1,0,0,0,0|1,0,1]=4 5452 B13R1.1 CNC(CCO)c1ccc(cc1)Cl 34a_100000730317_200000210301 [1,1,0,0,0,0|1,0,1]=4 5453 B13R1.1 [13CH3]NC(CCO)c1ccc(cc1)Cl 2230a_100000730317_200025704644 [1,1,0,0,0,0|1,0,1]=4 5454 B13R1.1 [13CH3]NC(CCO)c1ccc(cc1)Cl 34a_100000730317_200025704644 [1,1,0,0,0,0|1,0,1]=4 5455 B13R1.21 C#CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_200000035995 [1,1,0,0,0,0|1,0,1]=4 5456 B13R1.21 CC(C#N)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000703298 [1,1,0,0,0,0|1,0,1]=4 5457 B13R1.21 CC(CO)N(C)c1ccc(cc1)Cl 2230a_100020629279_100012180447 [1,1,0,0,0,0|2,0,0]=4 5458 B13R1.21 CC(CO)N(C)c1ccc(cc1)Cl 34a_100020629279_100012180447 [1,1,0,0,0,0|2,0,0]=4 5459 B13R1.21 CC(S[13CH3])C(=O)c1ccc(cc1)Cl 62a_100000183210_200025704644 [1,1,0,0,0,0|2,0,0]=4 5460 B13R1.21 CC(S[13CH3])C(=O)c1ccc(cc1)Cl 62a_200025704644_100000183210 [1,1,0,0,0,0|2,0,0]=4 5461 B13R1.21 CCC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000758301 [1,1,0,0,0,0|1,1,0]=4 5462 B13R1.21 CCC(C)C(=O)c1ccc(cc1)C 1458a_100000188618_100000758301 [1,1,0,0,0,0|2,0,0]=4 5463 B13R1.21 CCC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000758301 [1,1,0,0,0,0|1,0,0]=3 5464 B13R1.21 CCC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000758301 [1,1,0,0,0,0|1,1,0]=4 5465 B13R1.21 CCC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000758301 [1,1,0,0,0,0|1,1,0]=4 5466 B13R1.21 CCC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000758301 [1,1,0,0,0,0|2,0,0]=4 5467 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Br 11a_100000225621_100000185839 [1,1,0,0,0,0|0,1,0]=3 5468 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Br 1626a_100000225621_100000185839 [1,1,0,0,0,0|0,1,0]=3 5469 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Br 240690a_100000225621_100000185839 [1,1,0,0,0,0|0,1,0]=3 5470 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Br 527a_100000225621_100000185839 [1,1,0,0,0,0|0,1,0]=3 5471 B13R1.21 CCN(C)C(=O)c1ccc(cc1)C 11a_100000225621_100000188618 [1,1,0,0,0,0|1,0,0]=3 5472 B13R1.21 CCN(C)C(=O)c1ccc(cc1)C 1626a_100000225621_100000188618 [1,1,0,0,0,0|1,0,0]=3 5473 B13R1.21 CCN(C)C(=O)c1ccc(cc1)C 240690a_100000225621_100000188618 [1,1,0,0,0,0|1,0,0]=3 5474 B13R1.21 CCN(C)C(=O)c1ccc(cc1)C 527a_100000225621_100000188618 [1,1,0,0,0,0|1,0,0]=3 5475 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Cl 11a_100000225621_100000210187 [1,1,0,0,0,0|0,0,0]=2 5476 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Cl 1626a_100000225621_100000210187 [1,1,0,0,0,0|0,0,0]=2 5477 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Cl 240690a_100000225621_100000210187 [1,1,0,0,0,0|0,0,0]=2 5478 B13R1.21 CCN(C)C(=O)c1ccc(cc1)Cl 527a_100000225621_100000210187 [1,1,0,0,0,0|0,0,0]=2 5479 B13R1.21 CCN(C)C(=O)c1ccc(cc1)F 11a_100000225621_100000187176 [1,1,0,0,0,0|0,1,0]=3 5480 B13R1.21 CCN(C)C(=O)c1ccc(cc1)F 1626a_100000225621_100000187176 [1,1,0,0,0,0|0,1,0]=3 5481 B13R1.21 CCN(C)C(=O)c1ccc(cc1)F 240690a_100000225621_100000187176 [1,1,0,0,0,0|0,1,0]=3 5482 B13R1.21 CCN(C)C(=O)c1ccc(cc1)F 527a_100000225621_100000187176 [1,1,0,0,0,0|0,1,0]=3 5483 B13R1.21 CCN(C)C(=O)c1ccc(cc1)I 11a_100000225621_100000187904 [1,1,0,0,0,0|0,1,0]=3 5484 B13R1.21 CCN(C)C(=O)c1ccc(cc1)I 1626a_100000225621_100000187904 [1,1,0,0,0,0|0,1,0]=3 5485 B13R1.21 CCN(C)C(=O)c1ccc(cc1)I 240690a_100000225621_100000187904 [1,1,0,0,0,0|0,1,0]=3 5486 B13R1.21 CCN(C)C(=O)c1ccc(cc1)I 527a_100000225621_100000187904 [1,1,0,0,0,0|0,1,0]=3 5487 B13R1.21 CCN(C)C(=O)c1ccc(cc1)O 240690a_100000225621_100000212099 [1,1,0,0,0,0|1,0,0]=3 5488 B13R1.21 CCN(C)C(=O)c1ccc(cc1)O 527a_100000225621_100000212099 [1,1,0,0,0,0|1,0,0]=3 5489 B13R1.21 CCN(C)C(C)c1ccc(cc1)Cl 2230a_100000225621_100000684792 [1,1,0,0,0,0|1,0,1]=4 5490 B13R1.21 CCN(C)C(C)c1ccc(cc1)Cl 2230a_100000231102_100000210202 [1,1,0,0,0,0|1,0,1]=4 5491 B13R1.21 CCN(C)C(C)c1ccc(cc1)Cl 269982a_100000225621_100000684792 [1,1,0,0,0,0|1,0,1]=4 5492 B13R1.21 CCN(C)C(C)c1ccc(cc1)Cl 269982a_100000231102_100000204670 [1,1,0,0,0,0|1,0,1]=4 5493 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Cl 2230a_106832991635_100000183210 [1,1,0,0,0,0|2,0,0]=4 5494 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Cl 7a_106832991635_100000183210 [1,1,0,0,0,0|2,0,0]=4 5495 B13R1.21 CON(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000153844 [1,1,0,0,0,0|2,0,0]=4 5496 B13R1.21 CSC(C)C(=O)c1ccc(cc1)Cl 62a_100000183210_200000210301 [1,1,0,0,0,0|2,0,0]=4 5497 B13R1.21 CSC(C)C(=O)c1ccc(cc1)Cl 62a_200000210301_100000183210 [1,1,0,0,0,0|2,0,0]=4 5498 B13R1.21 C[C@H](CO)N(C)c1ccc(cc1)Cl 269982a_100020629279_100016084084 [1,1,0,0,0,0|2,0,0]=4 5499 B13R1.29 CCNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_100000210202 [1,1,0,0,0,0|1,0,1]=4 5500 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br 270084a_100015525214_100000182491 [1,1,0,0,0,0|1,1,0]=4 5501 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br 274078a_100015525214_100000182491 [1,1,0,0,0,0|1,1,0]=4 5502 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Br 40a_100015525214_100010306709 [1,1,0,0,0,0|1,1,0]=4 5503 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C 270084a_100015525214_100000211267 [1,1,0,0,0,0|2,0,0]=4 5504 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C 274078a_100015525214_100000211267 [1,1,0,0,0,0|2,0,0]=4 5505 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)C 40a_100015525214_100000039673 [1,1,0,0,0,0|2,0,0]=4 5506 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100015525214_100000209962 [1,1,0,0,0,0|1,0,0]=3 5507 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100015525214_100000209962 [1,1,0,0,0,0|1,0,0]=3 5508 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)Cl 40a_100015525214_100000077732 [1,1,0,0,0,0|1,0,0]=3 5509 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)F 270084a_100015525214_100000184267 [1,1,0,0,0,0|1,1,0]=4 5510 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)F 274078a_100015525214_100000184267 [1,1,0,0,0,0|1,1,0]=4 5511 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)F 40a_100015525214_100000081159 [1,1,0,0,0,0|1,1,0]=4 5512 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)I 270084a_100015525214_100011205396 [1,1,0,0,0,0|1,1,0]=4 5513 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)I 274078a_100015525214_100011205396 [1,1,0,0,0,0|1,1,0]=4 5514 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)N 40a_100015525214_100000054796 [1,1,0,0,0,0|2,0,0]=4 5515 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 270084a_100015525214_100020667864 [1,1,0,0,0,0|2,0,0]=4 5516 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_200000165184 [1,1,0,0,0,0|2,0,0]=4 5517 B13R1.29 CCNS(=O)(=O)c1ccc(cc1)O 274078a_100015525214_100020667864 [1,1,0,0,0,0|2,0,0]=4 5518 B13R1.29 CCNS(=O)(=O)c1ccc(nc1)Cl 270084a_100015525214_100000184283 [1,1,0,0,0,0|2,0,0]=4 5519 B13R1.29 CCNS(=O)(=O)c1ccc(nc1)Cl 274078a_100015525214_100000184283 [1,1,0,0,0,0|2,0,0]=4 5520 B13R1.29 CNNS(=O)(=O)c1ccc(cc1)Cl 40a_100016993582_100000077732 [1,1,0,0,0,0|2,0,0]=4 5521 B13R1.132 C=C(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000748629 [1,1,0,0,0,0|1,0,1]=4 5522 B13R1.132 C=C(F)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100009893438 [1,1,0,0,0,0|1,0,1]=4 5523 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000070787_100000211071 [1,1,0,0,0,0|0,0,2]=4 5524 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210624 [1,1,0,0,0,0|1,1,0]=4 5525 B13R1.132 CC(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210624 [1,1,0,0,0,0|1,0,0]=3 5526 B13R1.132 CC(C)CC(=O)c1ccc(cc1)F 1458a_100000187176_100000210624 [1,1,0,0,0,0|1,1,0]=4 5527 B13R1.132 CC(C)CC(=O)c1ccc(cc1)I 1458a_100000187904_100000210624 [1,1,0,0,0,0|1,1,0]=4 5528 B13R1.132 CC(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000210624 [1,1,0,0,0,0|2,0,0]=4 5529 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 11a_100138425928_100000185839 [1,1,0,0,0,0|0,1,0]=3 5530 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 1626a_100138425928_100000185839 [1,1,0,0,0,0|0,1,0]=3 5531 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 240690a_100138425928_100000185839 [1,1,0,0,0,0|0,1,0]=3 5532 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Br 527a_100138425928_100000185839 [1,1,0,0,0,0|0,1,0]=3 5533 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 11a_100138425928_100000210187 [1,1,0,0,0,0|0,0,0]=2 5534 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 1626a_100138425928_100000210187 [1,1,0,0,0,0|0,0,0]=2 5535 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 240690a_100138425928_100000210187 [1,1,0,0,0,0|0,0,0]=2 5536 B13R1.132 CC(C)NC(=O)c1ccc(cc1)Cl 527a_100138425928_100000210187 [1,1,0,0,0,0|0,0,0]=2 5537 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 11a_100138425928_100000187176 [1,1,0,0,0,0|0,1,0]=3 5538 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 1626a_100138425928_100000187176 [1,1,0,0,0,0|0,1,0]=3 5539 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 240690a_100138425928_100000187176 [1,1,0,0,0,0|0,1,0]=3 5540 B13R1.132 CC(C)NC(=O)c1ccc(cc1)F 527a_100138425928_100000187176 [1,1,0,0,0,0|0,1,0]=3 5541 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 11a_100138425928_100000187904 [1,1,0,0,0,0|0,1,0]=3 5542 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 1626a_100138425928_100000187904 [1,1,0,0,0,0|0,1,0]=3 5543 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 240690a_100138425928_100000187904 [1,1,0,0,0,0|0,1,0]=3 5544 B13R1.132 CC(C)NC(=O)c1ccc(cc1)I 527a_100138425928_100000187904 [1,1,0,0,0,0|0,1,0]=3 5545 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 240690a_100138425928_100000212099 [1,1,0,0,0,0|1,0,0]=3 5546 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 271570a_203496583355_200000152628 [1,1,0,0,0,0|1,0,0]=3 5547 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 527a_100138425928_100000212099 [1,1,0,0,0,0|1,0,0]=3 5548 B13R1.132 CC(C)NC(=O)c1ccc(nc1)O 271570a_203496583355_100000157566 [1,1,0,0,0,0|2,0,0]=4 5549 B13R1.132 CC(C)NC(C)c1ccc(cc1)Cl 2230a_100138425928_100000684792 [1,1,0,0,0,0|1,0,1]=4 5550 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210206 [1,1,0,0,0,0|1,0,1]=4 5551 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210206 [1,1,0,0,0,0|1,0,1]=4 5552 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Br 1458a_100000185839_100011218427 [1,1,0,0,0,0|0,1,0]=3 5553 B13R1.132 CC(O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011218427 [1,1,0,0,0,0|0,0,0]=2 5554 B13R1.132 CC(O)CC(=O)c1ccc(cc1)F 1458a_100000187176_100011218427 [1,1,0,0,0,0|0,1,0]=3 5555 B13R1.132 CC(O)CC(=O)c1ccc(cc1)I 1458a_100000187904_100011218427 [1,1,0,0,0,0|0,1,0]=3 5556 B13R1.132 CC(O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011218427 [1,1,0,0,0,0|1,0,0]=3 5557 B13R1.132 CC(O)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100011218427 [1,1,0,0,0,0|2,0,0]=4 5558 B13R1.132 CC(O)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100011218427 [1,1,0,0,0,0|2,0,0]=4 5559 B13R1.132 CC(O)CN(C)c1ccc(cc1)Cl 34a_100020629279_100011218427 [1,1,0,0,0,0|2,0,0]=4 5560 B13R1.132 CN(C)CC(=O)c1ccc(cc1)Cl 269982a_100102631434_100000211071 [1,1,0,0,0,0|2,0,0]=4 5561 B13R1.132 C[C@@H](O)CN(C)c1ccc(cc1)Cl 2230a_100020629279_100009817552 [1,1,0,0,0,0|2,0,0]=4 5562 B13R1.132 C[C@@H](O)CN(C)c1ccc(cc1)Cl 269982a_100020629279_100009817552 [1,1,0,0,0,0|2,0,0]=4 5563 B13R1.132 C[C@@H](O)CN(C)c1ccc(cc1)Cl 34a_100020629279_100009817552 [1,1,0,0,0,0|2,0,0]=4 5564 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)C 1458a_100000188618_100000210624 [1,1,0,0,0,0|2,0,0]=4 5565 B13R1.132 Cc1ccc(cc1)C(=O)CC(C)O 1458a_100000188618_100011218427 [1,1,0,0,0,0|1,0,0]=3 5566 B13R1.132 Cc1ccc(cc1)C(=O)CC(F)F 1458a_100000188618_100011934356 [1,1,0,0,0,0|2,0,0]=4 5567 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 11a_100138425928_100000188618 [1,1,0,0,0,0|1,0,0]=3 5568 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 1626a_100138425928_100000188618 [1,1,0,0,0,0|1,0,0]=3 5569 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 240690a_100138425928_100000188618 [1,1,0,0,0,0|1,0,0]=3 5570 B13R1.132 Cc1ccc(cc1)C(=O)NC(C)C 527a_100138425928_100000188618 [1,1,0,0,0,0|1,0,0]=3 5571 B13R1.132 NC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000187820 [1,1,0,0,0,0|0,0,2]=4 5572 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Br 1458a_100000185839_100011934356 [1,1,0,0,0,0|1,1,0]=4 5573 B13R1.132 O=C(CC(F)F)c1ccc(cc1)Cl 1458a_100000210187_100011934356 [1,1,0,0,0,0|1,0,0]=3 5574 B13R1.132 O=C(CC(F)F)c1ccc(cc1)F 1458a_100000187176_100011934356 [1,1,0,0,0,0|1,1,0]=4 5575 B13R1.132 O=C(CC(F)F)c1ccc(cc1)I 1458a_100000187904_100011934356 [1,1,0,0,0,0|1,1,0]=4 5576 B13R1.132 O=C(CC(F)F)c1ccc(cc1)O 1458a_100000212099_100011934356 [1,1,0,0,0,0|2,0,0]=4 5577 B13R1.132 O=C(C[N+](=O)[O-])c1ccc(cc1)Cl 1458a_100000210187_100000761209 [1,1,0,0,0,0|1,0,1]=4 5578 B13R1.132 O=C([O-])CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100020667443 [1,1,0,0,0,0|0,0,2]=4 5579 B13R1.452 C#Cc1ccc(cc1)C(=O)CCC 1458a_100011217615_100000210303 [1,1,0,0,0,0|2,0,0]=4 5580 B13R1.452 C#Cc1ccc(cc1)C(=O)CCF 1458a_100011217615_100011217306 [1,1,0,0,0,0|2,0,0]=4 5581 B13R1.452 C#Cc1ccc(cc1)C(=O)CCO 1458a_100011217615_100000211926 [1,1,0,0,0,0|1,0,0]=3 5582 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 11a_100015525214_100011217615 [1,1,0,0,0,0|1,0,0]=3 5583 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 240690a_100015525214_100011217615 [1,1,0,0,0,0|1,0,0]=3 5584 B13R1.452 C#Cc1ccc(cc1)C(=O)NCC 527a_100015525214_100011217615 [1,1,0,0,0,0|1,0,0]=3 5585 B13R1.452 C#Cc1ccc(cc1)C(=O)NNC 22a_100016993582_100011217615 [1,1,0,0,0,0|2,0,0]=4 5586 B13R1.452 C=Cc1ccc(cc1)C(=O)CCC 1458a_100000687532_100000210303 [1,1,0,0,0,0|2,0,0]=4 5587 B13R1.452 C=Cc1ccc(cc1)C(=O)CCC 271570a_100011290941_100011267722 [1,1,0,0,0,0|2,0,0]=4 5588 B13R1.452 C=Cc1ccc(cc1)C(=O)CCF 1458a_100000687532_100011217306 [1,1,0,0,0,0|2,0,0]=4 5589 B13R1.452 C=Cc1ccc(cc1)C(=O)CCO 1458a_100000687532_100000211926 [1,1,0,0,0,0|1,0,0]=3 5590 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 11a_100015525214_100000687532 [1,1,0,0,0,0|1,0,0]=3 5591 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000687532 [1,1,0,0,0,0|1,0,0]=3 5592 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 271570a_100011290941_100000155177 [1,1,0,0,0,0|1,0,0]=3 5593 B13R1.452 C=Cc1ccc(cc1)C(=O)NCC 527a_100015525214_100000687532 [1,1,0,0,0,0|1,0,0]=3 5594 B13R1.452 C=Cc1ccc(cc1)C(=O)NNC 22a_100016993582_100000687532 [1,1,0,0,0,0|2,0,0]=4 5595 B13R1.452 C=Cc1ccc(cc1)C(=O)OCC 271570a_100011290941_100000170077 [1,1,0,0,0,0|2,0,0]=4 5596 B13R1.452 C=Cc1ccc(cn1)C(=O)NCC 271570a_100011290941_100000160145 [1,1,0,0,0,0|2,0,0]=4 5597 B13R1.452 C=Cc1ccc(nc1)C(=O)NCC 271570a_100011290941_200011781264 [1,1,0,0,0,0|2,0,0]=4 5598 B13R1.452 CCCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210303 [1,1,0,0,0,0|2,0,0]=4 5599 B13R1.452 CCCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210303 [1,1,0,0,0,0|2,0,0]=4 5600 B13R1.452 CCCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210303 [1,1,0,0,0,0|2,0,0]=4 5601 B13R1.452 CCCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210303 [1,1,0,0,0,0|2,0,0]=4 5602 B13R1.452 CCCC(=O)c1ccc(cc1)OC 34a_100011216482_200000210301 [1,1,0,0,0,0|2,0,0]=4 5603 B13R1.452 CCCC(=O)c1ccc(cc1)OC 7a_100011216482_200000210301 [1,1,0,0,0,0|2,0,0]=4 5604 B13R1.452 CCCC(=O)c1ccc(cc1)O[13CH3] 34a_100011216482_200025704644 [1,1,0,0,0,0|2,0,0]=4 5605 B13R1.452 CCCC(=O)c1ccc(cc1)O[13CH3] 7a_100011216482_200025704644 [1,1,0,0,0,0|2,0,0]=4 5606 B13R1.452 CCCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210303 [1,1,0,0,0,0|2,0,0]=4 5607 B13R1.452 CCCC(=O)c1ccc(cc1)SC 62a_100011267722_200000210301 [1,1,0,0,0,0|2,0,0]=4 5608 B13R1.452 CCCC(=O)c1ccc(cc1)SC 62a_200000210301_100011267722 [1,1,0,0,0,0|2,0,0]=4 5609 B13R1.452 CCCC(=O)c1ccc(cc1)S[13CH3] 62a_100011267722_200025704644 [1,1,0,0,0,0|2,0,0]=4 5610 B13R1.452 CCCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100011267722 [1,1,0,0,0,0|2,0,0]=4 5611 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 11a_100015525214_100000210717 [1,1,0,0,0,0|1,0,0]=3 5612 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 240690a_100015525214_100000210717 [1,1,0,0,0,0|1,0,0]=3 5613 B13R1.452 CCNC(=O)c1ccc(cc1)C#N 527a_100015525214_100000210717 [1,1,0,0,0,0|1,0,0]=3 5614 B13R1.452 CCNC(=O)c1ccc(cc1)CC 11a_100015525214_100000211226 [1,1,0,0,0,0|1,0,0]=3 5615 B13R1.452 CCNC(=O)c1ccc(cc1)CC 240690a_100015525214_100000211226 [1,1,0,0,0,0|1,0,0]=3 5616 B13R1.452 CCNC(=O)c1ccc(cc1)CC 527a_100015525214_100000211226 [1,1,0,0,0,0|1,0,0]=3 5617 B13R1.452 CCNC(=O)c1ccc(cc1)CO 240690a_100015525214_100000183892 [1,1,0,0,0,0|1,0,0]=3 5618 B13R1.452 CCNC(=O)c1ccc(cc1)NC 2230a_100000741011_200000210301 [1,1,0,0,0,0|1,0,0]=3 5619 B13R1.452 CCNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155177 [1,1,0,0,0,0|1,0,0]=3 5620 B13R1.452 CCNC(=O)c1ccc(cc1)NC 34a_100000741011_200000210301 [1,1,0,0,0,0|1,0,0]=3 5621 B13R1.452 CCNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000741011_200025704644 [1,1,0,0,0,0|1,0,0]=3 5622 B13R1.452 CCNC(=O)c1ccc(cc1)N[13CH3] 34a_100000741011_200025704644 [1,1,0,0,0,0|1,0,0]=3 5623 B13R1.452 CCNC(=O)c1ccc(cc1)OC 11a_100015525214_100000184203 [1,1,0,0,0,0|1,0,0]=3 5624 B13R1.452 CCNC(=O)c1ccc(cc1)OC 240690a_100015525214_100000184203 [1,1,0,0,0,0|1,0,0]=3 5625 B13R1.452 CCNC(=O)c1ccc(cc1)OC 527a_100015525214_100000184203 [1,1,0,0,0,0|1,0,0]=3 5626 B13R1.452 CCNC(=O)c1ccc(cc1)SC 11a_100015525214_100000189692 [1,1,0,0,0,0|1,0,0]=3 5627 B13R1.452 CCNC(=O)c1ccc(cc1)SC 240690a_100015525214_100000189692 [1,1,0,0,0,0|1,0,0]=3 5628 B13R1.452 CCNC(=O)c1ccc(cc1)SC 527a_100015525214_100000189692 [1,1,0,0,0,0|1,0,0]=3 5629 B13R1.452 CCNC(=O)c1ccc(cc1)SC 62a_100000155177_200000210301 [1,1,0,0,0,0|1,0,0]=3 5630 B13R1.452 CCNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155177 [1,1,0,0,0,0|1,0,0]=3 5631 B13R1.452 CCNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155177_200025704644 [1,1,0,0,0,0|1,0,0]=3 5632 B13R1.452 CCNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155177 [1,1,0,0,0,0|1,0,0]=3 5633 B13R1.452 CCNC(=O)c1ccc(cn1)NC 27a_100102657272_200011781264 [1,1,0,0,0,0|2,0,0]=4 5634 B13R1.452 CCNC(=O)c1ccc(cn1)SC 62a_200000210301_200011781264 [1,1,0,0,0,0|2,0,0]=4 5635 B13R1.452 CCNC(=O)c1ccc(cn1)SC 62a_200011781264_200000210301 [1,1,0,0,0,0|2,0,0]=4 5636 B13R1.452 CCNC(=O)c1ccc(cn1)S[13CH3] 62a_200011781264_200025704644 [1,1,0,0,0,0|2,0,0]=4 5637 B13R1.452 CCNC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_200011781264 [1,1,0,0,0,0|2,0,0]=4 5638 B13R1.452 CCNC(=O)c1ccc(nc1)NC 27a_100102657272_100000160145 [1,1,0,0,0,0|2,0,0]=4 5639 B13R1.452 CCNC(=O)c1ccc(nc1)SC 62a_100000160145_200000210301 [1,1,0,0,0,0|2,0,0]=4 5640 B13R1.452 CCNC(=O)c1ccc(nc1)SC 62a_200000210301_100000160145 [1,1,0,0,0,0|2,0,0]=4 5641 B13R1.452 CCNC(=O)c1ccc(nc1)S[13CH3] 62a_100000160145_200025704644 [1,1,0,0,0,0|2,0,0]=4 5642 B13R1.452 CCNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000160145 [1,1,0,0,0,0|2,0,0]=4 5643 B13R1.452 CCOC(=O)c1ccc(cc1)OC 34a_100000169885_200000210301 [1,1,0,0,0,0|2,0,0]=4 5644 B13R1.452 CCOC(=O)c1ccc(cc1)OC 7a_100000169885_200000210301 [1,1,0,0,0,0|2,0,0]=4 5645 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 34a_100000169885_200025704644 [1,1,0,0,0,0|2,0,0]=4 5646 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 7a_100000169885_200025704644 [1,1,0,0,0,0|2,0,0]=4 5647 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_100000169895_200000210301 [1,1,0,0,0,0|2,0,0]=4 5648 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_200000210301_100000169919 [1,1,0,0,0,0|2,0,0]=4 5649 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_100000169895_200025704644 [1,1,0,0,0,0|2,0,0]=4 5650 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000169919 [1,1,0,0,0,0|2,0,0]=4 5651 B13R1.452 CCc1ccc(cc1)C(=O)CCF 1458a_100000211226_100011217306 [1,1,0,0,0,0|2,0,0]=4 5652 B13R1.452 CCc1ccc(cc1)C(=O)CCO 1458a_100000211226_100000211926 [1,1,0,0,0,0|1,0,0]=3 5653 B13R1.452 CCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000211226 [1,1,0,0,0,0|2,0,0]=4 5654 B13R1.452 CNNC(=O)c1ccc(cc1)C#N 22a_100016993582_100000210717 [1,1,0,0,0,0|2,0,0]=4 5655 B13R1.452 CNNC(=O)c1ccc(cc1)CO 22a_100016993582_100000183892 [1,1,0,0,0,0|2,0,0]=4 5656 B13R1.452 CNNC(=O)c1ccc(cc1)OC 22a_100016993582_100000184203 [1,1,0,0,0,0|2,0,0]=4 5657 B13R1.452 CNNC(=O)c1ccc(cc1)SC 22a_100016993582_100000189692 [1,1,0,0,0,0|2,0,0]=4 5658 B13R1.452 COc1ccc(cc1)C(=O)CCCl 7a_100009879949_200000210301 [1,1,0,0,0,0|2,0,0]=4 5659 B13R1.452 COc1ccc(cc1)C(=O)CCF 1458a_100000184203_100011217306 [1,1,0,0,0,0|2,0,0]=4 5660 B13R1.452 COc1ccc(cc1)C(=O)CCO 1458a_100000184203_100000211926 [1,1,0,0,0,0|1,0,0]=3 5661 B13R1.452 CSc1ccc(cc1)C(=O)CCF 1458a_100000189692_100011217306 [1,1,0,0,0,0|2,0,0]=4 5662 B13R1.452 CSc1ccc(cc1)C(=O)CCO 1458a_100000189692_100000211926 [1,1,0,0,0,0|1,0,0]=3 5663 B13R1.452 N#Cc1ccc(cc1)C(=O)CCF 1458a_100000210717_100011217306 [1,1,0,0,0,0|2,0,0]=4 5664 B13R1.452 N#Cc1ccc(cc1)C(=O)CCO 1458a_100000210717_100000211926 [1,1,0,0,0,0|1,0,0]=3 5665 B13R1.452 O=C(CCF)c1ccc(cc1)CO 1458a_100000183892_100011217306 [1,1,0,0,0,0|2,0,0]=4 5666 B13R1.452 O=C(CCO)c1ccc(cc1)CO 1458a_100000183892_100000211926 [1,1,0,0,0,0|1,0,0]=3 5667 B13R1.452 [13CH3]Oc1ccc(cc1)C(=O)CCCl 7a_100009879949_200025704644 [1,1,0,0,0,0|2,0,0]=4 5668 B13R1.466 C#CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000184674 [1,1,0,0,0,0|1,0,1]=4 5669 B13R1.466 C#CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000184674 [1,1,0,0,0,0|1,0,1]=4 5670 B13R1.466 C#CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000184674 [1,1,0,0,0,0|1,0,1]=4 5671 B13R1.466 C#CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000184674 [1,1,0,0,0,0|1,0,1]=4 5672 B13R1.466 C#CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000184674 [1,1,0,0,0,0|1,0,1]=4 5673 B13R1.466 C#CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000184674 [1,1,0,0,0,0|1,0,1]=4 5674 B13R1.466 C=CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210623 [1,1,0,0,0,0|1,0,1]=4 5675 B13R1.466 C=CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210623 [1,1,0,0,0,0|1,0,1]=4 5676 B13R1.466 C=CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210623 [1,1,0,0,0,0|1,0,1]=4 5677 B13R1.466 C=CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210623 [1,1,0,0,0,0|1,0,1]=4 5678 B13R1.466 C=CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210623 [1,1,0,0,0,0|1,0,1]=4 5679 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210623 [1,1,0,0,0,0|1,0,1]=4 5680 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210303 [1,1,0,0,0,0|1,1,0]=4 5681 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210303 [1,1,0,0,0,0|2,0,0]=4 5682 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210303 [1,1,0,0,0,0|1,0,0]=3 5683 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210303 [1,1,0,0,0,0|1,1,0]=4 5684 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210303 [1,1,0,0,0,0|1,1,0]=4 5685 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210303 [1,1,0,0,0,0|2,0,0]=4 5686 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210303 [1,1,0,0,0,0|1,1,0]=4 5687 B13R1.466 CCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210303 [1,1,0,0,0,0|2,0,0]=4 5688 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210303 [1,1,0,0,0,0|1,0,0]=3 5689 B13R1.466 CCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210303 [1,1,0,0,0,0|1,1,0]=4 5690 B13R1.466 CCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210303 [1,1,0,0,0,0|1,1,0]=4 5691 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210303 [1,1,0,0,0,0|2,0,0]=4 5692 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012345043 [1,1,0,0,0,0|2,0,0]=4 5693 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210303 [1,1,0,0,0,0|1,1,0]=4 5694 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210303 [1,1,0,0,0,0|2,0,0]=4 5695 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210303 [1,1,0,0,0,0|1,0,0]=3 5696 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210303 [1,1,0,0,0,0|1,1,0]=4 5697 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210303 [1,1,0,0,0,0|1,1,0]=4 5698 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210303 [1,1,0,0,0,0|2,0,0]=4 5699 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210303 [1,1,0,0,0,0|1,1,0]=4 5700 B13R1.466 CCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210303 [1,1,0,0,0,0|2,0,0]=4 5701 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210303 [1,1,0,0,0,0|1,0,0]=3 5702 B13R1.466 CCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210303 [1,1,0,0,0,0|1,1,0]=4 5703 B13R1.466 CCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210303 [1,1,0,0,0,0|1,1,0]=4 5704 B13R1.466 CCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210303 [1,1,0,0,0,0|2,0,0]=4 5705 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210303 [1,1,0,0,0,0|1,1,0]=4 5706 B13R1.466 CCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210303 [1,1,0,0,0,0|2,0,0]=4 5707 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210303 [1,1,0,0,0,0|1,0,0]=3 5708 B13R1.466 CCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210303 [1,1,0,0,0,0|1,1,0]=4 5709 B13R1.466 CCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210303 [1,1,0,0,0,0|1,1,0]=4 5710 B13R1.466 CCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210303 [1,1,0,0,0,0|2,0,0]=4 5711 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210303 [1,1,0,0,0,0|1,1,0]=4 5712 B13R1.466 CCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210303 [1,1,0,0,0,0|2,0,0]=4 5713 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210303 [1,1,0,0,0,0|1,0,0]=3 5714 B13R1.466 CCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210303 [1,1,0,0,0,0|1,1,0]=4 5715 B13R1.466 CCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210303 [1,1,0,0,0,0|1,1,0]=4 5716 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210303 [1,1,0,0,0,0|2,0,0]=4 5717 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 11a_100015525214_100012339404 [1,1,0,0,0,0|0,1,0]=3 5718 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 240690a_100015525214_100012339404 [1,1,0,0,0,0|0,1,0]=3 5719 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Br 527a_100015525214_100012339404 [1,1,0,0,0,0|0,1,0]=3 5720 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 11a_100015525214_100000186397 [1,1,0,0,0,0|1,0,0]=3 5721 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 240690a_100015525214_100000186397 [1,1,0,0,0,0|1,0,0]=3 5722 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)C 527a_100015525214_100000186397 [1,1,0,0,0,0|1,0,0]=3 5723 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 11a_100015525214_100000691181 [1,1,0,0,0,0|0,0,0]=2 5724 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100015525214_100000691181 [1,1,0,0,0,0|0,0,0]=2 5725 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100015525214_100000691181 [1,1,0,0,0,0|0,0,0]=2 5726 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 11a_100015525214_100000760357 [1,1,0,0,0,0|0,1,0]=3 5727 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 240690a_100015525214_100000760357 [1,1,0,0,0,0|0,1,0]=3 5728 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)F 527a_100015525214_100000760357 [1,1,0,0,0,0|0,1,0]=3 5729 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 11a_100015525214_100000739115 [1,1,0,0,0,0|0,1,0]=3 5730 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 240690a_100015525214_100000739115 [1,1,0,0,0,0|0,1,0]=3 5731 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)I 527a_100015525214_100000739115 [1,1,0,0,0,0|0,1,0]=3 5732 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)O 240690a_100015525214_100000189672 [1,1,0,0,0,0|1,0,0]=3 5733 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 11a_100015525214_100000692631 [1,1,0,0,0,0|0,1,0]=3 5734 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 240690a_100015525214_100000692631 [1,1,0,0,0,0|0,1,0]=3 5735 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Br 527a_100015525214_100000692631 [1,1,0,0,0,0|0,1,0]=3 5736 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 11a_100015525214_100000210898 [1,1,0,0,0,0|1,0,0]=3 5737 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 240690a_100015525214_100000210898 [1,1,0,0,0,0|1,0,0]=3 5738 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 527a_100015525214_100000210898 [1,1,0,0,0,0|1,0,0]=3 5739 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 11a_100015525214_100000686306 [1,1,0,0,0,0|0,0,0]=2 5740 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 240690a_100015525214_100000686306 [1,1,0,0,0,0|0,0,0]=2 5741 B13R1.466 CCNC(=O)c1ccc(c(c1)C)Cl 527a_100015525214_100000686306 [1,1,0,0,0,0|0,0,0]=2 5742 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 11a_100015525214_100000751819 [1,1,0,0,0,0|0,1,0]=3 5743 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 240690a_100015525214_100000751819 [1,1,0,0,0,0|0,1,0]=3 5744 B13R1.466 CCNC(=O)c1ccc(c(c1)C)F 527a_100015525214_100000751819 [1,1,0,0,0,0|0,1,0]=3 5745 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 11a_100015525214_100000751300 [1,1,0,0,0,0|0,1,0]=3 5746 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 240690a_100015525214_100000751300 [1,1,0,0,0,0|0,1,0]=3 5747 B13R1.466 CCNC(=O)c1ccc(c(c1)C)I 527a_100015525214_100000751300 [1,1,0,0,0,0|0,1,0]=3 5748 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 240690a_100015525214_100000685612 [1,1,0,0,0,0|1,0,0]=3 5749 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012357431 [1,1,0,0,0,0|1,0,0]=3 5750 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 11a_100015525214_100000687082 [1,1,0,0,0,0|0,1,0]=3 5751 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100015525214_100000687082 [1,1,0,0,0,0|0,1,0]=3 5752 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Br 527a_100015525214_100000687082 [1,1,0,0,0,0|0,1,0]=3 5753 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 11a_100015525214_100000751740 [1,1,0,0,0,0|1,0,0]=3 5754 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 240690a_100015525214_100000751740 [1,1,0,0,0,0|1,0,0]=3 5755 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)C 527a_100015525214_100000751740 [1,1,0,0,0,0|1,0,0]=3 5756 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100015525214_100000210401 [1,1,0,0,0,0|0,0,0]=2 5757 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100015525214_100000210401 [1,1,0,0,0,0|0,0,0]=2 5758 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100015525214_100000210401 [1,1,0,0,0,0|0,0,0]=2 5759 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 11a_100015525214_100000686462 [1,1,0,0,0,0|0,1,0]=3 5760 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 240690a_100015525214_100000686462 [1,1,0,0,0,0|0,1,0]=3 5761 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)F 527a_100015525214_100000686462 [1,1,0,0,0,0|0,1,0]=3 5762 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 11a_100015525214_100000684831 [1,1,0,0,0,0|0,1,0]=3 5763 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 240690a_100015525214_100000684831 [1,1,0,0,0,0|0,1,0]=3 5764 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)I 527a_100015525214_100000684831 [1,1,0,0,0,0|0,1,0]=3 5765 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 240690a_100015525214_100000212196 [1,1,0,0,0,0|1,0,0]=3 5766 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 527a_100015525214_100000212196 [1,1,0,0,0,0|1,0,0]=3 5767 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 11a_100015525214_100000743946 [1,1,0,0,0,0|0,1,0]=3 5768 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 240690a_100015525214_100000743946 [1,1,0,0,0,0|0,1,0]=3 5769 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Br 527a_100015525214_100000743946 [1,1,0,0,0,0|0,1,0]=3 5770 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 11a_100015525214_100000212313 [1,1,0,0,0,0|1,0,0]=3 5771 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 240690a_100015525214_100000212313 [1,1,0,0,0,0|1,0,0]=3 5772 B13R1.466 CCNC(=O)c1ccc(c(c1)F)C 527a_100015525214_100000212313 [1,1,0,0,0,0|1,0,0]=3 5773 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 11a_100015525214_100000743183 [1,1,0,0,0,0|0,0,0]=2 5774 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 240690a_100015525214_100000743183 [1,1,0,0,0,0|0,0,0]=2 5775 B13R1.466 CCNC(=O)c1ccc(c(c1)F)Cl 527a_100015525214_100000743183 [1,1,0,0,0,0|0,0,0]=2 5776 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 11a_100015525214_100000209822 [1,1,0,0,0,0|0,1,0]=3 5777 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 240690a_100015525214_100000209822 [1,1,0,0,0,0|0,1,0]=3 5778 B13R1.466 CCNC(=O)c1ccc(c(c1)F)F 527a_100015525214_100000209822 [1,1,0,0,0,0|0,1,0]=3 5779 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 11a_100015525214_100000062624 [1,1,0,0,0,0|0,1,0]=3 5780 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 240690a_100015525214_100000062624 [1,1,0,0,0,0|0,1,0]=3 5781 B13R1.466 CCNC(=O)c1ccc(c(c1)F)I 527a_100015525214_100000062624 [1,1,0,0,0,0|0,1,0]=3 5782 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 240690a_100015525214_100000185466 [1,1,0,0,0,0|1,0,0]=3 5783 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 527a_100015525214_100000185466 [1,1,0,0,0,0|1,0,0]=3 5784 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 11a_100015525214_100012343876 [1,1,0,0,0,0|0,1,0]=3 5785 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 240690a_100015525214_100012343876 [1,1,0,0,0,0|0,1,0]=3 5786 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Br 527a_100015525214_100012343876 [1,1,0,0,0,0|0,1,0]=3 5787 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 11a_100015525214_100000751299 [1,1,0,0,0,0|1,0,0]=3 5788 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 240690a_100015525214_100000751299 [1,1,0,0,0,0|1,0,0]=3 5789 B13R1.466 CCNC(=O)c1ccc(c(c1)I)C 527a_100015525214_100000751299 [1,1,0,0,0,0|1,0,0]=3 5790 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 11a_100015525214_100000739381 [1,1,0,0,0,0|0,0,0]=2 5791 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 240690a_100015525214_100000739381 [1,1,0,0,0,0|0,0,0]=2 5792 B13R1.466 CCNC(=O)c1ccc(c(c1)I)Cl 527a_100015525214_100000739381 [1,1,0,0,0,0|0,0,0]=2 5793 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 11a_100015525214_100000688015 [1,1,0,0,0,0|0,1,0]=3 5794 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 240690a_100015525214_100000688015 [1,1,0,0,0,0|0,1,0]=3 5795 B13R1.466 CCNC(=O)c1ccc(c(c1)I)F 527a_100015525214_100000688015 [1,1,0,0,0,0|0,1,0]=3 5796 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 11a_100015525214_100000725830 [1,1,0,0,0,0|0,1,0]=3 5797 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 240690a_100015525214_100000725830 [1,1,0,0,0,0|0,1,0]=3 5798 B13R1.466 CCNC(=O)c1ccc(c(c1)I)I 527a_100015525214_100000725830 [1,1,0,0,0,0|0,1,0]=3 5799 B13R1.466 CCNC(=O)c1ccc(c(c1)I)O 240690a_100015525214_100000037485 [1,1,0,0,0,0|1,0,0]=3 5800 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 240690a_100015525214_100000689001 [1,1,0,0,0,0|0,1,0]=3 5801 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 527a_100015525214_100000689001 [1,1,0,0,0,0|0,1,0]=3 5802 B13R1.466 CCNC(=O)c1ccc(c(c1)O)C 240690a_100015525214_100000233767 [1,1,0,0,0,0|1,0,0]=3 5803 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 240690a_100015525214_100011933997 [1,1,0,0,0,0|0,0,0]=2 5804 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 527a_100015525214_100011933997 [1,1,0,0,0,0|0,0,0]=2 5805 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 240690a_100015525214_100000035894 [1,1,0,0,0,0|0,1,0]=3 5806 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359900 [1,1,0,0,0,0|0,1,0]=3 5807 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 527a_100015525214_100000035894 [1,1,0,0,0,0|0,1,0]=3 5808 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 240690a_100015525214_100000239334 [1,1,0,0,0,0|0,1,0]=3 5809 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 527a_100015525214_100000239334 [1,1,0,0,0,0|0,1,0]=3 5810 B13R1.466 CCNC(C)c1ccc(c(c1)Br)Cl 269862a_100015525214_100012356427 [1,1,0,0,0,0|1,0,1]=4 5811 B13R1.466 CCNC(C)c1ccc(c(c1)C)Cl 269862a_100015525214_100011216000 [1,1,0,0,0,0|1,0,1]=4 5812 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100000210202 [1,1,0,0,0,0|1,0,1]=4 5813 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)Cl 269862a_100015525214_100000210641 [1,1,0,0,0,0|1,0,1]=4 5814 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_100000210202 [1,1,0,0,0,0|1,0,1]=4 5815 B13R1.466 CCNC(C)c1ccc(c(c1)F)Cl 269862a_100015525214_100000693814 [1,1,0,0,0,0|1,0,1]=4 5816 B13R1.466 CCN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_100000210202 [1,1,0,0,0,0|1,0,1]=4 5817 B13R1.466 CCN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_100000210202 [1,1,0,0,0,0|1,0,1]=4 5818 B13R1.466 CCOC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294787 [1,1,0,0,0,0|2,0,0]=4 5819 B13R1.466 CCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100012229600 [1,1,0,0,0,0|2,0,0]=4 5820 B13R1.466 CCOC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_200012351148 [1,1,0,0,0,0|2,0,0]=4 5821 B13R1.466 CCOC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100011533738 [1,1,0,0,0,0|2,0,0]=4 5822 B13R1.466 CCOC(=O)c1ccc(c(c1)N)O 271570a_203496583355_200011450955 [1,1,0,0,0,0|2,0,0]=4 5823 B13R1.466 CCOC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100012359631 [1,1,0,0,0,0|2,0,0]=4 5824 B13R1.466 CCOC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011934563 [1,1,0,0,0,0|1,1,0]=4 5825 B13R1.466 CCOC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100161115259 [1,1,0,0,0,0|2,0,0]=4 5826 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100009812659 [1,1,0,0,0,0|2,0,0]=4 5827 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012355281 [1,1,0,0,0,0|2,0,0]=4 5828 B13R1.466 CN(CCO)c1ccc(c(c1)Cl)Cl 2230a_100000219944_100000211926 [1,1,0,0,0,0|2,0,0]=4 5829 B13R1.466 CN(CCO)c1ccc(c(c1)Cl)Cl 269982a_100000219944_100000211926 [1,1,0,0,0,0|2,0,0]=4 5830 B13R1.466 CN(CCO)c1ccc(c(c1)Cl)Cl 34a_100000219944_100000211926 [1,1,0,0,0,0|2,0,0]=4 5831 B13R1.466 CNCC(=O)c1ccc(c(c1)C)Cl 7a_106832991635_200011216723 [1,1,0,0,0,0|2,0,0]=4 5832 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 2230a_106832991635_100000211430 [1,1,0,0,0,0|2,0,0]=4 5833 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 7a_106832991635_100000211430 [1,1,0,0,0,0|2,0,0]=4 5834 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 2230a_106832991635_100012351892 [1,1,0,0,0,0|2,0,0]=4 5835 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 34a_100102657272_100012351892 [1,1,0,0,0,0|2,0,0]=4 5836 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 7a_106832991635_100012351892 [1,1,0,0,0,0|2,0,0]=4 5837 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)Br 22a_100016993582_100012339404 [1,1,0,0,0,0|1,1,0]=4 5838 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)C 22a_100016993582_100000186397 [1,1,0,0,0,0|2,0,0]=4 5839 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)Cl 22a_100016993582_100000691181 [1,1,0,0,0,0|1,0,0]=3 5840 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)F 22a_100016993582_100000760357 [1,1,0,0,0,0|1,1,0]=4 5841 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)I 22a_100016993582_100000739115 [1,1,0,0,0,0|1,1,0]=4 5842 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)O 22a_100016993582_100000189672 [1,1,0,0,0,0|2,0,0]=4 5843 B13R1.466 CNNC(=O)c1ccc(c(c1)C)Br 22a_100016993582_100000692631 [1,1,0,0,0,0|1,1,0]=4 5844 B13R1.466 CNNC(=O)c1ccc(c(c1)C)C 22a_100016993582_100000210898 [1,1,0,0,0,0|2,0,0]=4 5845 B13R1.466 CNNC(=O)c1ccc(c(c1)C)Cl 22a_100016993582_100000686306 [1,1,0,0,0,0|1,0,0]=3 5846 B13R1.466 CNNC(=O)c1ccc(c(c1)C)F 22a_100016993582_100000751819 [1,1,0,0,0,0|1,1,0]=4 5847 B13R1.466 CNNC(=O)c1ccc(c(c1)C)I 22a_100016993582_100000751300 [1,1,0,0,0,0|1,1,0]=4 5848 B13R1.466 CNNC(=O)c1ccc(c(c1)C)O 22a_100016993582_100000685612 [1,1,0,0,0,0|2,0,0]=4 5849 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)Br 22a_100016993582_100000687082 [1,1,0,0,0,0|1,1,0]=4 5850 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)C 22a_100016993582_100000751740 [1,1,0,0,0,0|2,0,0]=4 5851 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)Cl 22a_100016993582_100000210401 [1,1,0,0,0,0|1,0,0]=3 5852 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)F 22a_100016993582_100000686462 [1,1,0,0,0,0|1,1,0]=4 5853 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)I 22a_100016993582_100000684831 [1,1,0,0,0,0|1,1,0]=4 5854 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)O 22a_100016993582_100000212196 [1,1,0,0,0,0|2,0,0]=4 5855 B13R1.466 CNNC(=O)c1ccc(c(c1)F)Br 22a_100016993582_100000743946 [1,1,0,0,0,0|1,1,0]=4 5856 B13R1.466 CNNC(=O)c1ccc(c(c1)F)C 22a_100016993582_100000212313 [1,1,0,0,0,0|2,0,0]=4 5857 B13R1.466 CNNC(=O)c1ccc(c(c1)F)Cl 22a_100016993582_100000743183 [1,1,0,0,0,0|1,0,0]=3 5858 B13R1.466 CNNC(=O)c1ccc(c(c1)F)F 22a_100016993582_100000209822 [1,1,0,0,0,0|1,1,0]=4 5859 B13R1.466 CNNC(=O)c1ccc(c(c1)F)I 22a_100016993582_100000062624 [1,1,0,0,0,0|1,1,0]=4 5860 B13R1.466 CNNC(=O)c1ccc(c(c1)F)O 22a_100016993582_100000185466 [1,1,0,0,0,0|2,0,0]=4 5861 B13R1.466 CNNC(=O)c1ccc(c(c1)I)Br 22a_100016993582_100012343876 [1,1,0,0,0,0|1,1,0]=4 5862 B13R1.466 CNNC(=O)c1ccc(c(c1)I)C 22a_100016993582_100000751299 [1,1,0,0,0,0|2,0,0]=4 5863 B13R1.466 CNNC(=O)c1ccc(c(c1)I)Cl 22a_100016993582_100000739381 [1,1,0,0,0,0|1,0,0]=3 5864 B13R1.466 CNNC(=O)c1ccc(c(c1)I)F 22a_100016993582_100000688015 [1,1,0,0,0,0|1,1,0]=4 5865 B13R1.466 CNNC(=O)c1ccc(c(c1)I)I 22a_100016993582_100000725830 [1,1,0,0,0,0|1,1,0]=4 5866 B13R1.466 CNNC(=O)c1ccc(c(c1)I)O 22a_100016993582_100000037485 [1,1,0,0,0,0|2,0,0]=4 5867 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Br 22a_100016993582_100000689001 [1,1,0,0,0,0|1,1,0]=4 5868 B13R1.466 CNNC(=O)c1ccc(c(c1)O)C 22a_100016993582_100000233767 [1,1,0,0,0,0|2,0,0]=4 5869 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Cl 22a_100016993582_100011933997 [1,1,0,0,0,0|1,0,0]=3 5870 B13R1.466 CNNC(=O)c1ccc(c(c1)O)F 22a_100016993582_100000035894 [1,1,0,0,0,0|1,1,0]=4 5871 B13R1.466 CNNC(=O)c1ccc(c(c1)O)I 22a_100016993582_100000239334 [1,1,0,0,0,0|1,1,0]=4 5872 B13R1.466 COCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_200000210301 [1,1,0,0,0,0|2,0,0]=4 5873 B13R1.466 COCC(=O)c1ccc(c(c1)F)Cl 34a_100138415774_100012351892 [1,1,0,0,0,0|2,0,0]=4 5874 B13R1.466 CSCC(=O)c1ccc(c(c1)C)Cl 62a_200000210301_200011216723 [1,1,0,0,0,0|2,0,0]=4 5875 B13R1.466 CSCC(=O)c1ccc(c(c1)C)Cl 62a_200011216723_200000210301 [1,1,0,0,0,0|2,0,0]=4 5876 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_200000210301 [1,1,0,0,0,0|2,0,0]=4 5877 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)Cl 62a_200000210301_100000211430 [1,1,0,0,0,0|2,0,0]=4 5878 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_200000210301 [1,1,0,0,0,0|2,0,0]=4 5879 B13R1.466 CSCC(=O)c1ccc(c(c1)F)Cl 62a_200000210301_100012351892 [1,1,0,0,0,0|2,0,0]=4 5880 B13R1.466 Cc1cc(ccc1Br)C(=O)CCF 1458a_100000692631_100011217306 [1,1,0,0,0,0|1,1,0]=4 5881 B13R1.466 Cc1cc(ccc1Br)C(=O)CCO 1458a_100000692631_100000211926 [1,1,0,0,0,0|0,1,0]=3 5882 B13R1.466 Cc1cc(ccc1Cl)C(=O)CC#N 1458a_100000686306_100011214920 [1,1,0,0,0,0|1,0,1]=4 5883 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCF 1458a_100000686306_100011217306 [1,1,0,0,0,0|1,0,0]=3 5884 B13R1.466 Cc1cc(ccc1Cl)C(=O)CCO 1458a_100000686306_100000211926 [1,1,0,0,0,0|0,0,0]=2 5885 B13R1.466 Cc1cc(ccc1Cl)C(=O)CS[13CH3] 62a_200011216723_200025704644 [1,1,0,0,0,0|2,0,0]=4 5886 B13R1.466 Cc1cc(ccc1Cl)C(=O)CS[13CH3] 62a_200025704644_200011216723 [1,1,0,0,0,0|2,0,0]=4 5887 B13R1.466 Cc1cc(ccc1Cl)N(C)CCO 2230a_114849113799_100000211926 [1,1,0,0,0,0|2,0,0]=4 5888 B13R1.466 Cc1cc(ccc1Cl)N(C)CCO 269982a_114849113799_100000211926 [1,1,0,0,0,0|2,0,0]=4 5889 B13R1.466 Cc1cc(ccc1Cl)N(C)CCO 34a_114849113799_100000211926 [1,1,0,0,0,0|2,0,0]=4 5890 B13R1.466 Cc1cc(ccc1F)C(=O)CCF 1458a_100000751819_100011217306 [1,1,0,0,0,0|1,1,0]=4 5891 B13R1.466 Cc1cc(ccc1F)C(=O)CCO 1458a_100000751819_100000211926 [1,1,0,0,0,0|0,1,0]=3 5892 B13R1.466 Cc1cc(ccc1I)C(=O)CCF 1458a_100000751300_100011217306 [1,1,0,0,0,0|1,1,0]=4 5893 B13R1.466 Cc1cc(ccc1I)C(=O)CCO 1458a_100000751300_100000211926 [1,1,0,0,0,0|0,1,0]=3 5894 B13R1.466 Cc1cc(ccc1O)C(=O)CCF 1458a_100000685612_100011217306 [1,1,0,0,0,0|2,0,0]=4 5895 B13R1.466 Cc1cc(ccc1O)C(=O)CCO 1458a_100000685612_100000211926 [1,1,0,0,0,0|1,0,0]=3 5896 B13R1.466 Cc1ccc(cc1Br)C(=O)CCF 1458a_100000186397_100011217306 [1,1,0,0,0,0|2,0,0]=4 5897 B13R1.466 Cc1ccc(cc1Br)C(=O)CCO 1458a_100000186397_100000211926 [1,1,0,0,0,0|1,0,0]=3 5898 B13R1.466 Cc1ccc(cc1C)C(=O)CCF 1458a_100000210898_100011217306 [1,1,0,0,0,0|2,0,0]=4 5899 B13R1.466 Cc1ccc(cc1C)C(=O)CCO 1458a_100000210898_100000211926 [1,1,0,0,0,0|1,0,0]=3 5900 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCF 1458a_100000751740_100011217306 [1,1,0,0,0,0|2,0,0]=4 5901 B13R1.466 Cc1ccc(cc1Cl)C(=O)CCO 1458a_100000751740_100000211926 [1,1,0,0,0,0|1,0,0]=3 5902 B13R1.466 Cc1ccc(cc1F)C(=O)CCF 1458a_100000212313_100011217306 [1,1,0,0,0,0|2,0,0]=4 5903 B13R1.466 Cc1ccc(cc1F)C(=O)CCO 1458a_100000212313_100000211926 [1,1,0,0,0,0|1,0,0]=3 5904 B13R1.466 Cc1ccc(cc1I)C(=O)CCF 1458a_100000751299_100011217306 [1,1,0,0,0,0|2,0,0]=4 5905 B13R1.466 Cc1ccc(cc1I)C(=O)CCO 1458a_100000751299_100000211926 [1,1,0,0,0,0|1,0,0]=3 5906 B13R1.466 Cc1ccc(cc1O)C(=O)CCF 1458a_100000233767_100011217306 [1,1,0,0,0,0|2,0,0]=4 5907 B13R1.466 Cc1ccc(cc1O)C(=O)CCO 1458a_100000233767_100000211926 [1,1,0,0,0,0|1,0,0]=3 5908 B13R1.466 N#CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011214920 [1,1,0,0,0,0|1,0,1]=4 5909 B13R1.466 N#CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011214920 [1,1,0,0,0,0|1,0,1]=4 5910 B13R1.466 N#CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100011214920 [1,1,0,0,0,0|1,0,1]=4 5911 B13R1.466 N#CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100011214920 [1,1,0,0,0,0|1,0,1]=4 5912 B13R1.466 N#CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100011214920 [1,1,0,0,0,0|1,0,1]=4 5913 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)Br 1458a_100012339404_100011217306 [1,1,0,0,0,0|1,1,0]=4 5914 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011217306 [1,1,0,0,0,0|1,0,0]=3 5915 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)F 1458a_100000760357_100011217306 [1,1,0,0,0,0|1,1,0]=4 5916 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)I 1458a_100000739115_100011217306 [1,1,0,0,0,0|1,1,0]=4 5917 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)O 1458a_100000189672_100011217306 [1,1,0,0,0,0|2,0,0]=4 5918 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100011217306 [1,1,0,0,0,0|1,1,0]=4 5919 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011217306 [1,1,0,0,0,0|1,0,0]=3 5920 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)F 1458a_100000686462_100011217306 [1,1,0,0,0,0|1,1,0]=4 5921 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)I 1458a_100000684831_100011217306 [1,1,0,0,0,0|1,1,0]=4 5922 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100011217306 [1,1,0,0,0,0|2,0,0]=4 5923 B13R1.466 O=C(CCF)c1ccc(c(c1)F)Br 1458a_100000743946_100011217306 [1,1,0,0,0,0|1,1,0]=4 5924 B13R1.466 O=C(CCF)c1ccc(c(c1)F)Cl 1458a_100000743183_100011217306 [1,1,0,0,0,0|1,0,0]=3 5925 B13R1.466 O=C(CCF)c1ccc(c(c1)F)F 1458a_100000209822_100011217306 [1,1,0,0,0,0|1,1,0]=4 5926 B13R1.466 O=C(CCF)c1ccc(c(c1)F)I 1458a_100000062624_100011217306 [1,1,0,0,0,0|1,1,0]=4 5927 B13R1.466 O=C(CCF)c1ccc(c(c1)F)O 1458a_100000185466_100011217306 [1,1,0,0,0,0|2,0,0]=4 5928 B13R1.466 O=C(CCF)c1ccc(c(c1)I)Br 1458a_100012343876_100011217306 [1,1,0,0,0,0|1,1,0]=4 5929 B13R1.466 O=C(CCF)c1ccc(c(c1)I)Cl 1458a_100000739381_100011217306 [1,1,0,0,0,0|1,0,0]=3 5930 B13R1.466 O=C(CCF)c1ccc(c(c1)I)F 1458a_100000688015_100011217306 [1,1,0,0,0,0|1,1,0]=4 5931 B13R1.466 O=C(CCF)c1ccc(c(c1)I)I 1458a_100000725830_100011217306 [1,1,0,0,0,0|1,1,0]=4 5932 B13R1.466 O=C(CCF)c1ccc(c(c1)I)O 1458a_100000037485_100011217306 [1,1,0,0,0,0|2,0,0]=4 5933 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Br 1458a_100000689001_100011217306 [1,1,0,0,0,0|1,1,0]=4 5934 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100011217306 [1,1,0,0,0,0|1,0,0]=3 5935 B13R1.466 O=C(CCF)c1ccc(c(c1)O)F 1458a_100000035894_100011217306 [1,1,0,0,0,0|1,1,0]=4 5936 B13R1.466 O=C(CCF)c1ccc(c(c1)O)I 1458a_100000239334_100011217306 [1,1,0,0,0,0|1,1,0]=4 5937 B13R1.466 O=C(CCF)c1ccc(c(c1)O)O 1458a_100000212155_100011217306 [1,1,0,0,0,0|2,0,0]=4 5938 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)Br 1458a_100012339404_100000211926 [1,1,0,0,0,0|0,1,0]=3 5939 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000211926 [1,1,0,0,0,0|0,0,0]=2 5940 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)F 1458a_100000760357_100000211926 [1,1,0,0,0,0|0,1,0]=3 5941 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)I 1458a_100000739115_100000211926 [1,1,0,0,0,0|0,1,0]=3 5942 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)O 1458a_100000189672_100000211926 [1,1,0,0,0,0|1,0,0]=3 5943 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000211926 [1,1,0,0,0,0|0,1,0]=3 5944 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000211926 [1,1,0,0,0,0|0,0,0]=2 5945 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)F 1458a_100000686462_100000211926 [1,1,0,0,0,0|0,1,0]=3 5946 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)I 1458a_100000684831_100000211926 [1,1,0,0,0,0|0,1,0]=3 5947 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100000211926 [1,1,0,0,0,0|1,0,0]=3 5948 B13R1.466 O=C(CCO)c1ccc(c(c1)F)Br 1458a_100000743946_100000211926 [1,1,0,0,0,0|0,1,0]=3 5949 B13R1.466 O=C(CCO)c1ccc(c(c1)F)Cl 1458a_100000743183_100000211926 [1,1,0,0,0,0|0,0,0]=2 5950 B13R1.466 O=C(CCO)c1ccc(c(c1)F)F 1458a_100000209822_100000211926 [1,1,0,0,0,0|0,1,0]=3 5951 B13R1.466 O=C(CCO)c1ccc(c(c1)F)I 1458a_100000062624_100000211926 [1,1,0,0,0,0|0,1,0]=3 5952 B13R1.466 O=C(CCO)c1ccc(c(c1)F)O 1458a_100000185466_100000211926 [1,1,0,0,0,0|1,0,0]=3 5953 B13R1.466 O=C(CCO)c1ccc(c(c1)I)Br 1458a_100012343876_100000211926 [1,1,0,0,0,0|0,1,0]=3 5954 B13R1.466 O=C(CCO)c1ccc(c(c1)I)Cl 1458a_100000739381_100000211926 [1,1,0,0,0,0|0,0,0]=2 5955 B13R1.466 O=C(CCO)c1ccc(c(c1)I)F 1458a_100000688015_100000211926 [1,1,0,0,0,0|0,1,0]=3 5956 B13R1.466 O=C(CCO)c1ccc(c(c1)I)I 1458a_100000725830_100000211926 [1,1,0,0,0,0|0,1,0]=3 5957 B13R1.466 O=C(CCO)c1ccc(c(c1)I)O 1458a_100000037485_100000211926 [1,1,0,0,0,0|1,0,0]=3 5958 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Br 1458a_100000689001_100000211926 [1,1,0,0,0,0|0,1,0]=3 5959 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100000211926 [1,1,0,0,0,0|0,0,0]=2 5960 B13R1.466 O=C(CCO)c1ccc(c(c1)O)F 1458a_100000035894_100000211926 [1,1,0,0,0,0|0,1,0]=3 5961 B13R1.466 O=C(CCO)c1ccc(c(c1)O)I 1458a_100000239334_100000211926 [1,1,0,0,0,0|0,1,0]=3 5962 B13R1.466 O=C(CCO)c1ccc(c(c1)O)O 1458a_100000212155_100000211926 [1,1,0,0,0,0|1,0,0]=3 5963 B13R1.466 [13CH3]OCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_200025704644 [1,1,0,0,0,0|2,0,0]=4 5964 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_200025704644 [1,1,0,0,0,0|2,0,0]=4 5965 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)Cl 62a_200025704644_100000211430 [1,1,0,0,0,0|2,0,0]=4 5966 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_200025704644 [1,1,0,0,0,0|2,0,0]=4 5967 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)F)Cl 62a_200025704644_100012351892 [1,1,0,0,0,0|2,0,0]=4 5968 B13R1.1511 C#CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000184674 [1,1,0,0,0,0|1,0,1]=4 5969 B13R1.1511 C#CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000184674 [1,1,0,0,0,0|1,0,1]=4 5970 B13R1.1511 C#CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000184674 [1,1,0,0,0,0|1,0,1]=4 5971 B13R1.1511 C#CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000184674 [1,1,0,0,0,0|1,0,1]=4 5972 B13R1.1511 C#CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000184674 [1,1,0,0,0,0|1,0,1]=4 5973 B13R1.1511 C#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000184674 [1,1,0,0,0,0|1,0,1]=4 5974 B13R1.1511 C=CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210623 [1,1,0,0,0,0|1,0,1]=4 5975 B13R1.1511 C=CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210623 [1,1,0,0,0,0|1,0,1]=4 5976 B13R1.1511 C=CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210623 [1,1,0,0,0,0|1,0,1]=4 5977 B13R1.1511 C=CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210623 [1,1,0,0,0,0|1,0,1]=4 5978 B13R1.1511 C=CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210623 [1,1,0,0,0,0|1,0,1]=4 5979 B13R1.1511 C=CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210623 [1,1,0,0,0,0|1,0,1]=4 5980 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210303 [1,1,0,0,0,0|1,1,0]=4 5981 B13R1.1511 CCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210303 [1,1,0,0,0,0|2,0,0]=4 5982 B13R1.1511 CCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210303 [1,1,0,0,0,0|1,0,0]=3 5983 B13R1.1511 CCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210303 [1,1,0,0,0,0|1,1,0]=4 5984 B13R1.1511 CCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210303 [1,1,0,0,0,0|1,1,0]=4 5985 B13R1.1511 CCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210303 [1,1,0,0,0,0|2,0,0]=4 5986 B13R1.1511 CCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210303 [1,1,0,0,0,0|1,1,0]=4 5987 B13R1.1511 CCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210303 [1,1,0,0,0,0|2,0,0]=4 5988 B13R1.1511 CCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210303 [1,1,0,0,0,0|1,0,0]=3 5989 B13R1.1511 CCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210303 [1,1,0,0,0,0|1,1,0]=4 5990 B13R1.1511 CCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210303 [1,1,0,0,0,0|1,1,0]=4 5991 B13R1.1511 CCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210303 [1,1,0,0,0,0|2,0,0]=4 5992 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210303 [1,1,0,0,0,0|1,1,0]=4 5993 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210303 [1,1,0,0,0,0|2,0,0]=4 5994 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210303 [1,1,0,0,0,0|1,0,0]=3 5995 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210303 [1,1,0,0,0,0|1,1,0]=4 5996 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210303 [1,1,0,0,0,0|1,1,0]=4 5997 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210303 [1,1,0,0,0,0|2,0,0]=4 5998 B13R1.1511 CCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210303 [1,1,0,0,0,0|1,1,0]=4 5999 B13R1.1511 CCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210303 [1,1,0,0,0,0|2,0,0]=4 6000 B13R1.1511 CCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210303 [1,1,0,0,0,0|1,0,0]=3 6001 B13R1.1511 CCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210303 [1,1,0,0,0,0|1,1,0]=4 6002 B13R1.1511 CCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210303 [1,1,0,0,0,0|1,1,0]=4 6003 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210303 [1,1,0,0,0,0|2,0,0]=4 6004 B13R1.1511 CCCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012345046 [1,1,0,0,0,0|2,0,0]=4 6005 B13R1.1511 CCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210303 [1,1,0,0,0,0|1,1,0]=4 6006 B13R1.1511 CCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210303 [1,1,0,0,0,0|2,0,0]=4 6007 B13R1.1511 CCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210303 [1,1,0,0,0,0|1,0,0]=3 6008 B13R1.1511 CCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210303 [1,1,0,0,0,0|1,1,0]=4 6009 B13R1.1511 CCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210303 [1,1,0,0,0,0|1,1,0]=4 6010 B13R1.1511 CCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210303 [1,1,0,0,0,0|2,0,0]=4 6011 B13R1.1511 CCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210303 [1,1,0,0,0,0|1,0,0]=3 6012 B13R1.1511 CCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210303 [1,1,0,0,0,0|1,1,0]=4 6013 B13R1.1511 CCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210303 [1,1,0,0,0,0|1,1,0]=4 6014 B13R1.1511 CCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210303 [1,1,0,0,0,0|2,0,0]=4 6015 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 11a_100015525214_100000762965 [1,1,0,0,0,0|0,1,0]=3 6016 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 240690a_100015525214_100000762965 [1,1,0,0,0,0|0,1,0]=3 6017 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Br 527a_100015525214_100000762965 [1,1,0,0,0,0|0,1,0]=3 6018 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 11a_100015525214_100000685072 [1,1,0,0,0,0|1,0,0]=3 6019 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 240690a_100015525214_100000685072 [1,1,0,0,0,0|1,0,0]=3 6020 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 527a_100015525214_100000685072 [1,1,0,0,0,0|1,0,0]=3 6021 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 11a_100015525214_100000766353 [1,1,0,0,0,0|0,0,0]=2 6022 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 240690a_100015525214_100000766353 [1,1,0,0,0,0|0,0,0]=2 6023 B13R1.1511 CCNC(=O)c1ccc(cc1Br)Cl 527a_100015525214_100000766353 [1,1,0,0,0,0|0,0,0]=2 6024 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 11a_100015525214_100000212304 [1,1,0,0,0,0|0,1,0]=3 6025 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 240690a_100015525214_100000212304 [1,1,0,0,0,0|0,1,0]=3 6026 B13R1.1511 CCNC(=O)c1ccc(cc1Br)F 527a_100015525214_100000212304 [1,1,0,0,0,0|0,1,0]=3 6027 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 11a_100015525214_100012360512 [1,1,0,0,0,0|0,1,0]=3 6028 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 240690a_100015525214_100012360512 [1,1,0,0,0,0|0,1,0]=3 6029 B13R1.1511 CCNC(=O)c1ccc(cc1Br)I 527a_100015525214_100012360512 [1,1,0,0,0,0|0,1,0]=3 6030 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 240690a_100015525214_100012344906 [1,1,0,0,0,0|1,0,0]=3 6031 B13R1.1511 CCNC(=O)c1ccc(cc1Br)O 527a_100015525214_100012344906 [1,1,0,0,0,0|1,0,0]=3 6032 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 11a_100015525214_100000741311 [1,1,0,0,0,0|0,1,0]=3 6033 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 240690a_100015525214_100000741311 [1,1,0,0,0,0|0,1,0]=3 6034 B13R1.1511 CCNC(=O)c1ccc(cc1C)Br 527a_100015525214_100000741311 [1,1,0,0,0,0|0,1,0]=3 6035 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 11a_100015525214_100000211164 [1,1,0,0,0,0|1,0,0]=3 6036 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 240690a_100015525214_100000211164 [1,1,0,0,0,0|1,0,0]=3 6037 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 527a_100015525214_100000211164 [1,1,0,0,0,0|1,0,0]=3 6038 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 11a_100015525214_100000688705 [1,1,0,0,0,0|0,0,0]=2 6039 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 240690a_100015525214_100000688705 [1,1,0,0,0,0|0,0,0]=2 6040 B13R1.1511 CCNC(=O)c1ccc(cc1C)Cl 527a_100015525214_100000688705 [1,1,0,0,0,0|0,0,0]=2 6041 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 11a_100015525214_100000686989 [1,1,0,0,0,0|0,1,0]=3 6042 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 240690a_100015525214_100000686989 [1,1,0,0,0,0|0,1,0]=3 6043 B13R1.1511 CCNC(=O)c1ccc(cc1C)F 527a_100015525214_100000686989 [1,1,0,0,0,0|0,1,0]=3 6044 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 11a_100015525214_100010189873 [1,1,0,0,0,0|0,1,0]=3 6045 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 240690a_100015525214_100010189873 [1,1,0,0,0,0|0,1,0]=3 6046 B13R1.1511 CCNC(=O)c1ccc(cc1C)I 527a_100015525214_100010189873 [1,1,0,0,0,0|0,1,0]=3 6047 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 240690a_100015525214_100000692822 [1,1,0,0,0,0|1,0,0]=3 6048 B13R1.1511 CCNC(=O)c1ccc(cc1C)O 527a_100015525214_100000692822 [1,1,0,0,0,0|1,0,0]=3 6049 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 11a_100015525214_100000741628 [1,1,0,0,0,0|0,1,0]=3 6050 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 240690a_100015525214_100000741628 [1,1,0,0,0,0|0,1,0]=3 6051 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 527a_100015525214_100000741628 [1,1,0,0,0,0|0,1,0]=3 6052 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 11a_100015525214_100000766932 [1,1,0,0,0,0|1,0,0]=3 6053 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 240690a_100015525214_100000766932 [1,1,0,0,0,0|1,0,0]=3 6054 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 527a_100015525214_100000766932 [1,1,0,0,0,0|1,0,0]=3 6055 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 11a_100015525214_100000185840 [1,1,0,0,0,0|0,0,0]=2 6056 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100015525214_100000185840 [1,1,0,0,0,0|0,0,0]=2 6057 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 527a_100015525214_100000185840 [1,1,0,0,0,0|0,0,0]=2 6058 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 11a_100015525214_100000211397 [1,1,0,0,0,0|0,1,0]=3 6059 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 240690a_100015525214_100000211397 [1,1,0,0,0,0|0,1,0]=3 6060 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 527a_100015525214_100000211397 [1,1,0,0,0,0|0,1,0]=3 6061 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 11a_100015525214_100000751301 [1,1,0,0,0,0|0,1,0]=3 6062 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 240690a_100015525214_100000751301 [1,1,0,0,0,0|0,1,0]=3 6063 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 527a_100015525214_100000751301 [1,1,0,0,0,0|0,1,0]=3 6064 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 240690a_100015525214_100000702456 [1,1,0,0,0,0|1,0,0]=3 6065 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 527a_100015525214_100000702456 [1,1,0,0,0,0|1,0,0]=3 6066 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 11a_100015525214_100000214689 [1,1,0,0,0,0|0,1,0]=3 6067 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 240690a_100015525214_100000214689 [1,1,0,0,0,0|0,1,0]=3 6068 B13R1.1511 CCNC(=O)c1ccc(cc1F)Br 527a_100015525214_100000214689 [1,1,0,0,0,0|0,1,0]=3 6069 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 11a_100015525214_100000766033 [1,1,0,0,0,0|1,0,0]=3 6070 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 240690a_100015525214_100000766033 [1,1,0,0,0,0|1,0,0]=3 6071 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 527a_100015525214_100000766033 [1,1,0,0,0,0|1,0,0]=3 6072 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 11a_100015525214_100000212326 [1,1,0,0,0,0|0,0,0]=2 6073 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 240690a_100015525214_100000212326 [1,1,0,0,0,0|0,0,0]=2 6074 B13R1.1511 CCNC(=O)c1ccc(cc1F)Cl 527a_100015525214_100000212326 [1,1,0,0,0,0|0,0,0]=2 6075 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 11a_100015525214_100000211022 [1,1,0,0,0,0|0,1,0]=3 6076 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 240690a_100015525214_100000211022 [1,1,0,0,0,0|0,1,0]=3 6077 B13R1.1511 CCNC(=O)c1ccc(cc1F)F 527a_100015525214_100000211022 [1,1,0,0,0,0|0,1,0]=3 6078 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 11a_100015525214_100000037189 [1,1,0,0,0,0|0,1,0]=3 6079 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 240690a_100015525214_100000037189 [1,1,0,0,0,0|0,1,0]=3 6080 B13R1.1511 CCNC(=O)c1ccc(cc1F)I 527a_100015525214_100000037189 [1,1,0,0,0,0|0,1,0]=3 6081 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 240690a_100015525214_100000689029 [1,1,0,0,0,0|1,0,0]=3 6082 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 271570a_203496583355_200000215476 [1,1,0,0,0,0|1,0,0]=3 6083 B13R1.1511 CCNC(=O)c1ccc(cc1F)O 527a_100015525214_100000689029 [1,1,0,0,0,0|1,0,0]=3 6084 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 11a_100015525214_100000751167 [1,1,0,0,0,0|0,1,0]=3 6085 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 240690a_100015525214_100000751167 [1,1,0,0,0,0|0,1,0]=3 6086 B13R1.1511 CCNC(=O)c1ccc(cc1I)Br 527a_100015525214_100000751167 [1,1,0,0,0,0|0,1,0]=3 6087 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 11a_100015525214_100009999607 [1,1,0,0,0,0|1,0,0]=3 6088 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 240690a_100015525214_100009999607 [1,1,0,0,0,0|1,0,0]=3 6089 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 527a_100015525214_100009999607 [1,1,0,0,0,0|1,0,0]=3 6090 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 11a_100015525214_100000739380 [1,1,0,0,0,0|0,0,0]=2 6091 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 240690a_100015525214_100000739380 [1,1,0,0,0,0|0,0,0]=2 6092 B13R1.1511 CCNC(=O)c1ccc(cc1I)Cl 527a_100015525214_100000739380 [1,1,0,0,0,0|0,0,0]=2 6093 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 11a_100015525214_100000739341 [1,1,0,0,0,0|0,1,0]=3 6094 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 240690a_100015525214_100000739341 [1,1,0,0,0,0|0,1,0]=3 6095 B13R1.1511 CCNC(=O)c1ccc(cc1I)F 527a_100015525214_100000739341 [1,1,0,0,0,0|0,1,0]=3 6096 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 240690a_100015525214_100000744433 [1,1,0,0,0,0|0,1,0]=3 6097 B13R1.1511 CCNC(=O)c1ccc(cc1O)Br 527a_100015525214_100000744433 [1,1,0,0,0,0|0,1,0]=3 6098 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 240690a_100015525214_100000212137 [1,1,0,0,0,0|1,0,0]=3 6099 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 527a_100015525214_100000212137 [1,1,0,0,0,0|1,0,0]=3 6100 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 11a_100015525214_100000188622 [1,1,0,0,0,0|0,0,0]=2 6101 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 240690a_100015525214_100000188622 [1,1,0,0,0,0|0,0,0]=2 6102 B13R1.1511 CCNC(=O)c1ccc(cc1O)Cl 527a_100015525214_100000188622 [1,1,0,0,0,0|0,0,0]=2 6103 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 240690a_100015525214_100000746061 [1,1,0,0,0,0|0,1,0]=3 6104 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203945 [1,1,0,0,0,0|0,1,0]=3 6105 B13R1.1511 CCNC(=O)c1ccc(cc1O)F 527a_100015525214_100000746061 [1,1,0,0,0,0|0,1,0]=3 6106 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 240690a_100015525214_100000091984 [1,1,0,0,0,0|0,1,0]=3 6107 B13R1.1511 CCNC(=O)c1ccc(cc1O)I 527a_100015525214_100000091984 [1,1,0,0,0,0|0,1,0]=3 6108 B13R1.1511 CCNC(C)c1ccc(cc1Br)Cl 269862a_100015525214_100011934292 [1,1,0,0,0,0|1,0,1]=4 6109 B13R1.1511 CCNC(C)c1ccc(cc1C)Cl 269862a_100015525214_100011998434 [1,1,0,0,0,0|1,0,1]=4 6110 B13R1.1511 CCNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_100000210202 [1,1,0,0,0,0|1,0,1]=4 6111 B13R1.1511 CCNC(C)c1ccc(cc1Cl)Cl 269862a_100015525214_100000210972 [1,1,0,0,0,0|1,0,1]=4 6112 B13R1.1511 CCNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_100000210202 [1,1,0,0,0,0|1,0,1]=4 6113 B13R1.1511 CCNC(C)c1ccc(cc1F)Cl 269862a_100015525214_100011805184 [1,1,0,0,0,0|1,0,1]=4 6114 B13R1.1511 CCNC(C)c1ccc(cc1O)Cl 269862a_100015525214_100000061402 [1,1,0,0,0,0|1,0,1]=4 6115 B13R1.1511 CCN[C@@H](C)c1ccc(cc1C)Cl 2230a_100020633667_100000210202 [1,1,0,0,0,0|1,0,1]=4 6116 B13R1.1511 CCN[C@@H](C)c1ccc(cc1C)Cl 34a_100020633667_100000210202 [1,1,0,0,0,0|1,0,1]=4 6117 B13R1.1511 CCOC(=O)c1ccc(cc1C)O 271570a_203496583355_100011327926 [1,1,0,0,0,0|2,0,0]=4 6118 B13R1.1511 CCOC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060723 [1,1,0,0,0,0|2,0,0]=4 6119 B13R1.1511 CCOC(=O)c1ccc(cc1F)O 271570a_203496583355_100010244673 [1,1,0,0,0,0|2,0,0]=4 6120 B13R1.1511 CCOC(=O)c1ccc(cc1O)C 271570a_203496583355_200012185120 [1,1,0,0,0,0|2,0,0]=4 6121 B13R1.1511 CCOC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047509 [1,1,0,0,0,0|1,0,0]=3 6122 B13R1.1511 CCOC(=O)c1ccc(cc1O)F 271570a_203496583355_100011206307 [1,1,0,0,0,0|1,1,0]=4 6123 B13R1.1511 CN(CCO)c1ccc(cc1Br)Cl 269982a_100020633009_100000211926 [1,1,0,0,0,0|2,0,0]=4 6124 B13R1.1511 CN(CCO)c1ccc(cc1Br)Cl 34a_100020633009_100000211926 [1,1,0,0,0,0|2,0,0]=4 6125 B13R1.1511 CN(CCO)c1ccc(cc1Cl)Cl 269982a_114849113696_100000211926 [1,1,0,0,0,0|2,0,0]=4 6126 B13R1.1511 CN(CCO)c1ccc(cc1Cl)Cl 34a_114849113696_100000211926 [1,1,0,0,0,0|2,0,0]=4 6127 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)Cl 2230a_106832991635_100011218845 [1,1,0,0,0,0|2,0,0]=4 6128 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 34a_100102657272_100012351891 [1,1,0,0,0,0|2,0,0]=4 6129 B13R1.1511 CNCC(=O)c1ccc(cc1F)Cl 7a_106832991635_100012351891 [1,1,0,0,0,0|2,0,0]=4 6130 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Br 22a_100016993582_100000762965 [1,1,0,0,0,0|1,1,0]=4 6131 B13R1.1511 CNNC(=O)c1ccc(cc1Br)C 22a_100016993582_100000685072 [1,1,0,0,0,0|2,0,0]=4 6132 B13R1.1511 CNNC(=O)c1ccc(cc1Br)Cl 22a_100016993582_100000766353 [1,1,0,0,0,0|1,0,0]=3 6133 B13R1.1511 CNNC(=O)c1ccc(cc1Br)F 22a_100016993582_100000212304 [1,1,0,0,0,0|1,1,0]=4 6134 B13R1.1511 CNNC(=O)c1ccc(cc1Br)I 22a_100016993582_100012360512 [1,1,0,0,0,0|1,1,0]=4 6135 B13R1.1511 CNNC(=O)c1ccc(cc1Br)O 22a_100016993582_100012344906 [1,1,0,0,0,0|2,0,0]=4 6136 B13R1.1511 CNNC(=O)c1ccc(cc1C)Br 22a_100016993582_100000741311 [1,1,0,0,0,0|1,1,0]=4 6137 B13R1.1511 CNNC(=O)c1ccc(cc1C)C 22a_100016993582_100000211164 [1,1,0,0,0,0|2,0,0]=4 6138 B13R1.1511 CNNC(=O)c1ccc(cc1C)Cl 22a_100016993582_100000688705 [1,1,0,0,0,0|1,0,0]=3 6139 B13R1.1511 CNNC(=O)c1ccc(cc1C)F 22a_100016993582_100000686989 [1,1,0,0,0,0|1,1,0]=4 6140 B13R1.1511 CNNC(=O)c1ccc(cc1C)I 22a_100016993582_100010189873 [1,1,0,0,0,0|1,1,0]=4 6141 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Br 22a_100016993582_100000741628 [1,1,0,0,0,0|1,1,0]=4 6142 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)C 22a_100016993582_100000766932 [1,1,0,0,0,0|2,0,0]=4 6143 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)Cl 22a_100016993582_100000185840 [1,1,0,0,0,0|1,0,0]=3 6144 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)F 22a_100016993582_100000211397 [1,1,0,0,0,0|1,1,0]=4 6145 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)I 22a_100016993582_100000751301 [1,1,0,0,0,0|1,1,0]=4 6146 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)O 22a_100016993582_100000702456 [1,1,0,0,0,0|2,0,0]=4 6147 B13R1.1511 CNNC(=O)c1ccc(cc1F)Br 22a_100016993582_100000214689 [1,1,0,0,0,0|1,1,0]=4 6148 B13R1.1511 CNNC(=O)c1ccc(cc1F)C 22a_100016993582_100000766033 [1,1,0,0,0,0|2,0,0]=4 6149 B13R1.1511 CNNC(=O)c1ccc(cc1F)Cl 22a_100016993582_100000212326 [1,1,0,0,0,0|1,0,0]=3 6150 B13R1.1511 CNNC(=O)c1ccc(cc1F)F 22a_100016993582_100000211022 [1,1,0,0,0,0|1,1,0]=4 6151 B13R1.1511 CNNC(=O)c1ccc(cc1F)I 22a_100016993582_100000037189 [1,1,0,0,0,0|1,1,0]=4 6152 B13R1.1511 CNNC(=O)c1ccc(cc1F)O 22a_100016993582_100000689029 [1,1,0,0,0,0|2,0,0]=4 6153 B13R1.1511 CNNC(=O)c1ccc(cc1I)Br 22a_100016993582_100000751167 [1,1,0,0,0,0|1,1,0]=4 6154 B13R1.1511 CNNC(=O)c1ccc(cc1I)C 22a_100016993582_100009999607 [1,1,0,0,0,0|2,0,0]=4 6155 B13R1.1511 CNNC(=O)c1ccc(cc1I)Cl 22a_100016993582_100000739380 [1,1,0,0,0,0|1,0,0]=3 6156 B13R1.1511 CNNC(=O)c1ccc(cc1I)F 22a_100016993582_100000739341 [1,1,0,0,0,0|1,1,0]=4 6157 B13R1.1511 CNNC(=O)c1ccc(cc1O)Br 22a_100016993582_100000744433 [1,1,0,0,0,0|1,1,0]=4 6158 B13R1.1511 CNNC(=O)c1ccc(cc1O)C 22a_100016993582_100000212137 [1,1,0,0,0,0|2,0,0]=4 6159 B13R1.1511 CNNC(=O)c1ccc(cc1O)Cl 22a_100016993582_100000188622 [1,1,0,0,0,0|1,0,0]=3 6160 B13R1.1511 CNNC(=O)c1ccc(cc1O)F 22a_100016993582_100000746061 [1,1,0,0,0,0|1,1,0]=4 6161 B13R1.1511 CNNC(=O)c1ccc(cc1O)I 22a_100016993582_100000091984 [1,1,0,0,0,0|1,1,0]=4 6162 B13R1.1511 CNNC(=O)c1ccc(cc1O)O 22a_100016993582_100000212172 [1,1,0,0,0,0|2,0,0]=4 6163 B13R1.1511 COCC(=O)c1ccc(cc1F)Cl 34a_100138415774_100012351891 [1,1,0,0,0,0|2,0,0]=4 6164 B13R1.1511 CSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200000210301 [1,1,0,0,0,0|2,0,0]=4 6165 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200000210301 [1,1,0,0,0,0|2,0,0]=4 6166 B13R1.1511 CSCC(=O)c1ccc(cc1F)Cl 62a_200000210301_100012351891 [1,1,0,0,0,0|2,0,0]=4 6167 B13R1.1511 Cc1cc(ccc1C(=O)CC#N)Cl 1458a_100000688705_100011214920 [1,1,0,0,0,0|1,0,1]=4 6168 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Br 1458a_100000741311_100011217306 [1,1,0,0,0,0|1,1,0]=4 6169 B13R1.1511 Cc1cc(ccc1C(=O)CCF)Cl 1458a_100000688705_100011217306 [1,1,0,0,0,0|1,0,0]=3 6170 B13R1.1511 Cc1cc(ccc1C(=O)CCF)F 1458a_100000686989_100011217306 [1,1,0,0,0,0|1,1,0]=4 6171 B13R1.1511 Cc1cc(ccc1C(=O)CCF)I 1458a_100010189873_100011217306 [1,1,0,0,0,0|1,1,0]=4 6172 B13R1.1511 Cc1cc(ccc1C(=O)CCF)O 1458a_100000692822_100011217306 [1,1,0,0,0,0|2,0,0]=4 6173 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Br 1458a_100000741311_100000211926 [1,1,0,0,0,0|0,1,0]=3 6174 B13R1.1511 Cc1cc(ccc1C(=O)CCO)Cl 1458a_100000688705_100000211926 [1,1,0,0,0,0|0,0,0]=2 6175 B13R1.1511 Cc1cc(ccc1C(=O)CCO)F 1458a_100000686989_100000211926 [1,1,0,0,0,0|0,1,0]=3 6176 B13R1.1511 Cc1cc(ccc1C(=O)CCO)I 1458a_100010189873_100000211926 [1,1,0,0,0,0|0,1,0]=3 6177 B13R1.1511 Cc1cc(ccc1C(=O)CCO)O 1458a_100000692822_100000211926 [1,1,0,0,0,0|1,0,0]=3 6178 B13R1.1511 Cc1cc(ccc1N(C)CCO)Cl 2230a_114849113698_100000211926 [1,1,0,0,0,0|2,0,0]=4 6179 B13R1.1511 Cc1cc(ccc1N(C)CCO)Cl 269982a_114849113698_100000211926 [1,1,0,0,0,0|2,0,0]=4 6180 B13R1.1511 Cc1cc(ccc1N(C)CCO)Cl 34a_114849113698_100000211926 [1,1,0,0,0,0|2,0,0]=4 6181 B13R1.1511 Cc1cc(ccc1N(C)CCO)Cl 38a_114849113698_100000211926 [1,1,0,0,0,0|2,0,0]=4 6182 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCF 1458a_100000685072_100011217306 [1,1,0,0,0,0|2,0,0]=4 6183 B13R1.1511 Cc1ccc(c(c1)Br)C(=O)CCO 1458a_100000685072_100000211926 [1,1,0,0,0,0|1,0,0]=3 6184 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCF 1458a_100000211164_100011217306 [1,1,0,0,0,0|2,0,0]=4 6185 B13R1.1511 Cc1ccc(c(c1)C)C(=O)CCO 1458a_100000211164_100000211926 [1,1,0,0,0,0|1,0,0]=3 6186 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCF 1458a_100000766932_100011217306 [1,1,0,0,0,0|2,0,0]=4 6187 B13R1.1511 Cc1ccc(c(c1)Cl)C(=O)CCO 1458a_100000766932_100000211926 [1,1,0,0,0,0|1,0,0]=3 6188 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCF 1458a_100000766033_100011217306 [1,1,0,0,0,0|2,0,0]=4 6189 B13R1.1511 Cc1ccc(c(c1)F)C(=O)CCO 1458a_100000766033_100000211926 [1,1,0,0,0,0|1,0,0]=3 6190 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCF 1458a_100009999607_100011217306 [1,1,0,0,0,0|2,0,0]=4 6191 B13R1.1511 Cc1ccc(c(c1)I)C(=O)CCO 1458a_100009999607_100000211926 [1,1,0,0,0,0|1,0,0]=3 6192 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCF 1458a_100000212137_100011217306 [1,1,0,0,0,0|2,0,0]=4 6193 B13R1.1511 Cc1ccc(c(c1)O)C(=O)CCO 1458a_100000212137_100000211926 [1,1,0,0,0,0|1,0,0]=3 6194 B13R1.1511 N#CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011214920 [1,1,0,0,0,0|1,0,1]=4 6195 B13R1.1511 N#CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011214920 [1,1,0,0,0,0|1,0,1]=4 6196 B13R1.1511 N#CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011214920 [1,1,0,0,0,0|1,0,1]=4 6197 B13R1.1511 N#CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011214920 [1,1,0,0,0,0|1,0,1]=4 6198 B13R1.1511 N#CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011214920 [1,1,0,0,0,0|1,0,1]=4 6199 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Br 1458a_100000762965_100011217306 [1,1,0,0,0,0|1,1,0]=4 6200 B13R1.1511 O=C(CCF)c1ccc(cc1Br)Cl 1458a_100000766353_100011217306 [1,1,0,0,0,0|1,0,0]=3 6201 B13R1.1511 O=C(CCF)c1ccc(cc1Br)F 1458a_100000212304_100011217306 [1,1,0,0,0,0|1,1,0]=4 6202 B13R1.1511 O=C(CCF)c1ccc(cc1Br)I 1458a_100012360512_100011217306 [1,1,0,0,0,0|1,1,0]=4 6203 B13R1.1511 O=C(CCF)c1ccc(cc1Br)O 1458a_100012344906_100011217306 [1,1,0,0,0,0|2,0,0]=4 6204 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Br 1458a_100000741628_100011217306 [1,1,0,0,0,0|1,1,0]=4 6205 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100011217306 [1,1,0,0,0,0|1,0,0]=3 6206 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)F 1458a_100000211397_100011217306 [1,1,0,0,0,0|1,1,0]=4 6207 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)I 1458a_100000751301_100011217306 [1,1,0,0,0,0|1,1,0]=4 6208 B13R1.1511 O=C(CCF)c1ccc(cc1Cl)O 1458a_100000702456_100011217306 [1,1,0,0,0,0|2,0,0]=4 6209 B13R1.1511 O=C(CCF)c1ccc(cc1F)Br 1458a_100000214689_100011217306 [1,1,0,0,0,0|1,1,0]=4 6210 B13R1.1511 O=C(CCF)c1ccc(cc1F)Cl 1458a_100000212326_100011217306 [1,1,0,0,0,0|1,0,0]=3 6211 B13R1.1511 O=C(CCF)c1ccc(cc1F)F 1458a_100000211022_100011217306 [1,1,0,0,0,0|1,1,0]=4 6212 B13R1.1511 O=C(CCF)c1ccc(cc1F)I 1458a_100000037189_100011217306 [1,1,0,0,0,0|1,1,0]=4 6213 B13R1.1511 O=C(CCF)c1ccc(cc1F)O 1458a_100000689029_100011217306 [1,1,0,0,0,0|2,0,0]=4 6214 B13R1.1511 O=C(CCF)c1ccc(cc1I)Br 1458a_100000751167_100011217306 [1,1,0,0,0,0|1,1,0]=4 6215 B13R1.1511 O=C(CCF)c1ccc(cc1I)Cl 1458a_100000739380_100011217306 [1,1,0,0,0,0|1,0,0]=3 6216 B13R1.1511 O=C(CCF)c1ccc(cc1I)F 1458a_100000739341_100011217306 [1,1,0,0,0,0|1,1,0]=4 6217 B13R1.1511 O=C(CCF)c1ccc(cc1O)Br 1458a_100000744433_100011217306 [1,1,0,0,0,0|1,1,0]=4 6218 B13R1.1511 O=C(CCF)c1ccc(cc1O)Cl 1458a_100000188622_100011217306 [1,1,0,0,0,0|1,0,0]=3 6219 B13R1.1511 O=C(CCF)c1ccc(cc1O)F 1458a_100000746061_100011217306 [1,1,0,0,0,0|1,1,0]=4 6220 B13R1.1511 O=C(CCF)c1ccc(cc1O)I 1458a_100000091984_100011217306 [1,1,0,0,0,0|1,1,0]=4 6221 B13R1.1511 O=C(CCF)c1ccc(cc1O)O 1458a_100000212172_100011217306 [1,1,0,0,0,0|2,0,0]=4 6222 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Br 1458a_100000762965_100000211926 [1,1,0,0,0,0|0,1,0]=3 6223 B13R1.1511 O=C(CCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000211926 [1,1,0,0,0,0|0,0,0]=2 6224 B13R1.1511 O=C(CCO)c1ccc(cc1Br)F 1458a_100000212304_100000211926 [1,1,0,0,0,0|0,1,0]=3 6225 B13R1.1511 O=C(CCO)c1ccc(cc1Br)I 1458a_100012360512_100000211926 [1,1,0,0,0,0|0,1,0]=3 6226 B13R1.1511 O=C(CCO)c1ccc(cc1Br)O 1458a_100012344906_100000211926 [1,1,0,0,0,0|1,0,0]=3 6227 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000211926 [1,1,0,0,0,0|0,1,0]=3 6228 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000211926 [1,1,0,0,0,0|0,0,0]=2 6229 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)F 1458a_100000211397_100000211926 [1,1,0,0,0,0|0,1,0]=3 6230 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)I 1458a_100000751301_100000211926 [1,1,0,0,0,0|0,1,0]=3 6231 B13R1.1511 O=C(CCO)c1ccc(cc1Cl)O 1458a_100000702456_100000211926 [1,1,0,0,0,0|1,0,0]=3 6232 B13R1.1511 O=C(CCO)c1ccc(cc1F)Br 1458a_100000214689_100000211926 [1,1,0,0,0,0|0,1,0]=3 6233 B13R1.1511 O=C(CCO)c1ccc(cc1F)Cl 1458a_100000212326_100000211926 [1,1,0,0,0,0|0,0,0]=2 6234 B13R1.1511 O=C(CCO)c1ccc(cc1F)F 1458a_100000211022_100000211926 [1,1,0,0,0,0|0,1,0]=3 6235 B13R1.1511 O=C(CCO)c1ccc(cc1F)I 1458a_100000037189_100000211926 [1,1,0,0,0,0|0,1,0]=3 6236 B13R1.1511 O=C(CCO)c1ccc(cc1F)O 1458a_100000689029_100000211926 [1,1,0,0,0,0|1,0,0]=3 6237 B13R1.1511 O=C(CCO)c1ccc(cc1I)Br 1458a_100000751167_100000211926 [1,1,0,0,0,0|0,1,0]=3 6238 B13R1.1511 O=C(CCO)c1ccc(cc1I)Cl 1458a_100000739380_100000211926 [1,1,0,0,0,0|0,0,0]=2 6239 B13R1.1511 O=C(CCO)c1ccc(cc1I)F 1458a_100000739341_100000211926 [1,1,0,0,0,0|0,1,0]=3 6240 B13R1.1511 O=C(CCO)c1ccc(cc1O)Br 1458a_100000744433_100000211926 [1,1,0,0,0,0|0,1,0]=3 6241 B13R1.1511 O=C(CCO)c1ccc(cc1O)Cl 1458a_100000188622_100000211926 [1,1,0,0,0,0|0,0,0]=2 6242 B13R1.1511 O=C(CCO)c1ccc(cc1O)F 1458a_100000746061_100000211926 [1,1,0,0,0,0|0,1,0]=3 6243 B13R1.1511 O=C(CCO)c1ccc(cc1O)I 1458a_100000091984_100000211926 [1,1,0,0,0,0|0,1,0]=3 6244 B13R1.1511 O=C(CCO)c1ccc(cc1O)O 1458a_100000212172_100000211926 [1,1,0,0,0,0|1,0,0]=3 6245 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_200025704644 [1,1,0,0,0,0|2,0,0]=4 6246 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_100012351891_200025704644 [1,1,0,0,0,0|2,0,0]=4 6247 B13R1.1511 [13CH3]SCC(=O)c1ccc(cc1F)Cl 62a_200025704644_100012351891 [1,1,0,0,0,0|2,0,0]=4 6248 B13R1.11 C#CC(C)NC(=O)c1ccccc1 11a_100000707721_100000185807 [1,1,0,0,0,0|1,0,1]=4 6249 B13R1.11 C#CC(C)NC(=O)c1ccccc1 1626a_100000707721_100000185807 [1,1,0,0,0,0|1,0,1]=4 6250 B13R1.11 C#CC(C)NC(=O)c1ccccc1 240690a_100000707721_100000185807 [1,1,0,0,0,0|1,0,1]=4 6251 B13R1.11 C#CC(C)NC(=O)c1ccccc1 527a_100000707721_100000185807 [1,1,0,0,0,0|1,0,1]=4 6252 B13R1.11 CC(C#N)NC(=O)c1ccccc1 11a_100000737613_100000185807 [1,1,0,0,0,0|1,0,1]=4 6253 B13R1.11 CC(C#N)NC(=O)c1ccccc1 1626a_100000737613_100000185807 [1,1,0,0,0,0|1,0,1]=4 6254 B13R1.11 CC(C#N)NC(=O)c1ccccc1 527a_100000737613_100000185807 [1,1,0,0,0,0|1,0,1]=4 6255 B13R1.11 CC(CO)N[C@H](C)c1ccccc1 2230a_100000751104_100012180447 [1,1,0,0,0,0|1,0,1]=4 6256 B13R1.11 CC(N[C@H](C)CO)c1ccccc1 2230a_100000737577_100000230085 [1,1,0,0,0,0|1,0,1]=4 6257 B13R1.11 CC(N[C@H](C)CO)c1ccccc1 269862a_100000737577_100000185851 [1,1,0,0,0,0|1,0,1]=4 6258 B13R1.11 CCC(C)CC(=O)c1ccccc1 1458a_100000185807_100000748023 [1,1,0,0,0,0|2,0,0]=4 6259 B13R1.11 CCC(C)NC(=O)c1ccccc1 11a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 6260 B13R1.11 CCC(C)NC(=O)c1ccccc1 1626a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 6261 B13R1.11 CCC(C)NC(=O)c1ccccc1 240690a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 6262 B13R1.11 CCC(C)NC(=O)c1ccccc1 527a_100000209981_100000185807 [1,1,0,0,0,0|1,0,0]=3 6263 B13R1.11 CCC(O)CC(=O)c1ccccc1 1458a_100000185807_100011218378 [1,1,0,0,0,0|2,0,0]=4 6264 B13R1.11 CC[C@H](C)CC(=O)c1ccccc1 1458a_100000185807_100009816398 [1,1,0,0,0,0|2,0,0]=4 6265 B13R1.11 C[C@@H](CO)CC(=O)c1ccccc1 1458a_100000185807_100000059175 [1,1,0,0,0,0|1,0,0]=3 6266 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 11a_100102880703_100000185807 [1,1,0,0,0,0|1,0,0]=3 6267 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 1626a_100102880703_100000185807 [1,1,0,0,0,0|1,0,0]=3 6268 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 240690a_100102880703_100000185807 [1,1,0,0,0,0|1,0,0]=3 6269 B13R1.11 C[C@H](CF)NC(=O)c1ccccc1 527a_100102880703_100000185807 [1,1,0,0,0,0|1,0,0]=3 6270 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 240690a_100000737577_100000185807 [1,1,0,0,0,0|0,0,0]=2 6271 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 527a_100000737577_100000185807 [1,1,0,0,0,0|0,0,0]=2 6272 B13R1.11 O=C(CO)CC(=O)c1ccccc1 1458a_100000210174_100000211460 [1,1,0,0,0,0|1,0,1]=4 6273 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 11a_100000212058_100000210664 [1,1,0,0,0,0|1,0,1]=4 6274 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 1626a_100000212058_100000210664 [1,1,0,0,0,0|1,0,1]=4 6275 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 240690a_100000212058_100000210664 [1,1,0,0,0,0|1,0,1]=4 6276 B13R1.18 C#CCNC(=O)c1cccc(c1)Br 527a_100000212058_100000210664 [1,1,0,0,0,0|1,0,1]=4 6277 B13R1.18 C#CCNC(=O)c1cccc(c1)C 11a_100000212058_100000189346 [1,1,0,0,0,0|1,0,1]=4 6278 B13R1.18 C#CCNC(=O)c1cccc(c1)C 1626a_100000212058_100000189346 [1,1,0,0,0,0|1,0,1]=4 6279 B13R1.18 C#CCNC(=O)c1cccc(c1)C 240690a_100000212058_100000189346 [1,1,0,0,0,0|1,0,1]=4 6280 B13R1.18 C#CCNC(=O)c1cccc(c1)C 527a_100000212058_100000189346 [1,1,0,0,0,0|1,0,1]=4 6281 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 11a_100000212058_100000210390 [1,1,0,0,0,0|1,0,1]=4 6282 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 1626a_100000212058_100000210390 [1,1,0,0,0,0|1,0,1]=4 6283 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 240690a_100000212058_100000210390 [1,1,0,0,0,0|1,0,1]=4 6284 B13R1.18 C#CCNC(=O)c1cccc(c1)Cl 527a_100000212058_100000210390 [1,1,0,0,0,0|1,0,1]=4 6285 B13R1.18 C#CCNC(=O)c1cccc(c1)F 11a_100000212058_100000210950 [1,1,0,0,0,0|1,0,1]=4 6286 B13R1.18 C#CCNC(=O)c1cccc(c1)F 1626a_100000212058_100000210950 [1,1,0,0,0,0|1,0,1]=4 6287 B13R1.18 C#CCNC(=O)c1cccc(c1)F 240690a_100000212058_100000210950 [1,1,0,0,0,0|1,0,1]=4 6288 B13R1.18 C#CCNC(=O)c1cccc(c1)F 527a_100000212058_100000210950 [1,1,0,0,0,0|1,0,1]=4 6289 B13R1.18 C#CCNC(=O)c1cccc(c1)I 11a_100000212058_100000184098 [1,1,0,0,0,0|1,0,1]=4 6290 B13R1.18 C#CCNC(=O)c1cccc(c1)I 1626a_100000212058_100000184098 [1,1,0,0,0,0|1,0,1]=4 6291 B13R1.18 C#CCNC(=O)c1cccc(c1)I 240690a_100000212058_100000184098 [1,1,0,0,0,0|1,0,1]=4 6292 B13R1.18 C#CCNC(=O)c1cccc(c1)I 527a_100000212058_100000184098 [1,1,0,0,0,0|1,0,1]=4 6293 B13R1.18 C#CCNC(=O)c1cccc(c1)O 240690a_100000212058_100000183914 [1,1,0,0,0,0|1,0,1]=4 6294 B13R1.18 C#CCNC(=O)c1cccc(c1)O 527a_100000212058_100000183914 [1,1,0,0,0,0|1,0,1]=4 6295 B13R1.18 C=CCNC(=O)c1cccc(c1)Br 1626a_100020586998_100000210664 [1,1,0,0,0,0|1,0,1]=4 6296 B13R1.18 C=CCNC(=O)c1cccc(c1)Br 240690a_100020586998_100000210664 [1,1,0,0,0,0|1,0,1]=4 6297 B13R1.18 C=CCNC(=O)c1cccc(c1)Br 527a_100020586998_100000210664 [1,1,0,0,0,0|1,0,1]=4 6298 B13R1.18 C=CCNC(=O)c1cccc(c1)C 1626a_100020586998_100000189346 [1,1,0,0,0,0|1,0,1]=4 6299 B13R1.18 C=CCNC(=O)c1cccc(c1)C 240690a_100020586998_100000189346 [1,1,0,0,0,0|1,0,1]=4 6300 B13R1.18 C=CCNC(=O)c1cccc(c1)C 527a_100020586998_100000189346 [1,1,0,0,0,0|1,0,1]=4 6301 B13R1.18 C=CCNC(=O)c1cccc(c1)Cl 1626a_100020586998_100000210390 [1,1,0,0,0,0|1,0,1]=4 6302 B13R1.18 C=CCNC(=O)c1cccc(c1)Cl 240690a_100020586998_100000210390 [1,1,0,0,0,0|1,0,1]=4 6303 B13R1.18 C=CCNC(=O)c1cccc(c1)Cl 527a_100020586998_100000210390 [1,1,0,0,0,0|1,0,1]=4 6304 B13R1.18 C=CCNC(=O)c1cccc(c1)F 1626a_100020586998_100000210950 [1,1,0,0,0,0|1,0,1]=4 6305 B13R1.18 C=CCNC(=O)c1cccc(c1)F 240690a_100020586998_100000210950 [1,1,0,0,0,0|1,0,1]=4 6306 B13R1.18 C=CCNC(=O)c1cccc(c1)F 527a_100020586998_100000210950 [1,1,0,0,0,0|1,0,1]=4 6307 B13R1.18 C=CCNC(=O)c1cccc(c1)I 1626a_100020586998_100000184098 [1,1,0,0,0,0|1,0,1]=4 6308 B13R1.18 C=CCNC(=O)c1cccc(c1)I 240690a_100020586998_100000184098 [1,1,0,0,0,0|1,0,1]=4 6309 B13R1.18 C=CCNC(=O)c1cccc(c1)I 527a_100020586998_100000184098 [1,1,0,0,0,0|1,0,1]=4 6310 B13R1.18 C=CCNC(=O)c1cccc(c1)O 240690a_100020586998_100000183914 [1,1,0,0,0,0|1,0,1]=4 6311 B13R1.18 C=CCNC(=O)c1cccc(c1)O 527a_100020586998_100000183914 [1,1,0,0,0,0|1,0,1]=4 6312 B13R1.18 CC(NCCO)c1cccc(c1)Br 2230a_100020642005_100000211926 [1,1,0,0,0,0|1,0,1]=4 6313 B13R1.18 CC(NCCO)c1cccc(c1)Br 269862a_100000210304_100000210093 [1,1,0,0,0,0|1,0,1]=4 6314 B13R1.18 CC(NCCO)c1cccc(c1)Cl 2230a_100102723534_100000211926 [1,1,0,0,0,0|1,0,1]=4 6315 B13R1.18 CC(NCCO)c1cccc(c1)Cl 269862a_100000210304_200000210964 [1,1,0,0,0,0|1,0,1]=4 6316 B13R1.18 CC(NCCO)c1cccc(c1)Cl 34a_100102723534_100000211926 [1,1,0,0,0,0|1,0,1]=4 6317 B13R1.18 CC(NCCO)c1cccc(c1)F 269862a_100000210304_100000187083 [1,1,0,0,0,0|1,0,1]=4 6318 B13R1.18 CC(NCCO)c1cccc(c1)I 269862a_100000210304_100011356966 [1,1,0,0,0,0|1,0,1]=4 6319 B13R1.18 CC(NCCO)c1cccc(c1)O 2230a_100000740644_100000211926 [1,1,0,0,0,0|1,0,1]=4 6320 B13R1.18 CC(NCCO)c1cccc(c1)O 269862a_100000210304_100000211620 [1,1,0,0,0,0|1,0,1]=4 6321 B13R1.18 CCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210211 [1,1,0,0,0,0|2,0,0]=4 6322 B13R1.18 CCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210211 [1,1,0,0,0,0|2,0,0]=4 6323 B13R1.18 CCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210211 [1,1,0,0,0,0|2,0,0]=4 6324 B13R1.18 CCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210211 [1,1,0,0,0,0|2,0,0]=4 6325 B13R1.18 CCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210211 [1,1,0,0,0,0|2,0,0]=4 6326 B13R1.18 CCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210211 [1,1,0,0,0,0|2,0,0]=4 6327 B13R1.18 CCCNC(=O)c1cccc(c1)Br 11a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 6328 B13R1.18 CCCNC(=O)c1cccc(c1)Br 1626a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 6329 B13R1.18 CCCNC(=O)c1cccc(c1)Br 240690a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 6330 B13R1.18 CCCNC(=O)c1cccc(c1)Br 527a_100020643023_100000210664 [1,1,0,0,0,0|1,0,0]=3 6331 B13R1.18 CCCNC(=O)c1cccc(c1)C 11a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 6332 B13R1.18 CCCNC(=O)c1cccc(c1)C 1626a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 6333 B13R1.18 CCCNC(=O)c1cccc(c1)C 240690a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 6334 B13R1.18 CCCNC(=O)c1cccc(c1)C 527a_100020643023_100000189346 [1,1,0,0,0,0|1,0,0]=3 6335 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 11a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 6336 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 1626a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 6337 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 240690a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 6338 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 527a_100020643023_100000210390 [1,1,0,0,0,0|1,0,0]=3 6339 B13R1.18 CCCNC(=O)c1cccc(c1)F 11a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 6340 B13R1.18 CCCNC(=O)c1cccc(c1)F 1626a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 6341 B13R1.18 CCCNC(=O)c1cccc(c1)F 240690a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 6342 B13R1.18 CCCNC(=O)c1cccc(c1)F 527a_100020643023_100000210950 [1,1,0,0,0,0|1,0,0]=3 6343 B13R1.18 CCCNC(=O)c1cccc(c1)I 11a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 6344 B13R1.18 CCCNC(=O)c1cccc(c1)I 1626a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 6345 B13R1.18 CCCNC(=O)c1cccc(c1)I 240690a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 6346 B13R1.18 CCCNC(=O)c1cccc(c1)I 527a_100020643023_100000184098 [1,1,0,0,0,0|1,0,0]=3 6347 B13R1.18 CCCNC(=O)c1cccc(c1)O 240690a_100020643023_100000183914 [1,1,0,0,0,0|1,0,0]=3 6348 B13R1.18 CCCNC(=O)c1cccc(c1)O 271570a_203496583355_200000152271 [1,1,0,0,0,0|1,0,0]=3 6349 B13R1.18 CCCNC(=O)c1cccc(c1)O 527a_100020643023_100000183914 [1,1,0,0,0,0|1,0,0]=3 6350 B13R1.18 CCCNC(=O)c1cncc(c1)O 271570a_203496583355_200000152275 [1,1,0,0,0,0|2,0,0]=4 6351 B13R1.18 CCNNC(=O)c1cccc(c1)Br 22a_100000756455_100000210664 [1,1,0,0,0,0|2,0,0]=4 6352 B13R1.18 CCNNC(=O)c1cccc(c1)C 22a_100000756455_100000189346 [1,1,0,0,0,0|2,0,0]=4 6353 B13R1.18 CCNNC(=O)c1cccc(c1)Cl 22a_100000756455_100000210390 [1,1,0,0,0,0|2,0,0]=4 6354 B13R1.18 CCNNC(=O)c1cccc(c1)F 22a_100000756455_100000210950 [1,1,0,0,0,0|2,0,0]=4 6355 B13R1.18 CCNNC(=O)c1cccc(c1)I 22a_100000756455_100000184098 [1,1,0,0,0,0|2,0,0]=4 6356 B13R1.18 CCNNC(=O)c1cccc(c1)O 22a_100000756455_100000183914 [1,1,0,0,0,0|2,0,0]=4 6357 B13R1.18 C[C@@H](NCCO)c1cccc(c1)F 2230a_100015193778_100000211926 [1,1,0,0,0,0|1,0,1]=4 6358 B13R1.18 C[C@@H](NCCO)c1cccc(c1)F 34a_100015193778_100000211926 [1,1,0,0,0,0|1,0,1]=4 6359 B13R1.18 Cc1cccc(c1)C(=O)CCCF 1458a_100000189346_100011934791 [1,1,0,0,0,0|2,0,0]=4 6360 B13R1.18 Cc1cccc(c1)C(=O)CCCO 1458a_100000189346_100011215043 [1,1,0,0,0,0|1,0,0]=3 6361 B13R1.18 Cc1cccc(c1)C(=O)NCC#N 1626a_100000734998_100000189346 [1,1,0,0,0,0|1,0,1]=4 6362 B13R1.18 Cc1cccc(c1)C(=O)NCC#N 527a_100000734998_100000189346 [1,1,0,0,0,0|1,0,1]=4 6363 B13R1.18 Cc1cccc(c1)C(=O)NCCF 11a_100000724931_100000189346 [1,1,0,0,0,0|1,0,0]=3 6364 B13R1.18 Cc1cccc(c1)C(=O)NCCF 1626a_100000724931_100000189346 [1,1,0,0,0,0|1,0,0]=3 6365 B13R1.18 Cc1cccc(c1)C(=O)NCCF 240690a_100000724931_100000189346 [1,1,0,0,0,0|1,0,0]=3 6366 B13R1.18 Cc1cccc(c1)C(=O)NCCF 527a_100000724931_100000189346 [1,1,0,0,0,0|1,0,0]=3 6367 B13R1.18 Cc1cccc(c1)C(=O)NCCO 240690a_100000210304_100000189346 [1,1,0,0,0,0|0,0,0]=2 6368 B13R1.18 Cc1cccc(c1)C(=O)NCCO 527a_100000210304_100000189346 [1,1,0,0,0,0|0,0,0]=2 6369 B13R1.18 Cc1cccc(c1)C(C)NCCO 269862a_100000210304_100000211476 [1,1,0,0,0,0|1,0,1]=4 6370 B13R1.18 Cc1cccc(c1)[C@@H](C)NCCO 2230a_100000698126_100000211926 [1,1,0,0,0,0|1,0,1]=4 6371 B13R1.18 Cc1cccc(c1)[C@@H](C)NCCO 34a_100000698126_100000211926 [1,1,0,0,0,0|1,0,1]=4 6372 B13R1.18 N#CCNC(=O)c1cccc(c1)Br 1626a_100000734998_100000210664 [1,1,0,0,0,0|1,0,1]=4 6373 B13R1.18 N#CCNC(=O)c1cccc(c1)Br 527a_100000734998_100000210664 [1,1,0,0,0,0|1,0,1]=4 6374 B13R1.18 N#CCNC(=O)c1cccc(c1)Cl 1626a_100000734998_100000210390 [1,1,0,0,0,0|1,0,1]=4 6375 B13R1.18 N#CCNC(=O)c1cccc(c1)Cl 527a_100000734998_100000210390 [1,1,0,0,0,0|1,0,1]=4 6376 B13R1.18 N#CCNC(=O)c1cccc(c1)F 1626a_100000734998_100000210950 [1,1,0,0,0,0|1,0,1]=4 6377 B13R1.18 N#CCNC(=O)c1cccc(c1)F 527a_100000734998_100000210950 [1,1,0,0,0,0|1,0,1]=4 6378 B13R1.18 N#CCNC(=O)c1cccc(c1)I 1626a_100000734998_100000184098 [1,1,0,0,0,0|1,0,1]=4 6379 B13R1.18 N#CCNC(=O)c1cccc(c1)I 527a_100000734998_100000184098 [1,1,0,0,0,0|1,0,1]=4 6380 B13R1.18 N#CCNC(=O)c1cccc(c1)O 527a_100000734998_100000183914 [1,1,0,0,0,0|1,0,1]=4 6381 B13R1.18 O=C(CCCF)c1cccc(c1)Br 1458a_100000210664_100011934791 [1,1,0,0,0,0|2,0,0]=4 6382 B13R1.18 O=C(CCCF)c1cccc(c1)Cl 1458a_100000210390_100011934791 [1,1,0,0,0,0|2,0,0]=4 6383 B13R1.18 O=C(CCCF)c1cccc(c1)F 1458a_100000210950_100011934791 [1,1,0,0,0,0|2,0,0]=4 6384 B13R1.18 O=C(CCCF)c1cccc(c1)I 1458a_100000184098_100011934791 [1,1,0,0,0,0|2,0,0]=4 6385 B13R1.18 O=C(CCCF)c1cccc(c1)O 1458a_100000183914_100011934791 [1,1,0,0,0,0|2,0,0]=4 6386 B13R1.18 O=C(CCCO)c1cccc(c1)Br 1458a_100000210664_100011215043 [1,1,0,0,0,0|1,0,0]=3 6387 B13R1.18 O=C(CCCO)c1cccc(c1)Cl 1458a_100000210390_100011215043 [1,1,0,0,0,0|1,0,0]=3 6388 B13R1.18 O=C(CCCO)c1cccc(c1)F 1458a_100000210950_100011215043 [1,1,0,0,0,0|1,0,0]=3 6389 B13R1.18 O=C(CCCO)c1cccc(c1)I 1458a_100000184098_100011215043 [1,1,0,0,0,0|1,0,0]=3 6390 B13R1.18 O=C(CCCO)c1cccc(c1)O 1458a_100000183914_100011215043 [1,1,0,0,0,0|1,0,0]=3 6391 B13R1.18 O=C(NCCF)c1cccc(c1)Br 11a_100000724931_100000210664 [1,1,0,0,0,0|1,0,0]=3 6392 B13R1.18 O=C(NCCF)c1cccc(c1)Br 1626a_100000724931_100000210664 [1,1,0,0,0,0|1,0,0]=3 6393 B13R1.18 O=C(NCCF)c1cccc(c1)Br 240690a_100000724931_100000210664 [1,1,0,0,0,0|1,0,0]=3 6394 B13R1.18 O=C(NCCF)c1cccc(c1)Br 527a_100000724931_100000210664 [1,1,0,0,0,0|1,0,0]=3 6395 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 11a_100000724931_100000210390 [1,1,0,0,0,0|1,0,0]=3 6396 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 1626a_100000724931_100000210390 [1,1,0,0,0,0|1,0,0]=3 6397 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 240690a_100000724931_100000210390 [1,1,0,0,0,0|1,0,0]=3 6398 B13R1.18 O=C(NCCF)c1cccc(c1)Cl 527a_100000724931_100000210390 [1,1,0,0,0,0|1,0,0]=3 6399 B13R1.18 O=C(NCCF)c1cccc(c1)F 11a_100000724931_100000210950 [1,1,0,0,0,0|1,0,0]=3 6400 B13R1.18 O=C(NCCF)c1cccc(c1)F 1626a_100000724931_100000210950 [1,1,0,0,0,0|1,0,0]=3 6401 B13R1.18 O=C(NCCF)c1cccc(c1)F 240690a_100000724931_100000210950 [1,1,0,0,0,0|1,0,0]=3 6402 B13R1.18 O=C(NCCF)c1cccc(c1)F 527a_100000724931_100000210950 [1,1,0,0,0,0|1,0,0]=3 6403 B13R1.18 O=C(NCCF)c1cccc(c1)I 11a_100000724931_100000184098 [1,1,0,0,0,0|1,0,0]=3 6404 B13R1.18 O=C(NCCF)c1cccc(c1)I 1626a_100000724931_100000184098 [1,1,0,0,0,0|1,0,0]=3 6405 B13R1.18 O=C(NCCF)c1cccc(c1)I 240690a_100000724931_100000184098 [1,1,0,0,0,0|1,0,0]=3 6406 B13R1.18 O=C(NCCF)c1cccc(c1)I 527a_100000724931_100000184098 [1,1,0,0,0,0|1,0,0]=3 6407 B13R1.18 O=C(NCCF)c1cccc(c1)O 240690a_100000724931_100000183914 [1,1,0,0,0,0|1,0,0]=3 6408 B13R1.18 O=C(NCCF)c1cccc(c1)O 527a_100000724931_100000183914 [1,1,0,0,0,0|1,0,0]=3 6409 B13R1.18 O=C(NCCO)c1cccc(c1)Br 240690a_100000210304_100000210664 [1,1,0,0,0,0|0,0,0]=2 6410 B13R1.18 O=C(NCCO)c1cccc(c1)Br 527a_100000210304_100000210664 [1,1,0,0,0,0|0,0,0]=2 6411 B13R1.18 O=C(NCCO)c1cccc(c1)Cl 240690a_100000210304_100000210390 [1,1,0,0,0,0|0,0,0]=2 6412 B13R1.18 O=C(NCCO)c1cccc(c1)Cl 527a_100000210304_100000210390 [1,1,0,0,0,0|0,0,0]=2 6413 B13R1.18 O=C(NCCO)c1cccc(c1)F 240690a_100000210304_100000210950 [1,1,0,0,0,0|0,0,0]=2 6414 B13R1.18 O=C(NCCO)c1cccc(c1)F 527a_100000210304_100000210950 [1,1,0,0,0,0|0,0,0]=2 6415 B13R1.18 O=C(NCCO)c1cccc(c1)I 240690a_100000210304_100000184098 [1,1,0,0,0,0|0,0,0]=2 6416 B13R1.18 O=C(NCCO)c1cccc(c1)I 527a_100000210304_100000184098 [1,1,0,0,0,0|0,0,0]=2 6417 B13R1.18 O=C(NCCO)c1cccc(c1)O 240690a_100000210304_100000183914 [1,1,0,0,0,0|0,0,0]=2 6418 B13R1.18 O=C(NCCO)c1cccc(c1)O 271570a_203496583355_200000158903 [1,1,0,0,0,0|0,0,0]=2 6419 B13R1.18 O=C(NCCO)c1cccc(c1)O 527a_100000210304_100000183914 [1,1,0,0,0,0|0,0,0]=2 6420 B13R1.24 C#CCCCC(=O)c1ccccc1 1458a_100000185807_100000731252 [1,1,0,0,0,0|2,0,0]=4 6421 B13R1.24 C#CCCNC(=O)c1ccccc1 11a_100000755551_100000185807 [1,1,0,0,0,0|1,0,0]=3 6422 B13R1.24 C#CCCNC(=O)c1ccccc1 1626a_100000755551_100000185807 [1,1,0,0,0,0|1,0,0]=3 6423 B13R1.24 C#CCCNC(=O)c1ccccc1 240690a_100000755551_100000185807 [1,1,0,0,0,0|1,0,0]=3 6424 B13R1.24 C#CCCNC(=O)c1ccccc1 527a_100000755551_100000185807 [1,1,0,0,0,0|1,0,0]=3 6425 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [1,1,0,0,0,0|2,0,0]=4 6426 B13R1.24 C=CCCNC(=O)c1ccccc1 11a_100015191253_100000185807 [1,1,0,0,0,0|1,0,0]=3 6427 B13R1.24 C=CCCNC(=O)c1ccccc1 1626a_100015191253_100000185807 [1,1,0,0,0,0|1,0,0]=3 6428 B13R1.24 C=CCCNC(=O)c1ccccc1 240690a_100015191253_100000185807 [1,1,0,0,0,0|1,0,0]=3 6429 B13R1.24 C=CCCNC(=O)c1ccccc1 527a_100015191253_100000185807 [1,1,0,0,0,0|1,0,0]=3 6430 B13R1.24 C=CCNNC(=O)c1ccccc1 22a_100020588587_100000185807 [1,1,0,0,0,0|1,0,1]=4 6431 B13R1.24 CC#CCNC(=O)c1ccccc1 11a_100000685387_100000185807 [1,1,0,0,0,0|1,0,1]=4 6432 B13R1.24 CC#CCNC(=O)c1ccccc1 1626a_100000685387_100000185807 [1,1,0,0,0,0|1,0,1]=4 6433 B13R1.24 CC#CCNC(=O)c1ccccc1 527a_100000685387_100000185807 [1,1,0,0,0,0|1,0,1]=4 6434 B13R1.24 CC(=NNCCO)c1ccccc1 4a_100000210001_100000185851 [1,1,0,0,0,0|1,0,0]=3 6435 B13R1.24 CC(=NNCCO)c1ccccn1 4a_100000210001_100000210467 [1,1,0,0,0,0|2,0,0]=4 6436 B13R1.24 CC(=NNCCO)c1cccnc1 4a_100000210001_100000210468 [1,1,0,0,0,0|2,0,0]=4 6437 B13R1.24 CC(=NNCCO)c1ccncc1 4a_100000210001_100000185792 [1,1,0,0,0,0|2,0,0]=4 6438 B13R1.24 CC(CNCCO)c1ccccc1 2230a_100000701038_100000211926 [1,1,0,0,0,0|1,0,1]=4 6439 B13R1.24 CC(CNCCO)c1ccccc1 2230a_100016997473_100000756946 [1,1,0,0,0,0|1,0,1]=4 6440 B13R1.24 CC(CNCCO)c1ccccc1 270004a_100000210304_100000212034 [1,1,0,0,0,0|1,0,1]=4 6441 B13R1.24 CC(CNCCO)c1ccccc1 34a_100000701038_100000211926 [1,1,0,0,0,0|1,0,1]=4 6442 B13R1.24 CC(CNCCO)c1ccccc1 34a_100016990907_100000756946 [1,1,0,0,0,0|1,0,1]=4 6443 B13R1.24 CC(NCCCO)c1ccccc1 269862a_100000182051_100000185851 [1,1,0,0,0,0|1,0,1]=4 6444 B13R1.24 CCC=NNC(=O)c1ccccc1 4a_100000184135_100000210100 [1,1,0,0,0,0|1,0,1]=4 6445 B13R1.24 CCCCCC(=O)c1ccccc1 1458a_100000185807_100000210326 [1,1,0,0,0,0|2,0,0]=4 6446 B13R1.24 CCCCNC(=O)c1ccccc1 11a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 6447 B13R1.24 CCCCNC(=O)c1ccccc1 1626a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 6448 B13R1.24 CCCCNC(=O)c1ccccc1 240690a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 6449 B13R1.24 CCCCNC(=O)c1ccccc1 527a_100000102301_100000185807 [1,1,0,0,0,0|1,0,0]=3 6450 B13R1.24 CCCNN=C(C)c1ccccc1 4a_100000740057_100000185851 [1,1,0,0,0,0|2,0,0]=4 6451 B13R1.24 CCCNNC(=O)c1ccccc1 22a_100000740057_100000185807 [1,1,0,0,0,0|1,0,0]=3 6452 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000210303_100000211460 [1,1,0,0,0,0|2,0,0]=4 6453 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000211460_100000210303 [1,1,0,0,0,0|2,0,0]=4 6454 B13R1.24 CCNCCC(=O)c1ccccc1 2230a_100015525214_100000750707 [1,1,0,0,0,0|2,0,0]=4 6455 B13R1.24 CCOCCC(=O)c1ccccc1 1458a_100000185807_100011215890 [1,1,0,0,0,0|2,0,0]=4 6456 B13R1.24 CCSCCC(=O)c1ccccc1 1458a_100000185807_100000757381 [1,1,0,0,0,0|2,0,0]=4 6457 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000210202_100000750707 [1,1,0,0,0,0|2,0,0]=4 6458 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000750707_100000210202 [1,1,0,0,0,0|2,0,0]=4 6459 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000073877_100000210202 [1,1,0,0,0,0|2,0,0]=4 6460 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000210202_100000073877 [1,1,0,0,0,0|2,0,0]=4 6461 B13R1.24 CNCCCC(=O)c1ccccc1 2230a_106832991635_100000211006 [1,1,0,0,0,0|2,0,0]=4 6462 B13R1.24 CNCCCC(=O)c1ccccc1 7a_106832991635_100000211006 [1,1,0,0,0,0|2,0,0]=4 6463 B13R1.24 CNCCNC(=O)c1ccccc1 2230a_100000736134_200000210301 [1,1,0,0,0,0|1,0,0]=3 6464 B13R1.24 CNCCNC(=O)c1ccccc1 7a_106832991635_200011215302 [1,1,0,0,0,0|1,0,0]=3 6465 B13R1.24 CNCCNC(=O)c1ccncc1 2230a_200011198449_200000210301 [1,1,0,0,0,0|2,0,0]=4 6466 B13R1.24 CNCCOC(=O)c1ccccc1 34a_100102657272_100009812718 [1,1,0,0,0,0|2,0,0]=4 6467 B13R1.24 CNCCOC(=O)c1ccccc1 7a_106832991635_100000184176 [1,1,0,0,0,0|2,0,0]=4 6468 B13R1.24 COCCCC(=O)c1ccccc1 1458a_100000185807_100000740836 [1,1,0,0,0,0|1,0,0]=3 6469 B13R1.24 COCCNC(=O)c1ccccc1 1626a_100000209980_100000185807 [1,1,0,0,0,0|0,0,0]=2 6470 B13R1.24 COCCNC(=O)c1ccccc1 240690a_100000209980_100000185807 [1,1,0,0,0,0|0,0,0]=2 6471 B13R1.24 COCCNC(=O)c1ccccc1 34a_200000158897_200000210301 [1,1,0,0,0,0|0,0,0]=2 6472 B13R1.24 COCCNC(=O)c1ccccc1 527a_100000209980_100000185807 [1,1,0,0,0,0|0,0,0]=2 6473 B13R1.24 COCCNC(=O)c1ccccc1 7a_200000158897_200000210301 [1,1,0,0,0,0|0,0,0]=2 6474 B13R1.24 COCCNC(C)c1ccccc1 2230a_100000209980_100000230085 [1,1,0,0,0,0|1,0,1]=4 6475 B13R1.24 COCCNC(C)c1ccccc1 269862a_100000209980_100000185851 [1,1,0,0,0,0|1,0,1]=4 6476 B13R1.24 COCCN[C@H](C)c1ccccc1 2230a_100000751104_100011201679 [1,1,0,0,0,0|1,0,1]=4 6477 B13R1.24 COCCOC(=O)c1ccccc1 34a_100138415774_100009812718 [1,1,0,0,0,0|1,0,0]=3 6478 B13R1.24 COCCOC(=O)c1ccccc1 7a_100000025465_200000210301 [1,1,0,0,0,0|1,0,0]=3 6479 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000211460_100000766300 [1,1,0,0,0,0|2,0,0]=4 6480 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000766300_100000211460 [1,1,0,0,0,0|2,0,0]=4 6481 B13R1.24 CSCCCC(=O)c1ccccc1 62a_100000211006_200000210301 [1,1,0,0,0,0|1,1,0]=4 6482 B13R1.24 CSCCCC(=O)c1ccccc1 62a_200000210301_100000211006 [1,1,0,0,0,0|1,1,0]=4 6483 B13R1.24 CSCCNC(=O)c1ccccc1 11a_100020590264_100000185807 [1,1,0,0,0,0|0,1,0]=3 6484 B13R1.24 CSCCNC(=O)c1ccccc1 1626a_100020590264_100000185807 [1,1,0,0,0,0|0,1,0]=3 6485 B13R1.24 CSCCNC(=O)c1ccccc1 240690a_100020590264_100000185807 [1,1,0,0,0,0|0,1,0]=3 6486 B13R1.24 CSCCNC(=O)c1ccccc1 527a_100020590264_100000185807 [1,1,0,0,0,0|0,1,0]=3 6487 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200000210301_200011215302 [1,1,0,0,0,0|0,1,0]=3 6488 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200011215302_200000210301 [1,1,0,0,0,0|0,1,0]=3 6489 B13R1.24 CSCCOC(=O)c1ccccc1 62a_100009812718_200000210301 [1,1,0,0,0,0|1,1,0]=4 6490 B13R1.24 CSCCOC(=O)c1ccccc1 62a_200000210301_100009812718 [1,1,0,0,0,0|1,1,0]=4 6491 B13R1.24 C[C@@H](NCCCO)c1ccccc1 2230a_100000751104_100000230001 [1,1,0,0,0,0|1,0,1]=4 6492 B13R1.24 N#CCCCC(=O)c1ccccc1 1458a_100000185807_100000211468 [1,1,0,0,0,0|2,0,0]=4 6493 B13R1.24 N#CCCNC(=O)c1ccccc1 11a_100000720768_100000185807 [1,1,0,0,0,0|1,0,0]=3 6494 B13R1.24 N#CCCNC(=O)c1ccccc1 1626a_100000720768_100000185807 [1,1,0,0,0,0|1,0,0]=3 6495 B13R1.24 N#CCCNC(=O)c1ccccc1 240690a_100000720768_100000185807 [1,1,0,0,0,0|1,0,0]=3 6496 B13R1.24 N#CCCNC(=O)c1ccccc1 527a_100000720768_100000185807 [1,1,0,0,0,0|1,0,0]=3 6497 B13R1.24 O=C(CC#CCO)c1ccccc1 1458a_100000185807_200000047223 [1,1,0,0,0,0|1,0,1]=4 6498 B13R1.24 O=C(CCCCF)c1ccccc1 1458a_100000185807_100000729493 [1,1,0,0,0,0|2,0,0]=4 6499 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [1,1,0,0,0,0|1,0,0]=3 6500 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100000750707_100015361967 [1,1,0,0,0,0|2,0,0]=4 6501 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100015361967_100000750707 [1,1,0,0,0,0|2,0,0]=4 6502 B13R1.24 O=C(CNCCF)c1ccccn1 34a_100000724931_100000027445 [1,1,0,0,0,0|2,0,0]=4 6503 B13R1.24 O=C(CNCCO)c1ccccn1 34a_100016990907_100000027445 [1,1,0,0,0,0|1,0,0]=3 6504 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100000211460_100011217306 [1,1,0,0,0,0|2,0,0]=4 6505 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100011217306_100000211460 [1,1,0,0,0,0|2,0,0]=4 6506 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211460_100000211926 [1,1,0,0,0,0|1,0,0]=3 6507 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211926_100000211460 [1,1,0,0,0,0|1,0,0]=3 6508 B13R1.24 O=C(CSCCO)c1ccccn1 62a_100000027445_100000211926 [1,1,0,0,0,0|2,0,0]=4 6509 B13R1.24 O=C(CSCCO)c1ccccn1 62a_100000211926_100000027445 [1,1,0,0,0,0|2,0,0]=4 6510 B13R1.24 O=C(CSCCO)c1cccnc1 62a_100000211926_100000757877 [1,1,0,0,0,0|2,0,0]=4 6511 B13R1.24 O=C(CSCCO)c1cccnc1 62a_100000757877_100000211926 [1,1,0,0,0,0|2,0,0]=4 6512 B13R1.24 O=C(CSCCO)c1ccncc1 62a_100000027454_100000211926 [1,1,0,0,0,0|2,0,0]=4 6513 B13R1.24 O=C(CSCCO)c1ccncc1 62a_100000211926_100000027454 [1,1,0,0,0,0|2,0,0]=4 6514 B13R1.24 O=C(NCCCF)c1ccccc1 11a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 6515 B13R1.24 O=C(NCCCF)c1ccccc1 1626a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 6516 B13R1.24 O=C(NCCCF)c1ccccc1 240690a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 6517 B13R1.24 O=C(NCCCF)c1ccccc1 527a_100015189416_100000185807 [1,1,0,0,0,0|1,0,0]=3 6518 B13R1.24 O=C(NCCCO)c1ccccc1 240690a_100000182051_100000185807 [1,1,0,0,0,0|0,0,0]=2 6519 B13R1.24 O=C(NCCCO)c1ccccc1 527a_100000182051_100000185807 [1,1,0,0,0,0|0,0,0]=2 6520 B13R1.24 O=C(NNCCO)c1ccccc1 22a_100000210001_100000185807 [1,1,0,0,0,0|0,0,0]=2 6521 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100000073877_100015361967 [1,1,0,0,0,0|2,0,0]=4 6522 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100015361967_100000073877 [1,1,0,0,0,0|2,0,0]=4 6523 B13R1.24 O=S(CSCCO)c1ccccc1 62a_100000211926_100000031784 [1,1,0,0,0,0|2,0,0]=4 6524 B13R1.24 OCCNCC(O)c1ccccc1 2230a_100000210709_100000211926 [1,1,0,0,0,0|0,0,2]=4 6525 B13R1.24 OCCNCC(O)c1ccccc1 2230a_100016997473_100000185958 [1,1,0,0,0,0|0,0,2]=4 6526 B13R1.24 OCCNCC(O)c1ccccc1 34a_100016990907_100000185958 [1,1,0,0,0,0|0,0,2]=4 6527 B13R1.24 OCCNC[C@@H](O)c1ccccc1 2230a_100016997473_100011933945 [1,1,0,0,0,0|0,0,2]=4 6528 B13R1.24 OCCNC[C@@H](O)c1ccccc1 34a_100016990907_100011933945 [1,1,0,0,0,0|0,0,2]=4 6529 B13R1.24 [13CH3]NCCNC(=O)c1ccccc1 2230a_100000736134_200025704644 [1,1,0,0,0,0|1,0,0]=3 6530 B13R1.24 [13CH3]NCCNC(=O)c1ccncc1 2230a_200011198449_200025704644 [1,1,0,0,0,0|2,0,0]=4 6531 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 34a_200000158897_200025704644 [1,1,0,0,0,0|0,0,0]=2 6532 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 7a_200000158897_200025704644 [1,1,0,0,0,0|0,0,0]=2 6533 B13R1.24 [13CH3]OCCOC(=O)c1ccccc1 7a_100000025465_200025704644 [1,1,0,0,0,0|1,0,0]=3 6534 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_100000211006_200025704644 [1,1,0,0,0,0|1,1,0]=4 6535 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_200025704644_100000211006 [1,1,0,0,0,0|1,1,0]=4 6536 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200011215302_200025704644 [1,1,0,0,0,0|0,1,0]=3 6537 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200025704644_200011215302 [1,1,0,0,0,0|0,1,0]=3 6538 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_100009812718_200025704644 [1,1,0,0,0,0|1,1,0]=4 6539 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_200025704644_100009812718 [1,1,0,0,0,0|1,1,0]=4 6540 B13R1.26 C=CC(NCCO)c1ccccc1 2230a_100016997473_200000085779 [1,1,0,0,0,0|1,0,1]=4 6541 B13R1.26 CCC(NCCO)c1ccccc1 2230a_100000737752_100000211926 [1,1,0,0,0,0|1,0,1]=4 6542 B13R1.26 CCC(NCCO)c1ccccc1 269862a_100000210304_100000210124 [1,1,0,0,0,0|1,0,1]=4 6543 B13R1.26 OCCN[C@H](CO)c1ccccc1 2230a_100000751927_100000211926 [1,1,0,0,0,0|0,0,2]=4 6544 B13R1.26 OCCN[C@H](CO)c1ccccc1 34a_100000751927_100000211926 [1,1,0,0,0,0|0,0,2]=4 6545 B13R1.45 C=C(C)CNC(=O)c1ccccc1 11a_100000765925_100000185807 [1,1,0,0,0,0|1,0,1]=4 6546 B13R1.45 C=C(C)CNC(=O)c1ccccc1 1626a_100000765925_100000185807 [1,1,0,0,0,0|1,0,1]=4 6547 B13R1.45 C=C(C)CNC(=O)c1ccccc1 240690a_100000765925_100000185807 [1,1,0,0,0,0|1,0,1]=4 6548 B13R1.45 C=C(C)CNC(=O)c1ccccc1 527a_100000765925_100000185807 [1,1,0,0,0,0|1,0,1]=4 6549 B13R1.45 CC(=O)CNC(=O)c1ccccc1 1458a_100000182045_200000210301 [1,1,0,0,0,0|0,0,2]=4 6550 B13R1.45 CC(C)CCC(=O)c1ccccc1 1458a_100000185807_100000210312 [1,1,0,0,0,0|2,0,0]=4 6551 B13R1.45 CC(C)CNC(=O)c1ccccc1 11a_100000210953_100000185807 [1,1,0,0,0,0|1,0,0]=3 6552 B13R1.45 CC(C)CNC(=O)c1ccccc1 1626a_100000210953_100000185807 [1,1,0,0,0,0|1,0,0]=3 6553 B13R1.45 CC(C)CNC(=O)c1ccccc1 240690a_100000210953_100000185807 [1,1,0,0,0,0|1,0,0]=3 6554 B13R1.45 CC(C)CNC(=O)c1ccccc1 527a_100000210953_100000185807 [1,1,0,0,0,0|1,0,0]=3 6555 B13R1.45 CC(C)NNC(=O)c1ccccc1 22a_100000741168_100000185807 [1,1,0,0,0,0|2,0,0]=4 6556 B13R1.45 CC(O)CCC(=O)c1ccccc1 1458a_100000185807_100012276601 [1,1,0,0,0,0|1,0,0]=3 6557 B13R1.45 CC(O)CNC(=O)c1ccccc1 11a_100000210904_100000185807 [1,1,0,0,0,0|0,0,0]=2 6558 B13R1.45 CC(O)CNC(=O)c1ccccc1 240690a_100000210904_100000185807 [1,1,0,0,0,0|0,0,0]=2 6559 B13R1.45 CC(O)CNC(=O)c1ccccc1 527a_100000210904_100000185807 [1,1,0,0,0,0|0,0,0]=2 6560 B13R1.45 CC(O)CNC(C)c1ccccc1 2230a_100000210904_100000230085 [1,1,0,0,0,0|1,0,1]=4 6561 B13R1.45 CC(O)CNC(C)c1ccccc1 269862a_100000210904_100000185851 [1,1,0,0,0,0|1,0,1]=4 6562 B13R1.45 CC(O)CNC(C)c1ccccc1 34a_100000210904_100000211855 [1,1,0,0,0,0|1,0,1]=4 6563 B13R1.45 CC(O)CN[C@H](C)c1ccccc1 2230a_100000751104_100011218427 [1,1,0,0,0,0|1,0,1]=4 6564 B13R1.45 C[C@@H](O)CN[C@H](C)c1ccccc1 2230a_100000751104_100009817552 [1,1,0,0,0,0|1,0,1]=4 6565 B13R1.45 NC(=O)CNC(=O)c1ccccc1 11a_100000711301_100000185807 [1,1,0,0,0,0|0,0,2]=4 6566 B13R1.45 NC(=O)CNC(=O)c1ccccc1 240690a_100000711301_100000185807 [1,1,0,0,0,0|0,0,2]=4 6567 B13R1.45 NC(=O)CNC(=O)c1ccccc1 527a_100000711301_100000185807 [1,1,0,0,0,0|0,0,2]=4 6568 B13R1.45 O=C(NCC(F)F)c1ccccc1 11a_100000765723_100000185807 [1,1,0,0,0,0|1,0,0]=3 6569 B13R1.45 O=C(NCC(F)F)c1ccccc1 1626a_100000765723_100000185807 [1,1,0,0,0,0|1,0,0]=3 6570 B13R1.45 O=C(NCC(F)F)c1ccccc1 240690a_100000765723_100000185807 [1,1,0,0,0,0|1,0,0]=3 6571 B13R1.45 O=C(NCC(F)F)c1ccccc1 527a_100000765723_100000185807 [1,1,0,0,0,0|1,0,0]=3 6572 B13R1.45 [13CH3]C(=O)CNC(=O)c1ccccc1 1458a_100000182045_200025704644 [1,1,0,0,0,0|0,0,2]=4 6573 B13R1.47 C#CCN(C)C(=O)c1ccccc1 11a_100000225692_100000185807 [1,1,0,0,0,0|1,0,1]=4 6574 B13R1.47 C#CCN(C)C(=O)c1ccccc1 1626a_100000225692_100000185807 [1,1,0,0,0,0|1,0,1]=4 6575 B13R1.47 C#CCN(C)C(=O)c1ccccc1 527a_100000225692_100000185807 [1,1,0,0,0,0|1,0,1]=4 6576 B13R1.47 C=C(C(=O)CCO)c1ccccc1 1458a_100000065200_100000211926 [1,1,0,0,0,0|2,0,0]=4 6577 B13R1.47 C=CCN(C)C(=O)c1ccccc1 11a_100000225617_100000185807 [1,1,0,0,0,0|1,0,1]=4 6578 B13R1.47 C=CCN(C)C(=O)c1ccccc1 1626a_100000225617_100000185807 [1,1,0,0,0,0|1,0,1]=4 6579 B13R1.47 C=CCN(C)C(=O)c1ccccc1 240690a_100000225617_100000185807 [1,1,0,0,0,0|1,0,1]=4 6580 B13R1.47 C=CCN(C)C(=O)c1ccccc1 527a_100000225617_100000185807 [1,1,0,0,0,0|1,0,1]=4 6581 B13R1.47 CC(CCO)C(=O)c1ccccc1 1458a_100000185807_100009893172 [1,1,0,0,0,0|1,0,0]=3 6582 B13R1.47 CC(c1ccccc1)N(C)CCO 2230a_100000195388_100000211926 [1,1,0,0,0,0|1,0,1]=4 6583 B13R1.47 CC(c1ccccc1)N(C)CCO 2230a_100000210263_100000230085 [1,1,0,0,0,0|1,0,1]=4 6584 B13R1.47 CC(c1ccccc1)N(C)CCO 269982a_100000195388_100000211926 [1,1,0,0,0,0|1,0,1]=4 6585 B13R1.47 CC(c1ccccc1)N(C)CCO 269982a_100000210263_100000230085 [1,1,0,0,0,0|1,0,1]=4 6586 B13R1.47 CCCC(C)C(=O)c1ccccc1 1458a_100000185807_100000766640 [1,1,0,0,0,0|2,0,0]=4 6587 B13R1.47 CCCN(C)C(=O)c1ccccc1 11a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 6588 B13R1.47 CCCN(C)C(=O)c1ccccc1 1626a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 6589 B13R1.47 CCCN(C)C(=O)c1ccccc1 240690a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 6590 B13R1.47 CCCN(C)C(=O)c1ccccc1 527a_100000747261_100000185807 [1,1,0,0,0,0|1,0,0]=3 6591 B13R1.47 CN(CC#N)C(=O)c1ccccc1 11a_100000748184_100000185807 [1,1,0,0,0,0|1,0,1]=4 6592 B13R1.47 CN(CC#N)C(=O)c1ccccc1 1626a_100000748184_100000185807 [1,1,0,0,0,0|1,0,1]=4 6593 B13R1.47 CN(CCO)C(=O)c1ccccc1 240690a_100000210263_100000185807 [1,1,0,0,0,0|0,0,0]=2 6594 B13R1.47 CN(CCO)C(=O)c1ccccc1 527a_100000210263_100000185807 [1,1,0,0,0,0|0,0,0]=2 6595 B13R1.47 C[C@H](c1ccccc1)N(C)CCO 2230a_100000753783_200000210301 [1,1,0,0,0,0|1,0,1]=4 6596 B13R1.47 C[C@H](c1ccccc1)N(C)CCO 269982a_100000753783_200000210301 [1,1,0,0,0,0|1,0,1]=4 6597 B13R1.47 C[C@H](c1ccccc1)N([13CH3])CCO 2230a_100000753783_200025704644 [1,1,0,0,0,0|1,0,1]=4 6598 B13R1.47 C[C@H](c1ccccc1)N([13CH3])CCO 269982a_100000753783_200025704644 [1,1,0,0,0,0|1,0,1]=4 6599 B13R1.122 CC(C)(NCCO)c1ccccc1 2230a_100011218174_100000211926 [1,1,0,0,0,0|1,0,1]=4 6600 B13R1.122 CC(C)(NCCO)c1ccccc1 2230a_100016997473_100000034625 [1,1,0,0,0,0|1,0,1]=4 6601 B13R1.122 CCCNS(=O)(=O)c1ccccc1 270084a_100020643023_100000210345 [1,1,0,0,0,0|2,0,0]=4 6602 B13R1.122 CCCNS(=O)(=O)c1ccccc1 274078a_100020643023_100000210345 [1,1,0,0,0,0|2,0,0]=4 6603 B13R1.122 CCCNS(=O)(=O)c1ccccc1 40a_100020643023_100000032697 [1,1,0,0,0,0|2,0,0]=4 6604 B13R1.122 O=S(=O)(NCCF)c1ccccc1 270084a_100000724931_100000210345 [1,1,0,0,0,0|2,0,0]=4 6605 B13R1.122 O=S(=O)(NCCF)c1ccccc1 274078a_100000724931_100000210345 [1,1,0,0,0,0|2,0,0]=4 6606 B13R1.122 O=S(=O)(NCCF)c1ccccc1 40a_100000724931_100000032697 [1,1,0,0,0,0|2,0,0]=4 6607 B13R1.122 O=S(=O)(NCCO)c1ccccc1 270084a_100000210304_100000210345 [1,1,0,0,0,0|1,0,0]=3 6608 B13R1.122 O=S(=O)(NCCO)c1ccccc1 274078a_100000210304_100000210345 [1,1,0,0,0,0|1,0,0]=3 6609 B13R1.122 O=S(=O)(NCCO)c1ccccc1 40a_100000210304_100000032697 [1,1,0,0,0,0|1,0,0]=3 6610 B13R1.122 O=S(=O)(NCCO)c1ccccn1 270084a_100000210304_100016994956 [1,1,0,0,0,0|2,0,0]=4 6611 B13R1.122 O=S(=O)(NCCO)c1ccccn1 274078a_100000210304_100016994956 [1,1,0,0,0,0|2,0,0]=4 6612 B13R1.122 O=S(=O)(NCCO)c1ccccn1 40a_100000210304_100000070048 [1,1,0,0,0,0|2,0,0]=4 6613 B13R1.122 O=S(=O)(NCCO)c1cccnc1 270084a_100000210304_100000736704 [1,1,0,0,0,0|2,0,0]=4 6614 B13R1.122 O=S(=O)(NCCO)c1cccnc1 274078a_100000210304_100000736704 [1,1,0,0,0,0|2,0,0]=4 6615 B13R1.674 C#CCNC(=O)c1ccccc1Br 11a_100000212058_100000188424 [1,1,0,0,0,0|1,0,1]=4 6616 B13R1.674 C#CCNC(=O)c1ccccc1Br 1626a_100000212058_100000188424 [1,1,0,0,0,0|1,0,1]=4 6617 B13R1.674 C#CCNC(=O)c1ccccc1Br 240690a_100000212058_100000188424 [1,1,0,0,0,0|1,0,1]=4 6618 B13R1.674 C#CCNC(=O)c1ccccc1Br 527a_100000212058_100000188424 [1,1,0,0,0,0|1,0,1]=4 6619 B13R1.674 C#CCNC(=O)c1ccccc1C 11a_100000212058_100000212026 [1,1,0,0,0,0|1,0,1]=4 6620 B13R1.674 C#CCNC(=O)c1ccccc1C 1626a_100000212058_100000212026 [1,1,0,0,0,0|1,0,1]=4 6621 B13R1.674 C#CCNC(=O)c1ccccc1C 240690a_100000212058_100000212026 [1,1,0,0,0,0|1,0,1]=4 6622 B13R1.674 C#CCNC(=O)c1ccccc1C 527a_100000212058_100000212026 [1,1,0,0,0,0|1,0,1]=4 6623 B13R1.674 C#CCNC(=O)c1ccccc1Cl 11a_100000212058_100000185844 [1,1,0,0,0,0|1,0,1]=4 6624 B13R1.674 C#CCNC(=O)c1ccccc1Cl 1626a_100000212058_100000185844 [1,1,0,0,0,0|1,0,1]=4 6625 B13R1.674 C#CCNC(=O)c1ccccc1Cl 240690a_100000212058_100000185844 [1,1,0,0,0,0|1,0,1]=4 6626 B13R1.674 C#CCNC(=O)c1ccccc1Cl 527a_100000212058_100000185844 [1,1,0,0,0,0|1,0,1]=4 6627 B13R1.674 C#CCNC(=O)c1ccccc1F 11a_100000212058_100000188656 [1,1,0,0,0,0|1,0,1]=4 6628 B13R1.674 C#CCNC(=O)c1ccccc1F 1626a_100000212058_100000188656 [1,1,0,0,0,0|1,0,1]=4 6629 B13R1.674 C#CCNC(=O)c1ccccc1F 240690a_100000212058_100000188656 [1,1,0,0,0,0|1,0,1]=4 6630 B13R1.674 C#CCNC(=O)c1ccccc1F 527a_100000212058_100000188656 [1,1,0,0,0,0|1,0,1]=4 6631 B13R1.674 C#CCNC(=O)c1ccccc1I 11a_100000212058_100000187884 [1,1,0,0,0,0|1,0,1]=4 6632 B13R1.674 C#CCNC(=O)c1ccccc1I 1626a_100000212058_100000187884 [1,1,0,0,0,0|1,0,1]=4 6633 B13R1.674 C#CCNC(=O)c1ccccc1I 240690a_100000212058_100000187884 [1,1,0,0,0,0|1,0,1]=4 6634 B13R1.674 C#CCNC(=O)c1ccccc1I 527a_100000212058_100000187884 [1,1,0,0,0,0|1,0,1]=4 6635 B13R1.674 C#CCNC(=O)c1ccccc1O 240690a_100000212058_100015234032 [1,1,0,0,0,0|1,0,1]=4 6636 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 1626a_100000212058_100009911694 [1,1,0,0,0,0|1,0,1]=4 6637 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 240690a_100000212058_100009911694 [1,1,0,0,0,0|1,0,1]=4 6638 B13R1.674 C#CCNC(=O)c1ccccc1[O-] 527a_100000212058_100009911694 [1,1,0,0,0,0|1,0,1]=4 6639 B13R1.674 C=CCNC(=O)c1ccccc1Br 1626a_100020586998_100000188424 [1,1,0,0,0,0|1,0,1]=4 6640 B13R1.674 C=CCNC(=O)c1ccccc1Br 240690a_100020586998_100000188424 [1,1,0,0,0,0|1,0,1]=4 6641 B13R1.674 C=CCNC(=O)c1ccccc1Br 527a_100020586998_100000188424 [1,1,0,0,0,0|1,0,1]=4 6642 B13R1.674 C=CCNC(=O)c1ccccc1C 1626a_100020586998_100000212026 [1,1,0,0,0,0|1,0,1]=4 6643 B13R1.674 C=CCNC(=O)c1ccccc1C 240690a_100020586998_100000212026 [1,1,0,0,0,0|1,0,1]=4 6644 B13R1.674 C=CCNC(=O)c1ccccc1C 527a_100020586998_100000212026 [1,1,0,0,0,0|1,0,1]=4 6645 B13R1.674 C=CCNC(=O)c1ccccc1Cl 1626a_100020586998_100000185844 [1,1,0,0,0,0|1,0,1]=4 6646 B13R1.674 C=CCNC(=O)c1ccccc1Cl 240690a_100020586998_100000185844 [1,1,0,0,0,0|1,0,1]=4 6647 B13R1.674 C=CCNC(=O)c1ccccc1Cl 527a_100020586998_100000185844 [1,1,0,0,0,0|1,0,1]=4 6648 B13R1.674 C=CCNC(=O)c1ccccc1F 1626a_100020586998_100000188656 [1,1,0,0,0,0|1,0,1]=4 6649 B13R1.674 C=CCNC(=O)c1ccccc1F 240690a_100020586998_100000188656 [1,1,0,0,0,0|1,0,1]=4 6650 B13R1.674 C=CCNC(=O)c1ccccc1F 527a_100020586998_100000188656 [1,1,0,0,0,0|1,0,1]=4 6651 B13R1.674 C=CCNC(=O)c1ccccc1I 1626a_100020586998_100000187884 [1,1,0,0,0,0|1,0,1]=4 6652 B13R1.674 C=CCNC(=O)c1ccccc1I 240690a_100020586998_100000187884 [1,1,0,0,0,0|1,0,1]=4 6653 B13R1.674 C=CCNC(=O)c1ccccc1I 527a_100020586998_100000187884 [1,1,0,0,0,0|1,0,1]=4 6654 B13R1.674 C=CCNC(=O)c1ccccc1O 240690a_100020586998_100015234032 [1,1,0,0,0,0|1,0,1]=4 6655 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 1626a_100020586998_100009911694 [1,1,0,0,0,0|1,0,1]=4 6656 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 240690a_100020586998_100009911694 [1,1,0,0,0,0|1,0,1]=4 6657 B13R1.674 C=CCNC(=O)c1ccccc1[O-] 527a_100020586998_100009911694 [1,1,0,0,0,0|1,0,1]=4 6658 B13R1.674 CC(NCCO)c1ccccc1Br 2230a_100000181357_100000211926 [1,1,0,0,0,0|1,0,1]=4 6659 B13R1.674 CC(NCCO)c1ccccc1Br 269862a_100000210304_100000187085 [1,1,0,0,0,0|1,0,1]=4 6660 B13R1.674 CC(NCCO)c1ccccc1Cl 2230a_100000174978_100000211926 [1,1,0,0,0,0|1,0,1]=4 6661 B13R1.674 CC(NCCO)c1ccccc1Cl 2230a_100016997473_100000181259 [1,1,0,0,0,0|1,0,1]=4 6662 B13R1.674 CC(NCCO)c1ccccc1Cl 269862a_100000210304_100000210134 [1,1,0,0,0,0|1,0,1]=4 6663 B13R1.674 CC(NCCO)c1ccccc1Cl 34a_100000174978_100000211926 [1,1,0,0,0,0|1,0,1]=4 6664 B13R1.674 CC(NCCO)c1ccccc1F 2230a_100000181408_100000211926 [1,1,0,0,0,0|1,0,1]=4 6665 B13R1.674 CC(NCCO)c1ccccc1F 2230a_100016997473_200000741388 [1,1,0,0,0,0|1,0,1]=4 6666 B13R1.674 CC(NCCO)c1ccccc1F 269862a_100000210304_100000210632 [1,1,0,0,0,0|1,0,1]=4 6667 B13R1.674 CC(NCCO)c1ccccc1F 34a_100000181408_100000211926 [1,1,0,0,0,0|1,0,1]=4 6668 B13R1.674 CC(NCCO)c1ccccc1F 34a_100016990907_200000741388 [1,1,0,0,0,0|1,0,1]=4 6669 B13R1.674 CC(NCCO)c1ccccc1I 269862a_100000210304_100000751169 [1,1,0,0,0,0|1,0,1]=4 6670 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [1,1,0,0,0,0|2,0,0]=4 6671 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [1,1,0,0,0,0|2,0,0]=4 6672 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [1,1,0,0,0,0|2,0,0]=4 6673 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [1,1,0,0,0,0|2,0,0]=4 6674 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [1,1,0,0,0,0|2,0,0]=4 6675 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [1,1,0,0,0,0|2,0,0]=4 6676 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [1,1,0,0,0,0|2,0,0]=4 6677 B13R1.674 CCCNC(=O)c1ccccc1Br 11a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 6678 B13R1.674 CCCNC(=O)c1ccccc1Br 1626a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 6679 B13R1.674 CCCNC(=O)c1ccccc1Br 240690a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 6680 B13R1.674 CCCNC(=O)c1ccccc1Br 527a_100020643023_100000188424 [1,1,0,0,0,0|1,0,0]=3 6681 B13R1.674 CCCNC(=O)c1ccccc1C 11a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 6682 B13R1.674 CCCNC(=O)c1ccccc1C 1626a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 6683 B13R1.674 CCCNC(=O)c1ccccc1C 240690a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 6684 B13R1.674 CCCNC(=O)c1ccccc1C 527a_100020643023_100000212026 [1,1,0,0,0,0|1,0,0]=3 6685 B13R1.674 CCCNC(=O)c1ccccc1Cl 11a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 6686 B13R1.674 CCCNC(=O)c1ccccc1Cl 1626a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 6687 B13R1.674 CCCNC(=O)c1ccccc1Cl 240690a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 6688 B13R1.674 CCCNC(=O)c1ccccc1Cl 527a_100020643023_100000185844 [1,1,0,0,0,0|1,0,0]=3 6689 B13R1.674 CCCNC(=O)c1ccccc1F 11a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 6690 B13R1.674 CCCNC(=O)c1ccccc1F 1626a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 6691 B13R1.674 CCCNC(=O)c1ccccc1F 240690a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 6692 B13R1.674 CCCNC(=O)c1ccccc1F 527a_100020643023_100000188656 [1,1,0,0,0,0|1,0,0]=3 6693 B13R1.674 CCCNC(=O)c1ccccc1I 11a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 6694 B13R1.674 CCCNC(=O)c1ccccc1I 1626a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 6695 B13R1.674 CCCNC(=O)c1ccccc1I 240690a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 6696 B13R1.674 CCCNC(=O)c1ccccc1I 527a_100020643023_100000187884 [1,1,0,0,0,0|1,0,0]=3 6697 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [1,1,0,0,0,0|1,0,0]=3 6698 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [1,1,0,0,0,0|1,0,0]=3 6699 B13R1.674 CCCNC(=O)c1ccccc1[O-] 1626a_100020643023_100009911694 [1,1,0,0,0,0|1,0,0]=3 6700 B13R1.674 CCCNC(=O)c1ccccc1[O-] 240690a_100020643023_100009911694 [1,1,0,0,0,0|1,0,0]=3 6701 B13R1.674 CCCNC(=O)c1ccccc1[O-] 527a_100020643023_100009911694 [1,1,0,0,0,0|1,0,0]=3 6702 B13R1.674 CCCNC(=O)c1cccnc1O 271570a_203496583355_100000161721 [1,1,0,0,0,0|2,0,0]=4 6703 B13R1.674 CCNNC(=O)c1ccccc1Br 22a_100000756455_100000188424 [1,1,0,0,0,0|2,0,0]=4 6704 B13R1.674 CCNNC(=O)c1ccccc1C 22a_100000756455_100000212026 [1,1,0,0,0,0|2,0,0]=4 6705 B13R1.674 CCNNC(=O)c1ccccc1Cl 22a_100000756455_100000185844 [1,1,0,0,0,0|2,0,0]=4 6706 B13R1.674 CCNNC(=O)c1ccccc1F 22a_100000756455_100000188656 [1,1,0,0,0,0|2,0,0]=4 6707 B13R1.674 CCNNC(=O)c1ccccc1I 22a_100000756455_100000187884 [1,1,0,0,0,0|2,0,0]=4 6708 B13R1.674 CCNNC(=O)c1ccccc1O 22a_100000756455_100015234032 [1,1,0,0,0,0|2,0,0]=4 6709 B13R1.674 CCNNC(=O)c1ccccc1[O-] 22a_100000756455_100009911694 [1,1,0,0,0,0|2,0,0]=4 6710 B13R1.674 C[C@@H](NCCO)c1ccccc1O 2230a_100025703389_100000211926 [1,1,0,0,0,0|1,0,1]=4 6711 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [1,1,0,0,0,0|2,0,0]=4 6712 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [1,1,0,0,0,0|1,0,0]=3 6713 B13R1.674 Cc1ccccc1C(=O)NCC#N 1626a_100000734998_100000212026 [1,1,0,0,0,0|1,0,1]=4 6714 B13R1.674 Cc1ccccc1C(=O)NCC#N 527a_100000734998_100000212026 [1,1,0,0,0,0|1,0,1]=4 6715 B13R1.674 Cc1ccccc1C(=O)NCCF 11a_100000724931_100000212026 [1,1,0,0,0,0|1,0,0]=3 6716 B13R1.674 Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000212026 [1,1,0,0,0,0|1,0,0]=3 6717 B13R1.674 Cc1ccccc1C(=O)NCCF 240690a_100000724931_100000212026 [1,1,0,0,0,0|1,0,0]=3 6718 B13R1.674 Cc1ccccc1C(=O)NCCF 527a_100000724931_100000212026 [1,1,0,0,0,0|1,0,0]=3 6719 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [1,1,0,0,0,0|0,0,0]=2 6720 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [1,1,0,0,0,0|0,0,0]=2 6721 B13R1.674 Cc1ccccc1C(C)NCCO 2230a_100000181355_100000211926 [1,1,0,0,0,0|1,0,1]=4 6722 B13R1.674 Cc1ccccc1C(C)NCCO 269862a_100000210304_100000211656 [1,1,0,0,0,0|1,0,1]=4 6723 B13R1.674 Cc1ccccc1C(C)NCCO 34a_100000181355_100000211926 [1,1,0,0,0,0|1,0,1]=4 6724 B13R1.674 N#CCNC(=O)c1ccccc1Br 1626a_100000734998_100000188424 [1,1,0,0,0,0|1,0,1]=4 6725 B13R1.674 N#CCNC(=O)c1ccccc1Br 527a_100000734998_100000188424 [1,1,0,0,0,0|1,0,1]=4 6726 B13R1.674 N#CCNC(=O)c1ccccc1Cl 1626a_100000734998_100000185844 [1,1,0,0,0,0|1,0,1]=4 6727 B13R1.674 N#CCNC(=O)c1ccccc1Cl 527a_100000734998_100000185844 [1,1,0,0,0,0|1,0,1]=4 6728 B13R1.674 N#CCNC(=O)c1ccccc1F 1626a_100000734998_100000188656 [1,1,0,0,0,0|1,0,1]=4 6729 B13R1.674 N#CCNC(=O)c1ccccc1F 527a_100000734998_100000188656 [1,1,0,0,0,0|1,0,1]=4 6730 B13R1.674 N#CCNC(=O)c1ccccc1I 1626a_100000734998_100000187884 [1,1,0,0,0,0|1,0,1]=4 6731 B13R1.674 N#CCNC(=O)c1ccccc1I 527a_100000734998_100000187884 [1,1,0,0,0,0|1,0,1]=4 6732 B13R1.674 N#CCNC(=O)c1ccccc1[O-] 1626a_100000734998_100009911694 [1,1,0,0,0,0|1,0,1]=4 6733 B13R1.674 N#CCNC(=O)c1ccccc1[O-] 527a_100000734998_100009911694 [1,1,0,0,0,0|1,0,1]=4 6734 B13R1.674 O=C(CCCF)c1ccccc1Br 1458a_100000188424_100011934791 [1,1,0,0,0,0|2,0,0]=4 6735 B13R1.674 O=C(CCCF)c1ccccc1Cl 1458a_100000185844_100011934791 [1,1,0,0,0,0|2,0,0]=4 6736 B13R1.674 O=C(CCCF)c1ccccc1F 1458a_100000188656_100011934791 [1,1,0,0,0,0|2,0,0]=4 6737 B13R1.674 O=C(CCCF)c1ccccc1I 1458a_100000187884_100011934791 [1,1,0,0,0,0|2,0,0]=4 6738 B13R1.674 O=C(CCCF)c1ccccc1O 1458a_100015234032_100011934791 [1,1,0,0,0,0|2,0,0]=4 6739 B13R1.674 O=C(CCCF)c1ccccc1[O-] 1458a_100009911694_100011934791 [1,1,0,0,0,0|2,0,0]=4 6740 B13R1.674 O=C(CCCO)c1ccccc1Br 1458a_100000188424_100011215043 [1,1,0,0,0,0|1,0,0]=3 6741 B13R1.674 O=C(CCCO)c1ccccc1Cl 1458a_100000185844_100011215043 [1,1,0,0,0,0|1,0,0]=3 6742 B13R1.674 O=C(CCCO)c1ccccc1F 1458a_100000188656_100011215043 [1,1,0,0,0,0|1,0,0]=3 6743 B13R1.674 O=C(CCCO)c1ccccc1I 1458a_100000187884_100011215043 [1,1,0,0,0,0|1,0,0]=3 6744 B13R1.674 O=C(CCCO)c1ccccc1O 1458a_100015234032_100011215043 [1,1,0,0,0,0|1,0,0]=3 6745 B13R1.674 O=C(CCCO)c1ccccc1[O-] 1458a_100009911694_100011215043 [1,1,0,0,0,0|1,0,0]=3 6746 B13R1.674 O=C(NCCF)c1ccccc1Br 11a_100000724931_100000188424 [1,1,0,0,0,0|1,0,0]=3 6747 B13R1.674 O=C(NCCF)c1ccccc1Br 1626a_100000724931_100000188424 [1,1,0,0,0,0|1,0,0]=3 6748 B13R1.674 O=C(NCCF)c1ccccc1Br 240690a_100000724931_100000188424 [1,1,0,0,0,0|1,0,0]=3 6749 B13R1.674 O=C(NCCF)c1ccccc1Br 527a_100000724931_100000188424 [1,1,0,0,0,0|1,0,0]=3 6750 B13R1.674 O=C(NCCF)c1ccccc1Cl 11a_100000724931_100000185844 [1,1,0,0,0,0|1,0,0]=3 6751 B13R1.674 O=C(NCCF)c1ccccc1Cl 1626a_100000724931_100000185844 [1,1,0,0,0,0|1,0,0]=3 6752 B13R1.674 O=C(NCCF)c1ccccc1Cl 240690a_100000724931_100000185844 [1,1,0,0,0,0|1,0,0]=3 6753 B13R1.674 O=C(NCCF)c1ccccc1Cl 527a_100000724931_100000185844 [1,1,0,0,0,0|1,0,0]=3 6754 B13R1.674 O=C(NCCF)c1ccccc1F 11a_100000724931_100000188656 [1,1,0,0,0,0|1,0,0]=3 6755 B13R1.674 O=C(NCCF)c1ccccc1F 1626a_100000724931_100000188656 [1,1,0,0,0,0|1,0,0]=3 6756 B13R1.674 O=C(NCCF)c1ccccc1F 240690a_100000724931_100000188656 [1,1,0,0,0,0|1,0,0]=3 6757 B13R1.674 O=C(NCCF)c1ccccc1F 527a_100000724931_100000188656 [1,1,0,0,0,0|1,0,0]=3 6758 B13R1.674 O=C(NCCF)c1ccccc1I 11a_100000724931_100000187884 [1,1,0,0,0,0|1,0,0]=3 6759 B13R1.674 O=C(NCCF)c1ccccc1I 1626a_100000724931_100000187884 [1,1,0,0,0,0|1,0,0]=3 6760 B13R1.674 O=C(NCCF)c1ccccc1I 240690a_100000724931_100000187884 [1,1,0,0,0,0|1,0,0]=3 6761 B13R1.674 O=C(NCCF)c1ccccc1I 527a_100000724931_100000187884 [1,1,0,0,0,0|1,0,0]=3 6762 B13R1.674 O=C(NCCF)c1ccccc1O 240690a_100000724931_100015234032 [1,1,0,0,0,0|1,0,0]=3 6763 B13R1.674 O=C(NCCF)c1ccccc1[O-] 1626a_100000724931_100009911694 [1,1,0,0,0,0|1,0,0]=3 6764 B13R1.674 O=C(NCCF)c1ccccc1[O-] 240690a_100000724931_100009911694 [1,1,0,0,0,0|1,0,0]=3 6765 B13R1.674 O=C(NCCF)c1ccccc1[O-] 527a_100000724931_100009911694 [1,1,0,0,0,0|1,0,0]=3 6766 B13R1.674 O=C(NCCO)c1ccccc1Br 240690a_100000210304_100000188424 [1,1,0,0,0,0|0,0,0]=2 6767 B13R1.674 O=C(NCCO)c1ccccc1Br 527a_100000210304_100000188424 [1,1,0,0,0,0|0,0,0]=2 6768 B13R1.674 O=C(NCCO)c1ccccc1Cl 240690a_100000210304_100000185844 [1,1,0,0,0,0|0,0,0]=2 6769 B13R1.674 O=C(NCCO)c1ccccc1Cl 527a_100000210304_100000185844 [1,1,0,0,0,0|0,0,0]=2 6770 B13R1.674 O=C(NCCO)c1ccccc1F 240690a_100000210304_100000188656 [1,1,0,0,0,0|0,0,0]=2 6771 B13R1.674 O=C(NCCO)c1ccccc1F 527a_100000210304_100000188656 [1,1,0,0,0,0|0,0,0]=2 6772 B13R1.674 O=C(NCCO)c1ccccc1I 240690a_100000210304_100000187884 [1,1,0,0,0,0|0,0,0]=2 6773 B13R1.674 O=C(NCCO)c1ccccc1I 527a_100000210304_100000187884 [1,1,0,0,0,0|0,0,0]=2 6774 B13R1.674 O=C(NCCO)c1ccccc1O 240690a_100000210304_100015234032 [1,1,0,0,0,0|0,0,0]=2 6775 B13R1.674 O=C(NCCO)c1ccccc1O 271570a_203496583355_200000158863 [1,1,0,0,0,0|0,0,0]=2 6776 B13R1.674 O=C(NCCO)c1ccccc1[O-] 240690a_100000210304_100009911694 [1,1,0,0,0,0|0,0,0]=2 6777 B13R1.674 O=C(NCCO)c1ccccc1[O-] 527a_100000210304_100009911694 [1,1,0,0,0,0|0,0,0]=2 6778 B13R1.23 CC(=NNCCO)c1cc(cs1)Cl 4a_100000210001_100000061699 [0,1,0,0,1,0|2,0,0]=4 6779 B13R1.23 CC(=NNCCO)c1ccc(s1)Cl 4a_100000210001_100000182421 [0,1,0,0,1,0|2,0,0]=4 6780 B13R1.23 CC(=NNCCO)c1csc(c1)Cl 4a_100000210001_100000074698 [0,1,0,0,1,0|2,0,0]=4 6781 B13R1.23 COCCNC(=O)c1ccc(o1)O 271570a_203496583355_100000157853 [0,1,0,0,1,0|2,0,0]=4 6782 B13R1.23 Cc1ccc(s1)C(=O)CNCCO 2230a_100016997473_100011262362 [0,1,0,0,1,0|2,0,0]=4 6783 B13R1.23 Cc1ccc(s1)C(=O)CNCCO 34a_100016990907_100011262362 [0,1,0,0,1,0|2,0,0]=4 6784 B13R1.23 O=C(CNCCO)c1ccc(s1)Br 2230a_100016997473_100000185163 [0,1,0,0,1,0|1,1,0]=4 6785 B13R1.23 O=C(CNCCO)c1ccc(s1)Cl 2230a_100016997473_100000185135 [0,1,0,0,1,0|1,0,0]=3 6786 B13R1.23 O=C(CSCCO)c1ccc(s1)Cl 62a_100000185135_100000211926 [0,1,0,0,1,0|2,0,0]=4 6787 B13R1.23 O=C(CSCCO)c1ccc(s1)Cl 62a_100000211926_100000185135 [0,1,0,0,1,0|2,0,0]=4 6788 B13R1.121 O=S(=O)(NCCO)c1ccc(s1)Cl 270084a_100000210304_100000211601 [0,1,0,0,1,0|2,0,0]=4 6789 B13R1.121 O=S(=O)(NCCO)c1ccc(s1)Cl 274078a_100000210304_100000211601 [0,1,0,0,1,0|2,0,0]=4 6790 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)Cl 11a_100000225692_100000211027 [0,1,0,0,0,1|1,0,1]=4 6791 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)Cl 527a_100000225692_100000211027 [0,1,0,0,0,1|1,0,1]=4 6792 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000225692 [0,1,0,0,0,1|1,0,1]=4 6793 B15R1.48 C=CCN(C)C(=O)Cc1ccc(cc1)Cl 11a_100000225617_100000211027 [0,1,0,0,0,1|1,0,1]=4 6794 B15R1.48 C=CCN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100000225617_100000211027 [0,1,0,0,0,1|1,0,1]=4 6795 B15R1.48 C=CCN(C)C(=O)Cc1ccc(cc1)Cl 527a_100000225617_100000211027 [0,1,0,0,0,1|1,0,1]=4 6796 B15R1.48 C=CCN(C)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000225617 [0,1,0,0,0,1|1,0,1]=4 6797 B15R1.48 CC(CCO)C(=O)Cc1ccc(cc1)Br 1458a_100000198978_100009893172 [0,1,0,0,0,1|1,1,0]=4 6798 B15R1.48 CC(CCO)C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100009893172 [0,1,0,0,0,1|1,0,0]=3 6799 B15R1.48 CC(CCO)C(=O)Cc1ccc(cc1)F 1458a_100000210951_100009893172 [0,1,0,0,0,1|1,1,0]=4 6800 B15R1.48 CC(CCO)C(=O)Cc1ccc(cc1)I 1458a_100000688869_100009893172 [0,1,0,0,0,1|1,1,0]=4 6801 B15R1.48 CC(CCO)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100009893172 [0,1,0,0,0,1|2,0,0]=4 6802 B15R1.48 CC(CCO)C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100009893172 [0,1,0,0,0,1|2,0,0]=4 6803 B15R1.48 CC(CCO)C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100009893172 [0,1,0,0,0,1|2,0,0]=4 6804 B15R1.48 CC(Cc1ccc(cc1)Cl)N(C)CCO 270004a_100000210263_100000747806 [0,1,0,0,0,1|1,0,1]=4 6805 B15R1.48 CCCC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000210906_100000694040 [0,1,0,0,0,1|2,0,0]=4 6806 B15R1.48 CCCC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000766640 [0,1,0,0,0,1|2,0,0]=4 6807 B15R1.48 CCCC(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210906 [0,1,0,0,0,1|2,0,0]=4 6808 B15R1.48 CCCC(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210906 [0,1,0,0,0,1|2,0,0]=4 6809 B15R1.48 CCCC(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210906 [0,1,0,0,0,1|2,0,0]=4 6810 B15R1.48 CCCC(C)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210906 [0,1,0,0,0,1|2,0,0]=4 6811 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)Br 11a_100000747261_100000198978 [0,1,0,0,0,1|1,1,0]=4 6812 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)Br 240690a_100000747261_100000198978 [0,1,0,0,0,1|1,1,0]=4 6813 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)Br 527a_100000747261_100000198978 [0,1,0,0,0,1|1,1,0]=4 6814 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)C 11a_100000747261_100000212244 [0,1,0,0,0,1|2,0,0]=4 6815 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)C 240690a_100000747261_100000212244 [0,1,0,0,0,1|2,0,0]=4 6816 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)C 527a_100000747261_100000212244 [0,1,0,0,0,1|2,0,0]=4 6817 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)Cl 11a_100000747261_100000211027 [0,1,0,0,0,1|1,0,0]=3 6818 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100000747261_100000211027 [0,1,0,0,0,1|1,0,0]=3 6819 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)Cl 527a_100000747261_100000211027 [0,1,0,0,0,1|1,0,0]=3 6820 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)F 11a_100000747261_100000210951 [0,1,0,0,0,1|1,1,0]=4 6821 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)F 1626a_100000747261_100000210951 [0,1,0,0,0,1|1,1,0]=4 6822 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)F 240690a_100000747261_100000210951 [0,1,0,0,0,1|1,1,0]=4 6823 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)F 527a_100000747261_100000210951 [0,1,0,0,0,1|1,1,0]=4 6824 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)I 11a_100000747261_100000688869 [0,1,0,0,0,1|1,1,0]=4 6825 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)I 1626a_100000747261_100000688869 [0,1,0,0,0,1|1,1,0]=4 6826 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)I 240690a_100000747261_100000688869 [0,1,0,0,0,1|1,1,0]=4 6827 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)I 527a_100000747261_100000688869 [0,1,0,0,0,1|1,1,0]=4 6828 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)O 1626a_100000747261_100000198540 [0,1,0,0,0,1|2,0,0]=4 6829 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)O 240690a_100000747261_100000198540 [0,1,0,0,0,1|2,0,0]=4 6830 B15R1.48 CCCN(C)C(=O)Cc1ccc(cc1)O 527a_100000747261_100000198540 [0,1,0,0,0,1|2,0,0]=4 6831 B15R1.48 CCCN(C)C(=O)Cc1ccc(cn1)Cl 11a_100000747261_100000728320 [0,1,0,0,0,1|2,0,0]=4 6832 B15R1.48 CCCN(C)C(=O)Cc1ccc(cn1)Cl 1626a_100000747261_100000728320 [0,1,0,0,0,1|2,0,0]=4 6833 B15R1.48 CCCN(C)C(=O)Cc1ccc(cn1)Cl 240690a_100000747261_100000728320 [0,1,0,0,0,1|2,0,0]=4 6834 B15R1.48 CCCN(C)C(=O)Cc1ccc(cn1)Cl 527a_100000747261_100000728320 [0,1,0,0,0,1|2,0,0]=4 6835 B15R1.48 CCCN(C)C(=O)Cc1ccc(nc1)Cl 11a_100000747261_100000061944 [0,1,0,0,0,1|2,0,0]=4 6836 B15R1.48 CCCN(C)C(=O)Cc1ccc(nc1)Cl 1626a_100000747261_100000061944 [0,1,0,0,0,1|2,0,0]=4 6837 B15R1.48 CCCN(C)C(=O)Cc1ccc(nc1)Cl 240690a_100000747261_100000061944 [0,1,0,0,0,1|2,0,0]=4 6838 B15R1.48 CCCN(C)C(=O)Cc1ccc(nc1)Cl 527a_100000747261_100000061944 [0,1,0,0,0,1|2,0,0]=4 6839 B15R1.48 CCCN(C)C(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000747261 [0,1,0,0,0,1|1,1,0]=4 6840 B15R1.48 CCCN(C)C(=O)Nc1ccc(cc1)C 2430a_100000124888_100000747261 [0,1,0,0,0,1|2,0,0]=4 6841 B15R1.48 CCCN(C)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000747261 [0,1,0,0,0,1|1,0,0]=3 6842 B15R1.48 CCCN(C)C(=O)Nc1ccc(cc1)F 2430a_100000185862_100000747261 [0,1,0,0,0,1|1,1,0]=4 6843 B15R1.48 CCCN(C)C(=O)Nc1ccc(cc1)I 2430a_100000185761_100000747261 [0,1,0,0,0,1|1,1,0]=4 6844 B15R1.48 CCCN(C)C(=O)Nc1ccc(cc1)O 2430a_100000185829_100000747261 [0,1,0,0,0,1|2,0,0]=4 6845 B15R1.48 CCC[C@H](O)C(=O)Cc1ccc(cc1)Cl 1458a_100009822183_100000694040 [0,1,0,0,0,1|2,0,0]=4 6846 B15R1.48 CCC[C@H](O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100009822183 [0,1,0,0,0,1|2,0,0]=4 6847 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)Cl 11a_100000748184_100000211027 [0,1,0,0,0,1|1,0,1]=4 6848 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)Br 240690a_100000210263_100000198978 [0,1,0,0,0,1|0,1,0]=3 6849 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)Br 527a_100000210263_100000198978 [0,1,0,0,0,1|0,1,0]=3 6850 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)Cl 240690a_100000210263_100000211027 [0,1,0,0,0,1|0,0,0]=2 6851 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)Cl 527a_100000210263_100000211027 [0,1,0,0,0,1|0,0,0]=2 6852 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)F 240690a_100000210263_100000210951 [0,1,0,0,0,1|0,1,0]=3 6853 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)F 527a_100000210263_100000210951 [0,1,0,0,0,1|0,1,0]=3 6854 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)I 240690a_100000210263_100000688869 [0,1,0,0,0,1|0,1,0]=3 6855 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)I 527a_100000210263_100000688869 [0,1,0,0,0,1|0,1,0]=3 6856 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)O 240690a_100000210263_100000198540 [0,1,0,0,0,1|1,0,0]=3 6857 B15R1.48 CN(CCO)C(=O)Cc1ccc(cc1)O 527a_100000210263_100000198540 [0,1,0,0,0,1|1,0,0]=3 6858 B15R1.48 CN(CCO)C(=O)Cc1ccc(cn1)Br 240690a_100000210263_100020629044 [0,1,0,0,0,1|1,1,0]=4 6859 B15R1.48 CN(CCO)C(=O)Cc1ccc(cn1)Cl 240690a_100000210263_100000728320 [0,1,0,0,0,1|1,0,0]=3 6860 B15R1.48 CN(CCO)C(=O)Cc1ccc(cn1)Cl 527a_100000210263_100000728320 [0,1,0,0,0,1|1,0,0]=3 6861 B15R1.48 CN(CCO)C(=O)Cc1ccc(nc1)Br 240690a_100000210263_100010067268 [0,1,0,0,0,1|1,1,0]=4 6862 B15R1.48 CN(CCO)C(=O)Cc1ccc(nc1)Br 527a_100000210263_100010067268 [0,1,0,0,0,1|1,1,0]=4 6863 B15R1.48 CN(CCO)C(=O)Cc1ccc(nc1)Cl 240690a_100000210263_100000061944 [0,1,0,0,0,1|1,0,0]=3 6864 B15R1.48 CN(CCO)C(=O)Cc1ccc(nc1)Cl 527a_100000210263_100000061944 [0,1,0,0,0,1|1,0,0]=3 6865 B15R1.48 CN(CCO)C(=O)Cn1ccc(=O)cc1 240690a_100000210263_200000238563 [0,1,0,0,0,1|2,0,0]=4 6866 B15R1.48 CN(CCO)C(=O)Cn1ccc(=O)cc1 527a_100000210263_200000238563 [0,1,0,0,0,1|2,0,0]=4 6867 B15R1.48 CN(CCO)C(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000210263 [0,1,0,0,0,1|0,1,0]=3 6868 B15R1.48 CN(CCO)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000210263 [0,1,0,0,0,1|0,0,0]=2 6869 B15R1.48 CN(CCO)C(=O)Nc1ccc(cc1)F 2430a_100000185862_100000210263 [0,1,0,0,0,1|0,1,0]=3 6870 B15R1.48 CN(CCO)C(=O)Nc1ccc(cc1)I 2430a_100000185761_100000210263 [0,1,0,0,0,1|0,1,0]=3 6871 B15R1.48 CN(CCO)C(=O)Nc1ccc(cc1)O 2430a_100000185829_100000210263 [0,1,0,0,0,1|1,0,0]=3 6872 B15R1.48 Cc1ccc(cc1)CC(=O)C(C)CCO 1458a_100000212244_100009893172 [0,1,0,0,0,1|2,0,0]=4 6873 B15R1.48 Cc1ccc(cc1)CC(=O)N(C)CCO 240690a_100000210263_100000212244 [0,1,0,0,0,1|1,0,0]=3 6874 B15R1.48 Cc1ccc(cc1)CC(=O)N(C)CCO 527a_100000210263_100000212244 [0,1,0,0,0,1|1,0,0]=3 6875 B15R1.48 Cc1ccc(cc1)NC(=O)C(=O)CCO 1458a_100000189662_100000211926 [0,1,0,0,0,1|2,0,0]=4 6876 B15R1.48 Cc1ccc(cc1)NC(=O)N(C)CCO 2430a_100000124888_100000210263 [0,1,0,0,0,1|1,0,0]=3 6877 B15R1.48 Cc1ccc(cn1)CC(=O)N(C)CCO 240690a_100000210263_100000740413 [0,1,0,0,0,1|2,0,0]=4 6878 B15R1.48 Cc1ccc(cn1)CC(=O)N(C)CCO 527a_100000210263_100000740413 [0,1,0,0,0,1|2,0,0]=4 6879 B15R1.48 Cc1ccc(nc1)CC(=O)N(C)CCO 240690a_100000210263_100025705728 [0,1,0,0,0,1|2,0,0]=4 6880 B15R1.48 O=C(CCO)C(=O)Nc1ccc(cn1)Cl 1458a_100011297360_100000211926 [0,1,0,0,0,1|2,0,0]=4 6881 B15R1.111 C=C(C)CNC(=O)Cc1ccc(cc1)Cl 11a_100000765925_100000211027 [0,1,0,0,0,1|1,0,1]=4 6882 B15R1.111 C=C(C)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000765925_100000211027 [0,1,0,0,0,1|1,0,1]=4 6883 B15R1.111 C=C(C)CNC(=O)Cc1ccc(cc1)Cl 527a_100000765925_100000211027 [0,1,0,0,0,1|1,0,1]=4 6884 B15R1.111 C=C(C)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000765925 [0,1,0,0,0,1|1,0,1]=4 6885 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000181311_100000694040 [0,1,0,0,0,1|2,0,0]=4 6886 B15R1.111 CC(C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210312 [0,1,0,0,0,1|2,0,0]=4 6887 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000181311 [0,1,0,0,0,1|2,0,0]=4 6888 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000181311 [0,1,0,0,0,1|2,0,0]=4 6889 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000181311 [0,1,0,0,0,1|2,0,0]=4 6890 B15R1.111 CC(C)CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000181311 [0,1,0,0,0,1|2,0,0]=4 6891 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Br 11a_100000210953_100000198978 [0,1,0,0,0,1|1,1,0]=4 6892 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Br 240690a_100000210953_100000198978 [0,1,0,0,0,1|1,1,0]=4 6893 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Br 527a_100000210953_100000198978 [0,1,0,0,0,1|1,1,0]=4 6894 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl 11a_100000210953_100000211027 [0,1,0,0,0,1|1,0,0]=3 6895 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000210953_100000211027 [0,1,0,0,0,1|1,0,0]=3 6896 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl 527a_100000210953_100000211027 [0,1,0,0,0,1|1,0,0]=3 6897 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 11a_100000210953_100000210951 [0,1,0,0,0,1|1,1,0]=4 6898 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 1626a_100000210953_100000210951 [0,1,0,0,0,1|1,1,0]=4 6899 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 240690a_100000210953_100000210951 [0,1,0,0,0,1|1,1,0]=4 6900 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)F 527a_100000210953_100000210951 [0,1,0,0,0,1|1,1,0]=4 6901 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 11a_100000210953_100000688869 [0,1,0,0,0,1|1,1,0]=4 6902 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 1626a_100000210953_100000688869 [0,1,0,0,0,1|1,1,0]=4 6903 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 240690a_100000210953_100000688869 [0,1,0,0,0,1|1,1,0]=4 6904 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)I 527a_100000210953_100000688869 [0,1,0,0,0,1|1,1,0]=4 6905 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)O 1626a_100000210953_100000198540 [0,1,0,0,0,1|2,0,0]=4 6906 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)O 240690a_100000210953_100000198540 [0,1,0,0,0,1|2,0,0]=4 6907 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)O 527a_100000210953_100000198540 [0,1,0,0,0,1|2,0,0]=4 6908 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 11a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 6909 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 1626a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 6910 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 240690a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 6911 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)Cl 527a_100000210953_100000728320 [0,1,0,0,0,1|2,0,0]=4 6912 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 11a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 6913 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 1626a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 6914 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 240690a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 6915 B15R1.111 CC(C)CNC(=O)Cc1ccc(nc1)Cl 527a_100000210953_100000061944 [0,1,0,0,0,1|2,0,0]=4 6916 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000210953 [0,1,0,0,0,1|1,1,0]=4 6917 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000210953 [0,1,0,0,0,1|1,0,0]=3 6918 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000210953 [0,1,0,0,0,1|1,1,0]=4 6919 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000210953 [0,1,0,0,0,1|1,1,0]=4 6920 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000210953 [0,1,0,0,0,1|2,0,0]=4 6921 B15R1.111 CC(C)CNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200009814596 [0,1,0,0,0,1|2,0,0]=4 6922 B15R1.111 CC(C)NNC(=O)Cc1ccc(cc1)Cl 22a_100000741168_100000211027 [0,1,0,0,0,1|2,0,0]=4 6923 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100012276601 [0,1,0,0,0,1|1,1,0]=4 6924 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100012276601 [0,1,0,0,0,1|1,0,0]=3 6925 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100012276601 [0,1,0,0,0,1|1,1,0]=4 6926 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100012276601 [0,1,0,0,0,1|1,1,0]=4 6927 B15R1.111 CC(O)CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100012276601 [0,1,0,0,0,1|2,0,0]=4 6928 B15R1.111 CC(O)CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100012276601 [0,1,0,0,0,1|2,0,0]=4 6929 B15R1.111 CC(O)CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100012276601 [0,1,0,0,0,1|2,0,0]=4 6930 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000718519 [0,1,0,0,0,1|1,1,0]=4 6931 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000718519 [0,1,0,0,0,1|1,0,0]=3 6932 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000718519 [0,1,0,0,0,1|1,1,0]=4 6933 B15R1.111 CC(O)CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000718519 [0,1,0,0,0,1|1,1,0]=4 6934 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Br 11a_100000210904_100000198978 [0,1,0,0,0,1|0,1,0]=3 6935 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Br 240690a_100000210904_100000198978 [0,1,0,0,0,1|0,1,0]=3 6936 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Br 527a_100000210904_100000198978 [0,1,0,0,0,1|0,1,0]=3 6937 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Cl 11a_100000210904_100000211027 [0,1,0,0,0,1|0,0,0]=2 6938 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000210904_100000211027 [0,1,0,0,0,1|0,0,0]=2 6939 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)Cl 527a_100000210904_100000211027 [0,1,0,0,0,1|0,0,0]=2 6940 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)F 11a_100000210904_100000210951 [0,1,0,0,0,1|0,1,0]=3 6941 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)F 240690a_100000210904_100000210951 [0,1,0,0,0,1|0,1,0]=3 6942 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)F 527a_100000210904_100000210951 [0,1,0,0,0,1|0,1,0]=3 6943 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)I 11a_100000210904_100000688869 [0,1,0,0,0,1|0,1,0]=3 6944 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)I 240690a_100000210904_100000688869 [0,1,0,0,0,1|0,1,0]=3 6945 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)I 527a_100000210904_100000688869 [0,1,0,0,0,1|0,1,0]=3 6946 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)O 240690a_100000210904_100000198540 [0,1,0,0,0,1|1,0,0]=3 6947 B15R1.111 CC(O)CNC(=O)Cc1ccc(cc1)O 527a_100000210904_100000198540 [0,1,0,0,0,1|1,0,0]=3 6948 B15R1.111 CC(O)CNC(=O)Cc1ccc(cn1)Br 11a_100000210904_100020629044 [0,1,0,0,0,1|1,1,0]=4 6949 B15R1.111 CC(O)CNC(=O)Cc1ccc(cn1)Br 240690a_100000210904_100020629044 [0,1,0,0,0,1|1,1,0]=4 6950 B15R1.111 CC(O)CNC(=O)Cc1ccc(cn1)Cl 11a_100000210904_100000728320 [0,1,0,0,0,1|1,0,0]=3 6951 B15R1.111 CC(O)CNC(=O)Cc1ccc(cn1)Cl 240690a_100000210904_100000728320 [0,1,0,0,0,1|1,0,0]=3 6952 B15R1.111 CC(O)CNC(=O)Cc1ccc(cn1)Cl 527a_100000210904_100000728320 [0,1,0,0,0,1|1,0,0]=3 6953 B15R1.111 CC(O)CNC(=O)Cc1ccc(nc1)Br 11a_100000210904_100010067268 [0,1,0,0,0,1|1,1,0]=4 6954 B15R1.111 CC(O)CNC(=O)Cc1ccc(nc1)Br 240690a_100000210904_100010067268 [0,1,0,0,0,1|1,1,0]=4 6955 B15R1.111 CC(O)CNC(=O)Cc1ccc(nc1)Br 527a_100000210904_100010067268 [0,1,0,0,0,1|1,1,0]=4 6956 B15R1.111 CC(O)CNC(=O)Cc1ccc(nc1)Cl 11a_100000210904_100000061944 [0,1,0,0,0,1|1,0,0]=3 6957 B15R1.111 CC(O)CNC(=O)Cc1ccc(nc1)Cl 240690a_100000210904_100000061944 [0,1,0,0,0,1|1,0,0]=3 6958 B15R1.111 CC(O)CNC(=O)Cc1ccc(nc1)Cl 527a_100000210904_100000061944 [0,1,0,0,0,1|1,0,0]=3 6959 B15R1.111 CC(O)CNC(=O)Cn1ccc(=O)cc1 11a_100000210904_200000238563 [0,1,0,0,0,1|2,0,0]=4 6960 B15R1.111 CC(O)CNC(=O)Cn1ccc(=O)cc1 240690a_100000210904_200000238563 [0,1,0,0,0,1|2,0,0]=4 6961 B15R1.111 CC(O)CNC(=O)Cn1ccc(=O)cc1 527a_100000210904_200000238563 [0,1,0,0,0,1|2,0,0]=4 6962 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000210904 [0,1,0,0,0,1|0,1,0]=3 6963 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000210904 [0,1,0,0,0,1|0,0,0]=2 6964 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000210904 [0,1,0,0,0,1|0,1,0]=3 6965 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000210904 [0,1,0,0,0,1|0,1,0]=3 6966 B15R1.111 CC(O)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000210904 [0,1,0,0,0,1|1,0,0]=3 6967 B15R1.111 CC(O)CNC(C)Cc1ccc(cc1)Cl 270004a_100000210904_100000747806 [0,1,0,0,0,1|1,0,1]=4 6968 B15R1.111 Cc1ccc(cc1)CC(=O)CCC(C)O 1458a_100000212244_100012276601 [0,1,0,0,0,1|2,0,0]=4 6969 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)C 11a_100000210953_100000212244 [0,1,0,0,0,1|2,0,0]=4 6970 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)C 240690a_100000210953_100000212244 [0,1,0,0,0,1|2,0,0]=4 6971 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)C 527a_100000210953_100000212244 [0,1,0,0,0,1|2,0,0]=4 6972 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)O 11a_100000210904_100000212244 [0,1,0,0,0,1|1,0,0]=3 6973 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)O 240690a_100000210904_100000212244 [0,1,0,0,0,1|1,0,0]=3 6974 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(C)O 527a_100000210904_100000212244 [0,1,0,0,0,1|1,0,0]=3 6975 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(F)F 11a_100000765723_100000212244 [0,1,0,0,0,1|2,0,0]=4 6976 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(F)F 240690a_100000765723_100000212244 [0,1,0,0,0,1|2,0,0]=4 6977 B15R1.111 Cc1ccc(cc1)CC(=O)NCC(F)F 527a_100000765723_100000212244 [0,1,0,0,0,1|2,0,0]=4 6978 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)O 1626a_100000124888_100000718519 [0,1,0,0,0,1|2,0,0]=4 6979 B15R1.111 Cc1ccc(cc1)NC(=O)NCC(C)C 2430a_100000124888_100000210953 [0,1,0,0,0,1|2,0,0]=4 6980 B15R1.111 Cc1ccc(cc1)NC(=O)NCC(C)O 2430a_100000124888_100000210904 [0,1,0,0,0,1|1,0,0]=3 6981 B15R1.111 Cc1ccc(cc1)NC(=O)NCC(F)F 2430a_100000124888_100000765723 [0,1,0,0,0,1|2,0,0]=4 6982 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)O 11a_100000210904_100000740413 [0,1,0,0,0,1|2,0,0]=4 6983 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)O 240690a_100000210904_100000740413 [0,1,0,0,0,1|2,0,0]=4 6984 B15R1.111 Cc1ccc(cn1)CC(=O)NCC(C)O 527a_100000210904_100000740413 [0,1,0,0,0,1|2,0,0]=4 6985 B15R1.111 Cc1ccc(nc1)CC(=O)NCC(C)O 11a_100000210904_100025705728 [0,1,0,0,0,1|2,0,0]=4 6986 B15R1.111 Cc1ccc(nc1)CC(=O)NCC(C)O 240690a_100000210904_100025705728 [0,1,0,0,0,1|2,0,0]=4 6987 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Cl 11a_100000711301_100000211027 [0,1,0,0,0,1|0,0,2]=4 6988 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000711301_100000211027 [0,1,0,0,0,1|0,0,2]=4 6989 B15R1.111 NC(=O)CNC(=O)Cc1ccc(cc1)Cl 527a_100000711301_100000211027 [0,1,0,0,0,1|0,0,2]=4 6990 B15R1.111 NC(=O)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000711301 [0,1,0,0,0,1|0,0,2]=4 6991 B15R1.111 O=C(Cc1ccc(cc1)Br)NCC(F)F 11a_100000765723_100000198978 [0,1,0,0,0,1|1,1,0]=4 6992 B15R1.111 O=C(Cc1ccc(cc1)Br)NCC(F)F 240690a_100000765723_100000198978 [0,1,0,0,0,1|1,1,0]=4 6993 B15R1.111 O=C(Cc1ccc(cc1)Br)NCC(F)F 527a_100000765723_100000198978 [0,1,0,0,0,1|1,1,0]=4 6994 B15R1.111 O=C(Cc1ccc(cc1)Cl)NCC(F)F 11a_100000765723_100000211027 [0,1,0,0,0,1|1,0,0]=3 6995 B15R1.111 O=C(Cc1ccc(cc1)Cl)NCC(F)F 240690a_100000765723_100000211027 [0,1,0,0,0,1|1,0,0]=3 6996 B15R1.111 O=C(Cc1ccc(cc1)Cl)NCC(F)F 527a_100000765723_100000211027 [0,1,0,0,0,1|1,0,0]=3 6997 B15R1.111 O=C(Cc1ccc(cc1)F)NCC(F)F 11a_100000765723_100000210951 [0,1,0,0,0,1|1,1,0]=4 6998 B15R1.111 O=C(Cc1ccc(cc1)F)NCC(F)F 1626a_100000765723_100000210951 [0,1,0,0,0,1|1,1,0]=4 6999 B15R1.111 O=C(Cc1ccc(cc1)F)NCC(F)F 240690a_100000765723_100000210951 [0,1,0,0,0,1|1,1,0]=4 7000 B15R1.111 O=C(Cc1ccc(cc1)F)NCC(F)F 527a_100000765723_100000210951 [0,1,0,0,0,1|1,1,0]=4 7001 B15R1.111 O=C(Cc1ccc(cc1)I)NCC(F)F 11a_100000765723_100000688869 [0,1,0,0,0,1|1,1,0]=4 7002 B15R1.111 O=C(Cc1ccc(cc1)I)NCC(F)F 1626a_100000765723_100000688869 [0,1,0,0,0,1|1,1,0]=4 7003 B15R1.111 O=C(Cc1ccc(cc1)I)NCC(F)F 240690a_100000765723_100000688869 [0,1,0,0,0,1|1,1,0]=4 7004 B15R1.111 O=C(Cc1ccc(cc1)I)NCC(F)F 527a_100000765723_100000688869 [0,1,0,0,0,1|1,1,0]=4 7005 B15R1.111 O=C(Cc1ccc(cc1)O)NCC(F)F 1626a_100000765723_100000198540 [0,1,0,0,0,1|2,0,0]=4 7006 B15R1.111 O=C(Cc1ccc(cc1)O)NCC(F)F 240690a_100000765723_100000198540 [0,1,0,0,0,1|2,0,0]=4 7007 B15R1.111 O=C(Cc1ccc(cc1)O)NCC(F)F 527a_100000765723_100000198540 [0,1,0,0,0,1|2,0,0]=4 7008 B15R1.111 O=C(Cc1ccc(cn1)Cl)NCC(F)F 11a_100000765723_100000728320 [0,1,0,0,0,1|2,0,0]=4 7009 B15R1.111 O=C(Cc1ccc(cn1)Cl)NCC(F)F 1626a_100000765723_100000728320 [0,1,0,0,0,1|2,0,0]=4 7010 B15R1.111 O=C(Cc1ccc(cn1)Cl)NCC(F)F 240690a_100000765723_100000728320 [0,1,0,0,0,1|2,0,0]=4 7011 B15R1.111 O=C(Cc1ccc(cn1)Cl)NCC(F)F 527a_100000765723_100000728320 [0,1,0,0,0,1|2,0,0]=4 7012 B15R1.111 O=C(Cc1ccc(nc1)Cl)NCC(F)F 11a_100000765723_100000061944 [0,1,0,0,0,1|2,0,0]=4 7013 B15R1.111 O=C(Cc1ccc(nc1)Cl)NCC(F)F 1626a_100000765723_100000061944 [0,1,0,0,0,1|2,0,0]=4 7014 B15R1.111 O=C(Cc1ccc(nc1)Cl)NCC(F)F 240690a_100000765723_100000061944 [0,1,0,0,0,1|2,0,0]=4 7015 B15R1.111 O=C(Cc1ccc(nc1)Cl)NCC(F)F 527a_100000765723_100000061944 [0,1,0,0,0,1|2,0,0]=4 7016 B15R1.111 O=C(NCC(F)F)Nc1ccc(cc1)Br 2430a_100000210018_100000765723 [0,1,0,0,0,1|1,1,0]=4 7017 B15R1.111 O=C(NCC(F)F)Nc1ccc(cc1)Cl 2430a_100000210052_100000765723 [0,1,0,0,0,1|1,0,0]=3 7018 B15R1.111 O=C(NCC(F)F)Nc1ccc(cc1)F 2430a_100000185862_100000765723 [0,1,0,0,0,1|1,1,0]=4 7019 B15R1.111 O=C(NCC(F)F)Nc1ccc(cc1)I 2430a_100000185761_100000765723 [0,1,0,0,0,1|1,1,0]=4 7020 B15R1.111 O=C(NCC(F)F)Nc1ccc(cc1)O 2430a_100000185829_100000765723 [0,1,0,0,0,1|2,0,0]=4 7021 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000731252 [0,1,0,0,0,1|2,0,0]=4 7022 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000690238_100000694040 [0,1,0,0,0,1|2,0,0]=4 7023 B15R1.128 C#CCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000690238 [0,1,0,0,0,1|2,0,0]=4 7024 B15R1.128 C#CCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000690238 [0,1,0,0,0,1|2,0,0]=4 7025 B15R1.128 C#CCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000690238 [0,1,0,0,0,1|2,0,0]=4 7026 B15R1.128 C#CCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000690238 [0,1,0,0,0,1|2,0,0]=4 7027 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br 11a_100000755551_100000198978 [0,1,0,0,0,1|1,1,0]=4 7028 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br 240690a_100000755551_100000198978 [0,1,0,0,0,1|1,1,0]=4 7029 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br 527a_100000755551_100000198978 [0,1,0,0,0,1|1,1,0]=4 7030 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C 11a_100000755551_100000212244 [0,1,0,0,0,1|2,0,0]=4 7031 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C 240690a_100000755551_100000212244 [0,1,0,0,0,1|2,0,0]=4 7032 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C 527a_100000755551_100000212244 [0,1,0,0,0,1|2,0,0]=4 7033 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl 11a_100000755551_100000211027 [0,1,0,0,0,1|1,0,0]=3 7034 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000755551_100000211027 [0,1,0,0,0,1|1,0,0]=3 7035 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl 527a_100000755551_100000211027 [0,1,0,0,0,1|1,0,0]=3 7036 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 11a_100000755551_100000210951 [0,1,0,0,0,1|1,1,0]=4 7037 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 1626a_100000755551_100000210951 [0,1,0,0,0,1|1,1,0]=4 7038 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 240690a_100000755551_100000210951 [0,1,0,0,0,1|1,1,0]=4 7039 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 527a_100000755551_100000210951 [0,1,0,0,0,1|1,1,0]=4 7040 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 11a_100000755551_100000688869 [0,1,0,0,0,1|1,1,0]=4 7041 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 1626a_100000755551_100000688869 [0,1,0,0,0,1|1,1,0]=4 7042 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 240690a_100000755551_100000688869 [0,1,0,0,0,1|1,1,0]=4 7043 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 527a_100000755551_100000688869 [0,1,0,0,0,1|1,1,0]=4 7044 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O 1626a_100000755551_100000198540 [0,1,0,0,0,1|2,0,0]=4 7045 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O 240690a_100000755551_100000198540 [0,1,0,0,0,1|2,0,0]=4 7046 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O 527a_100000755551_100000198540 [0,1,0,0,0,1|2,0,0]=4 7047 B15R1.128 C#CCCNC(=O)Cc1ccc(cn1)Cl 11a_100000755551_100000728320 [0,1,0,0,0,1|2,0,0]=4 7048 B15R1.128 C#CCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000755551_100000728320 [0,1,0,0,0,1|2,0,0]=4 7049 B15R1.128 C#CCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000755551_100000728320 [0,1,0,0,0,1|2,0,0]=4 7050 B15R1.128 C#CCCNC(=O)Cc1ccc(cn1)Cl 527a_100000755551_100000728320 [0,1,0,0,0,1|2,0,0]=4 7051 B15R1.128 C#CCCNC(=O)Cc1ccc(nc1)Cl 11a_100000755551_100000061944 [0,1,0,0,0,1|2,0,0]=4 7052 B15R1.128 C#CCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000755551_100000061944 [0,1,0,0,0,1|2,0,0]=4 7053 B15R1.128 C#CCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000755551_100000061944 [0,1,0,0,0,1|2,0,0]=4 7054 B15R1.128 C#CCCNC(=O)Cc1ccc(nc1)Cl 527a_100000755551_100000061944 [0,1,0,0,0,1|2,0,0]=4 7055 B15R1.128 C#CCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000755551 [0,1,0,0,0,1|1,1,0]=4 7056 B15R1.128 C#CCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000755551 [0,1,0,0,0,1|2,0,0]=4 7057 B15R1.128 C#CCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000755551 [0,1,0,0,0,1|1,0,0]=3 7058 B15R1.128 C#CCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000755551 [0,1,0,0,0,1|1,1,0]=4 7059 B15R1.128 C#CCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000755551 [0,1,0,0,0,1|1,1,0]=4 7060 B15R1.128 C#CCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000755551 [0,1,0,0,0,1|2,0,0]=4 7061 B15R1.128 C#CCNCC(=O)Nc1ccc(cc1)Cl 34a_100000212058_100000182960 [0,1,0,0,0,1|1,0,1]=4 7062 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000757094 [0,1,0,0,0,1|2,0,0]=4 7063 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000766728_100000694040 [0,1,0,0,0,1|2,0,0]=4 7064 B15R1.128 C=CCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000766728 [0,1,0,0,0,1|2,0,0]=4 7065 B15R1.128 C=CCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000766728 [0,1,0,0,0,1|2,0,0]=4 7066 B15R1.128 C=CCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000766728 [0,1,0,0,0,1|2,0,0]=4 7067 B15R1.128 C=CCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000766728 [0,1,0,0,0,1|2,0,0]=4 7068 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br 11a_100015191253_100000198978 [0,1,0,0,0,1|1,1,0]=4 7069 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br 240690a_100015191253_100000198978 [0,1,0,0,0,1|1,1,0]=4 7070 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br 527a_100015191253_100000198978 [0,1,0,0,0,1|1,1,0]=4 7071 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C 11a_100015191253_100000212244 [0,1,0,0,0,1|2,0,0]=4 7072 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C 240690a_100015191253_100000212244 [0,1,0,0,0,1|2,0,0]=4 7073 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C 527a_100015191253_100000212244 [0,1,0,0,0,1|2,0,0]=4 7074 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl 11a_100015191253_100000211027 [0,1,0,0,0,1|1,0,0]=3 7075 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100015191253_100000211027 [0,1,0,0,0,1|1,0,0]=3 7076 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl 527a_100015191253_100000211027 [0,1,0,0,0,1|1,0,0]=3 7077 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 11a_100015191253_100000210951 [0,1,0,0,0,1|1,1,0]=4 7078 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 1626a_100015191253_100000210951 [0,1,0,0,0,1|1,1,0]=4 7079 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 240690a_100015191253_100000210951 [0,1,0,0,0,1|1,1,0]=4 7080 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 527a_100015191253_100000210951 [0,1,0,0,0,1|1,1,0]=4 7081 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 11a_100015191253_100000688869 [0,1,0,0,0,1|1,1,0]=4 7082 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 1626a_100015191253_100000688869 [0,1,0,0,0,1|1,1,0]=4 7083 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 240690a_100015191253_100000688869 [0,1,0,0,0,1|1,1,0]=4 7084 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 527a_100015191253_100000688869 [0,1,0,0,0,1|1,1,0]=4 7085 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O 1626a_100015191253_100000198540 [0,1,0,0,0,1|2,0,0]=4 7086 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O 240690a_100015191253_100000198540 [0,1,0,0,0,1|2,0,0]=4 7087 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O 527a_100015191253_100000198540 [0,1,0,0,0,1|2,0,0]=4 7088 B15R1.128 C=CCCNC(=O)Cc1ccc(cn1)Cl 11a_100015191253_100000728320 [0,1,0,0,0,1|2,0,0]=4 7089 B15R1.128 C=CCCNC(=O)Cc1ccc(cn1)Cl 1626a_100015191253_100000728320 [0,1,0,0,0,1|2,0,0]=4 7090 B15R1.128 C=CCCNC(=O)Cc1ccc(cn1)Cl 240690a_100015191253_100000728320 [0,1,0,0,0,1|2,0,0]=4 7091 B15R1.128 C=CCCNC(=O)Cc1ccc(cn1)Cl 527a_100015191253_100000728320 [0,1,0,0,0,1|2,0,0]=4 7092 B15R1.128 C=CCCNC(=O)Cc1ccc(nc1)Cl 11a_100015191253_100000061944 [0,1,0,0,0,1|2,0,0]=4 7093 B15R1.128 C=CCCNC(=O)Cc1ccc(nc1)Cl 1626a_100015191253_100000061944 [0,1,0,0,0,1|2,0,0]=4 7094 B15R1.128 C=CCCNC(=O)Cc1ccc(nc1)Cl 240690a_100015191253_100000061944 [0,1,0,0,0,1|2,0,0]=4 7095 B15R1.128 C=CCCNC(=O)Cc1ccc(nc1)Cl 527a_100015191253_100000061944 [0,1,0,0,0,1|2,0,0]=4 7096 B15R1.128 C=CCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100015191253 [0,1,0,0,0,1|1,1,0]=4 7097 B15R1.128 C=CCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100015191253 [0,1,0,0,0,1|2,0,0]=4 7098 B15R1.128 C=CCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100015191253 [0,1,0,0,0,1|1,0,0]=3 7099 B15R1.128 C=CCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100015191253 [0,1,0,0,0,1|1,1,0]=4 7100 B15R1.128 C=CCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100015191253 [0,1,0,0,0,1|1,1,0]=4 7101 B15R1.128 C=CCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100015191253 [0,1,0,0,0,1|2,0,0]=4 7102 B15R1.128 C=CCNCC(=O)Nc1ccc(cc1)Cl 2230a_100020586998_100000182960 [0,1,0,0,0,1|1,0,1]=4 7103 B15R1.128 C=CCNNC(=O)Cc1ccc(cc1)Cl 22a_100020588587_100000211027 [0,1,0,0,0,1|1,0,1]=4 7104 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)Cl 11a_100000685387_100000211027 [0,1,0,0,0,1|1,0,1]=4 7105 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)Cl 527a_100000685387_100000211027 [0,1,0,0,0,1|1,0,1]=4 7106 B15R1.128 CC#CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000685387 [0,1,0,0,0,1|1,0,1]=4 7107 B15R1.128 CC(=NNCCO)Cc1ccc(cc1)C 4a_100000210001_100000751045 [0,1,0,0,0,1|2,0,0]=4 7108 B15R1.128 CC(=NNCCO)Cc1ccc(cc1)Cl 4a_100000210001_100000747806 [0,1,0,0,0,1|1,0,0]=3 7109 B15R1.128 CC(Cc1ccc(cc1)Cl)NCCCO 270004a_100000182051_100000747806 [0,1,0,0,0,1|1,0,1]=4 7110 B15R1.128 CCC=NNC(=O)Cc1ccc(cc1)Cl 4a_100000181177_100000210100 [0,1,0,0,0,1|1,0,1]=4 7111 B15R1.128 CCCC#CC(=O)Cc1ccc(cc1)Cl 1458a_200011218047_100000694040 [0,1,0,0,0,1|2,0,0]=4 7112 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_200011218047 [0,1,0,0,0,1|2,0,0]=4 7113 B15R1.128 CCCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000212230_100000694040 [0,1,0,0,0,1|2,0,0]=4 7114 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000212230 [0,1,0,0,0,1|2,0,0]=4 7115 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000212230 [0,1,0,0,0,1|2,0,0]=4 7116 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000212230 [0,1,0,0,0,1|2,0,0]=4 7117 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210326 [0,1,0,0,0,1|2,0,0]=4 7118 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000212188_100000694040 [0,1,0,0,0,1|2,0,0]=4 7119 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000212188 [0,1,0,0,0,1|2,0,0]=4 7120 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000212188 [0,1,0,0,0,1|2,0,0]=4 7121 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000212188 [0,1,0,0,0,1|2,0,0]=4 7122 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000212188 [0,1,0,0,0,1|2,0,0]=4 7123 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 11a_100000102301_100000198978 [0,1,0,0,0,1|1,1,0]=4 7124 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000102301_100000198978 [0,1,0,0,0,1|1,1,0]=4 7125 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 527a_100000102301_100000198978 [0,1,0,0,0,1|1,1,0]=4 7126 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 11a_100000102301_100000212244 [0,1,0,0,0,1|2,0,0]=4 7127 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 240690a_100000102301_100000212244 [0,1,0,0,0,1|2,0,0]=4 7128 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 527a_100000102301_100000212244 [0,1,0,0,0,1|2,0,0]=4 7129 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000102301_100000211027 [0,1,0,0,0,1|1,0,0]=3 7130 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000102301_100000211027 [0,1,0,0,0,1|1,0,0]=3 7131 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000102301_100000211027 [0,1,0,0,0,1|1,0,0]=3 7132 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 11a_100000102301_100000210951 [0,1,0,0,0,1|1,1,0]=4 7133 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 1626a_100000102301_100000210951 [0,1,0,0,0,1|1,1,0]=4 7134 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 240690a_100000102301_100000210951 [0,1,0,0,0,1|1,1,0]=4 7135 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 527a_100000102301_100000210951 [0,1,0,0,0,1|1,1,0]=4 7136 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 11a_100000102301_100000688869 [0,1,0,0,0,1|1,1,0]=4 7137 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 1626a_100000102301_100000688869 [0,1,0,0,0,1|1,1,0]=4 7138 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 240690a_100000102301_100000688869 [0,1,0,0,0,1|1,1,0]=4 7139 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 527a_100000102301_100000688869 [0,1,0,0,0,1|1,1,0]=4 7140 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 1626a_100000102301_100000198540 [0,1,0,0,0,1|2,0,0]=4 7141 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 240690a_100000102301_100000198540 [0,1,0,0,0,1|2,0,0]=4 7142 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 527a_100000102301_100000198540 [0,1,0,0,0,1|2,0,0]=4 7143 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 11a_100000102301_100000728320 [0,1,0,0,0,1|2,0,0]=4 7144 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000102301_100000728320 [0,1,0,0,0,1|2,0,0]=4 7145 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000102301_100000728320 [0,1,0,0,0,1|2,0,0]=4 7146 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 527a_100000102301_100000728320 [0,1,0,0,0,1|2,0,0]=4 7147 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 11a_100000102301_100000061944 [0,1,0,0,0,1|2,0,0]=4 7148 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000102301_100000061944 [0,1,0,0,0,1|2,0,0]=4 7149 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000102301_100000061944 [0,1,0,0,0,1|2,0,0]=4 7150 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 527a_100000102301_100000061944 [0,1,0,0,0,1|2,0,0]=4 7151 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000102301 [0,1,0,0,0,1|1,1,0]=4 7152 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000102301 [0,1,0,0,0,1|2,0,0]=4 7153 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000102301 [0,1,0,0,0,1|1,0,0]=3 7154 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000102301 [0,1,0,0,0,1|1,1,0]=4 7155 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000102301 [0,1,0,0,0,1|1,1,0]=4 7156 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000102301 [0,1,0,0,0,1|2,0,0]=4 7157 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200000163291 [0,1,0,0,0,1|2,0,0]=4 7158 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_100000210303 [0,1,0,0,0,1|1,1,0]=4 7159 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_100000210303 [0,1,0,0,0,1|1,1,0]=4 7160 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)F 34a_100025683178_100000210303 [0,1,0,0,0,1|1,1,0]=4 7161 B15R1.128 CCCNN=C(C)Cc1ccc(cc1)Cl 4a_100000740057_100000747806 [0,1,0,0,0,1|2,0,0]=4 7162 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)Br 22a_100000740057_100000198978 [0,1,0,0,0,1|1,1,0]=4 7163 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)C 22a_100000740057_100000212244 [0,1,0,0,0,1|2,0,0]=4 7164 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)Cl 22a_100000740057_100000211027 [0,1,0,0,0,1|1,0,0]=3 7165 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)F 22a_100000740057_100000210951 [0,1,0,0,0,1|1,1,0]=4 7166 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)I 22a_100000740057_100000688869 [0,1,0,0,0,1|1,1,0]=4 7167 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)O 22a_100000740057_100000198540 [0,1,0,0,0,1|2,0,0]=4 7168 B15R1.128 CCCNNC(=O)Cc1ccc(cn1)Cl 22a_100000740057_100000728320 [0,1,0,0,0,1|2,0,0]=4 7169 B15R1.128 CCCNNC(=O)Cc1ccc(nc1)Cl 22a_100000740057_100000061944 [0,1,0,0,0,1|2,0,0]=4 7170 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000745993_100000694040 [0,1,0,0,0,1|2,0,0]=4 7171 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000745993 [0,1,0,0,0,1|2,0,0]=4 7172 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000745993 [0,1,0,0,0,1|2,0,0]=4 7173 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000745993 [0,1,0,0,0,1|2,0,0]=4 7174 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000210258_100000182960 [0,1,0,0,0,1|2,0,0]=4 7175 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000745993 [0,1,0,0,0,1|2,0,0]=4 7176 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)Cl 1458a_100000217233_100000694040 [0,1,0,0,0,1|2,0,0]=4 7177 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000217233 [0,1,0,0,0,1|2,0,0]=4 7178 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000217233 [0,1,0,0,0,1|2,0,0]=4 7179 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000217233 [0,1,0,0,0,1|2,0,0]=4 7180 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000217233 [0,1,0,0,0,1|2,0,0]=4 7181 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 62a_100000210303_100000182960 [0,1,0,0,0,1|2,0,0]=4 7182 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210303 [0,1,0,0,0,1|2,0,0]=4 7183 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Cl 2230a_100015525214_100000188356 [0,1,0,0,0,1|2,0,0]=4 7184 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215890 [0,1,0,0,0,1|2,0,0]=4 7185 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749530_100000694040 [0,1,0,0,0,1|2,0,0]=4 7186 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749530 [0,1,0,0,0,1|2,0,0]=4 7187 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749530 [0,1,0,0,0,1|2,0,0]=4 7188 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749530 [0,1,0,0,0,1|2,0,0]=4 7189 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749530 [0,1,0,0,0,1|2,0,0]=4 7190 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000757381 [0,1,0,0,0,1|2,0,0]=4 7191 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000230768_100000694040 [0,1,0,0,0,1|2,0,0]=4 7192 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000230768 [0,1,0,0,0,1|2,0,0]=4 7193 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000230768 [0,1,0,0,0,1|2,0,0]=4 7194 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000230768 [0,1,0,0,0,1|2,0,0]=4 7195 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000230768 [0,1,0,0,0,1|2,0,0]=4 7196 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 62a_100000210202_100000188356 [0,1,0,0,0,1|2,0,0]=4 7197 B15R1.128 CNCCNC(=O)Nc1ccc(cc1)F 2230a_106832991635_100000163319 [0,1,0,0,0,1|1,1,0]=4 7198 B15R1.128 CNCCNC(=O)Nc1ccc(cc1)F 7a_106832991635_100000163319 [0,1,0,0,0,1|1,1,0]=4 7199 B15R1.128 COCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100016285016_100000694040 [0,1,0,0,0,1|1,0,1]=4 7200 B15R1.128 COCC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100016285016 [0,1,0,0,0,1|1,0,1]=4 7201 B15R1.128 COCC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100016285016 [0,1,0,0,0,1|1,0,1]=4 7202 B15R1.128 COCC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100016285016 [0,1,0,0,0,1|1,0,1]=4 7203 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000740836 [0,1,0,0,0,1|1,1,0]=4 7204 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Br 1458a_100000741012_100000189115 [0,1,0,0,0,1|1,1,0]=4 7205 B15R1.128 COCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000740836 [0,1,0,0,0,1|2,0,0]=4 7206 B15R1.128 COCCCC(=O)Cc1ccc(cc1)C 1458a_100000741012_100000210814 [0,1,0,0,0,1|2,0,0]=4 7207 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000740836 [0,1,0,0,0,1|1,0,0]=3 7208 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000741012_100000694040 [0,1,0,0,0,1|1,0,0]=3 7209 B15R1.128 COCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000740836 [0,1,0,0,0,1|1,1,0]=4 7210 B15R1.128 COCCCC(=O)Cc1ccc(cc1)F 1458a_100000741012_100000198546 [0,1,0,0,0,1|1,1,0]=4 7211 B15R1.128 COCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000740836 [0,1,0,0,0,1|1,1,0]=4 7212 B15R1.128 COCCCC(=O)Cc1ccc(cc1)I 1458a_100000741012_100000189116 [0,1,0,0,0,1|1,1,0]=4 7213 B15R1.128 COCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000740836 [0,1,0,0,0,1|2,0,0]=4 7214 B15R1.128 COCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000740836 [0,1,0,0,0,1|2,0,0]=4 7215 B15R1.128 COCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000741012_100012066911 [0,1,0,0,0,1|2,0,0]=4 7216 B15R1.128 COCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000740836 [0,1,0,0,0,1|2,0,0]=4 7217 B15R1.128 COCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000741012_100000735431 [0,1,0,0,0,1|2,0,0]=4 7218 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000741012 [0,1,0,0,0,1|1,1,0]=4 7219 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000741012 [0,1,0,0,0,1|1,1,0]=4 7220 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000741012 [0,1,0,0,0,1|1,1,0]=4 7221 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 34a_100138415774_100000190511 [0,1,0,0,0,1|1,1,0]=4 7222 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000741012 [0,1,0,0,0,1|1,1,0]=4 7223 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000741012 [0,1,0,0,0,1|2,0,0]=4 7224 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000741012 [0,1,0,0,0,1|2,0,0]=4 7225 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000741012 [0,1,0,0,0,1|2,0,0]=4 7226 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 34a_100138415774_200011194843 [0,1,0,0,0,1|2,0,0]=4 7227 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000741012 [0,1,0,0,0,1|2,0,0]=4 7228 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000741012 [0,1,0,0,0,1|1,0,0]=3 7229 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000741012 [0,1,0,0,0,1|1,0,0]=3 7230 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000741012 [0,1,0,0,0,1|1,0,0]=3 7231 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000741012 [0,1,0,0,0,1|1,0,0]=3 7232 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000741012 [0,1,0,0,0,1|1,1,0]=4 7233 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000741012 [0,1,0,0,0,1|1,1,0]=4 7234 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000741012 [0,1,0,0,0,1|1,1,0]=4 7235 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000741012 [0,1,0,0,0,1|1,1,0]=4 7236 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000741012 [0,1,0,0,0,1|1,1,0]=4 7237 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000741012 [0,1,0,0,0,1|1,1,0]=4 7238 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000741012 [0,1,0,0,0,1|1,1,0]=4 7239 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000741012 [0,1,0,0,0,1|1,1,0]=4 7240 B15R1.128 COCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000741012 [0,1,0,0,0,1|2,0,0]=4 7241 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Br 240690a_100000209980_100000198978 [0,1,0,0,0,1|0,1,0]=3 7242 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Br 527a_100000209980_100000198978 [0,1,0,0,0,1|0,1,0]=3 7243 B15R1.128 COCCNC(=O)Cc1ccc(cc1)C 240690a_100000209980_100000212244 [0,1,0,0,0,1|1,0,0]=3 7244 B15R1.128 COCCNC(=O)Cc1ccc(cc1)C 527a_100000209980_100000212244 [0,1,0,0,0,1|1,0,0]=3 7245 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000209980_100000211027 [0,1,0,0,0,1|0,0,0]=2 7246 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Cl 527a_100000209980_100000211027 [0,1,0,0,0,1|0,0,0]=2 7247 B15R1.128 COCCNC(=O)Cc1ccc(cc1)F 1626a_100000209980_100000210951 [0,1,0,0,0,1|0,1,0]=3 7248 B15R1.128 COCCNC(=O)Cc1ccc(cc1)F 240690a_100000209980_100000210951 [0,1,0,0,0,1|0,1,0]=3 7249 B15R1.128 COCCNC(=O)Cc1ccc(cc1)F 527a_100000209980_100000210951 [0,1,0,0,0,1|0,1,0]=3 7250 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I 1626a_100000209980_100000688869 [0,1,0,0,0,1|0,1,0]=3 7251 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I 240690a_100000209980_100000688869 [0,1,0,0,0,1|0,1,0]=3 7252 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I 527a_100000209980_100000688869 [0,1,0,0,0,1|0,1,0]=3 7253 B15R1.128 COCCNC(=O)Cc1ccc(cc1)O 1626a_100000209980_100000198540 [0,1,0,0,0,1|1,0,0]=3 7254 B15R1.128 COCCNC(=O)Cc1ccc(cc1)O 240690a_100000209980_100000198540 [0,1,0,0,0,1|1,0,0]=3 7255 B15R1.128 COCCNC(=O)Cc1ccc(cc1)O 527a_100000209980_100000198540 [0,1,0,0,0,1|1,0,0]=3 7256 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Br 240690a_100000209980_100020629044 [0,1,0,0,0,1|1,1,0]=4 7257 B15R1.128 COCCNC(=O)Cc1ccc(cn1)C 1626a_100000209980_100025705728 [0,1,0,0,0,1|2,0,0]=4 7258 B15R1.128 COCCNC(=O)Cc1ccc(cn1)C 240690a_100000209980_100025705728 [0,1,0,0,0,1|2,0,0]=4 7259 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000209980_100000728320 [0,1,0,0,0,1|1,0,0]=3 7260 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000209980_100000728320 [0,1,0,0,0,1|1,0,0]=3 7261 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Cl 527a_100000209980_100000728320 [0,1,0,0,0,1|1,0,0]=3 7262 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Br 240690a_100000209980_100010067268 [0,1,0,0,0,1|1,1,0]=4 7263 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Br 527a_100000209980_100010067268 [0,1,0,0,0,1|1,1,0]=4 7264 B15R1.128 COCCNC(=O)Cc1ccc(nc1)C 1626a_100000209980_100000740413 [0,1,0,0,0,1|2,0,0]=4 7265 B15R1.128 COCCNC(=O)Cc1ccc(nc1)C 240690a_100000209980_100000740413 [0,1,0,0,0,1|2,0,0]=4 7266 B15R1.128 COCCNC(=O)Cc1ccc(nc1)C 527a_100000209980_100000740413 [0,1,0,0,0,1|2,0,0]=4 7267 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000209980_100000061944 [0,1,0,0,0,1|1,0,0]=3 7268 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000209980_100000061944 [0,1,0,0,0,1|1,0,0]=3 7269 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Cl 527a_100000209980_100000061944 [0,1,0,0,0,1|1,0,0]=3 7270 B15R1.128 COCCNC(=O)Cn1ccc(=O)cc1 1626a_100000209980_200000238563 [0,1,0,0,0,1|2,0,0]=4 7271 B15R1.128 COCCNC(=O)Cn1ccc(=O)cc1 240690a_100000209980_200000238563 [0,1,0,0,0,1|2,0,0]=4 7272 B15R1.128 COCCNC(=O)Cn1ccc(=O)cc1 527a_100000209980_200000238563 [0,1,0,0,0,1|2,0,0]=4 7273 B15R1.128 COCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000209980 [0,1,0,0,0,1|0,1,0]=3 7274 B15R1.128 COCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000209980 [0,1,0,0,0,1|1,0,0]=3 7275 B15R1.128 COCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000209980 [0,1,0,0,0,1|0,0,0]=2 7276 B15R1.128 COCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000209980 [0,1,0,0,0,1|0,1,0]=3 7277 B15R1.128 COCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000209980 [0,1,0,0,0,1|0,1,0]=3 7278 B15R1.128 COCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000209980 [0,1,0,0,0,1|1,0,0]=3 7279 B15R1.128 COCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200009814598 [0,1,0,0,0,1|1,0,0]=3 7280 B15R1.128 COCCNC(C)Cc1ccc(cc1)Cl 270004a_100000209980_100000747806 [0,1,0,0,0,1|1,0,1]=4 7281 B15R1.128 COCSCC(=O)Nc1ccc(cc1)Cl 62a_100000766300_100000182960 [0,1,0,0,0,1|2,0,0]=4 7282 B15R1.128 COCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000766300 [0,1,0,0,0,1|2,0,0]=4 7283 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000173376_100000694040 [0,1,0,0,0,1|1,1,0]=4 7284 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000173376 [0,1,0,0,0,1|1,1,0]=4 7285 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000173376 [0,1,0,0,0,1|1,1,0]=4 7286 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000173376 [0,1,0,0,0,1|1,1,0]=4 7287 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000173376 [0,1,0,0,0,1|1,1,0]=4 7288 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br 11a_100020590264_100000198978 [0,1,0,0,0,1|0,2,0]=4 7289 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br 240690a_100020590264_100000198978 [0,1,0,0,0,1|0,2,0]=4 7290 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br 527a_100020590264_100000198978 [0,1,0,0,0,1|0,2,0]=4 7291 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C 11a_100020590264_100000212244 [0,1,0,0,0,1|1,1,0]=4 7292 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C 240690a_100020590264_100000212244 [0,1,0,0,0,1|1,1,0]=4 7293 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C 527a_100020590264_100000212244 [0,1,0,0,0,1|1,1,0]=4 7294 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl 11a_100020590264_100000211027 [0,1,0,0,0,1|0,1,0]=3 7295 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl 240690a_100020590264_100000211027 [0,1,0,0,0,1|0,1,0]=3 7296 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl 527a_100020590264_100000211027 [0,1,0,0,0,1|0,1,0]=3 7297 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 11a_100020590264_100000210951 [0,1,0,0,0,1|0,2,0]=4 7298 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 1626a_100020590264_100000210951 [0,1,0,0,0,1|0,2,0]=4 7299 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 240690a_100020590264_100000210951 [0,1,0,0,0,1|0,2,0]=4 7300 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 527a_100020590264_100000210951 [0,1,0,0,0,1|0,2,0]=4 7301 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 11a_100020590264_100000688869 [0,1,0,0,0,1|0,2,0]=4 7302 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 1626a_100020590264_100000688869 [0,1,0,0,0,1|0,2,0]=4 7303 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 240690a_100020590264_100000688869 [0,1,0,0,0,1|0,2,0]=4 7304 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 527a_100020590264_100000688869 [0,1,0,0,0,1|0,2,0]=4 7305 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O 1626a_100020590264_100000198540 [0,1,0,0,0,1|1,1,0]=4 7306 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O 240690a_100020590264_100000198540 [0,1,0,0,0,1|1,1,0]=4 7307 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O 527a_100020590264_100000198540 [0,1,0,0,0,1|1,1,0]=4 7308 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 11a_100020590264_100000728320 [0,1,0,0,0,1|1,1,0]=4 7309 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 1626a_100020590264_100000728320 [0,1,0,0,0,1|1,1,0]=4 7310 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 240690a_100020590264_100000728320 [0,1,0,0,0,1|1,1,0]=4 7311 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 527a_100020590264_100000728320 [0,1,0,0,0,1|1,1,0]=4 7312 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 11a_100020590264_100000061944 [0,1,0,0,0,1|1,1,0]=4 7313 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 1626a_100020590264_100000061944 [0,1,0,0,0,1|1,1,0]=4 7314 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 240690a_100020590264_100000061944 [0,1,0,0,0,1|1,1,0]=4 7315 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 527a_100020590264_100000061944 [0,1,0,0,0,1|1,1,0]=4 7316 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020590264 [0,1,0,0,0,1|0,2,0]=4 7317 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020590264 [0,1,0,0,0,1|1,1,0]=4 7318 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020590264 [0,1,0,0,0,1|0,1,0]=3 7319 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020590264 [0,1,0,0,0,1|0,2,0]=4 7320 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)F 62a_200000210301_100000163319 [0,1,0,0,0,1|0,2,0]=4 7321 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020590264 [0,1,0,0,0,1|0,2,0]=4 7322 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020590264 [0,1,0,0,0,1|1,1,0]=4 7323 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000212244_100000210776 [0,1,0,0,0,1|2,0,0]=4 7324 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000210814 [0,1,0,0,0,1|2,0,0]=4 7325 B15R1.128 Cc1ccc(cc1)CC(=O)COCCO 1458a_100000708028_100000210814 [0,1,0,0,0,1|2,0,0]=4 7326 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N 11a_100000720768_100000212244 [0,1,0,0,0,1|2,0,0]=4 7327 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N 240690a_100000720768_100000212244 [0,1,0,0,0,1|2,0,0]=4 7328 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N 527a_100000720768_100000212244 [0,1,0,0,0,1|2,0,0]=4 7329 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_100000212244 [0,1,0,0,0,1|2,0,0]=4 7330 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_100000212244 [0,1,0,0,0,1|2,0,0]=4 7331 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_100000212244 [0,1,0,0,0,1|2,0,0]=4 7332 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_100000212244 [0,1,0,0,0,1|1,0,0]=3 7333 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_100000212244 [0,1,0,0,0,1|1,0,0]=3 7334 B15R1.128 Cc1ccc(cc1)CC(=O)NNCCO 22a_100000210001_100000212244 [0,1,0,0,0,1|1,0,0]=3 7335 B15R1.128 Cc1ccc(cc1)NC(=O)CCCCO 1626a_100000124888_100000695505 [0,1,0,0,0,1|2,0,0]=4 7336 B15R1.128 Cc1ccc(cc1)NC(=O)CNCCF 34a_100000724931_100000182914 [0,1,0,0,0,1|2,0,0]=4 7337 B15R1.128 Cc1ccc(cc1)NC(=O)CNCCO 2230a_100016997473_100000182914 [0,1,0,0,0,1|1,0,0]=3 7338 B15R1.128 Cc1ccc(cc1)NC(=O)CNCCO 34a_100016990907_100000182914 [0,1,0,0,0,1|1,0,0]=3 7339 B15R1.128 Cc1ccc(cc1)NC(=O)COCCO 1626a_100000124888_100000708028 [0,1,0,0,0,1|2,0,0]=4 7340 B15R1.128 Cc1ccc(cc1)NC(=O)CSCCO 62a_100000211926_100000182914 [0,1,0,0,0,1|2,0,0]=4 7341 B15R1.128 Cc1ccc(cc1)NC(=O)NCCC#N 2430a_100000124888_100000720768 [0,1,0,0,0,1|2,0,0]=4 7342 B15R1.128 Cc1ccc(cc1)NC(=O)NCCCF 2430a_100000124888_100015189416 [0,1,0,0,0,1|2,0,0]=4 7343 B15R1.128 Cc1ccc(cc1)NC(=O)NCCCO 2430a_100000124888_100000182051 [0,1,0,0,0,1|1,0,0]=3 7344 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCO 240690a_100000182051_100000740413 [0,1,0,0,0,1|2,0,0]=4 7345 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCO 527a_100000182051_100000740413 [0,1,0,0,0,1|2,0,0]=4 7346 B15R1.128 Cc1ccc(cn1)CC(=O)NNCCO 22a_100000210001_100000740413 [0,1,0,0,0,1|2,0,0]=4 7347 B15R1.128 Cc1ccc(nc1)CC(=O)NCCCO 240690a_100000182051_100025705728 [0,1,0,0,0,1|2,0,0]=4 7348 B15R1.128 Cc1ccc(nc1)CC(=O)NNCCO 22a_100000210001_100025705728 [0,1,0,0,0,1|2,0,0]=4 7349 B15R1.128 Cc1ccc(nc1)NC(=O)CNCCO 2230a_100016997473_100020671718 [0,1,0,0,0,1|2,0,0]=4 7350 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000075515_100000694040 [0,1,0,0,0,1|2,0,0]=4 7351 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000211468 [0,1,0,0,0,1|2,0,0]=4 7352 B15R1.128 N#CCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000075515 [0,1,0,0,0,1|2,0,0]=4 7353 B15R1.128 N#CCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000075515 [0,1,0,0,0,1|2,0,0]=4 7354 B15R1.128 N#CCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000075515 [0,1,0,0,0,1|2,0,0]=4 7355 B15R1.128 N#CCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000075515 [0,1,0,0,0,1|2,0,0]=4 7356 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br 11a_100000720768_100000198978 [0,1,0,0,0,1|1,1,0]=4 7357 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br 240690a_100000720768_100000198978 [0,1,0,0,0,1|1,1,0]=4 7358 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br 527a_100000720768_100000198978 [0,1,0,0,0,1|1,1,0]=4 7359 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl 11a_100000720768_100000211027 [0,1,0,0,0,1|1,0,0]=3 7360 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000720768_100000211027 [0,1,0,0,0,1|1,0,0]=3 7361 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl 527a_100000720768_100000211027 [0,1,0,0,0,1|1,0,0]=3 7362 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 11a_100000720768_100000210951 [0,1,0,0,0,1|1,1,0]=4 7363 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 1626a_100000720768_100000210951 [0,1,0,0,0,1|1,1,0]=4 7364 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 240690a_100000720768_100000210951 [0,1,0,0,0,1|1,1,0]=4 7365 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 527a_100000720768_100000210951 [0,1,0,0,0,1|1,1,0]=4 7366 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 11a_100000720768_100000688869 [0,1,0,0,0,1|1,1,0]=4 7367 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 1626a_100000720768_100000688869 [0,1,0,0,0,1|1,1,0]=4 7368 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 240690a_100000720768_100000688869 [0,1,0,0,0,1|1,1,0]=4 7369 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 527a_100000720768_100000688869 [0,1,0,0,0,1|1,1,0]=4 7370 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O 1626a_100000720768_100000198540 [0,1,0,0,0,1|2,0,0]=4 7371 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O 240690a_100000720768_100000198540 [0,1,0,0,0,1|2,0,0]=4 7372 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O 527a_100000720768_100000198540 [0,1,0,0,0,1|2,0,0]=4 7373 B15R1.128 N#CCCNC(=O)Cc1ccc(cn1)Cl 11a_100000720768_100000728320 [0,1,0,0,0,1|2,0,0]=4 7374 B15R1.128 N#CCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000720768_100000728320 [0,1,0,0,0,1|2,0,0]=4 7375 B15R1.128 N#CCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000720768_100000728320 [0,1,0,0,0,1|2,0,0]=4 7376 B15R1.128 N#CCCNC(=O)Cc1ccc(cn1)Cl 527a_100000720768_100000728320 [0,1,0,0,0,1|2,0,0]=4 7377 B15R1.128 N#CCCNC(=O)Cc1ccc(nc1)Cl 11a_100000720768_100000061944 [0,1,0,0,0,1|2,0,0]=4 7378 B15R1.128 N#CCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000720768_100000061944 [0,1,0,0,0,1|2,0,0]=4 7379 B15R1.128 N#CCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000720768_100000061944 [0,1,0,0,0,1|2,0,0]=4 7380 B15R1.128 N#CCCNC(=O)Cc1ccc(nc1)Cl 527a_100000720768_100000061944 [0,1,0,0,0,1|2,0,0]=4 7381 B15R1.128 N#CCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000720768 [0,1,0,0,0,1|1,1,0]=4 7382 B15R1.128 N#CCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000720768 [0,1,0,0,0,1|1,0,0]=3 7383 B15R1.128 N#CCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000720768 [0,1,0,0,0,1|1,1,0]=4 7384 B15R1.128 N#CCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000720768 [0,1,0,0,0,1|1,1,0]=4 7385 B15R1.128 N#CCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000720768 [0,1,0,0,0,1|2,0,0]=4 7386 B15R1.128 NCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000210304_100000182960 [0,1,0,0,0,1|2,0,0]=4 7387 B15R1.128 Nc1ccc(cc1)NC(=O)COCCO 34a_100011269904_100000211926 [0,1,0,0,0,1|2,0,0]=4 7388 B15R1.128 O=C(CC#CCO)Cc1ccc(cc1)Cl 1458a_100000211027_200000047223 [0,1,0,0,0,1|1,0,1]=4 7389 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)Cl 1458a_100000211027_100000729493 [0,1,0,0,0,1|2,0,0]=4 7390 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Br 1458a_100000198978_100000210776 [0,1,0,0,0,1|1,1,0]=4 7391 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Br 1458a_100000695505_100000189115 [0,1,0,0,0,1|1,1,0]=4 7392 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000210776 [0,1,0,0,0,1|1,0,0]=3 7393 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Cl 1458a_100000695505_100000694040 [0,1,0,0,0,1|1,0,0]=3 7394 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)F 1458a_100000210951_100000210776 [0,1,0,0,0,1|1,1,0]=4 7395 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)F 1458a_100000695505_100000198546 [0,1,0,0,0,1|1,1,0]=4 7396 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)I 1458a_100000688869_100000210776 [0,1,0,0,0,1|1,1,0]=4 7397 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)I 1458a_100000695505_100000189116 [0,1,0,0,0,1|1,1,0]=4 7398 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)O 1458a_100000198540_100000210776 [0,1,0,0,0,1|2,0,0]=4 7399 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)Cl 1458a_100000695505_100012066911 [0,1,0,0,0,1|2,0,0]=4 7400 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)Cl 1458a_100000728320_100000210776 [0,1,0,0,0,1|2,0,0]=4 7401 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)Cl 1458a_100000061944_100000210776 [0,1,0,0,0,1|2,0,0]=4 7402 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)Cl 1458a_100000695505_100000735431 [0,1,0,0,0,1|2,0,0]=4 7403 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)Br 1626a_100000210018_100000695505 [0,1,0,0,0,1|1,1,0]=4 7404 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)Cl 1626a_100000210052_100000695505 [0,1,0,0,0,1|1,0,0]=3 7405 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)F 1626a_100000185862_100000695505 [0,1,0,0,0,1|1,1,0]=4 7406 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)I 1626a_100000185761_100000695505 [0,1,0,0,0,1|1,1,0]=4 7407 B15R1.128 O=C(CCSCF)Nc1ccc(cc1)Cl 62a_100015361967_100000188356 [0,1,0,0,0,1|2,0,0]=4 7408 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)Br 2230a_100000741985_100011217306 [0,1,0,0,0,1|1,1,0]=4 7409 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)Br 34a_100000724931_100000183692 [0,1,0,0,0,1|1,1,0]=4 7410 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)Cl 34a_100000724931_100000182960 [0,1,0,0,0,1|1,0,0]=3 7411 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)F 2230a_100025683178_100011217306 [0,1,0,0,0,1|1,1,0]=4 7412 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)F 34a_100000724931_100000181725 [0,1,0,0,0,1|1,1,0]=4 7413 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)F 34a_100025683178_100011217306 [0,1,0,0,0,1|1,1,0]=4 7414 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)I 34a_100000724931_100000183000 [0,1,0,0,0,1|1,1,0]=4 7415 B15R1.128 O=C(CNCCF)Nc1ccc(cc1)O 34a_100000724931_100000233757 [0,1,0,0,0,1|2,0,0]=4 7416 B15R1.128 O=C(CNCCF)Nc1ccc(nc1)Cl 34a_100000724931_100020591235 [0,1,0,0,0,1|2,0,0]=4 7417 B15R1.128 O=C(CNCCF)Oc1ccc(cc1)Br 34a_100000724931_200010760497 [0,1,0,0,0,1|1,1,0]=4 7418 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)Br 2230a_100000741985_100000211926 [0,1,0,0,0,1|0,1,0]=3 7419 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)Br 2230a_100016997473_100000183692 [0,1,0,0,0,1|0,1,0]=3 7420 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)Br 34a_100016990907_100000183692 [0,1,0,0,0,1|0,1,0]=3 7421 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)Cl 2230a_100016997473_100000182960 [0,1,0,0,0,1|0,0,0]=2 7422 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)Cl 34a_100016990907_100000182960 [0,1,0,0,0,1|0,0,0]=2 7423 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)F 2230a_100016997473_100000181725 [0,1,0,0,0,1|0,1,0]=3 7424 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)F 2230a_100025683178_100000211926 [0,1,0,0,0,1|0,1,0]=3 7425 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)F 34a_100016990907_100000181725 [0,1,0,0,0,1|0,1,0]=3 7426 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)F 34a_100025683178_100000211926 [0,1,0,0,0,1|0,1,0]=3 7427 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)I 2230a_100016997473_100000183000 [0,1,0,0,0,1|0,1,0]=3 7428 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)I 34a_100016990907_100000183000 [0,1,0,0,0,1|0,1,0]=3 7429 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)O 2230a_100016997473_100000233757 [0,1,0,0,0,1|1,0,0]=3 7430 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)O 271570a_203496583355_100000176195 [0,1,0,0,0,1|1,0,0]=3 7431 B15R1.128 O=C(CNCCO)Nc1ccc(cc1)O 34a_100016990907_100000233757 [0,1,0,0,0,1|1,0,0]=3 7432 B15R1.128 O=C(CNCCO)Nc1ccc(cn1)Br 2230a_100016997473_100000239667 [0,1,0,0,0,1|1,1,0]=4 7433 B15R1.128 O=C(CNCCO)Nc1ccc(cn1)Cl 2230a_100016997473_100000183295 [0,1,0,0,0,1|1,0,0]=3 7434 B15R1.128 O=C(CNCCO)Nc1ccc(nc1)Cl 2230a_100016997473_100020591235 [0,1,0,0,0,1|1,0,0]=3 7435 B15R1.128 O=C(CNCCO)Nc1ccc(nc1)Cl 34a_100016990907_100020591235 [0,1,0,0,0,1|1,0,0]=3 7436 B15R1.128 O=C(CNCCO)Oc1ccc(cc1)Br 2230a_100016997473_200010760497 [0,1,0,0,0,1|0,1,0]=3 7437 B15R1.128 O=C(CNCCO)Oc1ccc(cc1)Br 34a_100016990907_200010760497 [0,1,0,0,0,1|0,1,0]=3 7438 B15R1.128 O=C(COCCBr)Nc1ccc(cc1)Cl 34a_100000211926_100000182960 [0,1,0,0,0,1|2,0,0]=4 7439 B15R1.128 O=C(COCCO)Cc1ccc(cc1)Br 1458a_100000708028_100000189115 [0,1,0,0,0,1|1,1,0]=4 7440 B15R1.128 O=C(COCCO)Cc1ccc(cc1)Cl 1458a_100000708028_100000694040 [0,1,0,0,0,1|1,0,0]=3 7441 B15R1.128 O=C(COCCO)Cc1ccc(cc1)F 1458a_100000708028_100000198546 [0,1,0,0,0,1|1,1,0]=4 7442 B15R1.128 O=C(COCCO)Cc1ccc(cc1)I 1458a_100000708028_100000189116 [0,1,0,0,0,1|1,1,0]=4 7443 B15R1.128 O=C(COCCO)Cc1ccc(cn1)Cl 1458a_100000708028_100012066911 [0,1,0,0,0,1|2,0,0]=4 7444 B15R1.128 O=C(COCCO)Cc1ccc(nc1)Cl 1458a_100000708028_100000735431 [0,1,0,0,0,1|2,0,0]=4 7445 B15R1.128 O=C(COCCO)Nc1ccc(cc1)Br 1626a_100000210018_100000708028 [0,1,0,0,0,1|1,1,0]=4 7446 B15R1.128 O=C(COCCO)Nc1ccc(cc1)Cl 1626a_100000210052_100000708028 [0,1,0,0,0,1|1,0,0]=3 7447 B15R1.128 O=C(COCCO)Nc1ccc(cc1)F 1626a_100000185862_100000708028 [0,1,0,0,0,1|1,1,0]=4 7448 B15R1.128 O=C(COCCO)Nc1ccc(cc1)I 1626a_100000185761_100000708028 [0,1,0,0,0,1|1,1,0]=4 7449 B15R1.128 O=C(CSCCF)Nc1ccc(cc1)Cl 62a_100011217306_100000182960 [0,1,0,0,0,1|2,0,0]=4 7450 B15R1.128 O=C(CSCCF)Nc1ccc(cc1)Cl 62a_200011202288_100011217306 [0,1,0,0,0,1|2,0,0]=4 7451 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)Br 62a_100000183692_100000211926 [0,1,0,0,0,1|1,1,0]=4 7452 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)Br 62a_100000211926_100000183692 [0,1,0,0,0,1|1,1,0]=4 7453 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)Cl 62a_100000211926_100000182960 [0,1,0,0,0,1|1,0,0]=3 7454 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)Cl 62a_200011202288_100000211926 [0,1,0,0,0,1|1,0,0]=3 7455 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)F 62a_100000211926_100000181725 [0,1,0,0,0,1|1,1,0]=4 7456 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)F 62a_200000243717_100000211926 [0,1,0,0,0,1|1,1,0]=4 7457 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)I 62a_100000183000_100000211926 [0,1,0,0,0,1|1,1,0]=4 7458 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)I 62a_100000211926_100000183000 [0,1,0,0,0,1|1,1,0]=4 7459 B15R1.128 O=C(CSCCO)Nc1ccc(cc1)O 62a_100000211926_100000233757 [0,1,0,0,0,1|2,0,0]=4 7460 B15R1.128 O=C(CSCCO)Nc1ccc(cn1)Cl 62a_100000211926_100000183295 [0,1,0,0,0,1|2,0,0]=4 7461 B15R1.128 O=C(CSCCO)Nc1ccc(nc1)Cl 62a_100000211926_100020591235 [0,1,0,0,0,1|2,0,0]=4 7462 B15R1.128 O=C(CSCCO)Oc1ccc(cc1)Br 62a_100000211926_200010760497 [0,1,0,0,0,1|1,1,0]=4 7463 B15R1.128 O=C(CSCCO)Oc1ccc(cc1)Br 62a_200010760497_100000211926 [0,1,0,0,0,1|1,1,0]=4 7464 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCF 11a_100015189416_100000198978 [0,1,0,0,0,1|1,1,0]=4 7465 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCF 240690a_100015189416_100000198978 [0,1,0,0,0,1|1,1,0]=4 7466 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCF 527a_100015189416_100000198978 [0,1,0,0,0,1|1,1,0]=4 7467 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO 240690a_100000182051_100000198978 [0,1,0,0,0,1|0,1,0]=3 7468 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO 527a_100000182051_100000198978 [0,1,0,0,0,1|0,1,0]=3 7469 B15R1.128 O=C(Cc1ccc(cc1)Br)NNCCO 22a_100000210001_100000198978 [0,1,0,0,0,1|0,1,0]=3 7470 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCF 11a_100015189416_100000211027 [0,1,0,0,0,1|1,0,0]=3 7471 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCF 240690a_100015189416_100000211027 [0,1,0,0,0,1|1,0,0]=3 7472 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCF 527a_100015189416_100000211027 [0,1,0,0,0,1|1,0,0]=3 7473 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO 240690a_100000182051_100000211027 [0,1,0,0,0,1|0,0,0]=2 7474 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO 527a_100000182051_100000211027 [0,1,0,0,0,1|0,0,0]=2 7475 B15R1.128 O=C(Cc1ccc(cc1)Cl)NNCCO 22a_100000210001_100000211027 [0,1,0,0,0,1|0,0,0]=2 7476 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 11a_100015189416_100000210951 [0,1,0,0,0,1|1,1,0]=4 7477 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 1626a_100015189416_100000210951 [0,1,0,0,0,1|1,1,0]=4 7478 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 240690a_100015189416_100000210951 [0,1,0,0,0,1|1,1,0]=4 7479 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 527a_100015189416_100000210951 [0,1,0,0,0,1|1,1,0]=4 7480 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO 240690a_100000182051_100000210951 [0,1,0,0,0,1|0,1,0]=3 7481 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO 527a_100000182051_100000210951 [0,1,0,0,0,1|0,1,0]=3 7482 B15R1.128 O=C(Cc1ccc(cc1)F)NNCCO 22a_100000210001_100000210951 [0,1,0,0,0,1|0,1,0]=3 7483 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 11a_100015189416_100000688869 [0,1,0,0,0,1|1,1,0]=4 7484 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 1626a_100015189416_100000688869 [0,1,0,0,0,1|1,1,0]=4 7485 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 240690a_100015189416_100000688869 [0,1,0,0,0,1|1,1,0]=4 7486 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 527a_100015189416_100000688869 [0,1,0,0,0,1|1,1,0]=4 7487 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCO 240690a_100000182051_100000688869 [0,1,0,0,0,1|0,1,0]=3 7488 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCO 527a_100000182051_100000688869 [0,1,0,0,0,1|0,1,0]=3 7489 B15R1.128 O=C(Cc1ccc(cc1)I)NNCCO 22a_100000210001_100000688869 [0,1,0,0,0,1|0,1,0]=3 7490 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCF 1626a_100015189416_100000198540 [0,1,0,0,0,1|2,0,0]=4 7491 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCF 240690a_100015189416_100000198540 [0,1,0,0,0,1|2,0,0]=4 7492 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCF 527a_100015189416_100000198540 [0,1,0,0,0,1|2,0,0]=4 7493 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO 240690a_100000182051_100000198540 [0,1,0,0,0,1|1,0,0]=3 7494 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO 527a_100000182051_100000198540 [0,1,0,0,0,1|1,0,0]=3 7495 B15R1.128 O=C(Cc1ccc(cc1)O)NNCCO 22a_100000210001_100000198540 [0,1,0,0,0,1|1,0,0]=3 7496 B15R1.128 O=C(Cc1ccc(cn1)Br)NCCCO 240690a_100000182051_100020629044 [0,1,0,0,0,1|1,1,0]=4 7497 B15R1.128 O=C(Cc1ccc(cn1)Br)NNCCO 22a_100000210001_100020629044 [0,1,0,0,0,1|1,1,0]=4 7498 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 11a_100015189416_100000728320 [0,1,0,0,0,1|2,0,0]=4 7499 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 1626a_100015189416_100000728320 [0,1,0,0,0,1|2,0,0]=4 7500 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 240690a_100015189416_100000728320 [0,1,0,0,0,1|2,0,0]=4 7501 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 527a_100015189416_100000728320 [0,1,0,0,0,1|2,0,0]=4 7502 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCO 240690a_100000182051_100000728320 [0,1,0,0,0,1|1,0,0]=3 7503 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCO 527a_100000182051_100000728320 [0,1,0,0,0,1|1,0,0]=3 7504 B15R1.128 O=C(Cc1ccc(cn1)Cl)NNCCO 22a_100000210001_100000728320 [0,1,0,0,0,1|1,0,0]=3 7505 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCO 240690a_100000182051_100010067268 [0,1,0,0,0,1|1,1,0]=4 7506 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCO 527a_100000182051_100010067268 [0,1,0,0,0,1|1,1,0]=4 7507 B15R1.128 O=C(Cc1ccc(nc1)Br)NNCCO 22a_100000210001_100010067268 [0,1,0,0,0,1|1,1,0]=4 7508 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 11a_100015189416_100000061944 [0,1,0,0,0,1|2,0,0]=4 7509 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 1626a_100015189416_100000061944 [0,1,0,0,0,1|2,0,0]=4 7510 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 240690a_100015189416_100000061944 [0,1,0,0,0,1|2,0,0]=4 7511 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 527a_100015189416_100000061944 [0,1,0,0,0,1|2,0,0]=4 7512 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCO 240690a_100000182051_100000061944 [0,1,0,0,0,1|1,0,0]=3 7513 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCO 527a_100000182051_100000061944 [0,1,0,0,0,1|1,0,0]=3 7514 B15R1.128 O=C(Cc1ccc(nc1)Cl)NNCCO 22a_100000210001_100000061944 [0,1,0,0,0,1|1,0,0]=3 7515 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCO 240690a_100000182051_200000238563 [0,1,0,0,0,1|2,0,0]=4 7516 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCO 527a_100000182051_200000238563 [0,1,0,0,0,1|2,0,0]=4 7517 B15R1.128 O=C(Cn1ccc(=O)cc1)NNCCO 22a_100000210001_200000238563 [0,1,0,0,0,1|2,0,0]=4 7518 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)Br 2430a_100000210018_100015189416 [0,1,0,0,0,1|1,1,0]=4 7519 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)Cl 2430a_100000210052_100015189416 [0,1,0,0,0,1|1,0,0]=3 7520 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)F 2430a_100000185862_100015189416 [0,1,0,0,0,1|1,1,0]=4 7521 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)I 2430a_100000185761_100015189416 [0,1,0,0,0,1|1,1,0]=4 7522 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)O 2430a_100000185829_100015189416 [0,1,0,0,0,1|2,0,0]=4 7523 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)Br 2430a_100000210018_100000182051 [0,1,0,0,0,1|0,1,0]=3 7524 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)Cl 2430a_100000210052_100000182051 [0,1,0,0,0,1|0,0,0]=2 7525 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)F 2430a_100000185862_100000182051 [0,1,0,0,0,1|0,1,0]=3 7526 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)I 2430a_100000185761_100000182051 [0,1,0,0,0,1|0,1,0]=3 7527 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)O 2430a_100000185829_100000182051 [0,1,0,0,0,1|1,0,0]=3 7528 B15R1.128 [13CH3]SCCNC(=O)Nc1ccc(cc1)F 62a_200025704644_100000163319 [0,1,0,0,0,1|0,2,0]=4 7529 B15R1.135 C#CCNC(=O)C(C)c1ccc(cc1)Cl 11a_100000212058_100011216001 [0,1,0,0,0,1|1,0,1]=4 7530 B15R1.135 C#CCNC(=O)C(C)c1ccc(cc1)Cl 1626a_100000212058_100011216001 [0,1,0,0,0,1|1,0,1]=4 7531 B15R1.135 C#CCNC(=O)C(C)c1ccc(cc1)Cl 240690a_100000212058_100011216001 [0,1,0,0,0,1|1,0,1]=4 7532 B15R1.135 C#CCNC(=O)C(C)c1ccc(cc1)Cl 527a_100000212058_100011216001 [0,1,0,0,0,1|1,0,1]=4 7533 B15R1.135 C#CCNC(=O)C(F)c1ccc(cc1)Cl 11a_100000212058_100012277543 [0,1,0,0,0,1|1,0,1]=4 7534 B15R1.135 C#CCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100000212058_100012277543 [0,1,0,0,0,1|1,0,1]=4 7535 B15R1.135 C#CCNC(=O)C(F)c1ccc(cc1)Cl 240690a_100000212058_100012277543 [0,1,0,0,0,1|1,0,1]=4 7536 B15R1.135 C#CCNC(=O)C(F)c1ccc(cc1)Cl 527a_100000212058_100012277543 [0,1,0,0,0,1|1,0,1]=4 7537 B15R1.135 C#CCNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100000212058_100009817493 [0,1,0,0,0,1|1,0,1]=4 7538 B15R1.135 C=CCNC(=O)C(C)c1ccc(cc1)Cl 1626a_100020586998_100011216001 [0,1,0,0,0,1|1,0,1]=4 7539 B15R1.135 C=CCNC(=O)C(C)c1ccc(cc1)Cl 240690a_100020586998_100011216001 [0,1,0,0,0,1|1,0,1]=4 7540 B15R1.135 C=CCNC(=O)C(C)c1ccc(cc1)Cl 527a_100020586998_100011216001 [0,1,0,0,0,1|1,0,1]=4 7541 B15R1.135 C=CCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100020586998_100012277543 [0,1,0,0,0,1|1,0,1]=4 7542 B15R1.135 C=CCNC(=O)C(F)c1ccc(cc1)Cl 240690a_100020586998_100012277543 [0,1,0,0,0,1|1,0,1]=4 7543 B15R1.135 C=CCNC(=O)C(F)c1ccc(cc1)Cl 527a_100020586998_100012277543 [0,1,0,0,0,1|1,0,1]=4 7544 B15R1.135 C=CCNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100020586998_100009817493 [0,1,0,0,0,1|1,0,1]=4 7545 B15R1.135 CC(C(=O)C#CCO)c1ccc(cc1)Cl 1458a_100000049017_100000684792 [0,1,0,0,0,1|1,0,1]=4 7546 B15R1.135 CC(C(=O)CCCF)c1ccc(cc1)Cl 1458a_100011216001_100011934791 [0,1,0,0,0,1|2,0,0]=4 7547 B15R1.135 CC(C(=O)CCCO)c1ccc(cc1)Cl 1458a_100011216001_100011215043 [0,1,0,0,0,1|1,0,0]=3 7548 B15R1.135 CC(C(=O)CCCO)c1ccc(cc1)F 1458a_100011435297_100011215043 [0,1,0,0,0,1|1,1,0]=4 7549 B15R1.135 CC(C(=O)CCCO)c1ccc(cc1)O 1458a_100000031422_100011215043 [0,1,0,0,0,1|2,0,0]=4 7550 B15R1.135 CC(C(=O)NCC#N)c1ccc(cc1)Cl 1626a_100000734998_100011216001 [0,1,0,0,0,1|1,0,1]=4 7551 B15R1.135 CC(C(=O)NCC#N)c1ccc(cc1)Cl 527a_100000734998_100011216001 [0,1,0,0,0,1|1,0,1]=4 7552 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)Cl 11a_100000724931_100011216001 [0,1,0,0,0,1|1,0,0]=3 7553 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)Cl 1626a_100000724931_100011216001 [0,1,0,0,0,1|1,0,0]=3 7554 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)Cl 240690a_100000724931_100011216001 [0,1,0,0,0,1|1,0,0]=3 7555 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)Cl 527a_100000724931_100011216001 [0,1,0,0,0,1|1,0,0]=3 7556 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)F 11a_100000724931_100011435297 [0,1,0,0,0,1|1,1,0]=4 7557 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)F 1626a_100000724931_100011435297 [0,1,0,0,0,1|1,1,0]=4 7558 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)F 240690a_100000724931_100011435297 [0,1,0,0,0,1|1,1,0]=4 7559 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)F 527a_100000724931_100011435297 [0,1,0,0,0,1|1,1,0]=4 7560 B15R1.135 CC(C(=O)NCCF)c1ccc(cc1)O 240690a_100000724931_100000031422 [0,1,0,0,0,1|2,0,0]=4 7561 B15R1.135 CC(C(=O)NCCO)c1ccc(cc1)Cl 240690a_100000210304_100011216001 [0,1,0,0,0,1|0,0,0]=2 7562 B15R1.135 CC(C(=O)NCCO)c1ccc(cc1)Cl 527a_100000210304_100011216001 [0,1,0,0,0,1|0,0,0]=2 7563 B15R1.135 CC(C(=O)NCCO)c1ccc(cc1)F 240690a_100000210304_100011435297 [0,1,0,0,0,1|0,1,0]=3 7564 B15R1.135 CC(C(=O)NCCO)c1ccc(cc1)F 527a_100000210304_100011435297 [0,1,0,0,0,1|0,1,0]=3 7565 B15R1.135 CC(C(=O)NCCO)c1ccc(cc1)O 240690a_100000210304_100000031422 [0,1,0,0,0,1|1,0,0]=3 7566 B15R1.135 CC(NCCO)C(=O)c1ccc(cc1)Cl 2230a_100016997473_100000183210 [0,1,0,0,0,1|1,0,1]=4 7567 B15R1.135 CCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000210183_100000684792 [0,1,0,0,0,1|2,0,0]=4 7568 B15R1.135 CCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000210211 [0,1,0,0,0,1|2,0,0]=4 7569 B15R1.135 CCCCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000210211 [0,1,0,0,0,1|2,0,0]=4 7570 B15R1.135 CCCCC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000210183 [0,1,0,0,0,1|2,0,0]=4 7571 B15R1.135 CCCCC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000210183 [0,1,0,0,0,1|2,0,0]=4 7572 B15R1.135 CCCCC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000210183 [0,1,0,0,0,1|2,0,0]=4 7573 B15R1.135 CCCCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210211 [0,1,0,0,0,1|2,0,0]=4 7574 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)C 11a_100020643023_100000751627 [0,1,0,0,0,1|2,0,0]=4 7575 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)C 1626a_100020643023_100000751627 [0,1,0,0,0,1|2,0,0]=4 7576 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)C 240690a_100020643023_100000751627 [0,1,0,0,0,1|2,0,0]=4 7577 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)C 527a_100020643023_100000751627 [0,1,0,0,0,1|2,0,0]=4 7578 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)Cl 11a_100020643023_100011216001 [0,1,0,0,0,1|1,0,0]=3 7579 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)Cl 1626a_100020643023_100011216001 [0,1,0,0,0,1|1,0,0]=3 7580 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)Cl 240690a_100020643023_100011216001 [0,1,0,0,0,1|1,0,0]=3 7581 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)Cl 527a_100020643023_100011216001 [0,1,0,0,0,1|1,0,0]=3 7582 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)F 11a_100020643023_100011435297 [0,1,0,0,0,1|1,1,0]=4 7583 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)F 1626a_100020643023_100011435297 [0,1,0,0,0,1|1,1,0]=4 7584 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)F 240690a_100020643023_100011435297 [0,1,0,0,0,1|1,1,0]=4 7585 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)F 527a_100020643023_100011435297 [0,1,0,0,0,1|1,1,0]=4 7586 B15R1.135 CCCNC(=O)C(C)c1ccc(cc1)O 240690a_100020643023_100000031422 [0,1,0,0,0,1|2,0,0]=4 7587 B15R1.135 CCCNC(=O)C(F)c1ccc(cc1)Cl 11a_100020643023_100012277543 [0,1,0,0,0,1|1,0,0]=3 7588 B15R1.135 CCCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100020643023_100012277543 [0,1,0,0,0,1|1,0,0]=3 7589 B15R1.135 CCCNC(=O)C(F)c1ccc(cc1)Cl 240690a_100020643023_100012277543 [0,1,0,0,0,1|1,0,0]=3 7590 B15R1.135 CCCNC(=O)C(F)c1ccc(cc1)Cl 527a_100020643023_100012277543 [0,1,0,0,0,1|1,0,0]=3 7591 B15R1.135 CCCNC(=O)C(O)c1ccc(cc1)Br 240690a_100020643023_100000756554 [0,1,0,0,0,1|1,1,0]=4 7592 B15R1.135 CCCNC(=O)C(O)c1ccc(cc1)F 240690a_100020643023_100000209909 [0,1,0,0,0,1|1,1,0]=4 7593 B15R1.135 CCCNC(=O)C(O)c1ccc(cc1)O 240690a_100020643023_100011215213 [0,1,0,0,0,1|2,0,0]=4 7594 B15R1.135 CCCNC(=O)N(C)c1ccc(cc1)Br 512a_100020643023_100000219623 [0,1,0,0,0,1|1,1,0]=4 7595 B15R1.135 CCCNC(=O)N(C)c1ccc(cc1)C 512a_100020643023_100000219977 [0,1,0,0,0,1|2,0,0]=4 7596 B15R1.135 CCCNC(=O)N(C)c1ccc(cc1)I 512a_100000743151_100020643023 [0,1,0,0,0,1|1,1,0]=4 7597 B15R1.135 CCCNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100020643023_100009815954 [0,1,0,0,0,1|2,0,0]=4 7598 B15R1.135 CCCNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100020643023_100009817493 [0,1,0,0,0,1|1,0,0]=3 7599 B15R1.135 CCNNC(=O)C(C)c1ccc(cc1)Cl 22a_100000756455_100011216001 [0,1,0,0,0,1|2,0,0]=4 7600 B15R1.135 CCNNC(=O)C(F)c1ccc(cc1)Cl 22a_100000756455_100012277543 [0,1,0,0,0,1|2,0,0]=4 7601 B15R1.135 CCNNC(=O)[C@H](O)c1ccc(cc1)Cl 22a_100000756455_100009817493 [0,1,0,0,0,1|2,0,0]=4 7602 B15R1.135 CN(C(=O)NCCF)c1ccc(cc1)I 512a_100000743151_100000724931 [0,1,0,0,0,1|1,1,0]=4 7603 B15R1.135 CN(C(=O)NCCO)c1ccc(cc1)I 512a_100000743151_100000210304 [0,1,0,0,0,1|0,1,0]=3 7604 B15R1.135 C[C@@H](NCCO)[C@@H](O)c1ccc(cc1)Cl 2230a_200009830414_100000211926 [0,1,0,0,0,1|1,0,1]=4 7605 B15R1.135 C[C@@H](NCCO)[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_100000211926 [0,1,0,0,0,1|1,0,1]=4 7606 B15R1.135 Cc1ccc(cc1)C(C)C(=O)CCCO 1458a_100000751627_100011215043 [0,1,0,0,0,1|2,0,0]=4 7607 B15R1.135 Cc1ccc(cc1)C(C)C(=O)NCCF 11a_100000724931_100000751627 [0,1,0,0,0,1|2,0,0]=4 7608 B15R1.135 Cc1ccc(cc1)C(C)C(=O)NCCF 1626a_100000724931_100000751627 [0,1,0,0,0,1|2,0,0]=4 7609 B15R1.135 Cc1ccc(cc1)C(C)C(=O)NCCF 240690a_100000724931_100000751627 [0,1,0,0,0,1|2,0,0]=4 7610 B15R1.135 Cc1ccc(cc1)C(C)C(=O)NCCF 527a_100000724931_100000751627 [0,1,0,0,0,1|2,0,0]=4 7611 B15R1.135 Cc1ccc(cc1)C(C)C(=O)NCCO 240690a_100000210304_100000751627 [0,1,0,0,0,1|1,0,0]=3 7612 B15R1.135 Cc1ccc(cc1)C(C)C(=O)NCCO 527a_100000210304_100000751627 [0,1,0,0,0,1|1,0,0]=3 7613 B15R1.135 Cc1ccc(cc1)[C@@H](O)C(=O)CCCO 1458a_100009815954_100011215043 [0,1,0,0,0,1|2,0,0]=4 7614 B15R1.135 Cc1ccc(cc1)[C@@H](O)C(=O)NCCF 240690a_100000724931_100009815954 [0,1,0,0,0,1|2,0,0]=4 7615 B15R1.135 Cc1ccc(cc1)[C@@H](O)C(=O)NCCO 240690a_100000210304_100009815954 [0,1,0,0,0,1|1,0,0]=3 7616 B15R1.135 N#CCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100000734998_100012277543 [0,1,0,0,0,1|1,0,1]=4 7617 B15R1.135 N#CCNC(=O)C(F)c1ccc(cc1)Cl 527a_100000734998_100012277543 [0,1,0,0,0,1|1,0,1]=4 7618 B15R1.135 O=C(CCCF)C(F)c1ccc(cc1)Cl 1458a_100012277543_100011934791 [0,1,0,0,0,1|2,0,0]=4 7619 B15R1.135 O=C(CCCF)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100011934791 [0,1,0,0,0,1|2,0,0]=4 7620 B15R1.135 O=C(CCCO)C(F)c1ccc(cc1)Cl 1458a_100012277543_100011215043 [0,1,0,0,0,1|1,0,0]=3 7621 B15R1.135 O=C(CCCO)C(O)c1ccc(cc1)Br 1458a_100000756554_100011215043 [0,1,0,0,0,1|1,1,0]=4 7622 B15R1.135 O=C(CCCO)C(O)c1ccc(cc1)F 1458a_100000209909_100011215043 [0,1,0,0,0,1|1,1,0]=4 7623 B15R1.135 O=C(CCCO)C(O)c1ccc(cc1)O 1458a_100011215213_100011215043 [0,1,0,0,0,1|2,0,0]=4 7624 B15R1.135 O=C(CCCO)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100011215043 [0,1,0,0,0,1|1,0,0]=3 7625 B15R1.135 O=C(NCCF)C(F)c1ccc(cc1)Cl 11a_100000724931_100012277543 [0,1,0,0,0,1|1,0,0]=3 7626 B15R1.135 O=C(NCCF)C(F)c1ccc(cc1)Cl 1626a_100000724931_100012277543 [0,1,0,0,0,1|1,0,0]=3 7627 B15R1.135 O=C(NCCF)C(F)c1ccc(cc1)Cl 240690a_100000724931_100012277543 [0,1,0,0,0,1|1,0,0]=3 7628 B15R1.135 O=C(NCCF)C(F)c1ccc(cc1)Cl 527a_100000724931_100012277543 [0,1,0,0,0,1|1,0,0]=3 7629 B15R1.135 O=C(NCCF)C(O)c1ccc(cc1)Br 240690a_100000724931_100000756554 [0,1,0,0,0,1|1,1,0]=4 7630 B15R1.135 O=C(NCCF)C(O)c1ccc(cc1)F 240690a_100000724931_100000209909 [0,1,0,0,0,1|1,1,0]=4 7631 B15R1.135 O=C(NCCF)C(O)c1ccc(cc1)O 240690a_100000724931_100011215213 [0,1,0,0,0,1|2,0,0]=4 7632 B15R1.135 O=C(NCCF)[C@H](O)c1ccc(cc1)Cl 240690a_100000724931_100009817493 [0,1,0,0,0,1|1,0,0]=3 7633 B15R1.135 O=C(NCCO)C(F)c1ccc(cc1)Cl 240690a_100000210304_100012277543 [0,1,0,0,0,1|0,0,0]=2 7634 B15R1.135 O=C(NCCO)C(F)c1ccc(cc1)Cl 527a_100000210304_100012277543 [0,1,0,0,0,1|0,0,0]=2 7635 B15R1.135 O=C(NCCO)C(O)c1ccc(cc1)Br 240690a_100000210304_100000756554 [0,1,0,0,0,1|0,1,0]=3 7636 B15R1.135 O=C(NCCO)C(O)c1ccc(cc1)F 240690a_100000210304_100000209909 [0,1,0,0,0,1|0,1,0]=3 7637 B15R1.135 O=C(NCCO)C(O)c1ccc(cc1)O 240690a_100000210304_100011215213 [0,1,0,0,0,1|1,0,0]=3 7638 B15R1.135 O=C(NCCO)[C@H](O)c1ccc(cc1)Cl 240690a_100000210304_100009817493 [0,1,0,0,0,1|0,0,0]=2 7639 B15R1.564 OCCNC(CO)Cc1ccc(cc1)Cl 2230a_100025702442_100000211926 [0,1,0,0,0,1|0,0,2]=4 7640 B15R1.564 OCCNC(CO)Cc1ccc(cc1)Cl 34a_100025702442_100000211926 [0,1,0,0,0,1|0,0,2]=4 7641 B15R1.981 C#CC(C)NC(=O)Cc1ccc(cc1)Cl 11a_100000707721_100000211027 [0,1,0,0,0,1|1,0,1]=4 7642 B15R1.981 C#CC(C)NC(=O)Cc1ccc(cc1)Cl 240690a_100000707721_100000211027 [0,1,0,0,0,1|1,0,1]=4 7643 B15R1.981 C#CC(C)NC(=O)Cc1ccc(cc1)Cl 527a_100000707721_100000211027 [0,1,0,0,0,1|1,0,1]=4 7644 B15R1.981 C#CC(C)NC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000707721 [0,1,0,0,0,1|1,0,1]=4 7645 B15R1.981 CC(C#N)NC(=O)Cc1ccc(cc1)Cl 11a_100000737613_100000211027 [0,1,0,0,0,1|1,0,1]=4 7646 B15R1.981 CC(C#N)NC(=O)Cc1ccc(cc1)Cl 527a_100000737613_100000211027 [0,1,0,0,0,1|1,0,1]=4 7647 B15R1.981 CC(C#N)NC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000737613 [0,1,0,0,0,1|1,0,1]=4 7648 B15R1.981 CC(Cc1ccc(cc1)Cl)N[C@H](C)CO 270004a_100000737577_100000747806 [0,1,0,0,0,1|1,0,1]=4 7649 B15R1.981 CCC(C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000748023 [0,1,0,0,0,1|2,0,0]=4 7650 B15R1.981 CCC(C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000708755_100000694040 [0,1,0,0,0,1|2,0,0]=4 7651 B15R1.981 CCC(C)CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000708755 [0,1,0,0,0,1|2,0,0]=4 7652 B15R1.981 CCC(C)CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000708755 [0,1,0,0,0,1|2,0,0]=4 7653 B15R1.981 CCC(C)CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000708755 [0,1,0,0,0,1|2,0,0]=4 7654 B15R1.981 CCC(C)CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000708755 [0,1,0,0,0,1|2,0,0]=4 7655 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)Br 11a_100000209981_100000198978 [0,1,0,0,0,1|1,1,0]=4 7656 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)Br 240690a_100000209981_100000198978 [0,1,0,0,0,1|1,1,0]=4 7657 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)Br 527a_100000209981_100000198978 [0,1,0,0,0,1|1,1,0]=4 7658 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)C 11a_100000209981_100000212244 [0,1,0,0,0,1|2,0,0]=4 7659 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)C 240690a_100000209981_100000212244 [0,1,0,0,0,1|2,0,0]=4 7660 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)C 527a_100000209981_100000212244 [0,1,0,0,0,1|2,0,0]=4 7661 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)Cl 11a_100000209981_100000211027 [0,1,0,0,0,1|1,0,0]=3 7662 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)Cl 240690a_100000209981_100000211027 [0,1,0,0,0,1|1,0,0]=3 7663 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)Cl 527a_100000209981_100000211027 [0,1,0,0,0,1|1,0,0]=3 7664 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)F 11a_100000209981_100000210951 [0,1,0,0,0,1|1,1,0]=4 7665 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)F 1626a_100000209981_100000210951 [0,1,0,0,0,1|1,1,0]=4 7666 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)F 240690a_100000209981_100000210951 [0,1,0,0,0,1|1,1,0]=4 7667 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)F 527a_100000209981_100000210951 [0,1,0,0,0,1|1,1,0]=4 7668 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)I 11a_100000209981_100000688869 [0,1,0,0,0,1|1,1,0]=4 7669 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)I 1626a_100000209981_100000688869 [0,1,0,0,0,1|1,1,0]=4 7670 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)I 240690a_100000209981_100000688869 [0,1,0,0,0,1|1,1,0]=4 7671 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)I 527a_100000209981_100000688869 [0,1,0,0,0,1|1,1,0]=4 7672 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)O 1626a_100000209981_100000198540 [0,1,0,0,0,1|2,0,0]=4 7673 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)O 240690a_100000209981_100000198540 [0,1,0,0,0,1|2,0,0]=4 7674 B15R1.981 CCC(C)NC(=O)Cc1ccc(cc1)O 527a_100000209981_100000198540 [0,1,0,0,0,1|2,0,0]=4 7675 B15R1.981 CCC(C)NC(=O)Cc1ccc(cn1)Cl 11a_100000209981_100000728320 [0,1,0,0,0,1|2,0,0]=4 7676 B15R1.981 CCC(C)NC(=O)Cc1ccc(cn1)Cl 1626a_100000209981_100000728320 [0,1,0,0,0,1|2,0,0]=4 7677 B15R1.981 CCC(C)NC(=O)Cc1ccc(cn1)Cl 240690a_100000209981_100000728320 [0,1,0,0,0,1|2,0,0]=4 7678 B15R1.981 CCC(C)NC(=O)Cc1ccc(cn1)Cl 527a_100000209981_100000728320 [0,1,0,0,0,1|2,0,0]=4 7679 B15R1.981 CCC(C)NC(=O)Cc1ccc(nc1)Cl 11a_100000209981_100000061944 [0,1,0,0,0,1|2,0,0]=4 7680 B15R1.981 CCC(C)NC(=O)Cc1ccc(nc1)Cl 1626a_100000209981_100000061944 [0,1,0,0,0,1|2,0,0]=4 7681 B15R1.981 CCC(C)NC(=O)Cc1ccc(nc1)Cl 240690a_100000209981_100000061944 [0,1,0,0,0,1|2,0,0]=4 7682 B15R1.981 CCC(C)NC(=O)Cc1ccc(nc1)Cl 527a_100000209981_100000061944 [0,1,0,0,0,1|2,0,0]=4 7683 B15R1.981 CCC(C)NC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000209981 [0,1,0,0,0,1|1,1,0]=4 7684 B15R1.981 CCC(C)NC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000209981 [0,1,0,0,0,1|2,0,0]=4 7685 B15R1.981 CCC(C)NC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000209981 [0,1,0,0,0,1|1,0,0]=3 7686 B15R1.981 CCC(C)NC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000209981 [0,1,0,0,0,1|1,1,0]=4 7687 B15R1.981 CCC(C)NC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000209981 [0,1,0,0,0,1|1,1,0]=4 7688 B15R1.981 CCC(C)NC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000209981 [0,1,0,0,0,1|2,0,0]=4 7689 B15R1.981 CCC(O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011218378 [0,1,0,0,0,1|2,0,0]=4 7690 B15R1.981 CCC(O)CC(=O)Cc1ccc(cc1)Cl 1458a_100011667805_100000694040 [0,1,0,0,0,1|2,0,0]=4 7691 B15R1.981 CCC(O)CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100011667805 [0,1,0,0,0,1|2,0,0]=4 7692 B15R1.981 CCC(O)CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011667805 [0,1,0,0,0,1|2,0,0]=4 7693 B15R1.981 CC[C@H](C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100009816398 [0,1,0,0,0,1|2,0,0]=4 7694 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000059175 [0,1,0,0,0,1|1,1,0]=4 7695 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000059175 [0,1,0,0,0,1|1,0,0]=3 7696 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000059175 [0,1,0,0,0,1|1,1,0]=4 7697 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000059175 [0,1,0,0,0,1|1,1,0]=4 7698 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000059175 [0,1,0,0,0,1|2,0,0]=4 7699 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000059175 [0,1,0,0,0,1|2,0,0]=4 7700 B15R1.981 C[C@@H](CO)CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000059175 [0,1,0,0,0,1|2,0,0]=4 7701 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)Br 11a_100102880703_100000198978 [0,1,0,0,0,1|1,1,0]=4 7702 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)Br 240690a_100102880703_100000198978 [0,1,0,0,0,1|1,1,0]=4 7703 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)Br 527a_100102880703_100000198978 [0,1,0,0,0,1|1,1,0]=4 7704 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)Cl 11a_100102880703_100000211027 [0,1,0,0,0,1|1,0,0]=3 7705 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)Cl 240690a_100102880703_100000211027 [0,1,0,0,0,1|1,0,0]=3 7706 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)Cl 527a_100102880703_100000211027 [0,1,0,0,0,1|1,0,0]=3 7707 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)F 11a_100102880703_100000210951 [0,1,0,0,0,1|1,1,0]=4 7708 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)F 1626a_100102880703_100000210951 [0,1,0,0,0,1|1,1,0]=4 7709 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)F 240690a_100102880703_100000210951 [0,1,0,0,0,1|1,1,0]=4 7710 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)F 527a_100102880703_100000210951 [0,1,0,0,0,1|1,1,0]=4 7711 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)I 11a_100102880703_100000688869 [0,1,0,0,0,1|1,1,0]=4 7712 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)I 1626a_100102880703_100000688869 [0,1,0,0,0,1|1,1,0]=4 7713 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)I 240690a_100102880703_100000688869 [0,1,0,0,0,1|1,1,0]=4 7714 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)I 527a_100102880703_100000688869 [0,1,0,0,0,1|1,1,0]=4 7715 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)O 1626a_100102880703_100000198540 [0,1,0,0,0,1|2,0,0]=4 7716 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)O 240690a_100102880703_100000198540 [0,1,0,0,0,1|2,0,0]=4 7717 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cc1)O 527a_100102880703_100000198540 [0,1,0,0,0,1|2,0,0]=4 7718 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cn1)Cl 11a_100102880703_100000728320 [0,1,0,0,0,1|2,0,0]=4 7719 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cn1)Cl 1626a_100102880703_100000728320 [0,1,0,0,0,1|2,0,0]=4 7720 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cn1)Cl 240690a_100102880703_100000728320 [0,1,0,0,0,1|2,0,0]=4 7721 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(cn1)Cl 527a_100102880703_100000728320 [0,1,0,0,0,1|2,0,0]=4 7722 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(nc1)Cl 11a_100102880703_100000061944 [0,1,0,0,0,1|2,0,0]=4 7723 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(nc1)Cl 1626a_100102880703_100000061944 [0,1,0,0,0,1|2,0,0]=4 7724 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(nc1)Cl 240690a_100102880703_100000061944 [0,1,0,0,0,1|2,0,0]=4 7725 B15R1.981 C[C@H](CF)NC(=O)Cc1ccc(nc1)Cl 527a_100102880703_100000061944 [0,1,0,0,0,1|2,0,0]=4 7726 B15R1.981 C[C@H](CF)NC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102880703 [0,1,0,0,0,1|1,1,0]=4 7727 B15R1.981 C[C@H](CF)NC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102880703 [0,1,0,0,0,1|1,0,0]=3 7728 B15R1.981 C[C@H](CF)NC(=O)Nc1ccc(cc1)F 2430a_100000185862_100102880703 [0,1,0,0,0,1|1,1,0]=4 7729 B15R1.981 C[C@H](CF)NC(=O)Nc1ccc(cc1)I 2430a_100000185761_100102880703 [0,1,0,0,0,1|1,1,0]=4 7730 B15R1.981 C[C@H](CF)NC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102880703 [0,1,0,0,0,1|2,0,0]=4 7731 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)Br 240690a_100000737577_100000198978 [0,1,0,0,0,1|0,1,0]=3 7732 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)Br 527a_100000737577_100000198978 [0,1,0,0,0,1|0,1,0]=3 7733 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)Cl 240690a_100000737577_100000211027 [0,1,0,0,0,1|0,0,0]=2 7734 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)Cl 527a_100000737577_100000211027 [0,1,0,0,0,1|0,0,0]=2 7735 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)F 240690a_100000737577_100000210951 [0,1,0,0,0,1|0,1,0]=3 7736 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)F 527a_100000737577_100000210951 [0,1,0,0,0,1|0,1,0]=3 7737 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)I 240690a_100000737577_100000688869 [0,1,0,0,0,1|0,1,0]=3 7738 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)I 527a_100000737577_100000688869 [0,1,0,0,0,1|0,1,0]=3 7739 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)O 240690a_100000737577_100000198540 [0,1,0,0,0,1|1,0,0]=3 7740 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cc1)O 527a_100000737577_100000198540 [0,1,0,0,0,1|1,0,0]=3 7741 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cn1)Br 240690a_100000737577_100020629044 [0,1,0,0,0,1|1,1,0]=4 7742 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cn1)Cl 240690a_100000737577_100000728320 [0,1,0,0,0,1|1,0,0]=3 7743 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(cn1)Cl 527a_100000737577_100000728320 [0,1,0,0,0,1|1,0,0]=3 7744 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(nc1)Br 240690a_100000737577_100010067268 [0,1,0,0,0,1|1,1,0]=4 7745 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(nc1)Br 527a_100000737577_100010067268 [0,1,0,0,0,1|1,1,0]=4 7746 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(nc1)Cl 240690a_100000737577_100000061944 [0,1,0,0,0,1|1,0,0]=3 7747 B15R1.981 C[C@H](CO)NC(=O)Cc1ccc(nc1)Cl 527a_100000737577_100000061944 [0,1,0,0,0,1|1,0,0]=3 7748 B15R1.981 C[C@H](CO)NC(=O)Cn1ccc(=O)cc1 240690a_100000737577_200000238563 [0,1,0,0,0,1|2,0,0]=4 7749 B15R1.981 C[C@H](CO)NC(=O)Cn1ccc(=O)cc1 527a_100000737577_200000238563 [0,1,0,0,0,1|2,0,0]=4 7750 B15R1.981 C[C@H](CO)NC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000737577 [0,1,0,0,0,1|0,1,0]=3 7751 B15R1.981 C[C@H](CO)NC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000737577 [0,1,0,0,0,1|0,0,0]=2 7752 B15R1.981 C[C@H](CO)NC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000737577 [0,1,0,0,0,1|0,1,0]=3 7753 B15R1.981 C[C@H](CO)NC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000737577 [0,1,0,0,0,1|0,1,0]=3 7754 B15R1.981 C[C@H](CO)NC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000737577 [0,1,0,0,0,1|1,0,0]=3 7755 B15R1.981 Cc1ccc(cc1)CC(=O)C[C@@H](C)CO 1458a_100000212244_100000059175 [0,1,0,0,0,1|2,0,0]=4 7756 B15R1.981 Cc1ccc(cc1)CC(=O)N[C@H](C)CF 11a_100102880703_100000212244 [0,1,0,0,0,1|2,0,0]=4 7757 B15R1.981 Cc1ccc(cc1)CC(=O)N[C@H](C)CF 240690a_100102880703_100000212244 [0,1,0,0,0,1|2,0,0]=4 7758 B15R1.981 Cc1ccc(cc1)CC(=O)N[C@H](C)CF 527a_100102880703_100000212244 [0,1,0,0,0,1|2,0,0]=4 7759 B15R1.981 Cc1ccc(cc1)CC(=O)N[C@H](C)CO 240690a_100000737577_100000212244 [0,1,0,0,0,1|1,0,0]=3 7760 B15R1.981 Cc1ccc(cc1)CC(=O)N[C@H](C)CO 527a_100000737577_100000212244 [0,1,0,0,0,1|1,0,0]=3 7761 B15R1.981 Cc1ccc(cc1)NC(=O)N[C@H](C)CF 2430a_100000124888_100102880703 [0,1,0,0,0,1|2,0,0]=4 7762 B15R1.981 Cc1ccc(cc1)NC(=O)N[C@H](C)CO 2430a_100000124888_100000737577 [0,1,0,0,0,1|1,0,0]=3 7763 B15R1.981 Cc1ccc(cn1)CC(=O)N[C@H](C)CO 240690a_100000737577_100000740413 [0,1,0,0,0,1|2,0,0]=4 7764 B15R1.981 Cc1ccc(cn1)CC(=O)N[C@H](C)CO 527a_100000737577_100000740413 [0,1,0,0,0,1|2,0,0]=4 7765 B15R1.981 Cc1ccc(nc1)CC(=O)N[C@H](C)CO 240690a_100000737577_100025705728 [0,1,0,0,0,1|2,0,0]=4 7766 B15R1.981 O=C(CO)CC(=O)Nc1ccc(cc1)Cl 1458a_100000210174_100000182960 [0,1,0,0,0,1|1,0,1]=4 7767 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)Br)Cl 11a_100000212058_100012349508 [0,1,0,0,0,1|1,0,1]=4 7768 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100000212058_100012349508 [0,1,0,0,0,1|1,0,1]=4 7769 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100000212058_100012349508 [0,1,0,0,0,1|1,0,1]=4 7770 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_100000212058_100000210702 [0,1,0,0,0,1|1,0,1]=4 7771 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100000212058_100000210702 [0,1,0,0,0,1|1,0,1]=4 7772 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100000212058_100000210702 [0,1,0,0,0,1|1,0,1]=4 7773 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)F)Cl 11a_100000212058_100000722404 [0,1,0,0,0,1|1,0,1]=4 7774 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100000212058_100000722404 [0,1,0,0,0,1|1,0,1]=4 7775 B15R1.3908 C#CCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100000212058_100000722404 [0,1,0,0,0,1|1,0,1]=4 7776 B15R1.3908 C#CCNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100000212058 [0,1,0,0,0,1|1,0,1]=4 7777 B15R1.3908 C#CCNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100000212058 [0,1,0,0,0,1|1,0,1]=4 7778 B15R1.3908 C#CCNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100000212058 [0,1,0,0,0,1|1,0,1]=4 7779 B15R1.3908 C#CCNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100000212058 [0,1,0,0,0,1|1,0,1]=4 7780 B15R1.3908 C#CCNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100000212058 [0,1,0,0,0,1|1,0,1]=4 7781 B15R1.3908 C#CCNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100000212058 [0,1,0,0,0,1|1,0,1]=4 7782 B15R1.3908 C=CCNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100020586998_100012349508 [0,1,0,0,0,1|1,0,1]=4 7783 B15R1.3908 C=CCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100020586998_100012349508 [0,1,0,0,0,1|1,0,1]=4 7784 B15R1.3908 C=CCNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100020586998_100000210702 [0,1,0,0,0,1|1,0,1]=4 7785 B15R1.3908 C=CCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100020586998_100000210702 [0,1,0,0,0,1|1,0,1]=4 7786 B15R1.3908 C=CCNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100020586998_100000722404 [0,1,0,0,0,1|1,0,1]=4 7787 B15R1.3908 C=CCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100020586998_100000722404 [0,1,0,0,0,1|1,0,1]=4 7788 B15R1.3908 C=CCNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100020586998 [0,1,0,0,0,1|1,0,1]=4 7789 B15R1.3908 C=CCNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100020586998 [0,1,0,0,0,1|1,0,1]=4 7790 B15R1.3908 C=CCNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100020586998 [0,1,0,0,0,1|1,0,1]=4 7791 B15R1.3908 C=CCNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100020586998 [0,1,0,0,0,1|1,0,1]=4 7792 B15R1.3908 C=CCNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100020586998 [0,1,0,0,0,1|1,0,1]=4 7793 B15R1.3908 C=CCNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100020586998 [0,1,0,0,0,1|1,0,1]=4 7794 B15R1.3908 CC(Cc1ccc(c(c1)Cl)Cl)NCCO 270004a_100000210304_100011586667 [0,1,0,0,0,1|1,0,1]=4 7795 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000210183_100012353894 [0,1,0,0,0,1|2,0,0]=4 7796 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210211 [0,1,0,0,0,1|2,0,0]=4 7797 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000210183_100012184735 [0,1,0,0,0,1|2,0,0]=4 7798 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210183_100000184707 [0,1,0,0,0,1|2,0,0]=4 7799 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210211 [0,1,0,0,0,1|2,0,0]=4 7800 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000210183_100000716492 [0,1,0,0,0,1|2,0,0]=4 7801 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210211 [0,1,0,0,0,1|2,0,0]=4 7802 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100000210183 [0,1,0,0,0,1|2,0,0]=4 7803 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100000210183 [0,1,0,0,0,1|2,0,0]=4 7804 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000210183 [0,1,0,0,0,1|2,0,0]=4 7805 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000210183 [0,1,0,0,0,1|2,0,0]=4 7806 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100000210183 [0,1,0,0,0,1|2,0,0]=4 7807 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100000210183 [0,1,0,0,0,1|2,0,0]=4 7808 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000210183 [0,1,0,0,0,1|2,0,0]=4 7809 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100000210183 [0,1,0,0,0,1|2,0,0]=4 7810 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100000210183 [0,1,0,0,0,1|2,0,0]=4 7811 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100000210183 [0,1,0,0,0,1|2,0,0]=4 7812 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000210183 [0,1,0,0,0,1|2,0,0]=4 7813 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000210183 [0,1,0,0,0,1|2,0,0]=4 7814 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100000210183 [0,1,0,0,0,1|2,0,0]=4 7815 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100000210183 [0,1,0,0,0,1|2,0,0]=4 7816 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000210183 [0,1,0,0,0,1|2,0,0]=4 7817 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100000210183 [0,1,0,0,0,1|2,0,0]=4 7818 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100000210183 [0,1,0,0,0,1|2,0,0]=4 7819 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000210183 [0,1,0,0,0,1|2,0,0]=4 7820 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000210183 [0,1,0,0,0,1|2,0,0]=4 7821 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210183 [0,1,0,0,0,1|2,0,0]=4 7822 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)C 11a_100020643023_100000709925 [0,1,0,0,0,1|2,0,0]=4 7823 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)C 240690a_100020643023_100000709925 [0,1,0,0,0,1|2,0,0]=4 7824 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)C 527a_100020643023_100000709925 [0,1,0,0,0,1|2,0,0]=4 7825 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)Cl 11a_100020643023_100012349508 [0,1,0,0,0,1|1,0,0]=3 7826 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100020643023_100012349508 [0,1,0,0,0,1|1,0,0]=3 7827 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100020643023_100012349508 [0,1,0,0,0,1|1,0,0]=3 7828 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)F 11a_100020643023_100000742997 [0,1,0,0,0,1|1,1,0]=4 7829 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)F 240690a_100020643023_100000742997 [0,1,0,0,0,1|1,1,0]=4 7830 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)F 527a_100020643023_100000742997 [0,1,0,0,0,1|1,1,0]=4 7831 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)O 240690a_100020643023_100009990404 [0,1,0,0,0,1|2,0,0]=4 7832 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)O 527a_100020643023_100009990404 [0,1,0,0,0,1|2,0,0]=4 7833 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)Br 11a_100020643023_100012340274 [0,1,0,0,0,1|1,1,0]=4 7834 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)Br 240690a_100020643023_100012340274 [0,1,0,0,0,1|1,1,0]=4 7835 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)Br 527a_100020643023_100012340274 [0,1,0,0,0,1|1,1,0]=4 7836 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)C 11a_100020643023_100000184070 [0,1,0,0,0,1|2,0,0]=4 7837 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)C 240690a_100020643023_100000184070 [0,1,0,0,0,1|2,0,0]=4 7838 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)C 527a_100020643023_100000184070 [0,1,0,0,0,1|2,0,0]=4 7839 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)F 11a_100020643023_100011667458 [0,1,0,0,0,1|1,1,0]=4 7840 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)F 240690a_100020643023_100011667458 [0,1,0,0,0,1|1,1,0]=4 7841 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)F 527a_100020643023_100011667458 [0,1,0,0,0,1|1,1,0]=4 7842 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)O 240690a_100020643023_100000083968 [0,1,0,0,0,1|2,0,0]=4 7843 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)O 527a_100020643023_100000083968 [0,1,0,0,0,1|2,0,0]=4 7844 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)Br 11a_100020643023_100000766880 [0,1,0,0,0,1|1,1,0]=4 7845 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100020643023_100000766880 [0,1,0,0,0,1|1,1,0]=4 7846 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100020643023_100000766880 [0,1,0,0,0,1|1,1,0]=4 7847 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_100020643023_100000210702 [0,1,0,0,0,1|1,0,0]=3 7848 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100020643023_100000210702 [0,1,0,0,0,1|1,0,0]=3 7849 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100020643023_100000210702 [0,1,0,0,0,1|1,0,0]=3 7850 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)F 11a_100020643023_100011217296 [0,1,0,0,0,1|1,1,0]=4 7851 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100020643023_100011217296 [0,1,0,0,0,1|1,1,0]=4 7852 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100020643023_100011217296 [0,1,0,0,0,1|1,1,0]=4 7853 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)F 527a_100020643023_100011217296 [0,1,0,0,0,1|1,1,0]=4 7854 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100020643023_100000035197 [0,1,0,0,0,1|2,0,0]=4 7855 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)O 527a_100020643023_100000035197 [0,1,0,0,0,1|2,0,0]=4 7856 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)Br 11a_100020643023_100000691132 [0,1,0,0,0,1|1,1,0]=4 7857 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)Br 240690a_100020643023_100000691132 [0,1,0,0,0,1|1,1,0]=4 7858 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)Br 527a_100020643023_100000691132 [0,1,0,0,0,1|1,1,0]=4 7859 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)C 11a_100020643023_100011217375 [0,1,0,0,0,1|2,0,0]=4 7860 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)C 240690a_100020643023_100011217375 [0,1,0,0,0,1|2,0,0]=4 7861 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)C 527a_100020643023_100011217375 [0,1,0,0,0,1|2,0,0]=4 7862 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)Cl 11a_100020643023_100000722404 [0,1,0,0,0,1|1,0,0]=3 7863 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100020643023_100000722404 [0,1,0,0,0,1|1,0,0]=3 7864 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100020643023_100000722404 [0,1,0,0,0,1|1,0,0]=3 7865 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)F 11a_100020643023_100000684721 [0,1,0,0,0,1|1,1,0]=4 7866 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)F 1626a_100020643023_100000684721 [0,1,0,0,0,1|1,1,0]=4 7867 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)F 240690a_100020643023_100000684721 [0,1,0,0,0,1|1,1,0]=4 7868 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)F 527a_100020643023_100000684721 [0,1,0,0,0,1|1,1,0]=4 7869 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)I 11a_100020643023_100010149632 [0,1,0,0,0,1|1,1,0]=4 7870 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)I 1626a_100020643023_100010149632 [0,1,0,0,0,1|1,1,0]=4 7871 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)I 240690a_100020643023_100010149632 [0,1,0,0,0,1|1,1,0]=4 7872 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)I 527a_100020643023_100010149632 [0,1,0,0,0,1|1,1,0]=4 7873 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)O 240690a_100020643023_100000039761 [0,1,0,0,0,1|2,0,0]=4 7874 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)O 527a_100020643023_100000039761 [0,1,0,0,0,1|2,0,0]=4 7875 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)C 11a_100020643023_100000082272 [0,1,0,0,0,1|2,0,0]=4 7876 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)C 240690a_100020643023_100000082272 [0,1,0,0,0,1|2,0,0]=4 7877 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)C 527a_100020643023_100000082272 [0,1,0,0,0,1|2,0,0]=4 7878 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)O 527a_100020643023_100000031429 [0,1,0,0,0,1|2,0,0]=4 7879 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100020643023 [0,1,0,0,0,1|1,1,0]=4 7880 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)C 2430a_100000736455_100020643023 [0,1,0,0,0,1|2,0,0]=4 7881 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100020643023 [0,1,0,0,0,1|1,0,0]=3 7882 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)F 2430a_100000760356_100020643023 [0,1,0,0,0,1|1,1,0]=4 7883 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)I 2430a_100000750458_100020643023 [0,1,0,0,0,1|1,1,0]=4 7884 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100020643023 [0,1,0,0,0,1|2,0,0]=4 7885 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)Br 2430a_100000210723_100020643023 [0,1,0,0,0,1|1,1,0]=4 7886 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)C 2430a_100000724040_100020643023 [0,1,0,0,0,1|2,0,0]=4 7887 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100020643023 [0,1,0,0,0,1|1,0,0]=3 7888 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)F 2430a_100000750164_100020643023 [0,1,0,0,0,1|1,1,0]=4 7889 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)I 2430a_100000198070_100020643023 [0,1,0,0,0,1|1,1,0]=4 7890 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100020643023 [0,1,0,0,0,1|2,0,0]=4 7891 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100020643023 [0,1,0,0,0,1|1,1,0]=4 7892 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)C 2430a_100000188892_100020643023 [0,1,0,0,0,1|2,0,0]=4 7893 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100020643023 [0,1,0,0,0,1|1,0,0]=3 7894 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100020643023 [0,1,0,0,0,1|1,1,0]=4 7895 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100020643023 [0,1,0,0,0,1|1,1,0]=4 7896 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100020643023 [0,1,0,0,0,1|2,0,0]=4 7897 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)Br 2430a_100000759894_100020643023 [0,1,0,0,0,1|1,1,0]=4 7898 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)C 2430a_100000210958_100020643023 [0,1,0,0,0,1|2,0,0]=4 7899 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100020643023 [0,1,0,0,0,1|1,0,0]=3 7900 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)F 2430a_100000210724_100020643023 [0,1,0,0,0,1|1,1,0]=4 7901 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)I 2430a_100011356925_100020643023 [0,1,0,0,0,1|1,1,0]=4 7902 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100020643023 [0,1,0,0,0,1|2,0,0]=4 7903 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)I)Br 2430a_100000750459_100020643023 [0,1,0,0,0,1|1,1,0]=4 7904 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)I)C 2430a_100000184131_100020643023 [0,1,0,0,0,1|2,0,0]=4 7905 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100020643023 [0,1,0,0,0,1|1,0,0]=3 7906 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)I)F 2430a_114828291077_100020643023 [0,1,0,0,0,1|1,1,0]=4 7907 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)I)F 512a_114828291077_100020643023 [0,1,0,0,0,1|1,1,0]=4 7908 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100020643023 [0,1,0,0,0,1|2,0,0]=4 7909 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100020643023 [0,1,0,0,0,1|1,0,0]=3 7910 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100020643023 [0,1,0,0,0,1|1,1,0]=4 7911 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100020643023 [0,1,0,0,0,1|2,0,0]=4 7912 B15R1.3908 CCNNC(=O)Cc1ccc(c(c1)Br)Cl 22a_100000756455_100012349508 [0,1,0,0,0,1|2,0,0]=4 7913 B15R1.3908 CCNNC(=O)Cc1ccc(c(c1)Cl)Cl 22a_100000756455_100000210702 [0,1,0,0,0,1|2,0,0]=4 7914 B15R1.3908 CCNNC(=O)Cc1ccc(c(c1)F)Cl 22a_100000756455_100000722404 [0,1,0,0,0,1|2,0,0]=4 7915 B15R1.3908 Cc1cc(ccc1Br)CC(=O)CCCO 1458a_100012340274_100011215043 [0,1,0,0,0,1|1,1,0]=4 7916 B15R1.3908 Cc1cc(ccc1Br)CC(=O)NCCF 11a_100000724931_100012340274 [0,1,0,0,0,1|1,1,0]=4 7917 B15R1.3908 Cc1cc(ccc1Br)CC(=O)NCCF 240690a_100000724931_100012340274 [0,1,0,0,0,1|1,1,0]=4 7918 B15R1.3908 Cc1cc(ccc1Br)CC(=O)NCCF 527a_100000724931_100012340274 [0,1,0,0,0,1|1,1,0]=4 7919 B15R1.3908 Cc1cc(ccc1Br)CC(=O)NCCO 240690a_100000210304_100012340274 [0,1,0,0,0,1|0,1,0]=3 7920 B15R1.3908 Cc1cc(ccc1Br)CC(=O)NCCO 527a_100000210304_100012340274 [0,1,0,0,0,1|0,1,0]=3 7921 B15R1.3908 Cc1cc(ccc1Br)NC(=O)NCCF 2430a_100000210723_100000724931 [0,1,0,0,0,1|1,1,0]=4 7922 B15R1.3908 Cc1cc(ccc1Br)NC(=O)NCCO 2430a_100000210723_100000210304 [0,1,0,0,0,1|0,1,0]=3 7923 B15R1.3908 Cc1cc(ccc1Cl)CC(=O)C#CCO 1458a_100000049017_100012184735 [0,1,0,0,0,1|1,0,1]=4 7924 B15R1.3908 Cc1cc(ccc1Cl)NC(=O)NCC#N 2430a_100000187808_100000734998 [0,1,0,0,0,1|1,0,1]=4 7925 B15R1.3908 Cc1cc(ccc1Cl)NC(=O)NCCF 2430a_100000187808_100000724931 [0,1,0,0,0,1|1,0,0]=3 7926 B15R1.3908 Cc1cc(ccc1Cl)NC(=O)NCCO 2430a_100000187808_100000210304 [0,1,0,0,0,1|0,0,0]=2 7927 B15R1.3908 Cc1cc(ccc1F)CC(=O)CCCO 1458a_100011667458_100011215043 [0,1,0,0,0,1|1,1,0]=4 7928 B15R1.3908 Cc1cc(ccc1F)CC(=O)NCCF 11a_100000724931_100011667458 [0,1,0,0,0,1|1,1,0]=4 7929 B15R1.3908 Cc1cc(ccc1F)CC(=O)NCCF 240690a_100000724931_100011667458 [0,1,0,0,0,1|1,1,0]=4 7930 B15R1.3908 Cc1cc(ccc1F)CC(=O)NCCF 527a_100000724931_100011667458 [0,1,0,0,0,1|1,1,0]=4 7931 B15R1.3908 Cc1cc(ccc1F)CC(=O)NCCO 240690a_100000210304_100011667458 [0,1,0,0,0,1|0,1,0]=3 7932 B15R1.3908 Cc1cc(ccc1F)CC(=O)NCCO 527a_100000210304_100011667458 [0,1,0,0,0,1|0,1,0]=3 7933 B15R1.3908 Cc1cc(ccc1F)NC(=O)NCCF 2430a_100000750164_100000724931 [0,1,0,0,0,1|1,1,0]=4 7934 B15R1.3908 Cc1cc(ccc1F)NC(=O)NCCO 2430a_100000750164_100000210304 [0,1,0,0,0,1|0,1,0]=3 7935 B15R1.3908 Cc1cc(ccc1I)NC(=O)NCCF 2430a_100000198070_100000724931 [0,1,0,0,0,1|1,1,0]=4 7936 B15R1.3908 Cc1cc(ccc1I)NC(=O)NCCO 2430a_100000198070_100000210304 [0,1,0,0,0,1|0,1,0]=3 7937 B15R1.3908 Cc1cc(ccc1O)CC(=O)CCCO 1458a_100000083968_100011215043 [0,1,0,0,0,1|2,0,0]=4 7938 B15R1.3908 Cc1cc(ccc1O)CC(=O)NCCF 240690a_100000724931_100000083968 [0,1,0,0,0,1|2,0,0]=4 7939 B15R1.3908 Cc1cc(ccc1O)CC(=O)NCCF 527a_100000724931_100000083968 [0,1,0,0,0,1|2,0,0]=4 7940 B15R1.3908 Cc1cc(ccc1O)CC(=O)NCCO 240690a_100000210304_100000083968 [0,1,0,0,0,1|1,0,0]=3 7941 B15R1.3908 Cc1cc(ccc1O)CC(=O)NCCO 527a_100000210304_100000083968 [0,1,0,0,0,1|1,0,0]=3 7942 B15R1.3908 Cc1cc(ccc1O)NC(=O)NCCF 2430a_100011218179_100000724931 [0,1,0,0,0,1|2,0,0]=4 7943 B15R1.3908 Cc1cc(ccc1O)NC(=O)NCCO 2430a_100011218179_100000210304 [0,1,0,0,0,1|1,0,0]=3 7944 B15R1.3908 Cc1ccc(cc1Br)CC(=O)CCCO 1458a_100000709925_100011215043 [0,1,0,0,0,1|2,0,0]=4 7945 B15R1.3908 Cc1ccc(cc1Br)CC(=O)NCCF 11a_100000724931_100000709925 [0,1,0,0,0,1|2,0,0]=4 7946 B15R1.3908 Cc1ccc(cc1Br)CC(=O)NCCF 240690a_100000724931_100000709925 [0,1,0,0,0,1|2,0,0]=4 7947 B15R1.3908 Cc1ccc(cc1Br)CC(=O)NCCF 527a_100000724931_100000709925 [0,1,0,0,0,1|2,0,0]=4 7948 B15R1.3908 Cc1ccc(cc1Br)CC(=O)NCCO 240690a_100000210304_100000709925 [0,1,0,0,0,1|1,0,0]=3 7949 B15R1.3908 Cc1ccc(cc1Br)CC(=O)NCCO 527a_100000210304_100000709925 [0,1,0,0,0,1|1,0,0]=3 7950 B15R1.3908 Cc1ccc(cc1Br)NC(=O)NCCF 2430a_100000736455_100000724931 [0,1,0,0,0,1|2,0,0]=4 7951 B15R1.3908 Cc1ccc(cc1Br)NC(=O)NCCO 2430a_100000736455_100000210304 [0,1,0,0,0,1|1,0,0]=3 7952 B15R1.3908 Cc1ccc(cc1C)CC(=O)CCCO 1458a_100000184070_100011215043 [0,1,0,0,0,1|2,0,0]=4 7953 B15R1.3908 Cc1ccc(cc1C)CC(=O)NCCF 11a_100000724931_100000184070 [0,1,0,0,0,1|2,0,0]=4 7954 B15R1.3908 Cc1ccc(cc1C)CC(=O)NCCF 240690a_100000724931_100000184070 [0,1,0,0,0,1|2,0,0]=4 7955 B15R1.3908 Cc1ccc(cc1C)CC(=O)NCCF 527a_100000724931_100000184070 [0,1,0,0,0,1|2,0,0]=4 7956 B15R1.3908 Cc1ccc(cc1C)CC(=O)NCCO 240690a_100000210304_100000184070 [0,1,0,0,0,1|1,0,0]=3 7957 B15R1.3908 Cc1ccc(cc1C)CC(=O)NCCO 527a_100000210304_100000184070 [0,1,0,0,0,1|1,0,0]=3 7958 B15R1.3908 Cc1ccc(cc1C)NC(=O)NCCF 2430a_100000724040_100000724931 [0,1,0,0,0,1|2,0,0]=4 7959 B15R1.3908 Cc1ccc(cc1C)NC(=O)NCCO 2430a_100000724040_100000210304 [0,1,0,0,0,1|1,0,0]=3 7960 B15R1.3908 Cc1ccc(cc1Cl)NC(=O)NCCF 2430a_100000188892_100000724931 [0,1,0,0,0,1|2,0,0]=4 7961 B15R1.3908 Cc1ccc(cc1Cl)NC(=O)NCCO 2430a_100000188892_100000210304 [0,1,0,0,0,1|1,0,0]=3 7962 B15R1.3908 Cc1ccc(cc1F)CC(=O)CCCO 1458a_100011217375_100011215043 [0,1,0,0,0,1|2,0,0]=4 7963 B15R1.3908 Cc1ccc(cc1F)CC(=O)NCCF 11a_100000724931_100011217375 [0,1,0,0,0,1|2,0,0]=4 7964 B15R1.3908 Cc1ccc(cc1F)CC(=O)NCCF 240690a_100000724931_100011217375 [0,1,0,0,0,1|2,0,0]=4 7965 B15R1.3908 Cc1ccc(cc1F)CC(=O)NCCF 527a_100000724931_100011217375 [0,1,0,0,0,1|2,0,0]=4 7966 B15R1.3908 Cc1ccc(cc1F)CC(=O)NCCO 240690a_100000210304_100011217375 [0,1,0,0,0,1|1,0,0]=3 7967 B15R1.3908 Cc1ccc(cc1F)CC(=O)NCCO 527a_100000210304_100011217375 [0,1,0,0,0,1|1,0,0]=3 7968 B15R1.3908 Cc1ccc(cc1F)NC(=O)NCCF 2430a_100000210958_100000724931 [0,1,0,0,0,1|2,0,0]=4 7969 B15R1.3908 Cc1ccc(cc1F)NC(=O)NCCO 2430a_100000210958_100000210304 [0,1,0,0,0,1|1,0,0]=3 7970 B15R1.3908 Cc1ccc(cc1I)NC(=O)NCCF 2430a_100000184131_100000724931 [0,1,0,0,0,1|2,0,0]=4 7971 B15R1.3908 Cc1ccc(cc1I)NC(=O)NCCO 2430a_100000184131_100000210304 [0,1,0,0,0,1|1,0,0]=3 7972 B15R1.3908 Cc1ccc(cc1O)CC(=O)CCCO 1458a_100000082272_100011215043 [0,1,0,0,0,1|2,0,0]=4 7973 B15R1.3908 Cc1ccc(cc1O)CC(=O)NCCF 11a_100000724931_100000082272 [0,1,0,0,0,1|2,0,0]=4 7974 B15R1.3908 Cc1ccc(cc1O)CC(=O)NCCF 240690a_100000724931_100000082272 [0,1,0,0,0,1|2,0,0]=4 7975 B15R1.3908 Cc1ccc(cc1O)CC(=O)NCCF 527a_100000724931_100000082272 [0,1,0,0,0,1|2,0,0]=4 7976 B15R1.3908 Cc1ccc(cc1O)CC(=O)NCCO 240690a_100000210304_100000082272 [0,1,0,0,0,1|1,0,0]=3 7977 B15R1.3908 Cc1ccc(cc1O)CC(=O)NCCO 527a_100000210304_100000082272 [0,1,0,0,0,1|1,0,0]=3 7978 B15R1.3908 Cc1ccc(cc1O)NC(=O)NCCF 2430a_100000759471_100000724931 [0,1,0,0,0,1|2,0,0]=4 7979 B15R1.3908 Cc1ccc(cc1O)NC(=O)NCCO 2430a_100000759471_100000210304 [0,1,0,0,0,1|1,0,0]=3 7980 B15R1.3908 N#CCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100000734998_100012349508 [0,1,0,0,0,1|1,0,1]=4 7981 B15R1.3908 N#CCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100000734998_100000210702 [0,1,0,0,0,1|1,0,1]=4 7982 B15R1.3908 N#CCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100000734998_100000722404 [0,1,0,0,0,1|1,0,1]=4 7983 B15R1.3908 N#CCNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100000734998 [0,1,0,0,0,1|1,0,1]=4 7984 B15R1.3908 N#CCNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100000734998 [0,1,0,0,0,1|1,0,1]=4 7985 B15R1.3908 N#CCNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100000734998 [0,1,0,0,0,1|1,0,1]=4 7986 B15R1.3908 N#CCNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100000734998 [0,1,0,0,0,1|1,0,1]=4 7987 B15R1.3908 N#CCNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100000734998 [0,1,0,0,0,1|1,0,1]=4 7988 B15R1.3908 O=C(C#CCO)Cc1ccc(c(c1)Br)Cl 1458a_100000049017_100012353894 [0,1,0,0,0,1|1,0,1]=4 7989 B15R1.3908 O=C(C#CCO)Cc1ccc(c(c1)Cl)Cl 1458a_100000049017_100000184707 [0,1,0,0,0,1|1,0,1]=4 7990 B15R1.3908 O=C(C#CCO)Cc1ccc(c(c1)F)Cl 1458a_100000049017_100000716492 [0,1,0,0,0,1|1,0,1]=4 7991 B15R1.3908 O=C(CCCF)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100011934791 [0,1,0,0,0,1|2,0,0]=4 7992 B15R1.3908 O=C(CCCF)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100011934791 [0,1,0,0,0,1|2,0,0]=4 7993 B15R1.3908 O=C(CCCF)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100011934791 [0,1,0,0,0,1|2,0,0]=4 7994 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100011215043 [0,1,0,0,0,1|1,0,0]=3 7995 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Br)F 1458a_100000742997_100011215043 [0,1,0,0,0,1|1,1,0]=4 7996 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Br)O 1458a_100009990404_100011215043 [0,1,0,0,0,1|2,0,0]=4 7997 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100011215043 [0,1,0,0,0,1|1,1,0]=4 7998 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100011215043 [0,1,0,0,0,1|1,0,0]=3 7999 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100011215043 [0,1,0,0,0,1|1,1,0]=4 8000 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100011215043 [0,1,0,0,0,1|2,0,0]=4 8001 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)F)Br 1458a_100000691132_100011215043 [0,1,0,0,0,1|1,1,0]=4 8002 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100011215043 [0,1,0,0,0,1|1,0,0]=3 8003 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)F)F 1458a_100000684721_100011215043 [0,1,0,0,0,1|1,1,0]=4 8004 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)F)I 1458a_100010149632_100011215043 [0,1,0,0,0,1|1,1,0]=4 8005 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)F)O 1458a_100000039761_100011215043 [0,1,0,0,0,1|2,0,0]=4 8006 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)O)O 1458a_100000031429_100011215043 [0,1,0,0,0,1|2,0,0]=4 8007 B15R1.3908 O=C(Cc1ccc(c(c1)Br)Cl)NCCF 11a_100000724931_100012349508 [0,1,0,0,0,1|1,0,0]=3 8008 B15R1.3908 O=C(Cc1ccc(c(c1)Br)Cl)NCCF 240690a_100000724931_100012349508 [0,1,0,0,0,1|1,0,0]=3 8009 B15R1.3908 O=C(Cc1ccc(c(c1)Br)Cl)NCCF 527a_100000724931_100012349508 [0,1,0,0,0,1|1,0,0]=3 8010 B15R1.3908 O=C(Cc1ccc(c(c1)Br)Cl)NCCO 240690a_100000210304_100012349508 [0,1,0,0,0,1|0,0,0]=2 8011 B15R1.3908 O=C(Cc1ccc(c(c1)Br)Cl)NCCO 527a_100000210304_100012349508 [0,1,0,0,0,1|0,0,0]=2 8012 B15R1.3908 O=C(Cc1ccc(c(c1)Br)F)NCCF 11a_100000724931_100000742997 [0,1,0,0,0,1|1,1,0]=4 8013 B15R1.3908 O=C(Cc1ccc(c(c1)Br)F)NCCF 240690a_100000724931_100000742997 [0,1,0,0,0,1|1,1,0]=4 8014 B15R1.3908 O=C(Cc1ccc(c(c1)Br)F)NCCF 527a_100000724931_100000742997 [0,1,0,0,0,1|1,1,0]=4 8015 B15R1.3908 O=C(Cc1ccc(c(c1)Br)F)NCCO 240690a_100000210304_100000742997 [0,1,0,0,0,1|0,1,0]=3 8016 B15R1.3908 O=C(Cc1ccc(c(c1)Br)F)NCCO 527a_100000210304_100000742997 [0,1,0,0,0,1|0,1,0]=3 8017 B15R1.3908 O=C(Cc1ccc(c(c1)Br)O)NCCF 240690a_100000724931_100009990404 [0,1,0,0,0,1|2,0,0]=4 8018 B15R1.3908 O=C(Cc1ccc(c(c1)Br)O)NCCF 527a_100000724931_100009990404 [0,1,0,0,0,1|2,0,0]=4 8019 B15R1.3908 O=C(Cc1ccc(c(c1)Br)O)NCCO 240690a_100000210304_100009990404 [0,1,0,0,0,1|1,0,0]=3 8020 B15R1.3908 O=C(Cc1ccc(c(c1)Br)O)NCCO 527a_100000210304_100009990404 [0,1,0,0,0,1|1,0,0]=3 8021 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Br)NCCF 11a_100000724931_100000766880 [0,1,0,0,0,1|1,1,0]=4 8022 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Br)NCCF 240690a_100000724931_100000766880 [0,1,0,0,0,1|1,1,0]=4 8023 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Br)NCCF 527a_100000724931_100000766880 [0,1,0,0,0,1|1,1,0]=4 8024 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Br)NCCO 240690a_100000210304_100000766880 [0,1,0,0,0,1|0,1,0]=3 8025 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Br)NCCO 527a_100000210304_100000766880 [0,1,0,0,0,1|0,1,0]=3 8026 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Cl)NCCF 11a_100000724931_100000210702 [0,1,0,0,0,1|1,0,0]=3 8027 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Cl)NCCF 240690a_100000724931_100000210702 [0,1,0,0,0,1|1,0,0]=3 8028 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Cl)NCCF 527a_100000724931_100000210702 [0,1,0,0,0,1|1,0,0]=3 8029 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Cl)NCCO 240690a_100000210304_100000210702 [0,1,0,0,0,1|0,0,0]=2 8030 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)Cl)NCCO 527a_100000210304_100000210702 [0,1,0,0,0,1|0,0,0]=2 8031 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)F)NCCF 11a_100000724931_100011217296 [0,1,0,0,0,1|1,1,0]=4 8032 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)F)NCCF 1626a_100000724931_100011217296 [0,1,0,0,0,1|1,1,0]=4 8033 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)F)NCCF 240690a_100000724931_100011217296 [0,1,0,0,0,1|1,1,0]=4 8034 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)F)NCCF 527a_100000724931_100011217296 [0,1,0,0,0,1|1,1,0]=4 8035 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)F)NCCO 240690a_100000210304_100011217296 [0,1,0,0,0,1|0,1,0]=3 8036 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)F)NCCO 527a_100000210304_100011217296 [0,1,0,0,0,1|0,1,0]=3 8037 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)O)NCCF 240690a_100000724931_100000035197 [0,1,0,0,0,1|2,0,0]=4 8038 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)O)NCCF 527a_100000724931_100000035197 [0,1,0,0,0,1|2,0,0]=4 8039 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)O)NCCO 240690a_100000210304_100000035197 [0,1,0,0,0,1|1,0,0]=3 8040 B15R1.3908 O=C(Cc1ccc(c(c1)Cl)O)NCCO 527a_100000210304_100000035197 [0,1,0,0,0,1|1,0,0]=3 8041 B15R1.3908 O=C(Cc1ccc(c(c1)F)Br)NCCF 11a_100000724931_100000691132 [0,1,0,0,0,1|1,1,0]=4 8042 B15R1.3908 O=C(Cc1ccc(c(c1)F)Br)NCCF 240690a_100000724931_100000691132 [0,1,0,0,0,1|1,1,0]=4 8043 B15R1.3908 O=C(Cc1ccc(c(c1)F)Br)NCCF 527a_100000724931_100000691132 [0,1,0,0,0,1|1,1,0]=4 8044 B15R1.3908 O=C(Cc1ccc(c(c1)F)Br)NCCO 240690a_100000210304_100000691132 [0,1,0,0,0,1|0,1,0]=3 8045 B15R1.3908 O=C(Cc1ccc(c(c1)F)Br)NCCO 527a_100000210304_100000691132 [0,1,0,0,0,1|0,1,0]=3 8046 B15R1.3908 O=C(Cc1ccc(c(c1)F)Cl)NCCF 11a_100000724931_100000722404 [0,1,0,0,0,1|1,0,0]=3 8047 B15R1.3908 O=C(Cc1ccc(c(c1)F)Cl)NCCF 240690a_100000724931_100000722404 [0,1,0,0,0,1|1,0,0]=3 8048 B15R1.3908 O=C(Cc1ccc(c(c1)F)Cl)NCCF 527a_100000724931_100000722404 [0,1,0,0,0,1|1,0,0]=3 8049 B15R1.3908 O=C(Cc1ccc(c(c1)F)Cl)NCCO 240690a_100000210304_100000722404 [0,1,0,0,0,1|0,0,0]=2 8050 B15R1.3908 O=C(Cc1ccc(c(c1)F)Cl)NCCO 527a_100000210304_100000722404 [0,1,0,0,0,1|0,0,0]=2 8051 B15R1.3908 O=C(Cc1ccc(c(c1)F)F)NCCF 11a_100000724931_100000684721 [0,1,0,0,0,1|1,1,0]=4 8052 B15R1.3908 O=C(Cc1ccc(c(c1)F)F)NCCF 1626a_100000724931_100000684721 [0,1,0,0,0,1|1,1,0]=4 8053 B15R1.3908 O=C(Cc1ccc(c(c1)F)F)NCCF 240690a_100000724931_100000684721 [0,1,0,0,0,1|1,1,0]=4 8054 B15R1.3908 O=C(Cc1ccc(c(c1)F)F)NCCF 527a_100000724931_100000684721 [0,1,0,0,0,1|1,1,0]=4 8055 B15R1.3908 O=C(Cc1ccc(c(c1)F)F)NCCO 240690a_100000210304_100000684721 [0,1,0,0,0,1|0,1,0]=3 8056 B15R1.3908 O=C(Cc1ccc(c(c1)F)F)NCCO 527a_100000210304_100000684721 [0,1,0,0,0,1|0,1,0]=3 8057 B15R1.3908 O=C(Cc1ccc(c(c1)F)I)NCCF 11a_100000724931_100010149632 [0,1,0,0,0,1|1,1,0]=4 8058 B15R1.3908 O=C(Cc1ccc(c(c1)F)I)NCCF 1626a_100000724931_100010149632 [0,1,0,0,0,1|1,1,0]=4 8059 B15R1.3908 O=C(Cc1ccc(c(c1)F)I)NCCF 240690a_100000724931_100010149632 [0,1,0,0,0,1|1,1,0]=4 8060 B15R1.3908 O=C(Cc1ccc(c(c1)F)I)NCCF 527a_100000724931_100010149632 [0,1,0,0,0,1|1,1,0]=4 8061 B15R1.3908 O=C(Cc1ccc(c(c1)F)I)NCCO 240690a_100000210304_100010149632 [0,1,0,0,0,1|0,1,0]=3 8062 B15R1.3908 O=C(Cc1ccc(c(c1)F)I)NCCO 527a_100000210304_100010149632 [0,1,0,0,0,1|0,1,0]=3 8063 B15R1.3908 O=C(Cc1ccc(c(c1)F)O)NCCF 240690a_100000724931_100000039761 [0,1,0,0,0,1|2,0,0]=4 8064 B15R1.3908 O=C(Cc1ccc(c(c1)F)O)NCCF 527a_100000724931_100000039761 [0,1,0,0,0,1|2,0,0]=4 8065 B15R1.3908 O=C(Cc1ccc(c(c1)F)O)NCCO 240690a_100000210304_100000039761 [0,1,0,0,0,1|1,0,0]=3 8066 B15R1.3908 O=C(Cc1ccc(c(c1)F)O)NCCO 527a_100000210304_100000039761 [0,1,0,0,0,1|1,0,0]=3 8067 B15R1.3908 O=C(Cc1ccc(c(c1)O)O)NCCF 527a_100000724931_100000031429 [0,1,0,0,0,1|2,0,0]=4 8068 B15R1.3908 O=C(Cc1ccc(c(c1)O)O)NCCO 527a_100000210304_100000031429 [0,1,0,0,0,1|1,0,0]=3 8069 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100000724931 [0,1,0,0,0,1|1,1,0]=4 8070 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100000724931 [0,1,0,0,0,1|1,0,0]=3 8071 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Br)F 2430a_100000760356_100000724931 [0,1,0,0,0,1|1,1,0]=4 8072 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Br)I 2430a_100000750458_100000724931 [0,1,0,0,0,1|1,1,0]=4 8073 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Br)O 2430a_100011534360_100000724931 [0,1,0,0,0,1|2,0,0]=4 8074 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100000724931 [0,1,0,0,0,1|1,1,0]=4 8075 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100000724931 [0,1,0,0,0,1|1,0,0]=3 8076 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100000724931 [0,1,0,0,0,1|1,1,0]=4 8077 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100000724931 [0,1,0,0,0,1|1,1,0]=4 8078 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100000724931 [0,1,0,0,0,1|2,0,0]=4 8079 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)F)Br 2430a_100000759894_100000724931 [0,1,0,0,0,1|1,1,0]=4 8080 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100000724931 [0,1,0,0,0,1|1,0,0]=3 8081 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)F)F 2430a_100000210724_100000724931 [0,1,0,0,0,1|1,1,0]=4 8082 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)F)I 2430a_100011356925_100000724931 [0,1,0,0,0,1|1,1,0]=4 8083 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)F)O 2430a_100011220035_100000724931 [0,1,0,0,0,1|2,0,0]=4 8084 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)I)Br 2430a_100000750459_100000724931 [0,1,0,0,0,1|1,1,0]=4 8085 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100000724931 [0,1,0,0,0,1|1,0,0]=3 8086 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)I)F 2430a_114828291077_100000724931 [0,1,0,0,0,1|1,1,0]=4 8087 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)I)F 512a_114828291077_100000724931 [0,1,0,0,0,1|1,1,0]=4 8088 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100000724931 [0,1,0,0,0,1|1,0,0]=3 8089 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)O)F 2430a_100012017398_100000724931 [0,1,0,0,0,1|1,1,0]=4 8090 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)O)O 2430a_100102946323_100000724931 [0,1,0,0,0,1|2,0,0]=4 8091 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100000210304 [0,1,0,0,0,1|0,1,0]=3 8092 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100000210304 [0,1,0,0,0,1|0,0,0]=2 8093 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Br)F 2430a_100000760356_100000210304 [0,1,0,0,0,1|0,1,0]=3 8094 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Br)I 2430a_100000750458_100000210304 [0,1,0,0,0,1|0,1,0]=3 8095 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Br)O 2430a_100011534360_100000210304 [0,1,0,0,0,1|1,0,0]=3 8096 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100000210304 [0,1,0,0,0,1|0,1,0]=3 8097 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100000210304 [0,1,0,0,0,1|0,0,0]=2 8098 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100000210304 [0,1,0,0,0,1|0,1,0]=3 8099 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100000210304 [0,1,0,0,0,1|0,1,0]=3 8100 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100000210304 [0,1,0,0,0,1|1,0,0]=3 8101 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)F)Br 2430a_100000759894_100000210304 [0,1,0,0,0,1|0,1,0]=3 8102 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100000210304 [0,1,0,0,0,1|0,0,0]=2 8103 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)F)F 2430a_100000210724_100000210304 [0,1,0,0,0,1|0,1,0]=3 8104 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)F)I 2430a_100011356925_100000210304 [0,1,0,0,0,1|0,1,0]=3 8105 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)F)O 2430a_100011220035_100000210304 [0,1,0,0,0,1|1,0,0]=3 8106 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)I)Br 2430a_100000750459_100000210304 [0,1,0,0,0,1|0,1,0]=3 8107 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100000210304 [0,1,0,0,0,1|0,0,0]=2 8108 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)I)F 2430a_114828291077_100000210304 [0,1,0,0,0,1|0,1,0]=3 8109 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)I)F 512a_114828291077_100000210304 [0,1,0,0,0,1|0,1,0]=3 8110 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100000210304 [0,1,0,0,0,1|0,0,0]=2 8111 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)O)F 2430a_100012017398_100000210304 [0,1,0,0,0,1|0,1,0]=3 8112 B15R1.5920 CCCNS(=O)(=O)Cc1ccc(cc1)Cl 270084a_100020643023_100011198069 [0,1,0,0,0,1|2,0,0]=4 8113 B15R1.5920 CCCNS(=O)(=O)Cc1ccc(cc1)Cl 274078a_100020643023_100011198069 [0,1,0,0,0,1|2,0,0]=4 8114 B15R1.5920 Cc1ccc(cc1)CS(=O)(=O)NCCO 270084a_100000210304_100000689310 [0,1,0,0,0,1|2,0,0]=4 8115 B15R1.5920 Cc1ccc(cc1)CS(=O)(=O)NCCO 274078a_100000210304_100000689310 [0,1,0,0,0,1|2,0,0]=4 8116 B15R1.5920 O=S(=O)(Cc1ccc(cc1)Br)NCCO 270084a_100000210304_100000764255 [0,1,0,0,0,1|1,1,0]=4 8117 B15R1.5920 O=S(=O)(Cc1ccc(cc1)Br)NCCO 274078a_100000210304_100000764255 [0,1,0,0,0,1|1,1,0]=4 8118 B15R1.5920 O=S(=O)(Cc1ccc(cc1)Cl)NCCF 270084a_100000724931_100011198069 [0,1,0,0,0,1|2,0,0]=4 8119 B15R1.5920 O=S(=O)(Cc1ccc(cc1)Cl)NCCF 274078a_100000724931_100011198069 [0,1,0,0,0,1|2,0,0]=4 8120 B15R1.5920 O=S(=O)(Cc1ccc(cc1)Cl)NCCO 270084a_100000210304_100011198069 [0,1,0,0,0,1|1,0,0]=3 8121 B15R1.5920 O=S(=O)(Cc1ccc(cc1)Cl)NCCO 274078a_100000210304_100011198069 [0,1,0,0,0,1|1,0,0]=3 8122 B15R1.5920 O=S(=O)(Cc1ccc(cc1)F)NCCO 270084a_100000210304_100000735682 [0,1,0,0,0,1|1,1,0]=4 8123 B15R1.5920 O=S(=O)(Cc1ccc(cc1)F)NCCO 274078a_100000210304_100000735682 [0,1,0,0,0,1|1,1,0]=4 8124 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Br)Cl 11a_100000212058_100000755479 [0,1,0,0,0,1|1,0,1]=4 8125 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100000212058_100000755479 [0,1,0,0,0,1|1,0,1]=4 8126 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100000212058_100000755479 [0,1,0,0,0,1|1,0,1]=4 8127 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Br)Cl 527a_100000212058_100000755479 [0,1,0,0,0,1|1,0,1]=4 8128 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100000212058_100000210926 [0,1,0,0,0,1|1,0,1]=4 8129 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100000212058_100000210926 [0,1,0,0,0,1|1,0,1]=4 8130 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100000212058_100000210926 [0,1,0,0,0,1|1,0,1]=4 8131 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100000212058_100000210926 [0,1,0,0,0,1|1,0,1]=4 8132 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1F)Cl 11a_100000212058_100011830378 [0,1,0,0,0,1|1,0,1]=4 8133 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1F)Cl 1626a_100000212058_100011830378 [0,1,0,0,0,1|1,0,1]=4 8134 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1F)Cl 240690a_100000212058_100011830378 [0,1,0,0,0,1|1,0,1]=4 8135 B15R1.5927 C#CCNC(=O)Cc1ccc(cc1F)Cl 527a_100000212058_100011830378 [0,1,0,0,0,1|1,0,1]=4 8136 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100000212058 [0,1,0,0,0,1|1,0,1]=4 8137 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100000212058 [0,1,0,0,0,1|1,0,1]=4 8138 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000212058 [0,1,0,0,0,1|1,0,1]=4 8139 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100000212058 [0,1,0,0,0,1|1,0,1]=4 8140 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100000212058 [0,1,0,0,0,1|1,0,1]=4 8141 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100000212058 [0,1,0,0,0,1|1,0,1]=4 8142 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100020586998_100000755479 [0,1,0,0,0,1|1,0,1]=4 8143 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100020586998_100000755479 [0,1,0,0,0,1|1,0,1]=4 8144 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1Br)Cl 527a_100020586998_100000755479 [0,1,0,0,0,1|1,0,1]=4 8145 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100020586998_100000210926 [0,1,0,0,0,1|1,0,1]=4 8146 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100020586998_100000210926 [0,1,0,0,0,1|1,0,1]=4 8147 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100020586998_100000210926 [0,1,0,0,0,1|1,0,1]=4 8148 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1F)Cl 1626a_100020586998_100011830378 [0,1,0,0,0,1|1,0,1]=4 8149 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1F)Cl 240690a_100020586998_100011830378 [0,1,0,0,0,1|1,0,1]=4 8150 B15R1.5927 C=CCNC(=O)Cc1ccc(cc1F)Cl 527a_100020586998_100011830378 [0,1,0,0,0,1|1,0,1]=4 8151 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100020586998 [0,1,0,0,0,1|1,0,1]=4 8152 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100020586998 [0,1,0,0,0,1|1,0,1]=4 8153 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100020586998 [0,1,0,0,0,1|1,0,1]=4 8154 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100020586998 [0,1,0,0,0,1|1,0,1]=4 8155 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100020586998 [0,1,0,0,0,1|1,0,1]=4 8156 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100020586998 [0,1,0,0,0,1|1,0,1]=4 8157 B15R1.5927 CC(Cc1ccc(cc1Br)Cl)NCCO 270004a_100000210304_200010078464 [0,1,0,0,0,1|1,0,1]=4 8158 B15R1.5927 CC(Cc1ccc(cc1Cl)Cl)NCCO 270004a_100000210304_200011350722 [0,1,0,0,0,1|1,0,1]=4 8159 B15R1.5927 CCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000210183_100000755608 [0,1,0,0,0,1|2,0,0]=4 8160 B15R1.5927 CCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210211 [0,1,0,0,0,1|2,0,0]=4 8161 B15R1.5927 CCCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000210183_100012361307 [0,1,0,0,0,1|2,0,0]=4 8162 B15R1.5927 CCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210183_100000188473 [0,1,0,0,0,1|2,0,0]=4 8163 B15R1.5927 CCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210211 [0,1,0,0,0,1|2,0,0]=4 8164 B15R1.5927 CCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000210183_100000709361 [0,1,0,0,0,1|2,0,0]=4 8165 B15R1.5927 CCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210211 [0,1,0,0,0,1|2,0,0]=4 8166 B15R1.5927 CCCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000210183_100010254388 [0,1,0,0,0,1|2,0,0]=4 8167 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000210183 [0,1,0,0,0,1|2,0,0]=4 8168 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000210183 [0,1,0,0,0,1|2,0,0]=4 8169 B15R1.5927 CCCCC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000210183 [0,1,0,0,0,1|2,0,0]=4 8170 B15R1.5927 CCCCC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000210183 [0,1,0,0,0,1|2,0,0]=4 8171 B15R1.5927 CCCCC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000210183 [0,1,0,0,0,1|2,0,0]=4 8172 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000210183 [0,1,0,0,0,1|2,0,0]=4 8173 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000210183 [0,1,0,0,0,1|2,0,0]=4 8174 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000210183 [0,1,0,0,0,1|2,0,0]=4 8175 B15R1.5927 CCCCC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000210183 [0,1,0,0,0,1|2,0,0]=4 8176 B15R1.5927 CCCCC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000210183 [0,1,0,0,0,1|2,0,0]=4 8177 B15R1.5927 CCCCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000210183 [0,1,0,0,0,1|2,0,0]=4 8178 B15R1.5927 CCCCC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000210183 [0,1,0,0,0,1|2,0,0]=4 8179 B15R1.5927 CCCCC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000210183 [0,1,0,0,0,1|2,0,0]=4 8180 B15R1.5927 CCCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000210183 [0,1,0,0,0,1|2,0,0]=4 8181 B15R1.5927 CCCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000210183 [0,1,0,0,0,1|2,0,0]=4 8182 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Br 11a_100020643023_100010172832 [0,1,0,0,0,1|1,1,0]=4 8183 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Br 240690a_100020643023_100010172832 [0,1,0,0,0,1|1,1,0]=4 8184 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Br 527a_100020643023_100010172832 [0,1,0,0,0,1|1,1,0]=4 8185 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Cl 11a_100020643023_100000755479 [0,1,0,0,0,1|1,0,0]=3 8186 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100020643023_100000755479 [0,1,0,0,0,1|1,0,0]=3 8187 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100020643023_100000755479 [0,1,0,0,0,1|1,0,0]=3 8188 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)Cl 527a_100020643023_100000755479 [0,1,0,0,0,1|1,0,0]=3 8189 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)F 11a_100020643023_100000708238 [0,1,0,0,0,1|1,1,0]=4 8190 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)F 1626a_100020643023_100000708238 [0,1,0,0,0,1|1,1,0]=4 8191 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)F 240690a_100020643023_100000708238 [0,1,0,0,0,1|1,1,0]=4 8192 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)F 527a_100020643023_100000708238 [0,1,0,0,0,1|1,1,0]=4 8193 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)O 240690a_100020643023_100010176083 [0,1,0,0,0,1|2,0,0]=4 8194 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Br)O 527a_100020643023_100010176083 [0,1,0,0,0,1|2,0,0]=4 8195 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)Br 11a_100020643023_100000697930 [0,1,0,0,0,1|1,1,0]=4 8196 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)Br 1626a_100020643023_100000697930 [0,1,0,0,0,1|1,1,0]=4 8197 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)Br 240690a_100020643023_100000697930 [0,1,0,0,0,1|1,1,0]=4 8198 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)Br 527a_100020643023_100000697930 [0,1,0,0,0,1|1,1,0]=4 8199 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)C 11a_100020643023_100011236500 [0,1,0,0,0,1|2,0,0]=4 8200 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)C 1626a_100020643023_100011236500 [0,1,0,0,0,1|2,0,0]=4 8201 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)C 240690a_100020643023_100011236500 [0,1,0,0,0,1|2,0,0]=4 8202 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)C 527a_100020643023_100011236500 [0,1,0,0,0,1|2,0,0]=4 8203 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)F 11a_100020643023_100011667441 [0,1,0,0,0,1|1,1,0]=4 8204 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)F 1626a_100020643023_100011667441 [0,1,0,0,0,1|1,1,0]=4 8205 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)F 240690a_100020643023_100011667441 [0,1,0,0,0,1|1,1,0]=4 8206 B15R1.5927 CCCNC(=O)Cc1ccc(cc1C)F 527a_100020643023_100011667441 [0,1,0,0,0,1|1,1,0]=4 8207 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Br 11a_100020643023_100012361378 [0,1,0,0,0,1|1,1,0]=4 8208 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Br 1626a_100020643023_100012361378 [0,1,0,0,0,1|1,1,0]=4 8209 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100020643023_100012361378 [0,1,0,0,0,1|1,1,0]=4 8210 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Br 527a_100020643023_100012361378 [0,1,0,0,0,1|1,1,0]=4 8211 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100020643023_100000210926 [0,1,0,0,0,1|1,0,0]=3 8212 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100020643023_100000210926 [0,1,0,0,0,1|1,0,0]=3 8213 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100020643023_100000210926 [0,1,0,0,0,1|1,0,0]=3 8214 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100020643023_100000210926 [0,1,0,0,0,1|1,0,0]=3 8215 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)F 11a_100020643023_100000690284 [0,1,0,0,0,1|1,1,0]=4 8216 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)F 1626a_100020643023_100000690284 [0,1,0,0,0,1|1,1,0]=4 8217 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)F 240690a_100020643023_100000690284 [0,1,0,0,0,1|1,1,0]=4 8218 B15R1.5927 CCCNC(=O)Cc1ccc(cc1Cl)F 527a_100020643023_100000690284 [0,1,0,0,0,1|1,1,0]=4 8219 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Br 11a_100020643023_100011295475 [0,1,0,0,0,1|1,1,0]=4 8220 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Br 1626a_100020643023_100011295475 [0,1,0,0,0,1|1,1,0]=4 8221 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Br 240690a_100020643023_100011295475 [0,1,0,0,0,1|1,1,0]=4 8222 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Br 527a_100020643023_100011295475 [0,1,0,0,0,1|1,1,0]=4 8223 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)C 11a_100020643023_100000042674 [0,1,0,0,0,1|2,0,0]=4 8224 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)C 1626a_100020643023_100000042674 [0,1,0,0,0,1|2,0,0]=4 8225 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)C 240690a_100020643023_100000042674 [0,1,0,0,0,1|2,0,0]=4 8226 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)C 527a_100020643023_100000042674 [0,1,0,0,0,1|2,0,0]=4 8227 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Cl 11a_100020643023_100011830378 [0,1,0,0,0,1|1,0,0]=3 8228 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Cl 1626a_100020643023_100011830378 [0,1,0,0,0,1|1,0,0]=3 8229 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Cl 240690a_100020643023_100011830378 [0,1,0,0,0,1|1,0,0]=3 8230 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)Cl 527a_100020643023_100011830378 [0,1,0,0,0,1|1,0,0]=3 8231 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)F 11a_100020643023_100000684719 [0,1,0,0,0,1|1,1,0]=4 8232 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)F 1626a_100020643023_100000684719 [0,1,0,0,0,1|1,1,0]=4 8233 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)F 240690a_100020643023_100000684719 [0,1,0,0,0,1|1,1,0]=4 8234 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)F 527a_100020643023_100000684719 [0,1,0,0,0,1|1,1,0]=4 8235 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)I 11a_100020643023_100010149628 [0,1,0,0,0,1|1,1,0]=4 8236 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)I 1626a_100020643023_100010149628 [0,1,0,0,0,1|1,1,0]=4 8237 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)I 240690a_100020643023_100010149628 [0,1,0,0,0,1|1,1,0]=4 8238 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)I 527a_100020643023_100010149628 [0,1,0,0,0,1|1,1,0]=4 8239 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)O 240690a_100020643023_100000090534 [0,1,0,0,0,1|2,0,0]=4 8240 B15R1.5927 CCCNC(=O)Cc1ccc(cc1F)O 527a_100020643023_100000090534 [0,1,0,0,0,1|2,0,0]=4 8241 B15R1.5927 CCCNC(=O)Cc1ccc(cc1O)Br 240690a_100020643023_100000707504 [0,1,0,0,0,1|1,1,0]=4 8242 B15R1.5927 CCCNC(=O)Cc1ccc(nc1Cl)Cl 11a_100020643023_200010067290 [0,1,0,0,0,1|2,0,0]=4 8243 B15R1.5927 CCCNC(=O)Cc1ccc(nc1Cl)Cl 1626a_100020643023_200010067290 [0,1,0,0,0,1|2,0,0]=4 8244 B15R1.5927 CCCNC(=O)Cc1ccc(nc1Cl)Cl 240690a_100020643023_200010067290 [0,1,0,0,0,1|2,0,0]=4 8245 B15R1.5927 CCCNC(=O)Cc1ccc(nc1Cl)Cl 527a_100020643023_200010067290 [0,1,0,0,0,1|2,0,0]=4 8246 B15R1.5927 CCCNC(=O)Cc1ncc(cc1Br)Cl 11a_100020643023_200012351915 [0,1,0,0,0,1|2,0,0]=4 8247 B15R1.5927 CCCNC(=O)Cc1ncc(cc1Br)Cl 240690a_100020643023_200012351915 [0,1,0,0,0,1|2,0,0]=4 8248 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100020643023 [0,1,0,0,0,1|1,1,0]=4 8249 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100020643023 [0,1,0,0,0,1|2,0,0]=4 8250 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100020643023 [0,1,0,0,0,1|1,0,0]=3 8251 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100020643023 [0,1,0,0,0,1|1,1,0]=4 8252 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100020643023 [0,1,0,0,0,1|1,1,0]=4 8253 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100020643023 [0,1,0,0,0,1|2,0,0]=4 8254 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100020643023 [0,1,0,0,0,1|1,1,0]=4 8255 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100020643023 [0,1,0,0,0,1|2,0,0]=4 8256 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100020643023 [0,1,0,0,0,1|1,0,0]=3 8257 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100020643023 [0,1,0,0,0,1|1,1,0]=4 8258 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100020643023 [0,1,0,0,0,1|1,1,0]=4 8259 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100020643023 [0,1,0,0,0,1|2,0,0]=4 8260 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100020643023 [0,1,0,0,0,1|1,1,0]=4 8261 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100020643023 [0,1,0,0,0,1|2,0,0]=4 8262 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100020643023 [0,1,0,0,0,1|1,0,0]=3 8263 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100020643023 [0,1,0,0,0,1|1,1,0]=4 8264 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100020643023 [0,1,0,0,0,1|1,1,0]=4 8265 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100020643023 [0,1,0,0,0,1|2,0,0]=4 8266 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100020643023 [0,1,0,0,0,1|1,1,0]=4 8267 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100020643023 [0,1,0,0,0,1|2,0,0]=4 8268 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100020643023 [0,1,0,0,0,1|1,0,0]=3 8269 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100020643023 [0,1,0,0,0,1|1,1,0]=4 8270 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100020643023 [0,1,0,0,0,1|1,1,0]=4 8271 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100020643023 [0,1,0,0,0,1|2,0,0]=4 8272 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100020643023 [0,1,0,0,0,1|2,0,0]=4 8273 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100020643023 [0,1,0,0,0,1|1,0,0]=3 8274 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100020643023 [0,1,0,0,0,1|1,1,0]=4 8275 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100020643023 [0,1,0,0,0,1|1,1,0]=4 8276 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100020643023 [0,1,0,0,0,1|1,1,0]=4 8277 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100020643023 [0,1,0,0,0,1|2,0,0]=4 8278 B15R1.5927 CCCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100020643023 [0,1,0,0,0,1|2,0,0]=4 8279 B15R1.5927 CCCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100020643023 [0,1,0,0,0,1|1,0,0]=3 8280 B15R1.5927 CCCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100020643023 [0,1,0,0,0,1|1,1,0]=4 8281 B15R1.5927 CCCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100020643023 [0,1,0,0,0,1|1,1,0]=4 8282 B15R1.5927 CCCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100020643023 [0,1,0,0,0,1|2,0,0]=4 8283 B15R1.5927 CCNNC(=O)Cc1ccc(cc1Br)Cl 22a_100000756455_100000755479 [0,1,0,0,0,1|2,0,0]=4 8284 B15R1.5927 CCNNC(=O)Cc1ccc(cc1Cl)Cl 22a_100000756455_100000210926 [0,1,0,0,0,1|2,0,0]=4 8285 B15R1.5927 CCNNC(=O)Cc1ccc(cc1F)Cl 22a_100000756455_100011830378 [0,1,0,0,0,1|2,0,0]=4 8286 B15R1.5927 Cc1cc(ccc1CC(=O)C#CCO)Cl 1458a_100000049017_100012361307 [0,1,0,0,0,1|1,0,1]=4 8287 B15R1.5927 Cc1cc(ccc1CC(=O)CCCO)Br 1458a_100000697930_100011215043 [0,1,0,0,0,1|1,1,0]=4 8288 B15R1.5927 Cc1cc(ccc1CC(=O)CCCO)F 1458a_100011667441_100011215043 [0,1,0,0,0,1|1,1,0]=4 8289 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)Br 11a_100000724931_100000697930 [0,1,0,0,0,1|1,1,0]=4 8290 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)Br 1626a_100000724931_100000697930 [0,1,0,0,0,1|1,1,0]=4 8291 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)Br 240690a_100000724931_100000697930 [0,1,0,0,0,1|1,1,0]=4 8292 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)Br 527a_100000724931_100000697930 [0,1,0,0,0,1|1,1,0]=4 8293 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)F 11a_100000724931_100011667441 [0,1,0,0,0,1|1,1,0]=4 8294 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)F 1626a_100000724931_100011667441 [0,1,0,0,0,1|1,1,0]=4 8295 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)F 240690a_100000724931_100011667441 [0,1,0,0,0,1|1,1,0]=4 8296 B15R1.5927 Cc1cc(ccc1CC(=O)NCCF)F 527a_100000724931_100011667441 [0,1,0,0,0,1|1,1,0]=4 8297 B15R1.5927 Cc1cc(ccc1CC(=O)NCCO)Br 240690a_100000210304_100000697930 [0,1,0,0,0,1|0,1,0]=3 8298 B15R1.5927 Cc1cc(ccc1CC(=O)NCCO)Br 527a_100000210304_100000697930 [0,1,0,0,0,1|0,1,0]=3 8299 B15R1.5927 Cc1cc(ccc1CC(=O)NCCO)F 240690a_100000210304_100011667441 [0,1,0,0,0,1|0,1,0]=3 8300 B15R1.5927 Cc1cc(ccc1CC(=O)NCCO)F 527a_100000210304_100011667441 [0,1,0,0,0,1|0,1,0]=3 8301 B15R1.5927 Cc1cc(ccc1NC(=O)NCC#N)Cl 2430a_100000210418_100000734998 [0,1,0,0,0,1|1,0,1]=4 8302 B15R1.5927 Cc1cc(ccc1NC(=O)NCCF)Br 2430a_100000211769_100000724931 [0,1,0,0,0,1|1,1,0]=4 8303 B15R1.5927 Cc1cc(ccc1NC(=O)NCCF)Cl 2430a_100000210418_100000724931 [0,1,0,0,0,1|1,0,0]=3 8304 B15R1.5927 Cc1cc(ccc1NC(=O)NCCF)F 2430a_100000211637_100000724931 [0,1,0,0,0,1|1,1,0]=4 8305 B15R1.5927 Cc1cc(ccc1NC(=O)NCCF)I 2430a_100000184554_100000724931 [0,1,0,0,0,1|1,1,0]=4 8306 B15R1.5927 Cc1cc(ccc1NC(=O)NCCF)O 2430a_100000756630_100000724931 [0,1,0,0,0,1|2,0,0]=4 8307 B15R1.5927 Cc1cc(ccc1NC(=O)NCCO)Br 2430a_100000211769_100000210304 [0,1,0,0,0,1|0,1,0]=3 8308 B15R1.5927 Cc1cc(ccc1NC(=O)NCCO)Cl 2430a_100000210418_100000210304 [0,1,0,0,0,1|0,0,0]=2 8309 B15R1.5927 Cc1cc(ccc1NC(=O)NCCO)F 2430a_100000211637_100000210304 [0,1,0,0,0,1|0,1,0]=3 8310 B15R1.5927 Cc1cc(ccc1NC(=O)NCCO)I 2430a_100000184554_100000210304 [0,1,0,0,0,1|0,1,0]=3 8311 B15R1.5927 Cc1cc(ccc1NC(=O)NCCO)O 2430a_100000756630_100000210304 [0,1,0,0,0,1|1,0,0]=3 8312 B15R1.5927 Cc1ccc(c(c1)Br)NC(=O)NCCF 2430a_100000210942_100000724931 [0,1,0,0,0,1|2,0,0]=4 8313 B15R1.5927 Cc1ccc(c(c1)Br)NC(=O)NCCO 2430a_100000210942_100000210304 [0,1,0,0,0,1|1,0,0]=3 8314 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)CCCO 1458a_100011236500_100011215043 [0,1,0,0,0,1|2,0,0]=4 8315 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)NCCF 11a_100000724931_100011236500 [0,1,0,0,0,1|2,0,0]=4 8316 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)NCCF 1626a_100000724931_100011236500 [0,1,0,0,0,1|2,0,0]=4 8317 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)NCCF 240690a_100000724931_100011236500 [0,1,0,0,0,1|2,0,0]=4 8318 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)NCCF 527a_100000724931_100011236500 [0,1,0,0,0,1|2,0,0]=4 8319 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)NCCO 240690a_100000210304_100011236500 [0,1,0,0,0,1|1,0,0]=3 8320 B15R1.5927 Cc1ccc(c(c1)C)CC(=O)NCCO 527a_100000210304_100011236500 [0,1,0,0,0,1|1,0,0]=3 8321 B15R1.5927 Cc1ccc(c(c1)C)NC(=O)NCCF 2430a_100000736561_100000724931 [0,1,0,0,0,1|2,0,0]=4 8322 B15R1.5927 Cc1ccc(c(c1)C)NC(=O)NCCO 2430a_100000736561_100000210304 [0,1,0,0,0,1|1,0,0]=3 8323 B15R1.5927 Cc1ccc(c(c1)Cl)NC(=O)NCCF 2430a_100000210522_100000724931 [0,1,0,0,0,1|2,0,0]=4 8324 B15R1.5927 Cc1ccc(c(c1)Cl)NC(=O)NCCO 2430a_100000210522_100000210304 [0,1,0,0,0,1|1,0,0]=3 8325 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)CCCO 1458a_100000042674_100011215043 [0,1,0,0,0,1|2,0,0]=4 8326 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)NCCF 11a_100000724931_100000042674 [0,1,0,0,0,1|2,0,0]=4 8327 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)NCCF 1626a_100000724931_100000042674 [0,1,0,0,0,1|2,0,0]=4 8328 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)NCCF 240690a_100000724931_100000042674 [0,1,0,0,0,1|2,0,0]=4 8329 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)NCCF 527a_100000724931_100000042674 [0,1,0,0,0,1|2,0,0]=4 8330 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)NCCO 240690a_100000210304_100000042674 [0,1,0,0,0,1|1,0,0]=3 8331 B15R1.5927 Cc1ccc(c(c1)F)CC(=O)NCCO 527a_100000210304_100000042674 [0,1,0,0,0,1|1,0,0]=3 8332 B15R1.5927 Cc1ccc(c(c1)F)NC(=O)NCCF 2430a_100000211023_100000724931 [0,1,0,0,0,1|2,0,0]=4 8333 B15R1.5927 Cc1ccc(c(c1)F)NC(=O)NCCO 2430a_100000211023_100000210304 [0,1,0,0,0,1|1,0,0]=3 8334 B15R1.5927 Cc1ccc(c(c1)I)NC(=O)NCCF 2430a_100011356834_100000724931 [0,1,0,0,0,1|2,0,0]=4 8335 B15R1.5927 Cc1ccc(c(c1)I)NC(=O)NCCO 2430a_100011356834_100000210304 [0,1,0,0,0,1|1,0,0]=3 8336 B15R1.5927 Cc1ccc(c(c1)O)NC(=O)NCCF 2430a_100000211527_100000724931 [0,1,0,0,0,1|2,0,0]=4 8337 B15R1.5927 Cc1ccc(c(c1)O)NC(=O)NCCO 2430a_100000211527_100000210304 [0,1,0,0,0,1|1,0,0]=3 8338 B15R1.5927 Cc1ccn(c(=O)c1)CC(=O)NCCO 240690a_100000210304_100000721392 [0,1,0,0,0,1|2,0,0]=4 8339 B15R1.5927 Cc1ccn(c(=O)c1)CC(=O)NCCO 527a_100000210304_100000721392 [0,1,0,0,0,1|2,0,0]=4 8340 B15R1.5927 N#CCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100000734998_100000755479 [0,1,0,0,0,1|1,0,1]=4 8341 B15R1.5927 N#CCNC(=O)Cc1ccc(cc1Br)Cl 527a_100000734998_100000755479 [0,1,0,0,0,1|1,0,1]=4 8342 B15R1.5927 N#CCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100000734998_100000210926 [0,1,0,0,0,1|1,0,1]=4 8343 B15R1.5927 N#CCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100000734998_100000210926 [0,1,0,0,0,1|1,0,1]=4 8344 B15R1.5927 N#CCNC(=O)Cc1ccc(cc1F)Cl 1626a_100000734998_100011830378 [0,1,0,0,0,1|1,0,1]=4 8345 B15R1.5927 N#CCNC(=O)Cc1ccc(cc1F)Cl 527a_100000734998_100011830378 [0,1,0,0,0,1|1,0,1]=4 8346 B15R1.5927 N#CCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100000734998 [0,1,0,0,0,1|1,0,1]=4 8347 B15R1.5927 N#CCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000734998 [0,1,0,0,0,1|1,0,1]=4 8348 B15R1.5927 N#CCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100000734998 [0,1,0,0,0,1|1,0,1]=4 8349 B15R1.5927 N#CCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100000734998 [0,1,0,0,0,1|1,0,1]=4 8350 B15R1.5927 N#CCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100000734998 [0,1,0,0,0,1|1,0,1]=4 8351 B15R1.5927 O=C(C#CCO)Cc1ccc(cc1Br)Cl 1458a_100000049017_100000755608 [0,1,0,0,0,1|1,0,1]=4 8352 B15R1.5927 O=C(C#CCO)Cc1ccc(cc1Cl)Cl 1458a_100000049017_100000188473 [0,1,0,0,0,1|1,0,1]=4 8353 B15R1.5927 O=C(C#CCO)Cc1ccc(cc1F)Cl 1458a_100000049017_100000709361 [0,1,0,0,0,1|1,0,1]=4 8354 B15R1.5927 O=C(C#CCO)Cc1ccc(cc1I)Cl 1458a_100000049017_100010254388 [0,1,0,0,0,1|1,0,1]=4 8355 B15R1.5927 O=C(CCCF)Cc1ccc(cc1Br)Cl 1458a_100000755479_100011934791 [0,1,0,0,0,1|2,0,0]=4 8356 B15R1.5927 O=C(CCCF)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100011934791 [0,1,0,0,0,1|2,0,0]=4 8357 B15R1.5927 O=C(CCCF)Cc1ccc(cc1F)Cl 1458a_100011830378_100011934791 [0,1,0,0,0,1|2,0,0]=4 8358 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Br)Br 1458a_100010172832_100011215043 [0,1,0,0,0,1|1,1,0]=4 8359 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Br)Cl 1458a_100000755479_100011215043 [0,1,0,0,0,1|1,0,0]=3 8360 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Br)F 1458a_100000708238_100011215043 [0,1,0,0,0,1|1,1,0]=4 8361 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Br)O 1458a_100010176083_100011215043 [0,1,0,0,0,1|2,0,0]=4 8362 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Cl)Br 1458a_100012361378_100011215043 [0,1,0,0,0,1|1,1,0]=4 8363 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100011215043 [0,1,0,0,0,1|1,0,0]=3 8364 B15R1.5927 O=C(CCCO)Cc1ccc(cc1Cl)F 1458a_100000690284_100011215043 [0,1,0,0,0,1|1,1,0]=4 8365 B15R1.5927 O=C(CCCO)Cc1ccc(cc1F)Br 1458a_100011295475_100011215043 [0,1,0,0,0,1|1,1,0]=4 8366 B15R1.5927 O=C(CCCO)Cc1ccc(cc1F)Cl 1458a_100011830378_100011215043 [0,1,0,0,0,1|1,0,0]=3 8367 B15R1.5927 O=C(CCCO)Cc1ccc(cc1F)F 1458a_100000684719_100011215043 [0,1,0,0,0,1|1,1,0]=4 8368 B15R1.5927 O=C(CCCO)Cc1ccc(cc1F)I 1458a_100010149628_100011215043 [0,1,0,0,0,1|1,1,0]=4 8369 B15R1.5927 O=C(CCCO)Cc1ccc(cc1F)O 1458a_100000090534_100011215043 [0,1,0,0,0,1|2,0,0]=4 8370 B15R1.5927 O=C(CCCO)Cc1ccc(cc1O)Br 1458a_100000707504_100011215043 [0,1,0,0,0,1|1,1,0]=4 8371 B15R1.5927 O=C(CCCO)Cc1ccc(nc1Cl)Cl 1458a_200010067290_100011215043 [0,1,0,0,0,1|2,0,0]=4 8372 B15R1.5927 O=C(CCCO)Cc1ncc(cc1Br)Cl 1458a_200012351915_100011215043 [0,1,0,0,0,1|2,0,0]=4 8373 B15R1.5927 O=C(Cc1ccc(cc1Br)Br)NCCF 11a_100000724931_100010172832 [0,1,0,0,0,1|1,1,0]=4 8374 B15R1.5927 O=C(Cc1ccc(cc1Br)Br)NCCF 240690a_100000724931_100010172832 [0,1,0,0,0,1|1,1,0]=4 8375 B15R1.5927 O=C(Cc1ccc(cc1Br)Br)NCCF 527a_100000724931_100010172832 [0,1,0,0,0,1|1,1,0]=4 8376 B15R1.5927 O=C(Cc1ccc(cc1Br)Br)NCCO 240690a_100000210304_100010172832 [0,1,0,0,0,1|0,1,0]=3 8377 B15R1.5927 O=C(Cc1ccc(cc1Br)Br)NCCO 527a_100000210304_100010172832 [0,1,0,0,0,1|0,1,0]=3 8378 B15R1.5927 O=C(Cc1ccc(cc1Br)Cl)NCCF 11a_100000724931_100000755479 [0,1,0,0,0,1|1,0,0]=3 8379 B15R1.5927 O=C(Cc1ccc(cc1Br)Cl)NCCF 1626a_100000724931_100000755479 [0,1,0,0,0,1|1,0,0]=3 8380 B15R1.5927 O=C(Cc1ccc(cc1Br)Cl)NCCF 240690a_100000724931_100000755479 [0,1,0,0,0,1|1,0,0]=3 8381 B15R1.5927 O=C(Cc1ccc(cc1Br)Cl)NCCF 527a_100000724931_100000755479 [0,1,0,0,0,1|1,0,0]=3 8382 B15R1.5927 O=C(Cc1ccc(cc1Br)Cl)NCCO 240690a_100000210304_100000755479 [0,1,0,0,0,1|0,0,0]=2 8383 B15R1.5927 O=C(Cc1ccc(cc1Br)Cl)NCCO 527a_100000210304_100000755479 [0,1,0,0,0,1|0,0,0]=2 8384 B15R1.5927 O=C(Cc1ccc(cc1Br)F)NCCF 11a_100000724931_100000708238 [0,1,0,0,0,1|1,1,0]=4 8385 B15R1.5927 O=C(Cc1ccc(cc1Br)F)NCCF 1626a_100000724931_100000708238 [0,1,0,0,0,1|1,1,0]=4 8386 B15R1.5927 O=C(Cc1ccc(cc1Br)F)NCCF 240690a_100000724931_100000708238 [0,1,0,0,0,1|1,1,0]=4 8387 B15R1.5927 O=C(Cc1ccc(cc1Br)F)NCCF 527a_100000724931_100000708238 [0,1,0,0,0,1|1,1,0]=4 8388 B15R1.5927 O=C(Cc1ccc(cc1Br)F)NCCO 240690a_100000210304_100000708238 [0,1,0,0,0,1|0,1,0]=3 8389 B15R1.5927 O=C(Cc1ccc(cc1Br)F)NCCO 527a_100000210304_100000708238 [0,1,0,0,0,1|0,1,0]=3 8390 B15R1.5927 O=C(Cc1ccc(cc1Br)O)NCCF 240690a_100000724931_100010176083 [0,1,0,0,0,1|2,0,0]=4 8391 B15R1.5927 O=C(Cc1ccc(cc1Br)O)NCCF 527a_100000724931_100010176083 [0,1,0,0,0,1|2,0,0]=4 8392 B15R1.5927 O=C(Cc1ccc(cc1Br)O)NCCO 240690a_100000210304_100010176083 [0,1,0,0,0,1|1,0,0]=3 8393 B15R1.5927 O=C(Cc1ccc(cc1Br)O)NCCO 527a_100000210304_100010176083 [0,1,0,0,0,1|1,0,0]=3 8394 B15R1.5927 O=C(Cc1ccc(cc1Cl)Br)NCCF 11a_100000724931_100012361378 [0,1,0,0,0,1|1,1,0]=4 8395 B15R1.5927 O=C(Cc1ccc(cc1Cl)Br)NCCF 1626a_100000724931_100012361378 [0,1,0,0,0,1|1,1,0]=4 8396 B15R1.5927 O=C(Cc1ccc(cc1Cl)Br)NCCF 240690a_100000724931_100012361378 [0,1,0,0,0,1|1,1,0]=4 8397 B15R1.5927 O=C(Cc1ccc(cc1Cl)Br)NCCF 527a_100000724931_100012361378 [0,1,0,0,0,1|1,1,0]=4 8398 B15R1.5927 O=C(Cc1ccc(cc1Cl)Br)NCCO 240690a_100000210304_100012361378 [0,1,0,0,0,1|0,1,0]=3 8399 B15R1.5927 O=C(Cc1ccc(cc1Cl)Br)NCCO 527a_100000210304_100012361378 [0,1,0,0,0,1|0,1,0]=3 8400 B15R1.5927 O=C(Cc1ccc(cc1Cl)Cl)NCCF 11a_100000724931_100000210926 [0,1,0,0,0,1|1,0,0]=3 8401 B15R1.5927 O=C(Cc1ccc(cc1Cl)Cl)NCCF 1626a_100000724931_100000210926 [0,1,0,0,0,1|1,0,0]=3 8402 B15R1.5927 O=C(Cc1ccc(cc1Cl)Cl)NCCF 240690a_100000724931_100000210926 [0,1,0,0,0,1|1,0,0]=3 8403 B15R1.5927 O=C(Cc1ccc(cc1Cl)Cl)NCCF 527a_100000724931_100000210926 [0,1,0,0,0,1|1,0,0]=3 8404 B15R1.5927 O=C(Cc1ccc(cc1Cl)Cl)NCCO 240690a_100000210304_100000210926 [0,1,0,0,0,1|0,0,0]=2 8405 B15R1.5927 O=C(Cc1ccc(cc1Cl)Cl)NCCO 527a_100000210304_100000210926 [0,1,0,0,0,1|0,0,0]=2 8406 B15R1.5927 O=C(Cc1ccc(cc1Cl)F)NCCF 11a_100000724931_100000690284 [0,1,0,0,0,1|1,1,0]=4 8407 B15R1.5927 O=C(Cc1ccc(cc1Cl)F)NCCF 1626a_100000724931_100000690284 [0,1,0,0,0,1|1,1,0]=4 8408 B15R1.5927 O=C(Cc1ccc(cc1Cl)F)NCCF 240690a_100000724931_100000690284 [0,1,0,0,0,1|1,1,0]=4 8409 B15R1.5927 O=C(Cc1ccc(cc1Cl)F)NCCF 527a_100000724931_100000690284 [0,1,0,0,0,1|1,1,0]=4 8410 B15R1.5927 O=C(Cc1ccc(cc1Cl)F)NCCO 240690a_100000210304_100000690284 [0,1,0,0,0,1|0,1,0]=3 8411 B15R1.5927 O=C(Cc1ccc(cc1Cl)F)NCCO 527a_100000210304_100000690284 [0,1,0,0,0,1|0,1,0]=3 8412 B15R1.5927 O=C(Cc1ccc(cc1F)Br)NCCF 11a_100000724931_100011295475 [0,1,0,0,0,1|1,1,0]=4 8413 B15R1.5927 O=C(Cc1ccc(cc1F)Br)NCCF 1626a_100000724931_100011295475 [0,1,0,0,0,1|1,1,0]=4 8414 B15R1.5927 O=C(Cc1ccc(cc1F)Br)NCCF 240690a_100000724931_100011295475 [0,1,0,0,0,1|1,1,0]=4 8415 B15R1.5927 O=C(Cc1ccc(cc1F)Br)NCCF 527a_100000724931_100011295475 [0,1,0,0,0,1|1,1,0]=4 8416 B15R1.5927 O=C(Cc1ccc(cc1F)Br)NCCO 240690a_100000210304_100011295475 [0,1,0,0,0,1|0,1,0]=3 8417 B15R1.5927 O=C(Cc1ccc(cc1F)Br)NCCO 527a_100000210304_100011295475 [0,1,0,0,0,1|0,1,0]=3 8418 B15R1.5927 O=C(Cc1ccc(cc1F)Cl)NCCF 11a_100000724931_100011830378 [0,1,0,0,0,1|1,0,0]=3 8419 B15R1.5927 O=C(Cc1ccc(cc1F)Cl)NCCF 1626a_100000724931_100011830378 [0,1,0,0,0,1|1,0,0]=3 8420 B15R1.5927 O=C(Cc1ccc(cc1F)Cl)NCCF 240690a_100000724931_100011830378 [0,1,0,0,0,1|1,0,0]=3 8421 B15R1.5927 O=C(Cc1ccc(cc1F)Cl)NCCF 527a_100000724931_100011830378 [0,1,0,0,0,1|1,0,0]=3 8422 B15R1.5927 O=C(Cc1ccc(cc1F)Cl)NCCO 240690a_100000210304_100011830378 [0,1,0,0,0,1|0,0,0]=2 8423 B15R1.5927 O=C(Cc1ccc(cc1F)Cl)NCCO 527a_100000210304_100011830378 [0,1,0,0,0,1|0,0,0]=2 8424 B15R1.5927 O=C(Cc1ccc(cc1F)F)NCCF 11a_100000724931_100000684719 [0,1,0,0,0,1|1,1,0]=4 8425 B15R1.5927 O=C(Cc1ccc(cc1F)F)NCCF 1626a_100000724931_100000684719 [0,1,0,0,0,1|1,1,0]=4 8426 B15R1.5927 O=C(Cc1ccc(cc1F)F)NCCF 240690a_100000724931_100000684719 [0,1,0,0,0,1|1,1,0]=4 8427 B15R1.5927 O=C(Cc1ccc(cc1F)F)NCCF 527a_100000724931_100000684719 [0,1,0,0,0,1|1,1,0]=4 8428 B15R1.5927 O=C(Cc1ccc(cc1F)F)NCCO 240690a_100000210304_100000684719 [0,1,0,0,0,1|0,1,0]=3 8429 B15R1.5927 O=C(Cc1ccc(cc1F)F)NCCO 527a_100000210304_100000684719 [0,1,0,0,0,1|0,1,0]=3 8430 B15R1.5927 O=C(Cc1ccc(cc1F)I)NCCF 11a_100000724931_100010149628 [0,1,0,0,0,1|1,1,0]=4 8431 B15R1.5927 O=C(Cc1ccc(cc1F)I)NCCF 1626a_100000724931_100010149628 [0,1,0,0,0,1|1,1,0]=4 8432 B15R1.5927 O=C(Cc1ccc(cc1F)I)NCCF 240690a_100000724931_100010149628 [0,1,0,0,0,1|1,1,0]=4 8433 B15R1.5927 O=C(Cc1ccc(cc1F)I)NCCF 527a_100000724931_100010149628 [0,1,0,0,0,1|1,1,0]=4 8434 B15R1.5927 O=C(Cc1ccc(cc1F)I)NCCO 240690a_100000210304_100010149628 [0,1,0,0,0,1|0,1,0]=3 8435 B15R1.5927 O=C(Cc1ccc(cc1F)I)NCCO 527a_100000210304_100010149628 [0,1,0,0,0,1|0,1,0]=3 8436 B15R1.5927 O=C(Cc1ccc(cc1F)O)NCCF 240690a_100000724931_100000090534 [0,1,0,0,0,1|2,0,0]=4 8437 B15R1.5927 O=C(Cc1ccc(cc1F)O)NCCF 527a_100000724931_100000090534 [0,1,0,0,0,1|2,0,0]=4 8438 B15R1.5927 O=C(Cc1ccc(cc1F)O)NCCO 240690a_100000210304_100000090534 [0,1,0,0,0,1|1,0,0]=3 8439 B15R1.5927 O=C(Cc1ccc(cc1F)O)NCCO 527a_100000210304_100000090534 [0,1,0,0,0,1|1,0,0]=3 8440 B15R1.5927 O=C(Cc1ccc(cc1O)Br)NCCF 240690a_100000724931_100000707504 [0,1,0,0,0,1|1,1,0]=4 8441 B15R1.5927 O=C(Cc1ccc(cc1O)Br)NCCO 240690a_100000210304_100000707504 [0,1,0,0,0,1|0,1,0]=3 8442 B15R1.5927 O=C(Cc1ccc(nc1Cl)Cl)NCCF 11a_100000724931_200010067290 [0,1,0,0,0,1|2,0,0]=4 8443 B15R1.5927 O=C(Cc1ccc(nc1Cl)Cl)NCCF 1626a_100000724931_200010067290 [0,1,0,0,0,1|2,0,0]=4 8444 B15R1.5927 O=C(Cc1ccc(nc1Cl)Cl)NCCF 240690a_100000724931_200010067290 [0,1,0,0,0,1|2,0,0]=4 8445 B15R1.5927 O=C(Cc1ccc(nc1Cl)Cl)NCCF 527a_100000724931_200010067290 [0,1,0,0,0,1|2,0,0]=4 8446 B15R1.5927 O=C(Cc1ccc(nc1Cl)Cl)NCCO 240690a_100000210304_200010067290 [0,1,0,0,0,1|1,0,0]=3 8447 B15R1.5927 O=C(Cc1ccc(nc1Cl)Cl)NCCO 527a_100000210304_200010067290 [0,1,0,0,0,1|1,0,0]=3 8448 B15R1.5927 O=C(Cc1ncc(cc1Br)Cl)NCCF 11a_100000724931_200012351915 [0,1,0,0,0,1|2,0,0]=4 8449 B15R1.5927 O=C(Cc1ncc(cc1Br)Cl)NCCF 240690a_100000724931_200012351915 [0,1,0,0,0,1|2,0,0]=4 8450 B15R1.5927 O=C(Cc1ncc(cc1Br)Cl)NCCO 240690a_100000210304_200012351915 [0,1,0,0,0,1|1,0,0]=3 8451 B15R1.5927 O=C(Cc1ncc(cc1F)Br)NCCO 240690a_100000210304_100012351917 [0,1,0,0,0,1|1,1,0]=4 8452 B15R1.5927 O=C(Cc1ncc(cc1F)Br)NCCO 527a_100000210304_100012351917 [0,1,0,0,0,1|1,1,0]=4 8453 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Br)Br 2430a_100000211012_100000724931 [0,1,0,0,0,1|1,1,0]=4 8454 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Br)Cl 2430a_100000752454_100000724931 [0,1,0,0,0,1|1,0,0]=3 8455 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Br)F 2430a_100000738039_100000724931 [0,1,0,0,0,1|1,1,0]=4 8456 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Br)I 2430a_100000750455_100000724931 [0,1,0,0,0,1|1,1,0]=4 8457 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Br)O 2430a_100012001276_100000724931 [0,1,0,0,0,1|2,0,0]=4 8458 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000724931 [0,1,0,0,0,1|1,1,0]=4 8459 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000724931 [0,1,0,0,0,1|1,0,0]=3 8460 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)F 2430a_100000212003_100000724931 [0,1,0,0,0,1|1,1,0]=4 8461 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)I 2430a_100011218065_100000724931 [0,1,0,0,0,1|1,1,0]=4 8462 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)O 2430a_100011215599_100000724931 [0,1,0,0,0,1|2,0,0]=4 8463 B15R1.5927 O=C(NCCF)Nc1ccc(cc1F)Br 2430a_100000210722_100000724931 [0,1,0,0,0,1|1,1,0]=4 8464 B15R1.5927 O=C(NCCF)Nc1ccc(cc1F)Cl 2430a_100000211020_100000724931 [0,1,0,0,0,1|1,0,0]=3 8465 B15R1.5927 O=C(NCCF)Nc1ccc(cc1F)F 2430a_100000210720_100000724931 [0,1,0,0,0,1|1,1,0]=4 8466 B15R1.5927 O=C(NCCF)Nc1ccc(cc1F)I 2430a_100011215594_100000724931 [0,1,0,0,0,1|1,1,0]=4 8467 B15R1.5927 O=C(NCCF)Nc1ccc(cc1F)O 2430a_100000759473_100000724931 [0,1,0,0,0,1|2,0,0]=4 8468 B15R1.5927 O=C(NCCF)Nc1ccc(cc1I)Cl 2430a_100000761889_100000724931 [0,1,0,0,0,1|1,0,0]=3 8469 B15R1.5927 O=C(NCCF)Nc1ccc(cc1I)F 2430a_100000760547_100000724931 [0,1,0,0,0,1|1,1,0]=4 8470 B15R1.5927 O=C(NCCF)Nc1ccc(cc1I)I 2430a_100010002754_100000724931 [0,1,0,0,0,1|1,1,0]=4 8471 B15R1.5927 O=C(NCCF)Nc1ccc(cc1I)I 512a_100010002754_100000724931 [0,1,0,0,0,1|1,1,0]=4 8472 B15R1.5927 O=C(NCCF)Nc1ccc(cc1I)O 2430a_100010084370_100000724931 [0,1,0,0,0,1|2,0,0]=4 8473 B15R1.5927 O=C(NCCF)Nc1ccc(cc1O)Cl 2430a_100000185728_100000724931 [0,1,0,0,0,1|1,0,0]=3 8474 B15R1.5927 O=C(NCCF)Nc1ccc(cc1O)F 2430a_100000753323_100000724931 [0,1,0,0,0,1|1,1,0]=4 8475 B15R1.5927 O=C(NCCF)Nc1ccc(cc1O)I 2430a_100000057187_100000724931 [0,1,0,0,0,1|1,1,0]=4 8476 B15R1.5927 O=C(NCCF)Nc1ccc(cc1O)O 2430a_100000106777_100000724931 [0,1,0,0,0,1|2,0,0]=4 8477 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Br)Br 2430a_100000211012_100000210304 [0,1,0,0,0,1|0,1,0]=3 8478 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Br)Cl 2430a_100000752454_100000210304 [0,1,0,0,0,1|0,0,0]=2 8479 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Br)F 2430a_100000738039_100000210304 [0,1,0,0,0,1|0,1,0]=3 8480 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Br)I 2430a_100000750455_100000210304 [0,1,0,0,0,1|0,1,0]=3 8481 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Br)O 2430a_100012001276_100000210304 [0,1,0,0,0,1|1,0,0]=3 8482 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000210304 [0,1,0,0,0,1|0,1,0]=3 8483 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000210304 [0,1,0,0,0,1|0,0,0]=2 8484 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)F 2430a_100000212003_100000210304 [0,1,0,0,0,1|0,1,0]=3 8485 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)I 2430a_100011218065_100000210304 [0,1,0,0,0,1|0,1,0]=3 8486 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)O 2430a_100011215599_100000210304 [0,1,0,0,0,1|1,0,0]=3 8487 B15R1.5927 O=C(NCCO)Nc1ccc(cc1F)Br 2430a_100000210722_100000210304 [0,1,0,0,0,1|0,1,0]=3 8488 B15R1.5927 O=C(NCCO)Nc1ccc(cc1F)Cl 2430a_100000211020_100000210304 [0,1,0,0,0,1|0,0,0]=2 8489 B15R1.5927 O=C(NCCO)Nc1ccc(cc1F)F 2430a_100000210720_100000210304 [0,1,0,0,0,1|0,1,0]=3 8490 B15R1.5927 O=C(NCCO)Nc1ccc(cc1F)I 2430a_100011215594_100000210304 [0,1,0,0,0,1|0,1,0]=3 8491 B15R1.5927 O=C(NCCO)Nc1ccc(cc1F)O 2430a_100000759473_100000210304 [0,1,0,0,0,1|1,0,0]=3 8492 B15R1.5927 O=C(NCCO)Nc1ccc(cc1I)Cl 2430a_100000761889_100000210304 [0,1,0,0,0,1|0,0,0]=2 8493 B15R1.5927 O=C(NCCO)Nc1ccc(cc1I)F 2430a_100000760547_100000210304 [0,1,0,0,0,1|0,1,0]=3 8494 B15R1.5927 O=C(NCCO)Nc1ccc(cc1I)I 2430a_100010002754_100000210304 [0,1,0,0,0,1|0,1,0]=3 8495 B15R1.5927 O=C(NCCO)Nc1ccc(cc1I)I 512a_100010002754_100000210304 [0,1,0,0,0,1|0,1,0]=3 8496 B15R1.5927 O=C(NCCO)Nc1ccc(cc1I)O 2430a_100010084370_100000210304 [0,1,0,0,0,1|1,0,0]=3 8497 B15R1.5927 O=C(NCCO)Nc1ccc(cc1O)Cl 2430a_100000185728_100000210304 [0,1,0,0,0,1|0,0,0]=2 8498 B15R1.5927 O=C(NCCO)Nc1ccc(cc1O)F 2430a_100000753323_100000210304 [0,1,0,0,0,1|0,1,0]=3 8499 B15R1.5927 O=C(NCCO)Nc1ccc(cc1O)I 2430a_100000057187_100000210304 [0,1,0,0,0,1|0,1,0]=3 8500 B15R1.5929 C#Cc1ccc(cc1)CC(=O)CCCO 1458a_200009884166_100011215043 [0,1,0,0,0,1|2,0,0]=4 8501 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCC 11a_100020643023_200009884166 [0,1,0,0,0,1|2,0,0]=4 8502 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCC 1626a_100020643023_200009884166 [0,1,0,0,0,1|2,0,0]=4 8503 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCC 240690a_100020643023_200009884166 [0,1,0,0,0,1|2,0,0]=4 8504 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCC 527a_100020643023_200009884166 [0,1,0,0,0,1|2,0,0]=4 8505 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCF 11a_100000724931_200009884166 [0,1,0,0,0,1|2,0,0]=4 8506 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCF 1626a_100000724931_200009884166 [0,1,0,0,0,1|2,0,0]=4 8507 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_200009884166 [0,1,0,0,0,1|2,0,0]=4 8508 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCF 527a_100000724931_200009884166 [0,1,0,0,0,1|2,0,0]=4 8509 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_200009884166 [0,1,0,0,0,1|1,0,0]=3 8510 B15R1.5929 C#Cc1ccc(cc1)CC(=O)NCCO 527a_100000210304_200009884166 [0,1,0,0,0,1|1,0,0]=3 8511 B15R1.5929 C#Cc1ccc(cc1)NC(=O)NCCC 2430a_100011215031_100020643023 [0,1,0,0,0,1|2,0,0]=4 8512 B15R1.5929 C#Cc1ccc(cc1)NC(=O)NCCC 512a_100011215031_100020643023 [0,1,0,0,0,1|2,0,0]=4 8513 B15R1.5929 C#Cc1ccc(cc1)NC(=O)NCCF 2430a_100011215031_100000724931 [0,1,0,0,0,1|2,0,0]=4 8514 B15R1.5929 C#Cc1ccc(cc1)NC(=O)NCCF 512a_100011215031_100000724931 [0,1,0,0,0,1|2,0,0]=4 8515 B15R1.5929 C#Cc1ccc(cc1)NC(=O)NCCO 2430a_100011215031_100000210304 [0,1,0,0,0,1|1,0,0]=3 8516 B15R1.5929 C#Cc1ccc(cc1)NC(=O)NCCO 512a_100011215031_100000210304 [0,1,0,0,0,1|1,0,0]=3 8517 B15R1.5929 C=Cc1ccc(cc1)CC(=O)NCCC 271570a_100011290941_200000152284 [0,1,0,0,0,1|2,0,0]=4 8518 B15R1.5929 C=Cc1ccc(cc1)NC(=O)NCCC 2430a_100011218248_100020643023 [0,1,0,0,0,1|2,0,0]=4 8519 B15R1.5929 C=Cc1ccc(cc1)NC(=O)NCCC 271570a_100011290941_200000163292 [0,1,0,0,0,1|2,0,0]=4 8520 B15R1.5929 C=Cc1ccc(cc1)NC(=O)NCCF 2430a_100011218248_100000724931 [0,1,0,0,0,1|2,0,0]=4 8521 B15R1.5929 C=Cc1ccc(cc1)NC(=O)NCCO 2430a_100011218248_100000210304 [0,1,0,0,0,1|1,0,0]=3 8522 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)C#N 11a_100020643023_100000748677 [0,1,0,0,0,1|2,0,0]=4 8523 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)C#N 1626a_100020643023_100000748677 [0,1,0,0,0,1|2,0,0]=4 8524 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)C#N 240690a_100020643023_100000748677 [0,1,0,0,0,1|2,0,0]=4 8525 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)C#N 527a_100020643023_100000748677 [0,1,0,0,0,1|2,0,0]=4 8526 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)CC 11a_100020643023_200000759805 [0,1,0,0,0,1|2,0,0]=4 8527 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)CC 1626a_100020643023_200000759805 [0,1,0,0,0,1|2,0,0]=4 8528 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)CC 240690a_100020643023_200000759805 [0,1,0,0,0,1|2,0,0]=4 8529 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)CC 527a_100020643023_200000759805 [0,1,0,0,0,1|2,0,0]=4 8530 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)CO 240690a_100020643023_100011356463 [0,1,0,0,0,1|2,0,0]=4 8531 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)OC 11a_100020643023_100000210706 [0,1,0,0,0,1|2,0,0]=4 8532 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)OC 240690a_100020643023_100000210706 [0,1,0,0,0,1|2,0,0]=4 8533 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)OC 527a_100020643023_100000210706 [0,1,0,0,0,1|2,0,0]=4 8534 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)SC 11a_100020643023_100000756958 [0,1,0,0,0,1|2,0,0]=4 8535 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)SC 1626a_100020643023_100000756958 [0,1,0,0,0,1|2,0,0]=4 8536 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)SC 240690a_100020643023_100000756958 [0,1,0,0,0,1|2,0,0]=4 8537 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)SC 527a_100020643023_100000756958 [0,1,0,0,0,1|2,0,0]=4 8538 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)SC 62a_200000152284_200000210301 [0,1,0,0,0,1|2,0,0]=4 8539 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)SC 62a_200000210301_200000152284 [0,1,0,0,0,1|2,0,0]=4 8540 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)S[13CH3] 62a_200000152284_200025704644 [0,1,0,0,0,1|2,0,0]=4 8541 B15R1.5929 CCCNC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_200000152284 [0,1,0,0,0,1|2,0,0]=4 8542 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)C#N 2430a_100000185469_100020643023 [0,1,0,0,0,1|2,0,0]=4 8543 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)CC 2430a_100000211069_100020643023 [0,1,0,0,0,1|2,0,0]=4 8544 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)CO 2430a_100011215238_100020643023 [0,1,0,0,0,1|2,0,0]=4 8545 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)OC 2430a_100000184247_100020643023 [0,1,0,0,0,1|2,0,0]=4 8546 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)SC 2430a_100000212337_100020643023 [0,1,0,0,0,1|2,0,0]=4 8547 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)SC 62a_200000210301_200000163292 [0,1,0,0,0,1|2,0,0]=4 8548 B15R1.5929 CCCNC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_200000163292 [0,1,0,0,0,1|2,0,0]=4 8549 B15R1.5929 CCc1ccc(cc1)CC(=O)CCCO 1458a_200000759805_100011215043 [0,1,0,0,0,1|2,0,0]=4 8550 B15R1.5929 CCc1ccc(cc1)CC(=O)NCCF 11a_100000724931_200000759805 [0,1,0,0,0,1|2,0,0]=4 8551 B15R1.5929 CCc1ccc(cc1)CC(=O)NCCF 1626a_100000724931_200000759805 [0,1,0,0,0,1|2,0,0]=4 8552 B15R1.5929 CCc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_200000759805 [0,1,0,0,0,1|2,0,0]=4 8553 B15R1.5929 CCc1ccc(cc1)CC(=O)NCCF 527a_100000724931_200000759805 [0,1,0,0,0,1|2,0,0]=4 8554 B15R1.5929 CCc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_200000759805 [0,1,0,0,0,1|1,0,0]=3 8555 B15R1.5929 CCc1ccc(cc1)CC(=O)NCCO 527a_100000210304_200000759805 [0,1,0,0,0,1|1,0,0]=3 8556 B15R1.5929 CCc1ccc(cc1)NC(=O)NCCF 2430a_100000211069_100000724931 [0,1,0,0,0,1|2,0,0]=4 8557 B15R1.5929 CCc1ccc(cc1)NC(=O)NCCO 2430a_100000211069_100000210304 [0,1,0,0,0,1|1,0,0]=3 8558 B15R1.5929 COc1ccc(cc1)CC(=O)CCCO 1458a_100000210706_100011215043 [0,1,0,0,0,1|2,0,0]=4 8559 B15R1.5929 COc1ccc(cc1)CC(=O)NCCF 11a_100000724931_100000210706 [0,1,0,0,0,1|2,0,0]=4 8560 B15R1.5929 COc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_100000210706 [0,1,0,0,0,1|2,0,0]=4 8561 B15R1.5929 COc1ccc(cc1)CC(=O)NCCF 527a_100000724931_100000210706 [0,1,0,0,0,1|2,0,0]=4 8562 B15R1.5929 COc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_100000210706 [0,1,0,0,0,1|1,0,0]=3 8563 B15R1.5929 COc1ccc(cc1)CC(=O)NCCO 527a_100000210304_100000210706 [0,1,0,0,0,1|1,0,0]=3 8564 B15R1.5929 COc1ccc(cc1)NC(=O)NCCF 2430a_100000184247_100000724931 [0,1,0,0,0,1|2,0,0]=4 8565 B15R1.5929 COc1ccc(cc1)NC(=O)NCCO 2430a_100000184247_100000210304 [0,1,0,0,0,1|1,0,0]=3 8566 B15R1.5929 COc1ccc(cn1)CC(=O)NCCO 240690a_100000210304_100012001117 [0,1,0,0,0,1|2,0,0]=4 8567 B15R1.5929 COc1ccc(cn1)CC(=O)NCCO 527a_100000210304_100012001117 [0,1,0,0,0,1|2,0,0]=4 8568 B15R1.5929 COc1ccc(nc1)CC(=O)NCCO 240690a_100000210304_100000722272 [0,1,0,0,0,1|2,0,0]=4 8569 B15R1.5929 COc1ccc(nc1)CC(=O)NCCO 527a_100000210304_100000722272 [0,1,0,0,0,1|2,0,0]=4 8570 B15R1.5929 CSc1ccc(cc1)CC(=O)CCCO 1458a_100000756958_100011215043 [0,1,0,0,0,1|2,0,0]=4 8571 B15R1.5929 CSc1ccc(cc1)CC(=O)NCCF 11a_100000724931_100000756958 [0,1,0,0,0,1|2,0,0]=4 8572 B15R1.5929 CSc1ccc(cc1)CC(=O)NCCF 1626a_100000724931_100000756958 [0,1,0,0,0,1|2,0,0]=4 8573 B15R1.5929 CSc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_100000756958 [0,1,0,0,0,1|2,0,0]=4 8574 B15R1.5929 CSc1ccc(cc1)CC(=O)NCCF 527a_100000724931_100000756958 [0,1,0,0,0,1|2,0,0]=4 8575 B15R1.5929 CSc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_100000756958 [0,1,0,0,0,1|1,0,0]=3 8576 B15R1.5929 CSc1ccc(cc1)CC(=O)NCCO 527a_100000210304_100000756958 [0,1,0,0,0,1|1,0,0]=3 8577 B15R1.5929 CSc1ccc(cc1)NC(=O)NCCF 2430a_100000212337_100000724931 [0,1,0,0,0,1|2,0,0]=4 8578 B15R1.5929 CSc1ccc(cc1)NC(=O)NCCO 2430a_100000212337_100000210304 [0,1,0,0,0,1|1,0,0]=3 8579 B15R1.5929 N#Cc1ccc(cc1)CC(=O)CCCO 1458a_100000748677_100011215043 [0,1,0,0,0,1|2,0,0]=4 8580 B15R1.5929 N#Cc1ccc(cc1)CC(=O)NCCF 11a_100000724931_100000748677 [0,1,0,0,0,1|2,0,0]=4 8581 B15R1.5929 N#Cc1ccc(cc1)CC(=O)NCCF 1626a_100000724931_100000748677 [0,1,0,0,0,1|2,0,0]=4 8582 B15R1.5929 N#Cc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_100000748677 [0,1,0,0,0,1|2,0,0]=4 8583 B15R1.5929 N#Cc1ccc(cc1)CC(=O)NCCF 527a_100000724931_100000748677 [0,1,0,0,0,1|2,0,0]=4 8584 B15R1.5929 N#Cc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_100000748677 [0,1,0,0,0,1|1,0,0]=3 8585 B15R1.5929 N#Cc1ccc(cc1)CC(=O)NCCO 527a_100000210304_100000748677 [0,1,0,0,0,1|1,0,0]=3 8586 B15R1.5929 N#Cc1ccc(cc1)NC(=O)NCCF 2430a_100000185469_100000724931 [0,1,0,0,0,1|2,0,0]=4 8587 B15R1.5929 N#Cc1ccc(cc1)NC(=O)NCCO 2430a_100000185469_100000210304 [0,1,0,0,0,1|1,0,0]=3 8588 B15R1.5929 O=C(CCCO)Cc1ccc(cc1)CO 1458a_100011356463_100011215043 [0,1,0,0,0,1|2,0,0]=4 8589 B15R1.5929 O=C(Cc1ccc(cc1)CO)NCCF 240690a_100000724931_100011356463 [0,1,0,0,0,1|2,0,0]=4 8590 B15R1.5929 O=C(Cc1ccc(cc1)CO)NCCO 240690a_100000210304_100011356463 [0,1,0,0,0,1|1,0,0]=3 8591 B15R1.5929 O=C(NCCF)Nc1ccc(cc1)CO 2430a_100011215238_100000724931 [0,1,0,0,0,1|2,0,0]=4 8592 B15R1.5929 O=C(NCCO)Nc1ccc(cc1)CO 2430a_100011215238_100000210304 [0,1,0,0,0,1|1,0,0]=3 8593 B15R1.23 C=CCN(C)CC(=O)c1ccc(cc1)Cl 269982a_100000225617_100000211071 [0,2,0,0,0,0|1,0,1]=4 8594 B15R1.23 CC(CCO)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100009893172 [0,2,0,0,0,0|1,0,1]=4 8595 B15R1.23 CC(CCO)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100009893172 [0,2,0,0,0,0|1,0,1]=4 8596 B15R1.23 CC(N[C@H](C)CCO)c1ccc(cc1)Cl 2230a_100000706166_100000684792 [0,2,0,0,0,0|1,0,1]=4 8597 B15R1.23 CC(N[C@H](C)CCO)c1ccc(cc1)Cl 269862a_100000706166_100000185797 [0,2,0,0,0,0|1,0,1]=4 8598 B15R1.23 CCCC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000747444 [0,2,0,0,0,0|2,0,0]=4 8599 B15R1.23 CCCC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000211992_100000211071 [0,2,0,0,0,0|2,0,0]=4 8600 B15R1.23 CCCC(C)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011216630 [0,2,0,0,0,0|2,0,0]=4 8601 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Br 11a_100000741246_100000185839 [0,2,0,0,0,0|1,1,0]=4 8602 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Br 1626a_100000741246_100000185839 [0,2,0,0,0,0|1,1,0]=4 8603 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Br 240690a_100000741246_100000185839 [0,2,0,0,0,0|1,1,0]=4 8604 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Br 527a_100000741246_100000185839 [0,2,0,0,0,0|1,1,0]=4 8605 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)C 11a_100000741246_100000188618 [0,2,0,0,0,0|2,0,0]=4 8606 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)C 1626a_100000741246_100000188618 [0,2,0,0,0,0|2,0,0]=4 8607 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)C 240690a_100000741246_100000188618 [0,2,0,0,0,0|2,0,0]=4 8608 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)C 527a_100000741246_100000188618 [0,2,0,0,0,0|2,0,0]=4 8609 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Cl 11a_100000741246_100000210187 [0,2,0,0,0,0|1,0,0]=3 8610 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Cl 1626a_100000741246_100000210187 [0,2,0,0,0,0|1,0,0]=3 8611 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Cl 240690a_100000741246_100000210187 [0,2,0,0,0,0|1,0,0]=3 8612 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)Cl 527a_100000741246_100000210187 [0,2,0,0,0,0|1,0,0]=3 8613 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)F 11a_100000741246_100000187176 [0,2,0,0,0,0|1,1,0]=4 8614 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)F 1626a_100000741246_100000187176 [0,2,0,0,0,0|1,1,0]=4 8615 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)F 240690a_100000741246_100000187176 [0,2,0,0,0,0|1,1,0]=4 8616 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)F 527a_100000741246_100000187176 [0,2,0,0,0,0|1,1,0]=4 8617 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)I 11a_100000741246_100000187904 [0,2,0,0,0,0|1,1,0]=4 8618 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)I 1626a_100000741246_100000187904 [0,2,0,0,0,0|1,1,0]=4 8619 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)I 240690a_100000741246_100000187904 [0,2,0,0,0,0|1,1,0]=4 8620 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)I 527a_100000741246_100000187904 [0,2,0,0,0,0|1,1,0]=4 8621 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)O 240690a_100000741246_100000212099 [0,2,0,0,0,0|2,0,0]=4 8622 B15R1.23 CCCC(C)NC(=O)c1ccc(cc1)O 527a_100000741246_100000212099 [0,2,0,0,0,0|2,0,0]=4 8623 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)Br 269982a_100000747261_100000188085 [0,2,0,0,0,0|1,1,0]=4 8624 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)C 2230a_100000747261_100000211441 [0,2,0,0,0,0|2,0,0]=4 8625 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)C 269982a_100000747261_100000211441 [0,2,0,0,0,0|2,0,0]=4 8626 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)Cl 269982a_100000747261_100000211071 [0,2,0,0,0,0|1,0,0]=3 8627 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)F 269982a_100000747261_100000211279 [0,2,0,0,0,0|1,1,0]=4 8628 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)I 269982a_100000747261_100011216261 [0,2,0,0,0,0|1,1,0]=4 8629 B15R1.23 CCCN(C)CC(=O)c1ccc(cc1)O 269982a_100000747261_100009814261 [0,2,0,0,0,0|2,0,0]=4 8630 B15R1.23 CCCN(C)CC(=O)c1ccc(cn1)Cl 269982a_100000747261_100016989621 [0,2,0,0,0,0|2,0,0]=4 8631 B15R1.23 CCCN(C)CC(=O)c1ccc(nc1)Cl 269982a_100000747261_100009864725 [0,2,0,0,0,0|2,0,0]=4 8632 B15R1.23 CN(CCO)CC(=O)c1ccc(cc1)Br 269982a_100000210263_100000188085 [0,2,0,0,0,0|0,1,0]=3 8633 B15R1.23 CN(CCO)CC(=O)c1ccc(cc1)Cl 269982a_100000210263_100000211071 [0,2,0,0,0,0|0,0,0]=2 8634 B15R1.23 CN(CCO)CC(=O)c1ccc(cc1)F 269982a_100000210263_100000211279 [0,2,0,0,0,0|0,1,0]=3 8635 B15R1.23 CN(CCO)CC(=O)c1ccc(cc1)I 269982a_100000210263_100011216261 [0,2,0,0,0,0|0,1,0]=3 8636 B15R1.23 CN(CCO)CC(=O)c1ccc(cc1)O 269982a_100000210263_100009814261 [0,2,0,0,0,0|1,0,0]=3 8637 B15R1.23 CN(CCO)CC(=O)c1ccc(cn1)Cl 269982a_100000210263_100016989621 [0,2,0,0,0,0|1,0,0]=3 8638 B15R1.23 CN(CCO)CC(=O)c1ccc(nc1)Cl 269982a_100000210263_100009864725 [0,2,0,0,0,0|1,0,0]=3 8639 B15R1.23 CN(CCO)CC(O)c1ccc(cc1)Cl 2230a_100000210263_200011996143 [0,2,0,0,0,0|0,0,2]=4 8640 B15R1.23 CNCC(=O)NC(=O)c1ccc(cc1)Cl 7a_106832991635_100000010301 [0,2,0,0,0,0|1,0,1]=4 8641 B15R1.23 COCC(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000210968_100000211071 [0,2,0,0,0,0|1,0,1]=4 8642 B15R1.23 COCC(C)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000765312 [0,2,0,0,0,0|1,0,1]=4 8643 B15R1.23 COCC(C)N[C@H](C)c1ccc(cc1)Cl 270004a_100015205461_100000749346 [0,2,0,0,0,0|1,0,1]=4 8644 B15R1.23 COCC(C)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000765312 [0,2,0,0,0,0|1,0,1]=4 8645 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Br 11a_100000764878_100000185839 [0,2,0,0,0,0|0,1,0]=3 8646 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Br 1626a_100000764878_100000185839 [0,2,0,0,0,0|0,1,0]=3 8647 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Br 240690a_100000764878_100000185839 [0,2,0,0,0,0|0,1,0]=3 8648 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Br 527a_100000764878_100000185839 [0,2,0,0,0,0|0,1,0]=3 8649 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)C 11a_100000764878_100000188618 [0,2,0,0,0,0|1,0,0]=3 8650 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)C 1626a_100000764878_100000188618 [0,2,0,0,0,0|1,0,0]=3 8651 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)C 240690a_100000764878_100000188618 [0,2,0,0,0,0|1,0,0]=3 8652 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)C 527a_100000764878_100000188618 [0,2,0,0,0,0|1,0,0]=3 8653 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Cl 11a_100000764878_100000210187 [0,2,0,0,0,0|0,0,0]=2 8654 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Cl 1626a_100000764878_100000210187 [0,2,0,0,0,0|0,0,0]=2 8655 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Cl 240690a_100000764878_100000210187 [0,2,0,0,0,0|0,0,0]=2 8656 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)Cl 527a_100000764878_100000210187 [0,2,0,0,0,0|0,0,0]=2 8657 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)F 11a_100000764878_100000187176 [0,2,0,0,0,0|0,1,0]=3 8658 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)F 1626a_100000764878_100000187176 [0,2,0,0,0,0|0,1,0]=3 8659 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)F 240690a_100000764878_100000187176 [0,2,0,0,0,0|0,1,0]=3 8660 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)F 527a_100000764878_100000187176 [0,2,0,0,0,0|0,1,0]=3 8661 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)I 11a_100000764878_100000187904 [0,2,0,0,0,0|0,1,0]=3 8662 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)I 1626a_100000764878_100000187904 [0,2,0,0,0,0|0,1,0]=3 8663 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)I 240690a_100000764878_100000187904 [0,2,0,0,0,0|0,1,0]=3 8664 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)I 527a_100000764878_100000187904 [0,2,0,0,0,0|0,1,0]=3 8665 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)O 240690a_100000764878_100000212099 [0,2,0,0,0,0|1,0,0]=3 8666 B15R1.23 COC[C@@H](C)NC(=O)c1ccc(cc1)O 527a_100000764878_100000212099 [0,2,0,0,0,0|1,0,0]=3 8667 B15R1.23 COC[C@@H](C)NC(C)c1ccc(cc1)Cl 2230a_100000764878_100000684792 [0,2,0,0,0,0|1,0,1]=4 8668 B15R1.23 COC[C@@H](C)NC(C)c1ccc(cc1)Cl 269862a_100000764878_100000185797 [0,2,0,0,0,0|1,0,1]=4 8669 B15R1.23 CSCC(=O)NC(=O)c1ccc(cc1)Cl 62a_200000210301_100000010301 [0,2,0,0,0,0|0,1,1]=4 8670 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Br 11a_100016994482_100000185839 [0,2,0,0,0,0|1,1,0]=4 8671 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Br 1626a_100016994482_100000185839 [0,2,0,0,0,0|1,1,0]=4 8672 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Br 240690a_100016994482_100000185839 [0,2,0,0,0,0|1,1,0]=4 8673 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Br 527a_100016994482_100000185839 [0,2,0,0,0,0|1,1,0]=4 8674 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Cl 11a_100016994482_100000210187 [0,2,0,0,0,0|1,0,0]=3 8675 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Cl 1626a_100016994482_100000210187 [0,2,0,0,0,0|1,0,0]=3 8676 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Cl 240690a_100016994482_100000210187 [0,2,0,0,0,0|1,0,0]=3 8677 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)Cl 527a_100016994482_100000210187 [0,2,0,0,0,0|1,0,0]=3 8678 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)F 11a_100016994482_100000187176 [0,2,0,0,0,0|1,1,0]=4 8679 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)F 1626a_100016994482_100000187176 [0,2,0,0,0,0|1,1,0]=4 8680 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)F 240690a_100016994482_100000187176 [0,2,0,0,0,0|1,1,0]=4 8681 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)F 527a_100016994482_100000187176 [0,2,0,0,0,0|1,1,0]=4 8682 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)I 11a_100016994482_100000187904 [0,2,0,0,0,0|1,1,0]=4 8683 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)I 1626a_100016994482_100000187904 [0,2,0,0,0,0|1,1,0]=4 8684 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)I 240690a_100016994482_100000187904 [0,2,0,0,0,0|1,1,0]=4 8685 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)I 527a_100016994482_100000187904 [0,2,0,0,0,0|1,1,0]=4 8686 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)O 240690a_100016994482_100000212099 [0,2,0,0,0,0|2,0,0]=4 8687 B15R1.23 C[C@@H](CC#N)NC(=O)c1ccc(cc1)O 527a_100016994482_100000212099 [0,2,0,0,0,0|2,0,0]=4 8688 B15R1.23 C[C@@H](NC(=O)CCO)c1ccc(cc1)Cl 240690a_100015205461_100011216618 [0,2,0,0,0,0|1,0,1]=4 8689 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)Br 240690a_100000706166_100000185839 [0,2,0,0,0,0|0,1,0]=3 8690 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)Br 527a_100000706166_100000185839 [0,2,0,0,0,0|0,1,0]=3 8691 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)Cl 240690a_100000706166_100000210187 [0,2,0,0,0,0|0,0,0]=2 8692 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)Cl 527a_100000706166_100000210187 [0,2,0,0,0,0|0,0,0]=2 8693 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)F 240690a_100000706166_100000187176 [0,2,0,0,0,0|0,1,0]=3 8694 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)F 527a_100000706166_100000187176 [0,2,0,0,0,0|0,1,0]=3 8695 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)I 240690a_100000706166_100000187904 [0,2,0,0,0,0|0,1,0]=3 8696 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)I 527a_100000706166_100000187904 [0,2,0,0,0,0|0,1,0]=3 8697 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)O 240690a_100000706166_100000212099 [0,2,0,0,0,0|1,0,0]=3 8698 B15R1.23 C[C@H](CCO)NC(=O)c1ccc(cc1)O 527a_100000706166_100000212099 [0,2,0,0,0,0|1,0,0]=3 8699 B15R1.23 Cc1ccc(cc1)C(=O)CC(=O)CCO 1458a_100011216618_100000211441 [0,2,0,0,0,0|2,0,0]=4 8700 B15R1.23 Cc1ccc(cc1)C(=O)CN(C)CCO 2230a_100000210263_100000211441 [0,2,0,0,0,0|1,0,0]=3 8701 B15R1.23 Cc1ccc(cc1)C(=O)CN(C)CCO 269982a_100000210263_100000211441 [0,2,0,0,0,0|1,0,0]=3 8702 B15R1.23 Cc1ccc(cc1)C(=O)N[C@@H](C)CC#N 11a_100016994482_100000188618 [0,2,0,0,0,0|2,0,0]=4 8703 B15R1.23 Cc1ccc(cc1)C(=O)N[C@@H](C)CC#N 1626a_100016994482_100000188618 [0,2,0,0,0,0|2,0,0]=4 8704 B15R1.23 Cc1ccc(cc1)C(=O)N[C@@H](C)CC#N 240690a_100016994482_100000188618 [0,2,0,0,0,0|2,0,0]=4 8705 B15R1.23 Cc1ccc(cc1)C(=O)N[C@@H](C)CC#N 527a_100016994482_100000188618 [0,2,0,0,0,0|2,0,0]=4 8706 B15R1.23 Cc1ccc(cc1)C(=O)N[C@H](C)CCO 240690a_100000706166_100000188618 [0,2,0,0,0,0|1,0,0]=3 8707 B15R1.23 Cc1ccc(cc1)C(=O)N[C@H](C)CCO 527a_100000706166_100000188618 [0,2,0,0,0,0|1,0,0]=3 8708 B15R1.23 Cc1ccc(cn1)C(=O)CN(C)CCO 269982a_100000210263_100012027583 [0,2,0,0,0,0|2,0,0]=4 8709 B15R1.23 O=C(CC(=O)c1ccc(cc1)Cl)NCO 1458a_100000210187_100000185155 [0,2,0,0,0,0|1,0,1]=4 8710 B15R1.23 O=C(CCO)CC(=O)c1ccc(cc1)Br 1458a_100011216618_100000188085 [0,2,0,0,0,0|1,1,0]=4 8711 B15R1.23 O=C(CCO)CC(=O)c1ccc(cc1)Cl 1458a_100011216618_100000211071 [0,2,0,0,0,0|1,0,0]=3 8712 B15R1.23 O=C(CCO)CC(=O)c1ccc(cc1)F 1458a_100011216618_100000211279 [0,2,0,0,0,0|1,1,0]=4 8713 B15R1.23 O=C(CCO)CC(=O)c1ccc(cc1)I 1458a_100011216618_100011216261 [0,2,0,0,0,0|1,1,0]=4 8714 B15R1.23 O=C(CCO)CC(=O)c1ccc(cc1)O 1458a_100011216618_100009814261 [0,2,0,0,0,0|2,0,0]=4 8715 B15R1.23 O=C(CCO)CC(=O)c1ccc(cn1)Cl 1458a_100011216618_100016989621 [0,2,0,0,0,0|2,0,0]=4 8716 B15R1.23 O=C(CCO)CC(=O)c1ccc(nc1)Cl 1458a_100011216618_100009864725 [0,2,0,0,0,0|2,0,0]=4 8717 B15R1.23 [13CH3]SCC(=O)NC(=O)c1ccc(cc1)Cl 62a_200025704644_100000010301 [0,2,0,0,0,0|0,1,1]=4 8718 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)Br 240690a_100016989147_100000185839 [0,2,0,0,0,0|0,1,0]=3 8719 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)Br 527a_100016989147_100000185839 [0,2,0,0,0,0|0,1,0]=3 8720 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)C 240690a_100016989147_100000188618 [0,2,0,0,0,0|1,0,0]=3 8721 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)C 527a_100016989147_100000188618 [0,2,0,0,0,0|1,0,0]=3 8722 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)Cl 240690a_100016989147_100000210187 [0,2,0,0,0,0|0,0,0]=2 8723 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)Cl 527a_100016989147_100000210187 [0,2,0,0,0,0|0,0,0]=2 8724 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)F 240690a_100016989147_100000187176 [0,2,0,0,0,0|0,1,0]=3 8725 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)F 527a_100016989147_100000187176 [0,2,0,0,0,0|0,1,0]=3 8726 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)I 240690a_100016989147_100000187904 [0,2,0,0,0,0|0,1,0]=3 8727 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)I 527a_100016989147_100000187904 [0,2,0,0,0,0|0,1,0]=3 8728 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)O 240690a_100016989147_100000212099 [0,2,0,0,0,0|1,0,0]=3 8729 B15R1.46 C=C[C@@H](CO)NC(=O)c1ccc(cc1)O 527a_100016989147_100000212099 [0,2,0,0,0,0|1,0,0]=3 8730 B15R1.46 C=C[C@@H](CO)NC(C)c1ccc(cc1)Cl 2230a_100016989147_100000684792 [0,2,0,0,0,0|1,0,1]=4 8731 B15R1.46 C=C[C@@H](CO)NC(C)c1ccc(cc1)Cl 269862a_100016989147_100000185797 [0,2,0,0,0,0|1,0,1]=4 8732 B15R1.46 CC(NC(CO)CO)c1ccc(cc1)Cl 2230a_100000759517_100000684792 [0,2,0,0,0,0|1,0,1]=4 8733 B15R1.46 CCC(CC)CC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215472 [0,2,0,0,0,0|2,0,0]=4 8734 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Br 11a_100000199018_100000185839 [0,2,0,0,0,0|1,1,0]=4 8735 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Br 1626a_100000199018_100000185839 [0,2,0,0,0,0|1,1,0]=4 8736 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Br 240690a_100000199018_100000185839 [0,2,0,0,0,0|1,1,0]=4 8737 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Br 527a_100000199018_100000185839 [0,2,0,0,0,0|1,1,0]=4 8738 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)C 11a_100000199018_100000188618 [0,2,0,0,0,0|2,0,0]=4 8739 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)C 1626a_100000199018_100000188618 [0,2,0,0,0,0|2,0,0]=4 8740 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)C 240690a_100000199018_100000188618 [0,2,0,0,0,0|2,0,0]=4 8741 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)C 527a_100000199018_100000188618 [0,2,0,0,0,0|2,0,0]=4 8742 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Cl 11a_100000199018_100000210187 [0,2,0,0,0,0|1,0,0]=3 8743 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Cl 1626a_100000199018_100000210187 [0,2,0,0,0,0|1,0,0]=3 8744 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Cl 240690a_100000199018_100000210187 [0,2,0,0,0,0|1,0,0]=3 8745 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)Cl 527a_100000199018_100000210187 [0,2,0,0,0,0|1,0,0]=3 8746 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)F 11a_100000199018_100000187176 [0,2,0,0,0,0|1,1,0]=4 8747 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)F 1626a_100000199018_100000187176 [0,2,0,0,0,0|1,1,0]=4 8748 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)F 240690a_100000199018_100000187176 [0,2,0,0,0,0|1,1,0]=4 8749 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)F 527a_100000199018_100000187176 [0,2,0,0,0,0|1,1,0]=4 8750 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)I 11a_100000199018_100000187904 [0,2,0,0,0,0|1,1,0]=4 8751 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)I 1626a_100000199018_100000187904 [0,2,0,0,0,0|1,1,0]=4 8752 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)I 240690a_100000199018_100000187904 [0,2,0,0,0,0|1,1,0]=4 8753 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)I 527a_100000199018_100000187904 [0,2,0,0,0,0|1,1,0]=4 8754 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)O 240690a_100000199018_100000212099 [0,2,0,0,0,0|2,0,0]=4 8755 B15R1.46 CCC(CC)NC(=O)c1ccc(cc1)O 527a_100000199018_100000212099 [0,2,0,0,0,0|2,0,0]=4 8756 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)Br 240690a_100000709445_100000185839 [0,2,0,0,0,0|0,1,0]=3 8757 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)Br 527a_100000709445_100000185839 [0,2,0,0,0,0|0,1,0]=3 8758 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)C 240690a_100000709445_100000188618 [0,2,0,0,0,0|1,0,0]=3 8759 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)C 527a_100000709445_100000188618 [0,2,0,0,0,0|1,0,0]=3 8760 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)Cl 240690a_100000709445_100000210187 [0,2,0,0,0,0|0,0,0]=2 8761 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)Cl 527a_100000709445_100000210187 [0,2,0,0,0,0|0,0,0]=2 8762 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)F 240690a_100000709445_100000187176 [0,2,0,0,0,0|0,1,0]=3 8763 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)F 527a_100000709445_100000187176 [0,2,0,0,0,0|0,1,0]=3 8764 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)I 240690a_100000709445_100000187904 [0,2,0,0,0,0|0,1,0]=3 8765 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)I 527a_100000709445_100000187904 [0,2,0,0,0,0|0,1,0]=3 8766 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)O 240690a_100000709445_100000212099 [0,2,0,0,0,0|1,0,0]=3 8767 B15R1.46 CC[C@@H](CO)NC(=O)c1ccc(cc1)O 527a_100000709445_100000212099 [0,2,0,0,0,0|1,0,0]=3 8768 B15R1.46 CC[C@@H](CO)NC(C)c1ccc(cc1)Cl 2230a_100000709445_100000684792 [0,2,0,0,0,0|1,0,1]=4 8769 B15R1.46 CC[C@@H](CO)NC(C)c1ccc(cc1)Cl 269862a_100000709445_100000185797 [0,2,0,0,0,0|1,0,1]=4 8770 B15R1.46 Cc1ccc(cc1)C(=O)NC(CO)CO 240690a_100000759517_100000188618 [0,2,0,0,0,0|1,0,0]=3 8771 B15R1.46 Cc1ccc(cc1)C(=O)NC(CO)CO 527a_100000759517_100000188618 [0,2,0,0,0,0|1,0,0]=3 8772 B15R1.46 N#CC(C#N)NC(=O)c1ccc(cc1)Cl 11a_200000072138_100000210187 [0,2,0,0,0,0|1,0,1]=4 8773 B15R1.46 N#CC(C#N)NC(=O)c1ccc(cc1)Cl 1626a_200000072138_100000210187 [0,2,0,0,0,0|1,0,1]=4 8774 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)Br 240690a_100000759517_100000185839 [0,2,0,0,0,0|0,1,0]=3 8775 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)Br 527a_100000759517_100000185839 [0,2,0,0,0,0|0,1,0]=3 8776 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)Cl 240690a_100000759517_100000210187 [0,2,0,0,0,0|0,0,0]=2 8777 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)Cl 527a_100000759517_100000210187 [0,2,0,0,0,0|0,0,0]=2 8778 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)F 240690a_100000759517_100000187176 [0,2,0,0,0,0|0,1,0]=3 8779 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)F 527a_100000759517_100000187176 [0,2,0,0,0,0|0,1,0]=3 8780 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)I 240690a_100000759517_100000187904 [0,2,0,0,0,0|0,1,0]=3 8781 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)I 527a_100000759517_100000187904 [0,2,0,0,0,0|0,1,0]=3 8782 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)O 240690a_100000759517_100000212099 [0,2,0,0,0,0|1,0,0]=3 8783 B15R1.46 O=C(NC(CO)CO)c1ccc(cc1)O 527a_100000759517_100000212099 [0,2,0,0,0,0|1,0,0]=3 8784 B15R1.75 CC(C#N)N(C)C(=O)c1ccc(cc1)Cl 11a_100000745055_100000210187 [0,2,0,0,0,0|1,0,1]=4 8785 B15R1.75 CC(C#N)N(C)C(=O)c1ccc(cc1)Cl 1626a_100000745055_100000210187 [0,2,0,0,0,0|1,0,1]=4 8786 B15R1.75 CC(C#N)N(C)C(=O)c1ccc(cc1)Cl 527a_100000745055_100000210187 [0,2,0,0,0,0|1,0,1]=4 8787 B15R1.75 CC(C(=O)CO)C(=O)c1ccc(cc1)Cl 1458a_100000210174_100000183210 [0,2,0,0,0,0|1,0,1]=4 8788 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)Br 240690a_100000693034_100000185839 [0,2,0,0,0,0|0,1,0]=3 8789 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)Br 527a_100000693034_100000185839 [0,2,0,0,0,0|0,1,0]=3 8790 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)Cl 240690a_100000693034_100000210187 [0,2,0,0,0,0|0,0,0]=2 8791 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)Cl 527a_100000693034_100000210187 [0,2,0,0,0,0|0,0,0]=2 8792 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)F 240690a_100000693034_100000187176 [0,2,0,0,0,0|0,1,0]=3 8793 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)F 527a_100000693034_100000187176 [0,2,0,0,0,0|0,1,0]=3 8794 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)I 240690a_100000693034_100000187904 [0,2,0,0,0,0|0,1,0]=3 8795 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)I 527a_100000693034_100000187904 [0,2,0,0,0,0|0,1,0]=3 8796 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)O 240690a_100000693034_100000212099 [0,2,0,0,0,0|1,0,0]=3 8797 B15R1.75 CC(CO)N(C)C(=O)c1ccc(cc1)O 527a_100000693034_100000212099 [0,2,0,0,0,0|1,0,0]=3 8798 B15R1.75 CC(CO)N(C)C(C)c1ccc(cc1)Cl 2230a_100000231102_100012180447 [0,2,0,0,0,0|1,0,1]=4 8799 B15R1.75 CC(CO)N(C)C(C)c1ccc(cc1)Cl 2230a_100000693034_100000684792 [0,2,0,0,0,0|1,0,1]=4 8800 B15R1.75 CC(CO)N(C)C(C)c1ccc(cc1)Cl 269982a_100000693034_100000684792 [0,2,0,0,0,0|1,0,1]=4 8801 B15R1.75 CC(c1ccc(cc1)Cl)N(C)[C@H](C)CO 269982a_100000231102_100016084084 [0,2,0,0,0,0|1,0,1]=4 8802 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Br 11a_100000741768_100000185839 [0,2,0,0,0,0|1,1,0]=4 8803 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Br 1626a_100000741768_100000185839 [0,2,0,0,0,0|1,1,0]=4 8804 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Br 240690a_100000741768_100000185839 [0,2,0,0,0,0|1,1,0]=4 8805 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Br 527a_100000741768_100000185839 [0,2,0,0,0,0|1,1,0]=4 8806 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)C 11a_100000741768_100000188618 [0,2,0,0,0,0|2,0,0]=4 8807 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)C 1626a_100000741768_100000188618 [0,2,0,0,0,0|2,0,0]=4 8808 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)C 240690a_100000741768_100000188618 [0,2,0,0,0,0|2,0,0]=4 8809 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)C 527a_100000741768_100000188618 [0,2,0,0,0,0|2,0,0]=4 8810 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Cl 11a_100000741768_100000210187 [0,2,0,0,0,0|1,0,0]=3 8811 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Cl 1626a_100000741768_100000210187 [0,2,0,0,0,0|1,0,0]=3 8812 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Cl 240690a_100000741768_100000210187 [0,2,0,0,0,0|1,0,0]=3 8813 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)Cl 527a_100000741768_100000210187 [0,2,0,0,0,0|1,0,0]=3 8814 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)F 11a_100000741768_100000187176 [0,2,0,0,0,0|1,1,0]=4 8815 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)F 1626a_100000741768_100000187176 [0,2,0,0,0,0|1,1,0]=4 8816 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)F 240690a_100000741768_100000187176 [0,2,0,0,0,0|1,1,0]=4 8817 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)F 527a_100000741768_100000187176 [0,2,0,0,0,0|1,1,0]=4 8818 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)I 11a_100000741768_100000187904 [0,2,0,0,0,0|1,1,0]=4 8819 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)I 1626a_100000741768_100000187904 [0,2,0,0,0,0|1,1,0]=4 8820 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)I 240690a_100000741768_100000187904 [0,2,0,0,0,0|1,1,0]=4 8821 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)I 527a_100000741768_100000187904 [0,2,0,0,0,0|1,1,0]=4 8822 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)O 240690a_100000741768_100000212099 [0,2,0,0,0,0|2,0,0]=4 8823 B15R1.75 CCC(C)N(C)C(=O)c1ccc(cc1)O 527a_100000741768_100000212099 [0,2,0,0,0,0|2,0,0]=4 8824 B15R1.75 Cc1ccc(cc1)C(=O)N(C)C(C)CO 240690a_100000693034_100000188618 [0,2,0,0,0,0|1,0,0]=3 8825 B15R1.75 Cc1ccc(cc1)C(=O)N(C)C(C)CO 527a_100000693034_100000188618 [0,2,0,0,0,0|1,0,0]=3 8826 B15R1.211 C#Cc1ccc(cc1)C(=O)C[C@@H](C)CO 1458a_100011217615_100000059175 [0,2,0,0,0,0|2,0,0]=4 8827 B15R1.211 C#Cc1ccc(cc1)C(=O)NC(C)CC 11a_100000209981_100011217615 [0,2,0,0,0,0|2,0,0]=4 8828 B15R1.211 C#Cc1ccc(cc1)C(=O)NC(C)CC 1626a_100000209981_100011217615 [0,2,0,0,0,0|2,0,0]=4 8829 B15R1.211 C#Cc1ccc(cc1)C(=O)NC(C)CC 240690a_100000209981_100011217615 [0,2,0,0,0,0|2,0,0]=4 8830 B15R1.211 C#Cc1ccc(cc1)C(=O)NC(C)CC 527a_100000209981_100011217615 [0,2,0,0,0,0|2,0,0]=4 8831 B15R1.211 C#Cc1ccc(cc1)C(=O)N[C@H](C)CF 11a_100102880703_100011217615 [0,2,0,0,0,0|2,0,0]=4 8832 B15R1.211 C#Cc1ccc(cc1)C(=O)N[C@H](C)CF 1626a_100102880703_100011217615 [0,2,0,0,0,0|2,0,0]=4 8833 B15R1.211 C#Cc1ccc(cc1)C(=O)N[C@H](C)CF 240690a_100102880703_100011217615 [0,2,0,0,0,0|2,0,0]=4 8834 B15R1.211 C#Cc1ccc(cc1)C(=O)N[C@H](C)CF 527a_100102880703_100011217615 [0,2,0,0,0,0|2,0,0]=4 8835 B15R1.211 C#Cc1ccc(cc1)C(=O)N[C@H](C)CO 240690a_100000737577_100011217615 [0,2,0,0,0,0|1,0,0]=3 8836 B15R1.211 C#Cc1ccc(cc1)C(=O)N[C@H](C)CO 527a_100000737577_100011217615 [0,2,0,0,0,0|1,0,0]=3 8837 B15R1.211 C=Cc1ccc(cc1)C(=O)C[C@@H](C)CO 1458a_100000687532_100000059175 [0,2,0,0,0,0|2,0,0]=4 8838 B15R1.211 C=Cc1ccc(cc1)C(=O)NC(C)CC 11a_100000209981_100000687532 [0,2,0,0,0,0|2,0,0]=4 8839 B15R1.211 C=Cc1ccc(cc1)C(=O)NC(C)CC 1626a_100000209981_100000687532 [0,2,0,0,0,0|2,0,0]=4 8840 B15R1.211 C=Cc1ccc(cc1)C(=O)NC(C)CC 240690a_100000209981_100000687532 [0,2,0,0,0,0|2,0,0]=4 8841 B15R1.211 C=Cc1ccc(cc1)C(=O)NC(C)CC 527a_100000209981_100000687532 [0,2,0,0,0,0|2,0,0]=4 8842 B15R1.211 C=Cc1ccc(cc1)C(=O)N[C@H](C)CF 11a_100102880703_100000687532 [0,2,0,0,0,0|2,0,0]=4 8843 B15R1.211 C=Cc1ccc(cc1)C(=O)N[C@H](C)CF 1626a_100102880703_100000687532 [0,2,0,0,0,0|2,0,0]=4 8844 B15R1.211 C=Cc1ccc(cc1)C(=O)N[C@H](C)CF 240690a_100102880703_100000687532 [0,2,0,0,0,0|2,0,0]=4 8845 B15R1.211 C=Cc1ccc(cc1)C(=O)N[C@H](C)CF 527a_100102880703_100000687532 [0,2,0,0,0,0|2,0,0]=4 8846 B15R1.211 C=Cc1ccc(cc1)C(=O)N[C@H](C)CO 240690a_100000737577_100000687532 [0,2,0,0,0,0|1,0,0]=3 8847 B15R1.211 C=Cc1ccc(cc1)C(=O)N[C@H](C)CO 527a_100000737577_100000687532 [0,2,0,0,0,0|1,0,0]=3 8848 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)C#N 11a_100000209981_100000210717 [0,2,0,0,0,0|2,0,0]=4 8849 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)C#N 1626a_100000209981_100000210717 [0,2,0,0,0,0|2,0,0]=4 8850 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)C#N 240690a_100000209981_100000210717 [0,2,0,0,0,0|2,0,0]=4 8851 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)C#N 527a_100000209981_100000210717 [0,2,0,0,0,0|2,0,0]=4 8852 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)CO 1626a_100000209981_100000183892 [0,2,0,0,0,0|2,0,0]=4 8853 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)CO 240690a_100000209981_100000183892 [0,2,0,0,0,0|2,0,0]=4 8854 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)OC 11a_100000209981_100000184203 [0,2,0,0,0,0|2,0,0]=4 8855 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)OC 1626a_100000209981_100000184203 [0,2,0,0,0,0|2,0,0]=4 8856 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)OC 240690a_100000209981_100000184203 [0,2,0,0,0,0|2,0,0]=4 8857 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)OC 527a_100000209981_100000184203 [0,2,0,0,0,0|2,0,0]=4 8858 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)SC 11a_100000209981_100000189692 [0,2,0,0,0,0|2,0,0]=4 8859 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)SC 1626a_100000209981_100000189692 [0,2,0,0,0,0|2,0,0]=4 8860 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)SC 240690a_100000209981_100000189692 [0,2,0,0,0,0|2,0,0]=4 8861 B15R1.211 CCC(C)NC(=O)c1ccc(cc1)SC 527a_100000209981_100000189692 [0,2,0,0,0,0|2,0,0]=4 8862 B15R1.211 CCc1ccc(cc1)C(=O)C[C@@H](C)CO 1458a_100000211226_100000059175 [0,2,0,0,0,0|2,0,0]=4 8863 B15R1.211 CCc1ccc(cc1)C(=O)NC(C)CC 11a_100000209981_100000211226 [0,2,0,0,0,0|2,0,0]=4 8864 B15R1.211 CCc1ccc(cc1)C(=O)NC(C)CC 1626a_100000209981_100000211226 [0,2,0,0,0,0|2,0,0]=4 8865 B15R1.211 CCc1ccc(cc1)C(=O)NC(C)CC 240690a_100000209981_100000211226 [0,2,0,0,0,0|2,0,0]=4 8866 B15R1.211 CCc1ccc(cc1)C(=O)NC(C)CC 527a_100000209981_100000211226 [0,2,0,0,0,0|2,0,0]=4 8867 B15R1.211 CCc1ccc(cc1)C(=O)N[C@H](C)CF 11a_100102880703_100000211226 [0,2,0,0,0,0|2,0,0]=4 8868 B15R1.211 CCc1ccc(cc1)C(=O)N[C@H](C)CF 1626a_100102880703_100000211226 [0,2,0,0,0,0|2,0,0]=4 8869 B15R1.211 CCc1ccc(cc1)C(=O)N[C@H](C)CF 240690a_100102880703_100000211226 [0,2,0,0,0,0|2,0,0]=4 8870 B15R1.211 CCc1ccc(cc1)C(=O)N[C@H](C)CF 527a_100102880703_100000211226 [0,2,0,0,0,0|2,0,0]=4 8871 B15R1.211 CCc1ccc(cc1)C(=O)N[C@H](C)CO 240690a_100000737577_100000211226 [0,2,0,0,0,0|1,0,0]=3 8872 B15R1.211 CCc1ccc(cc1)C(=O)N[C@H](C)CO 527a_100000737577_100000211226 [0,2,0,0,0,0|1,0,0]=3 8873 B15R1.211 COc1ccc(cc1)C(=O)C[C@@H](C)CO 1458a_100000184203_100000059175 [0,2,0,0,0,0|2,0,0]=4 8874 B15R1.211 COc1ccc(cc1)C(=O)N[C@H](C)CF 11a_100102880703_100000184203 [0,2,0,0,0,0|2,0,0]=4 8875 B15R1.211 COc1ccc(cc1)C(=O)N[C@H](C)CF 1626a_100102880703_100000184203 [0,2,0,0,0,0|2,0,0]=4 8876 B15R1.211 COc1ccc(cc1)C(=O)N[C@H](C)CF 240690a_100102880703_100000184203 [0,2,0,0,0,0|2,0,0]=4 8877 B15R1.211 COc1ccc(cc1)C(=O)N[C@H](C)CF 527a_100102880703_100000184203 [0,2,0,0,0,0|2,0,0]=4 8878 B15R1.211 COc1ccc(cc1)C(=O)N[C@H](C)CO 240690a_100000737577_100000184203 [0,2,0,0,0,0|1,0,0]=3 8879 B15R1.211 COc1ccc(cc1)C(=O)N[C@H](C)CO 527a_100000737577_100000184203 [0,2,0,0,0,0|1,0,0]=3 8880 B15R1.211 CSc1ccc(cc1)C(=O)C[C@@H](C)CO 1458a_100000189692_100000059175 [0,2,0,0,0,0|2,0,0]=4 8881 B15R1.211 CSc1ccc(cc1)C(=O)N[C@H](C)CF 11a_100102880703_100000189692 [0,2,0,0,0,0|2,0,0]=4 8882 B15R1.211 CSc1ccc(cc1)C(=O)N[C@H](C)CF 1626a_100102880703_100000189692 [0,2,0,0,0,0|2,0,0]=4 8883 B15R1.211 CSc1ccc(cc1)C(=O)N[C@H](C)CF 240690a_100102880703_100000189692 [0,2,0,0,0,0|2,0,0]=4 8884 B15R1.211 CSc1ccc(cc1)C(=O)N[C@H](C)CF 527a_100102880703_100000189692 [0,2,0,0,0,0|2,0,0]=4 8885 B15R1.211 CSc1ccc(cc1)C(=O)N[C@H](C)CO 240690a_100000737577_100000189692 [0,2,0,0,0,0|1,0,0]=3 8886 B15R1.211 CSc1ccc(cc1)C(=O)N[C@H](C)CO 527a_100000737577_100000189692 [0,2,0,0,0,0|1,0,0]=3 8887 B15R1.211 C[C@@H](CO)CC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000059175 [0,2,0,0,0,0|2,0,0]=4 8888 B15R1.211 C[C@@H](CO)CC(=O)c1ccc(cc1)CO 1458a_100000183892_100000059175 [0,2,0,0,0,0|2,0,0]=4 8889 B15R1.211 C[C@H](CF)NC(=O)c1ccc(cc1)C#N 11a_100102880703_100000210717 [0,2,0,0,0,0|2,0,0]=4 8890 B15R1.211 C[C@H](CF)NC(=O)c1ccc(cc1)C#N 1626a_100102880703_100000210717 [0,2,0,0,0,0|2,0,0]=4 8891 B15R1.211 C[C@H](CF)NC(=O)c1ccc(cc1)C#N 240690a_100102880703_100000210717 [0,2,0,0,0,0|2,0,0]=4 8892 B15R1.211 C[C@H](CF)NC(=O)c1ccc(cc1)C#N 527a_100102880703_100000210717 [0,2,0,0,0,0|2,0,0]=4 8893 B15R1.211 C[C@H](CF)NC(=O)c1ccc(cc1)CO 1626a_100102880703_100000183892 [0,2,0,0,0,0|2,0,0]=4 8894 B15R1.211 C[C@H](CF)NC(=O)c1ccc(cc1)CO 240690a_100102880703_100000183892 [0,2,0,0,0,0|2,0,0]=4 8895 B15R1.211 C[C@H](CO)NC(=O)c1ccc(cc1)C#N 240690a_100000737577_100000210717 [0,2,0,0,0,0|1,0,0]=3 8896 B15R1.211 C[C@H](CO)NC(=O)c1ccc(cc1)C#N 527a_100000737577_100000210717 [0,2,0,0,0,0|1,0,0]=3 8897 B15R1.211 C[C@H](CO)NC(=O)c1ccc(cc1)CO 240690a_100000737577_100000183892 [0,2,0,0,0,0|1,0,0]=3 8898 B15R1.299 C#CC(C)(C)NC(=O)c1ccc(cc1)Cl 11a_100000054563_100000210187 [0,2,0,0,0,0|1,0,1]=4 8899 B15R1.299 C#CC(C)(C)NC(=O)c1ccc(cc1)Cl 1626a_100000054563_100000210187 [0,2,0,0,0,0|1,0,1]=4 8900 B15R1.299 C#CC(C)(C)NC(=O)c1ccc(cc1)Cl 240690a_100000054563_100000210187 [0,2,0,0,0,0|1,0,1]=4 8901 B15R1.299 CC(C)(C#N)NC(=O)c1ccc(cc1)Cl 11a_100000761509_100000210187 [0,2,0,0,0,0|1,0,1]=4 8902 B15R1.299 CC(C)(C#N)NC(=O)c1ccc(cc1)Cl 1626a_100000761509_100000210187 [0,2,0,0,0,0|1,0,1]=4 8903 B15R1.299 CC(C)(C#N)NC(=O)c1ccc(cc1)Cl 527a_100000761509_100000210187 [0,2,0,0,0,0|1,0,1]=4 8904 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)Br 240690a_100000210608_100000185839 [0,2,0,0,0,0|0,1,0]=3 8905 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)Br 527a_100020618417_100000185839 [0,2,0,0,0,0|0,1,0]=3 8906 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)Cl 240690a_100000210608_100000210187 [0,2,0,0,0,0|0,0,0]=2 8907 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)Cl 527a_100020618417_100000210187 [0,2,0,0,0,0|0,0,0]=2 8908 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)F 240690a_100000210608_100000187176 [0,2,0,0,0,0|0,1,0]=3 8909 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)F 527a_100020618417_100000187176 [0,2,0,0,0,0|0,1,0]=3 8910 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)I 240690a_100000210608_100000187904 [0,2,0,0,0,0|0,1,0]=3 8911 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)I 527a_100020618417_100000187904 [0,2,0,0,0,0|0,1,0]=3 8912 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)O 240690a_100000210608_100000212099 [0,2,0,0,0,0|1,0,0]=3 8913 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)O 527a_100020618417_100000212099 [0,2,0,0,0,0|1,0,0]=3 8914 B15R1.299 CC(NC(C)(C)CO)c1ccc(cc1)Cl 2230a_100000210608_100000684792 [0,2,0,0,0,0|1,0,1]=4 8915 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Br 11a_100000211385_100000185839 [0,2,0,0,0,0|1,1,0]=4 8916 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Br 1626a_100000211385_100000185839 [0,2,0,0,0,0|1,1,0]=4 8917 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Br 240690a_100000211385_100000185839 [0,2,0,0,0,0|1,1,0]=4 8918 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Br 527a_100000211385_100000185839 [0,2,0,0,0,0|1,1,0]=4 8919 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)C 11a_100000211385_100000188618 [0,2,0,0,0,0|2,0,0]=4 8920 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)C 1626a_100000211385_100000188618 [0,2,0,0,0,0|2,0,0]=4 8921 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)C 240690a_100000211385_100000188618 [0,2,0,0,0,0|2,0,0]=4 8922 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)C 527a_100000211385_100000188618 [0,2,0,0,0,0|2,0,0]=4 8923 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Cl 11a_100000211385_100000210187 [0,2,0,0,0,0|1,0,0]=3 8924 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Cl 1626a_100000211385_100000210187 [0,2,0,0,0,0|1,0,0]=3 8925 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Cl 240690a_100000211385_100000210187 [0,2,0,0,0,0|1,0,0]=3 8926 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)Cl 527a_100000211385_100000210187 [0,2,0,0,0,0|1,0,0]=3 8927 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)F 11a_100000211385_100000187176 [0,2,0,0,0,0|1,1,0]=4 8928 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)F 1626a_100000211385_100000187176 [0,2,0,0,0,0|1,1,0]=4 8929 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)F 240690a_100000211385_100000187176 [0,2,0,0,0,0|1,1,0]=4 8930 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)F 527a_100000211385_100000187176 [0,2,0,0,0,0|1,1,0]=4 8931 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)I 11a_100000211385_100000187904 [0,2,0,0,0,0|1,1,0]=4 8932 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)I 1626a_100000211385_100000187904 [0,2,0,0,0,0|1,1,0]=4 8933 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)I 240690a_100000211385_100000187904 [0,2,0,0,0,0|1,1,0]=4 8934 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)I 527a_100000211385_100000187904 [0,2,0,0,0,0|1,1,0]=4 8935 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)O 240690a_100000211385_100000212099 [0,2,0,0,0,0|2,0,0]=4 8936 B15R1.299 CCC(C)(C)NC(=O)c1ccc(cc1)O 527a_100000211385_100000212099 [0,2,0,0,0,0|2,0,0]=4 8937 B15R1.299 CCS(=O)(=O)NC(=O)c1ccc(cc1)Cl 2740a_100000171174_100000210187 [0,2,0,0,0,0|2,0,0]=4 8938 B15R1.299 Cc1ccc(cc1)C(=O)NC(C)(C)CO 240690a_100000210608_100000188618 [0,2,0,0,0,0|1,0,0]=3 8939 B15R1.299 Cc1ccc(cc1)C(=O)NC(C)(C)CO 527a_100020618417_100000188618 [0,2,0,0,0,0|1,0,0]=3 8940 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Br)Cl 11a_100000707721_100000691181 [0,2,0,0,0,0|1,0,1]=4 8941 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Br)Cl 1626a_100000707721_100000691181 [0,2,0,0,0,0|1,0,1]=4 8942 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Br)Cl 240690a_100000707721_100000691181 [0,2,0,0,0,0|1,0,1]=4 8943 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Br)Cl 527a_100000707721_100000691181 [0,2,0,0,0,0|1,0,1]=4 8944 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)C)Cl 11a_100000707721_100000686306 [0,2,0,0,0,0|1,0,1]=4 8945 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)C)Cl 1626a_100000707721_100000686306 [0,2,0,0,0,0|1,0,1]=4 8946 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)C)Cl 240690a_100000707721_100000686306 [0,2,0,0,0,0|1,0,1]=4 8947 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)C)Cl 527a_100000707721_100000686306 [0,2,0,0,0,0|1,0,1]=4 8948 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Cl)Cl 11a_100000707721_100000210401 [0,2,0,0,0,0|1,0,1]=4 8949 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000707721_100000210401 [0,2,0,0,0,0|1,0,1]=4 8950 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000707721_100000210401 [0,2,0,0,0,0|1,0,1]=4 8951 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)Cl)Cl 527a_100000707721_100000210401 [0,2,0,0,0,0|1,0,1]=4 8952 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)F)Cl 11a_100000707721_100000743183 [0,2,0,0,0,0|1,0,1]=4 8953 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)F)Cl 1626a_100000707721_100000743183 [0,2,0,0,0,0|1,0,1]=4 8954 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)F)Cl 240690a_100000707721_100000743183 [0,2,0,0,0,0|1,0,1]=4 8955 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)F)Cl 527a_100000707721_100000743183 [0,2,0,0,0,0|1,0,1]=4 8956 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)I)Cl 11a_100000707721_100000739381 [0,2,0,0,0,0|1,0,1]=4 8957 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)I)Cl 1626a_100000707721_100000739381 [0,2,0,0,0,0|1,0,1]=4 8958 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)I)Cl 240690a_100000707721_100000739381 [0,2,0,0,0,0|1,0,1]=4 8959 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)I)Cl 527a_100000707721_100000739381 [0,2,0,0,0,0|1,0,1]=4 8960 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)O)Cl 240690a_100000707721_100011933997 [0,2,0,0,0,0|1,0,1]=4 8961 B15R1.758 C#CC(C)NC(=O)c1ccc(c(c1)O)Cl 527a_100000707721_100011933997 [0,2,0,0,0,0|1,0,1]=4 8962 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)Br)Cl 11a_100000737613_100000691181 [0,2,0,0,0,0|1,0,1]=4 8963 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)Br)Cl 1626a_100000737613_100000691181 [0,2,0,0,0,0|1,0,1]=4 8964 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)Br)Cl 527a_100000737613_100000691181 [0,2,0,0,0,0|1,0,1]=4 8965 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)Cl)Cl 11a_100000737613_100000210401 [0,2,0,0,0,0|1,0,1]=4 8966 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000737613_100000210401 [0,2,0,0,0,0|1,0,1]=4 8967 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)Cl)Cl 527a_100000737613_100000210401 [0,2,0,0,0,0|1,0,1]=4 8968 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)F)Cl 11a_100000737613_100000743183 [0,2,0,0,0,0|1,0,1]=4 8969 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)F)Cl 1626a_100000737613_100000743183 [0,2,0,0,0,0|1,0,1]=4 8970 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)F)Cl 527a_100000737613_100000743183 [0,2,0,0,0,0|1,0,1]=4 8971 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)I)Cl 11a_100000737613_100000739381 [0,2,0,0,0,0|1,0,1]=4 8972 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)I)Cl 1626a_100000737613_100000739381 [0,2,0,0,0,0|1,0,1]=4 8973 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)I)Cl 527a_100000737613_100000739381 [0,2,0,0,0,0|1,0,1]=4 8974 B15R1.758 CC(C#N)NC(=O)c1ccc(c(c1)O)Cl 527a_100000737613_100011933997 [0,2,0,0,0,0|1,0,1]=4 8975 B15R1.758 CC(CO)NC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100012180447 [0,2,0,0,0,0|1,0,1]=4 8976 B15R1.758 CC(CO)NC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_100012180447 [0,2,0,0,0,0|1,0,1]=4 8977 B15R1.758 CC(CO)N[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_100012180447 [0,2,0,0,0,0|1,0,1]=4 8978 B15R1.758 CC(CO)N[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_100012180447 [0,2,0,0,0,0|1,0,1]=4 8979 B15R1.758 CC(N[C@H](C)CO)c1ccc(c(c1)Br)Cl 269862a_100000737577_100012356427 [0,2,0,0,0,0|1,0,1]=4 8980 B15R1.758 CC(N[C@H](C)CO)c1ccc(c(c1)Cl)Cl 269862a_100000737577_100000210641 [0,2,0,0,0,0|1,0,1]=4 8981 B15R1.758 CC(N[C@H](C)CO)c1ccc(c(c1)F)Cl 269862a_100000737577_100000693814 [0,2,0,0,0,0|1,0,1]=4 8982 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000748023 [0,2,0,0,0,0|2,0,0]=4 8983 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000748023 [0,2,0,0,0,0|2,0,0]=4 8984 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000748023 [0,2,0,0,0,0|2,0,0]=4 8985 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000748023 [0,2,0,0,0,0|2,0,0]=4 8986 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000748023 [0,2,0,0,0,0|2,0,0]=4 8987 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000748023 [0,2,0,0,0,0|2,0,0]=4 8988 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Br 11a_100000209981_100012339404 [0,2,0,0,0,0|1,1,0]=4 8989 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Br 1626a_100000209981_100012339404 [0,2,0,0,0,0|1,1,0]=4 8990 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Br 240690a_100000209981_100012339404 [0,2,0,0,0,0|1,1,0]=4 8991 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Br 527a_100000209981_100012339404 [0,2,0,0,0,0|1,1,0]=4 8992 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)C 11a_100000209981_100000186397 [0,2,0,0,0,0|2,0,0]=4 8993 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)C 1626a_100000209981_100000186397 [0,2,0,0,0,0|2,0,0]=4 8994 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)C 240690a_100000209981_100000186397 [0,2,0,0,0,0|2,0,0]=4 8995 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)C 527a_100000209981_100000186397 [0,2,0,0,0,0|2,0,0]=4 8996 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Cl 11a_100000209981_100000691181 [0,2,0,0,0,0|1,0,0]=3 8997 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Cl 1626a_100000209981_100000691181 [0,2,0,0,0,0|1,0,0]=3 8998 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Cl 240690a_100000209981_100000691181 [0,2,0,0,0,0|1,0,0]=3 8999 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)Cl 527a_100000209981_100000691181 [0,2,0,0,0,0|1,0,0]=3 9000 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)F 11a_100000209981_100000760357 [0,2,0,0,0,0|1,1,0]=4 9001 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)F 1626a_100000209981_100000760357 [0,2,0,0,0,0|1,1,0]=4 9002 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)F 240690a_100000209981_100000760357 [0,2,0,0,0,0|1,1,0]=4 9003 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)F 527a_100000209981_100000760357 [0,2,0,0,0,0|1,1,0]=4 9004 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)I 11a_100000209981_100000739115 [0,2,0,0,0,0|1,1,0]=4 9005 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)I 1626a_100000209981_100000739115 [0,2,0,0,0,0|1,1,0]=4 9006 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)I 240690a_100000209981_100000739115 [0,2,0,0,0,0|1,1,0]=4 9007 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)I 527a_100000209981_100000739115 [0,2,0,0,0,0|1,1,0]=4 9008 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)O 240690a_100000209981_100000189672 [0,2,0,0,0,0|2,0,0]=4 9009 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Br 11a_100000209981_100000692631 [0,2,0,0,0,0|1,1,0]=4 9010 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Br 1626a_100000209981_100000692631 [0,2,0,0,0,0|1,1,0]=4 9011 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Br 240690a_100000209981_100000692631 [0,2,0,0,0,0|1,1,0]=4 9012 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Br 527a_100000209981_100000692631 [0,2,0,0,0,0|1,1,0]=4 9013 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)C 11a_100000209981_100000210898 [0,2,0,0,0,0|2,0,0]=4 9014 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)C 1626a_100000209981_100000210898 [0,2,0,0,0,0|2,0,0]=4 9015 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)C 240690a_100000209981_100000210898 [0,2,0,0,0,0|2,0,0]=4 9016 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)C 527a_100000209981_100000210898 [0,2,0,0,0,0|2,0,0]=4 9017 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Cl 11a_100000209981_100000686306 [0,2,0,0,0,0|1,0,0]=3 9018 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Cl 1626a_100000209981_100000686306 [0,2,0,0,0,0|1,0,0]=3 9019 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Cl 240690a_100000209981_100000686306 [0,2,0,0,0,0|1,0,0]=3 9020 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)Cl 527a_100000209981_100000686306 [0,2,0,0,0,0|1,0,0]=3 9021 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)F 11a_100000209981_100000751819 [0,2,0,0,0,0|1,1,0]=4 9022 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)F 1626a_100000209981_100000751819 [0,2,0,0,0,0|1,1,0]=4 9023 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)F 240690a_100000209981_100000751819 [0,2,0,0,0,0|1,1,0]=4 9024 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)F 527a_100000209981_100000751819 [0,2,0,0,0,0|1,1,0]=4 9025 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)I 11a_100000209981_100000751300 [0,2,0,0,0,0|1,1,0]=4 9026 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)I 1626a_100000209981_100000751300 [0,2,0,0,0,0|1,1,0]=4 9027 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)I 240690a_100000209981_100000751300 [0,2,0,0,0,0|1,1,0]=4 9028 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)I 527a_100000209981_100000751300 [0,2,0,0,0,0|1,1,0]=4 9029 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)O 240690a_100000209981_100000685612 [0,2,0,0,0,0|2,0,0]=4 9030 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Br 11a_100000209981_100000687082 [0,2,0,0,0,0|1,1,0]=4 9031 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Br 1626a_100000209981_100000687082 [0,2,0,0,0,0|1,1,0]=4 9032 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Br 240690a_100000209981_100000687082 [0,2,0,0,0,0|1,1,0]=4 9033 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Br 527a_100000209981_100000687082 [0,2,0,0,0,0|1,1,0]=4 9034 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)C 11a_100000209981_100000751740 [0,2,0,0,0,0|2,0,0]=4 9035 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)C 1626a_100000209981_100000751740 [0,2,0,0,0,0|2,0,0]=4 9036 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)C 240690a_100000209981_100000751740 [0,2,0,0,0,0|2,0,0]=4 9037 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)C 527a_100000209981_100000751740 [0,2,0,0,0,0|2,0,0]=4 9038 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Cl 11a_100000209981_100000210401 [0,2,0,0,0,0|1,0,0]=3 9039 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000209981_100000210401 [0,2,0,0,0,0|1,0,0]=3 9040 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000209981_100000210401 [0,2,0,0,0,0|1,0,0]=3 9041 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)Cl 527a_100000209981_100000210401 [0,2,0,0,0,0|1,0,0]=3 9042 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)F 11a_100000209981_100000686462 [0,2,0,0,0,0|1,1,0]=4 9043 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)F 1626a_100000209981_100000686462 [0,2,0,0,0,0|1,1,0]=4 9044 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)F 240690a_100000209981_100000686462 [0,2,0,0,0,0|1,1,0]=4 9045 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)F 527a_100000209981_100000686462 [0,2,0,0,0,0|1,1,0]=4 9046 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)I 11a_100000209981_100000684831 [0,2,0,0,0,0|1,1,0]=4 9047 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)I 1626a_100000209981_100000684831 [0,2,0,0,0,0|1,1,0]=4 9048 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)I 240690a_100000209981_100000684831 [0,2,0,0,0,0|1,1,0]=4 9049 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)I 527a_100000209981_100000684831 [0,2,0,0,0,0|1,1,0]=4 9050 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)O 240690a_100000209981_100000212196 [0,2,0,0,0,0|2,0,0]=4 9051 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)O 527a_100000209981_100000212196 [0,2,0,0,0,0|2,0,0]=4 9052 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Br 11a_100000209981_100000743946 [0,2,0,0,0,0|1,1,0]=4 9053 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Br 1626a_100000209981_100000743946 [0,2,0,0,0,0|1,1,0]=4 9054 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Br 240690a_100000209981_100000743946 [0,2,0,0,0,0|1,1,0]=4 9055 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Br 527a_100000209981_100000743946 [0,2,0,0,0,0|1,1,0]=4 9056 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)C 11a_100000209981_100000212313 [0,2,0,0,0,0|2,0,0]=4 9057 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)C 1626a_100000209981_100000212313 [0,2,0,0,0,0|2,0,0]=4 9058 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)C 240690a_100000209981_100000212313 [0,2,0,0,0,0|2,0,0]=4 9059 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)C 527a_100000209981_100000212313 [0,2,0,0,0,0|2,0,0]=4 9060 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Cl 11a_100000209981_100000743183 [0,2,0,0,0,0|1,0,0]=3 9061 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Cl 1626a_100000209981_100000743183 [0,2,0,0,0,0|1,0,0]=3 9062 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Cl 240690a_100000209981_100000743183 [0,2,0,0,0,0|1,0,0]=3 9063 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)Cl 527a_100000209981_100000743183 [0,2,0,0,0,0|1,0,0]=3 9064 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)F 11a_100000209981_100000209822 [0,2,0,0,0,0|1,1,0]=4 9065 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)F 1626a_100000209981_100000209822 [0,2,0,0,0,0|1,1,0]=4 9066 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)F 240690a_100000209981_100000209822 [0,2,0,0,0,0|1,1,0]=4 9067 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)F 527a_100000209981_100000209822 [0,2,0,0,0,0|1,1,0]=4 9068 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)I 11a_100000209981_100000062624 [0,2,0,0,0,0|1,1,0]=4 9069 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)I 1626a_100000209981_100000062624 [0,2,0,0,0,0|1,1,0]=4 9070 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)I 240690a_100000209981_100000062624 [0,2,0,0,0,0|1,1,0]=4 9071 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)I 527a_100000209981_100000062624 [0,2,0,0,0,0|1,1,0]=4 9072 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)O 240690a_100000209981_100000185466 [0,2,0,0,0,0|2,0,0]=4 9073 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)O 527a_100000209981_100000185466 [0,2,0,0,0,0|2,0,0]=4 9074 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Br 11a_100000209981_100012343876 [0,2,0,0,0,0|1,1,0]=4 9075 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Br 1626a_100000209981_100012343876 [0,2,0,0,0,0|1,1,0]=4 9076 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Br 240690a_100000209981_100012343876 [0,2,0,0,0,0|1,1,0]=4 9077 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Br 527a_100000209981_100012343876 [0,2,0,0,0,0|1,1,0]=4 9078 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)C 11a_100000209981_100000751299 [0,2,0,0,0,0|2,0,0]=4 9079 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)C 1626a_100000209981_100000751299 [0,2,0,0,0,0|2,0,0]=4 9080 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)C 240690a_100000209981_100000751299 [0,2,0,0,0,0|2,0,0]=4 9081 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)C 527a_100000209981_100000751299 [0,2,0,0,0,0|2,0,0]=4 9082 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Cl 11a_100000209981_100000739381 [0,2,0,0,0,0|1,0,0]=3 9083 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Cl 1626a_100000209981_100000739381 [0,2,0,0,0,0|1,0,0]=3 9084 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Cl 240690a_100000209981_100000739381 [0,2,0,0,0,0|1,0,0]=3 9085 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)Cl 527a_100000209981_100000739381 [0,2,0,0,0,0|1,0,0]=3 9086 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)F 11a_100000209981_100000688015 [0,2,0,0,0,0|1,1,0]=4 9087 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)F 1626a_100000209981_100000688015 [0,2,0,0,0,0|1,1,0]=4 9088 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)F 240690a_100000209981_100000688015 [0,2,0,0,0,0|1,1,0]=4 9089 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)F 527a_100000209981_100000688015 [0,2,0,0,0,0|1,1,0]=4 9090 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)I 11a_100000209981_100000725830 [0,2,0,0,0,0|1,1,0]=4 9091 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)I 1626a_100000209981_100000725830 [0,2,0,0,0,0|1,1,0]=4 9092 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)I 240690a_100000209981_100000725830 [0,2,0,0,0,0|1,1,0]=4 9093 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)I 527a_100000209981_100000725830 [0,2,0,0,0,0|1,1,0]=4 9094 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)O 1626a_100000209981_100000037485 [0,2,0,0,0,0|2,0,0]=4 9095 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)O 240690a_100000209981_100000037485 [0,2,0,0,0,0|2,0,0]=4 9096 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Br 240690a_100000209981_100000689001 [0,2,0,0,0,0|1,1,0]=4 9097 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Br 527a_100000209981_100000689001 [0,2,0,0,0,0|1,1,0]=4 9098 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)C 240690a_100000209981_100000233767 [0,2,0,0,0,0|2,0,0]=4 9099 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Cl 240690a_100000209981_100011933997 [0,2,0,0,0,0|1,0,0]=3 9100 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Cl 527a_100000209981_100011933997 [0,2,0,0,0,0|1,0,0]=3 9101 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)F 240690a_100000209981_100000035894 [0,2,0,0,0,0|1,1,0]=4 9102 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)F 527a_100000209981_100000035894 [0,2,0,0,0,0|1,1,0]=4 9103 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)I 1626a_100000209981_100000239334 [0,2,0,0,0,0|1,1,0]=4 9104 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)I 240690a_100000209981_100000239334 [0,2,0,0,0,0|1,1,0]=4 9105 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)I 527a_100000209981_100000239334 [0,2,0,0,0,0|1,1,0]=4 9106 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011218378 [0,2,0,0,0,0|2,0,0]=4 9107 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100011218378 [0,2,0,0,0,0|2,0,0]=4 9108 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011218378 [0,2,0,0,0,0|2,0,0]=4 9109 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100011218378 [0,2,0,0,0,0|2,0,0]=4 9110 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100011218378 [0,2,0,0,0,0|2,0,0]=4 9111 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100011218378 [0,2,0,0,0,0|2,0,0]=4 9112 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100009816398 [0,2,0,0,0,0|2,0,0]=4 9113 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100009816398 [0,2,0,0,0,0|2,0,0]=4 9114 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100009816398 [0,2,0,0,0,0|2,0,0]=4 9115 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100009816398 [0,2,0,0,0,0|2,0,0]=4 9116 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100009816398 [0,2,0,0,0,0|2,0,0]=4 9117 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100009816398 [0,2,0,0,0,0|2,0,0]=4 9118 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000059175 [0,2,0,0,0,0|1,1,0]=4 9119 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000059175 [0,2,0,0,0,0|1,0,0]=3 9120 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000059175 [0,2,0,0,0,0|1,1,0]=4 9121 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000059175 [0,2,0,0,0,0|1,1,0]=4 9122 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000059175 [0,2,0,0,0,0|2,0,0]=4 9123 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000059175 [0,2,0,0,0,0|1,1,0]=4 9124 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000059175 [0,2,0,0,0,0|1,0,0]=3 9125 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000059175 [0,2,0,0,0,0|1,1,0]=4 9126 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000059175 [0,2,0,0,0,0|1,1,0]=4 9127 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000059175 [0,2,0,0,0,0|2,0,0]=4 9128 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000059175 [0,2,0,0,0,0|1,1,0]=4 9129 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000059175 [0,2,0,0,0,0|1,0,0]=3 9130 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000059175 [0,2,0,0,0,0|1,1,0]=4 9131 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000059175 [0,2,0,0,0,0|1,1,0]=4 9132 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000059175 [0,2,0,0,0,0|2,0,0]=4 9133 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000059175 [0,2,0,0,0,0|1,1,0]=4 9134 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000059175 [0,2,0,0,0,0|1,0,0]=3 9135 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000059175 [0,2,0,0,0,0|1,1,0]=4 9136 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000059175 [0,2,0,0,0,0|1,1,0]=4 9137 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000059175 [0,2,0,0,0,0|2,0,0]=4 9138 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000059175 [0,2,0,0,0,0|1,1,0]=4 9139 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000059175 [0,2,0,0,0,0|1,0,0]=3 9140 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000059175 [0,2,0,0,0,0|1,1,0]=4 9141 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000059175 [0,2,0,0,0,0|1,1,0]=4 9142 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000059175 [0,2,0,0,0,0|2,0,0]=4 9143 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Br 11a_100102880703_100012339404 [0,2,0,0,0,0|1,1,0]=4 9144 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Br 1626a_100102880703_100012339404 [0,2,0,0,0,0|1,1,0]=4 9145 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Br 240690a_100102880703_100012339404 [0,2,0,0,0,0|1,1,0]=4 9146 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Br 527a_100102880703_100012339404 [0,2,0,0,0,0|1,1,0]=4 9147 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Cl 11a_100102880703_100000691181 [0,2,0,0,0,0|1,0,0]=3 9148 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Cl 1626a_100102880703_100000691181 [0,2,0,0,0,0|1,0,0]=3 9149 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Cl 240690a_100102880703_100000691181 [0,2,0,0,0,0|1,0,0]=3 9150 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)Cl 527a_100102880703_100000691181 [0,2,0,0,0,0|1,0,0]=3 9151 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)F 11a_100102880703_100000760357 [0,2,0,0,0,0|1,1,0]=4 9152 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)F 1626a_100102880703_100000760357 [0,2,0,0,0,0|1,1,0]=4 9153 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)F 240690a_100102880703_100000760357 [0,2,0,0,0,0|1,1,0]=4 9154 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)F 527a_100102880703_100000760357 [0,2,0,0,0,0|1,1,0]=4 9155 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)I 11a_100102880703_100000739115 [0,2,0,0,0,0|1,1,0]=4 9156 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)I 1626a_100102880703_100000739115 [0,2,0,0,0,0|1,1,0]=4 9157 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)I 240690a_100102880703_100000739115 [0,2,0,0,0,0|1,1,0]=4 9158 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)I 527a_100102880703_100000739115 [0,2,0,0,0,0|1,1,0]=4 9159 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Br)O 240690a_100102880703_100000189672 [0,2,0,0,0,0|2,0,0]=4 9160 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Br 11a_100102880703_100000687082 [0,2,0,0,0,0|1,1,0]=4 9161 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Br 1626a_100102880703_100000687082 [0,2,0,0,0,0|1,1,0]=4 9162 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Br 240690a_100102880703_100000687082 [0,2,0,0,0,0|1,1,0]=4 9163 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Br 527a_100102880703_100000687082 [0,2,0,0,0,0|1,1,0]=4 9164 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Cl 11a_100102880703_100000210401 [0,2,0,0,0,0|1,0,0]=3 9165 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Cl 1626a_100102880703_100000210401 [0,2,0,0,0,0|1,0,0]=3 9166 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Cl 240690a_100102880703_100000210401 [0,2,0,0,0,0|1,0,0]=3 9167 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)Cl 527a_100102880703_100000210401 [0,2,0,0,0,0|1,0,0]=3 9168 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)F 11a_100102880703_100000686462 [0,2,0,0,0,0|1,1,0]=4 9169 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)F 1626a_100102880703_100000686462 [0,2,0,0,0,0|1,1,0]=4 9170 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)F 240690a_100102880703_100000686462 [0,2,0,0,0,0|1,1,0]=4 9171 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)F 527a_100102880703_100000686462 [0,2,0,0,0,0|1,1,0]=4 9172 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)I 11a_100102880703_100000684831 [0,2,0,0,0,0|1,1,0]=4 9173 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)I 1626a_100102880703_100000684831 [0,2,0,0,0,0|1,1,0]=4 9174 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)I 240690a_100102880703_100000684831 [0,2,0,0,0,0|1,1,0]=4 9175 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)I 527a_100102880703_100000684831 [0,2,0,0,0,0|1,1,0]=4 9176 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)O 240690a_100102880703_100000212196 [0,2,0,0,0,0|2,0,0]=4 9177 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)Cl)O 527a_100102880703_100000212196 [0,2,0,0,0,0|2,0,0]=4 9178 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Br 11a_100102880703_100000743946 [0,2,0,0,0,0|1,1,0]=4 9179 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Br 1626a_100102880703_100000743946 [0,2,0,0,0,0|1,1,0]=4 9180 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Br 240690a_100102880703_100000743946 [0,2,0,0,0,0|1,1,0]=4 9181 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Br 527a_100102880703_100000743946 [0,2,0,0,0,0|1,1,0]=4 9182 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Cl 11a_100102880703_100000743183 [0,2,0,0,0,0|1,0,0]=3 9183 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Cl 1626a_100102880703_100000743183 [0,2,0,0,0,0|1,0,0]=3 9184 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Cl 240690a_100102880703_100000743183 [0,2,0,0,0,0|1,0,0]=3 9185 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)Cl 527a_100102880703_100000743183 [0,2,0,0,0,0|1,0,0]=3 9186 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)F 11a_100102880703_100000209822 [0,2,0,0,0,0|1,1,0]=4 9187 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)F 1626a_100102880703_100000209822 [0,2,0,0,0,0|1,1,0]=4 9188 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)F 240690a_100102880703_100000209822 [0,2,0,0,0,0|1,1,0]=4 9189 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)F 527a_100102880703_100000209822 [0,2,0,0,0,0|1,1,0]=4 9190 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)I 11a_100102880703_100000062624 [0,2,0,0,0,0|1,1,0]=4 9191 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)I 1626a_100102880703_100000062624 [0,2,0,0,0,0|1,1,0]=4 9192 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)I 240690a_100102880703_100000062624 [0,2,0,0,0,0|1,1,0]=4 9193 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)I 527a_100102880703_100000062624 [0,2,0,0,0,0|1,1,0]=4 9194 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)O 240690a_100102880703_100000185466 [0,2,0,0,0,0|2,0,0]=4 9195 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)F)O 527a_100102880703_100000185466 [0,2,0,0,0,0|2,0,0]=4 9196 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Br 11a_100102880703_100012343876 [0,2,0,0,0,0|1,1,0]=4 9197 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Br 1626a_100102880703_100012343876 [0,2,0,0,0,0|1,1,0]=4 9198 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Br 240690a_100102880703_100012343876 [0,2,0,0,0,0|1,1,0]=4 9199 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Br 527a_100102880703_100012343876 [0,2,0,0,0,0|1,1,0]=4 9200 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Cl 11a_100102880703_100000739381 [0,2,0,0,0,0|1,0,0]=3 9201 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Cl 1626a_100102880703_100000739381 [0,2,0,0,0,0|1,0,0]=3 9202 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Cl 240690a_100102880703_100000739381 [0,2,0,0,0,0|1,0,0]=3 9203 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)Cl 527a_100102880703_100000739381 [0,2,0,0,0,0|1,0,0]=3 9204 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)F 11a_100102880703_100000688015 [0,2,0,0,0,0|1,1,0]=4 9205 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)F 1626a_100102880703_100000688015 [0,2,0,0,0,0|1,1,0]=4 9206 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)F 240690a_100102880703_100000688015 [0,2,0,0,0,0|1,1,0]=4 9207 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)F 527a_100102880703_100000688015 [0,2,0,0,0,0|1,1,0]=4 9208 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)I 11a_100102880703_100000725830 [0,2,0,0,0,0|1,1,0]=4 9209 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)I 1626a_100102880703_100000725830 [0,2,0,0,0,0|1,1,0]=4 9210 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)I 240690a_100102880703_100000725830 [0,2,0,0,0,0|1,1,0]=4 9211 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)I 527a_100102880703_100000725830 [0,2,0,0,0,0|1,1,0]=4 9212 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)O 1626a_100102880703_100000037485 [0,2,0,0,0,0|2,0,0]=4 9213 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)I)O 240690a_100102880703_100000037485 [0,2,0,0,0,0|2,0,0]=4 9214 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)Br 240690a_100102880703_100000689001 [0,2,0,0,0,0|1,1,0]=4 9215 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)Br 527a_100102880703_100000689001 [0,2,0,0,0,0|1,1,0]=4 9216 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)Cl 240690a_100102880703_100011933997 [0,2,0,0,0,0|1,0,0]=3 9217 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)Cl 527a_100102880703_100011933997 [0,2,0,0,0,0|1,0,0]=3 9218 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)F 240690a_100102880703_100000035894 [0,2,0,0,0,0|1,1,0]=4 9219 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)F 527a_100102880703_100000035894 [0,2,0,0,0,0|1,1,0]=4 9220 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)I 1626a_100102880703_100000239334 [0,2,0,0,0,0|1,1,0]=4 9221 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)I 240690a_100102880703_100000239334 [0,2,0,0,0,0|1,1,0]=4 9222 B15R1.758 C[C@H](CF)NC(=O)c1ccc(c(c1)O)I 527a_100102880703_100000239334 [0,2,0,0,0,0|1,1,0]=4 9223 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)Br 240690a_100000737577_100012339404 [0,2,0,0,0,0|0,1,0]=3 9224 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)Br 527a_100000737577_100012339404 [0,2,0,0,0,0|0,1,0]=3 9225 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)Cl 240690a_100000737577_100000691181 [0,2,0,0,0,0|0,0,0]=2 9226 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)Cl 527a_100000737577_100000691181 [0,2,0,0,0,0|0,0,0]=2 9227 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)F 240690a_100000737577_100000760357 [0,2,0,0,0,0|0,1,0]=3 9228 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)F 527a_100000737577_100000760357 [0,2,0,0,0,0|0,1,0]=3 9229 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)I 240690a_100000737577_100000739115 [0,2,0,0,0,0|0,1,0]=3 9230 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)I 527a_100000737577_100000739115 [0,2,0,0,0,0|0,1,0]=3 9231 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Br)O 240690a_100000737577_100000189672 [0,2,0,0,0,0|1,0,0]=3 9232 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)Br 240690a_100000737577_100000687082 [0,2,0,0,0,0|0,1,0]=3 9233 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)Br 527a_100000737577_100000687082 [0,2,0,0,0,0|0,1,0]=3 9234 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000737577_100000210401 [0,2,0,0,0,0|0,0,0]=2 9235 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)Cl 527a_100000737577_100000210401 [0,2,0,0,0,0|0,0,0]=2 9236 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)F 240690a_100000737577_100000686462 [0,2,0,0,0,0|0,1,0]=3 9237 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)F 527a_100000737577_100000686462 [0,2,0,0,0,0|0,1,0]=3 9238 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)I 240690a_100000737577_100000684831 [0,2,0,0,0,0|0,1,0]=3 9239 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)I 527a_100000737577_100000684831 [0,2,0,0,0,0|0,1,0]=3 9240 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)O 240690a_100000737577_100000212196 [0,2,0,0,0,0|1,0,0]=3 9241 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)Cl)O 527a_100000737577_100000212196 [0,2,0,0,0,0|1,0,0]=3 9242 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)Br 240690a_100000737577_100000743946 [0,2,0,0,0,0|0,1,0]=3 9243 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)Br 527a_100000737577_100000743946 [0,2,0,0,0,0|0,1,0]=3 9244 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)Cl 240690a_100000737577_100000743183 [0,2,0,0,0,0|0,0,0]=2 9245 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)Cl 527a_100000737577_100000743183 [0,2,0,0,0,0|0,0,0]=2 9246 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)F 240690a_100000737577_100000209822 [0,2,0,0,0,0|0,1,0]=3 9247 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)F 527a_100000737577_100000209822 [0,2,0,0,0,0|0,1,0]=3 9248 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)I 240690a_100000737577_100000062624 [0,2,0,0,0,0|0,1,0]=3 9249 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)I 527a_100000737577_100000062624 [0,2,0,0,0,0|0,1,0]=3 9250 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)O 240690a_100000737577_100000185466 [0,2,0,0,0,0|1,0,0]=3 9251 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)F)O 527a_100000737577_100000185466 [0,2,0,0,0,0|1,0,0]=3 9252 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)Br 240690a_100000737577_100012343876 [0,2,0,0,0,0|0,1,0]=3 9253 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)Br 527a_100000737577_100012343876 [0,2,0,0,0,0|0,1,0]=3 9254 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)Cl 240690a_100000737577_100000739381 [0,2,0,0,0,0|0,0,0]=2 9255 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)Cl 527a_100000737577_100000739381 [0,2,0,0,0,0|0,0,0]=2 9256 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)F 240690a_100000737577_100000688015 [0,2,0,0,0,0|0,1,0]=3 9257 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)F 527a_100000737577_100000688015 [0,2,0,0,0,0|0,1,0]=3 9258 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)I 240690a_100000737577_100000725830 [0,2,0,0,0,0|0,1,0]=3 9259 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)I 527a_100000737577_100000725830 [0,2,0,0,0,0|0,1,0]=3 9260 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)I)O 240690a_100000737577_100000037485 [0,2,0,0,0,0|1,0,0]=3 9261 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)Br 240690a_100000737577_100000689001 [0,2,0,0,0,0|0,1,0]=3 9262 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)Br 527a_100000737577_100000689001 [0,2,0,0,0,0|0,1,0]=3 9263 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)Cl 240690a_100000737577_100011933997 [0,2,0,0,0,0|0,0,0]=2 9264 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)Cl 527a_100000737577_100011933997 [0,2,0,0,0,0|0,0,0]=2 9265 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)F 240690a_100000737577_100000035894 [0,2,0,0,0,0|0,1,0]=3 9266 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)F 527a_100000737577_100000035894 [0,2,0,0,0,0|0,1,0]=3 9267 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)I 240690a_100000737577_100000239334 [0,2,0,0,0,0|0,1,0]=3 9268 B15R1.758 C[C@H](CO)NC(=O)c1ccc(c(c1)O)I 527a_100000737577_100000239334 [0,2,0,0,0,0|0,1,0]=3 9269 B15R1.758 Cc1cc(ccc1Br)C(=O)C[C@@H](C)CO 1458a_100000692631_100000059175 [0,2,0,0,0,0|1,1,0]=4 9270 B15R1.758 Cc1cc(ccc1Br)C(=O)N[C@H](C)CF 11a_100102880703_100000692631 [0,2,0,0,0,0|1,1,0]=4 9271 B15R1.758 Cc1cc(ccc1Br)C(=O)N[C@H](C)CF 1626a_100102880703_100000692631 [0,2,0,0,0,0|1,1,0]=4 9272 B15R1.758 Cc1cc(ccc1Br)C(=O)N[C@H](C)CF 240690a_100102880703_100000692631 [0,2,0,0,0,0|1,1,0]=4 9273 B15R1.758 Cc1cc(ccc1Br)C(=O)N[C@H](C)CF 527a_100102880703_100000692631 [0,2,0,0,0,0|1,1,0]=4 9274 B15R1.758 Cc1cc(ccc1Br)C(=O)N[C@H](C)CO 240690a_100000737577_100000692631 [0,2,0,0,0,0|0,1,0]=3 9275 B15R1.758 Cc1cc(ccc1Br)C(=O)N[C@H](C)CO 527a_100000737577_100000692631 [0,2,0,0,0,0|0,1,0]=3 9276 B15R1.758 Cc1cc(ccc1Cl)C(=O)CC(=O)CO 1458a_100000210174_200011216723 [0,2,0,0,0,0|1,0,1]=4 9277 B15R1.758 Cc1cc(ccc1Cl)C(=O)C[C@@H](C)CO 1458a_100000686306_100000059175 [0,2,0,0,0,0|1,0,0]=3 9278 B15R1.758 Cc1cc(ccc1Cl)C(=O)NC(C)C#N 11a_100000737613_100000686306 [0,2,0,0,0,0|1,0,1]=4 9279 B15R1.758 Cc1cc(ccc1Cl)C(=O)NC(C)C#N 1626a_100000737613_100000686306 [0,2,0,0,0,0|1,0,1]=4 9280 B15R1.758 Cc1cc(ccc1Cl)C(=O)NC(C)C#N 527a_100000737613_100000686306 [0,2,0,0,0,0|1,0,1]=4 9281 B15R1.758 Cc1cc(ccc1Cl)C(=O)N[C@H](C)CF 11a_100102880703_100000686306 [0,2,0,0,0,0|1,0,0]=3 9282 B15R1.758 Cc1cc(ccc1Cl)C(=O)N[C@H](C)CF 1626a_100102880703_100000686306 [0,2,0,0,0,0|1,0,0]=3 9283 B15R1.758 Cc1cc(ccc1Cl)C(=O)N[C@H](C)CF 240690a_100102880703_100000686306 [0,2,0,0,0,0|1,0,0]=3 9284 B15R1.758 Cc1cc(ccc1Cl)C(=O)N[C@H](C)CF 527a_100102880703_100000686306 [0,2,0,0,0,0|1,0,0]=3 9285 B15R1.758 Cc1cc(ccc1Cl)C(=O)N[C@H](C)CO 240690a_100000737577_100000686306 [0,2,0,0,0,0|0,0,0]=2 9286 B15R1.758 Cc1cc(ccc1Cl)C(=O)N[C@H](C)CO 527a_100000737577_100000686306 [0,2,0,0,0,0|0,0,0]=2 9287 B15R1.758 Cc1cc(ccc1Cl)C(C)N[C@H](C)CO 269862a_100000737577_100011216000 [0,2,0,0,0,0|1,0,1]=4 9288 B15R1.758 Cc1cc(ccc1F)C(=O)C[C@@H](C)CO 1458a_100000751819_100000059175 [0,2,0,0,0,0|1,1,0]=4 9289 B15R1.758 Cc1cc(ccc1F)C(=O)N[C@H](C)CF 11a_100102880703_100000751819 [0,2,0,0,0,0|1,1,0]=4 9290 B15R1.758 Cc1cc(ccc1F)C(=O)N[C@H](C)CF 1626a_100102880703_100000751819 [0,2,0,0,0,0|1,1,0]=4 9291 B15R1.758 Cc1cc(ccc1F)C(=O)N[C@H](C)CF 240690a_100102880703_100000751819 [0,2,0,0,0,0|1,1,0]=4 9292 B15R1.758 Cc1cc(ccc1F)C(=O)N[C@H](C)CF 527a_100102880703_100000751819 [0,2,0,0,0,0|1,1,0]=4 9293 B15R1.758 Cc1cc(ccc1F)C(=O)N[C@H](C)CO 240690a_100000737577_100000751819 [0,2,0,0,0,0|0,1,0]=3 9294 B15R1.758 Cc1cc(ccc1F)C(=O)N[C@H](C)CO 527a_100000737577_100000751819 [0,2,0,0,0,0|0,1,0]=3 9295 B15R1.758 Cc1cc(ccc1I)C(=O)C[C@@H](C)CO 1458a_100000751300_100000059175 [0,2,0,0,0,0|1,1,0]=4 9296 B15R1.758 Cc1cc(ccc1I)C(=O)N[C@H](C)CF 11a_100102880703_100000751300 [0,2,0,0,0,0|1,1,0]=4 9297 B15R1.758 Cc1cc(ccc1I)C(=O)N[C@H](C)CF 1626a_100102880703_100000751300 [0,2,0,0,0,0|1,1,0]=4 9298 B15R1.758 Cc1cc(ccc1I)C(=O)N[C@H](C)CF 240690a_100102880703_100000751300 [0,2,0,0,0,0|1,1,0]=4 9299 B15R1.758 Cc1cc(ccc1I)C(=O)N[C@H](C)CF 527a_100102880703_100000751300 [0,2,0,0,0,0|1,1,0]=4 9300 B15R1.758 Cc1cc(ccc1I)C(=O)N[C@H](C)CO 240690a_100000737577_100000751300 [0,2,0,0,0,0|0,1,0]=3 9301 B15R1.758 Cc1cc(ccc1I)C(=O)N[C@H](C)CO 527a_100000737577_100000751300 [0,2,0,0,0,0|0,1,0]=3 9302 B15R1.758 Cc1cc(ccc1O)C(=O)C[C@@H](C)CO 1458a_100000685612_100000059175 [0,2,0,0,0,0|2,0,0]=4 9303 B15R1.758 Cc1cc(ccc1O)C(=O)N[C@H](C)CF 240690a_100102880703_100000685612 [0,2,0,0,0,0|2,0,0]=4 9304 B15R1.758 Cc1cc(ccc1O)C(=O)N[C@H](C)CO 240690a_100000737577_100000685612 [0,2,0,0,0,0|1,0,0]=3 9305 B15R1.758 Cc1ccc(cc1Br)C(=O)C[C@@H](C)CO 1458a_100000186397_100000059175 [0,2,0,0,0,0|2,0,0]=4 9306 B15R1.758 Cc1ccc(cc1Br)C(=O)N[C@H](C)CF 11a_100102880703_100000186397 [0,2,0,0,0,0|2,0,0]=4 9307 B15R1.758 Cc1ccc(cc1Br)C(=O)N[C@H](C)CF 1626a_100102880703_100000186397 [0,2,0,0,0,0|2,0,0]=4 9308 B15R1.758 Cc1ccc(cc1Br)C(=O)N[C@H](C)CF 240690a_100102880703_100000186397 [0,2,0,0,0,0|2,0,0]=4 9309 B15R1.758 Cc1ccc(cc1Br)C(=O)N[C@H](C)CF 527a_100102880703_100000186397 [0,2,0,0,0,0|2,0,0]=4 9310 B15R1.758 Cc1ccc(cc1Br)C(=O)N[C@H](C)CO 240690a_100000737577_100000186397 [0,2,0,0,0,0|1,0,0]=3 9311 B15R1.758 Cc1ccc(cc1Br)C(=O)N[C@H](C)CO 527a_100000737577_100000186397 [0,2,0,0,0,0|1,0,0]=3 9312 B15R1.758 Cc1ccc(cc1C)C(=O)C[C@@H](C)CO 1458a_100000210898_100000059175 [0,2,0,0,0,0|2,0,0]=4 9313 B15R1.758 Cc1ccc(cc1C)C(=O)N[C@H](C)CF 11a_100102880703_100000210898 [0,2,0,0,0,0|2,0,0]=4 9314 B15R1.758 Cc1ccc(cc1C)C(=O)N[C@H](C)CF 1626a_100102880703_100000210898 [0,2,0,0,0,0|2,0,0]=4 9315 B15R1.758 Cc1ccc(cc1C)C(=O)N[C@H](C)CF 240690a_100102880703_100000210898 [0,2,0,0,0,0|2,0,0]=4 9316 B15R1.758 Cc1ccc(cc1C)C(=O)N[C@H](C)CF 527a_100102880703_100000210898 [0,2,0,0,0,0|2,0,0]=4 9317 B15R1.758 Cc1ccc(cc1C)C(=O)N[C@H](C)CO 240690a_100000737577_100000210898 [0,2,0,0,0,0|1,0,0]=3 9318 B15R1.758 Cc1ccc(cc1C)C(=O)N[C@H](C)CO 527a_100000737577_100000210898 [0,2,0,0,0,0|1,0,0]=3 9319 B15R1.758 Cc1ccc(cc1Cl)C(=O)C[C@@H](C)CO 1458a_100000751740_100000059175 [0,2,0,0,0,0|2,0,0]=4 9320 B15R1.758 Cc1ccc(cc1Cl)C(=O)N[C@H](C)CF 11a_100102880703_100000751740 [0,2,0,0,0,0|2,0,0]=4 9321 B15R1.758 Cc1ccc(cc1Cl)C(=O)N[C@H](C)CF 1626a_100102880703_100000751740 [0,2,0,0,0,0|2,0,0]=4 9322 B15R1.758 Cc1ccc(cc1Cl)C(=O)N[C@H](C)CF 240690a_100102880703_100000751740 [0,2,0,0,0,0|2,0,0]=4 9323 B15R1.758 Cc1ccc(cc1Cl)C(=O)N[C@H](C)CF 527a_100102880703_100000751740 [0,2,0,0,0,0|2,0,0]=4 9324 B15R1.758 Cc1ccc(cc1Cl)C(=O)N[C@H](C)CO 240690a_100000737577_100000751740 [0,2,0,0,0,0|1,0,0]=3 9325 B15R1.758 Cc1ccc(cc1Cl)C(=O)N[C@H](C)CO 527a_100000737577_100000751740 [0,2,0,0,0,0|1,0,0]=3 9326 B15R1.758 Cc1ccc(cc1F)C(=O)C[C@@H](C)CO 1458a_100000212313_100000059175 [0,2,0,0,0,0|2,0,0]=4 9327 B15R1.758 Cc1ccc(cc1F)C(=O)N[C@H](C)CF 11a_100102880703_100000212313 [0,2,0,0,0,0|2,0,0]=4 9328 B15R1.758 Cc1ccc(cc1F)C(=O)N[C@H](C)CF 1626a_100102880703_100000212313 [0,2,0,0,0,0|2,0,0]=4 9329 B15R1.758 Cc1ccc(cc1F)C(=O)N[C@H](C)CF 240690a_100102880703_100000212313 [0,2,0,0,0,0|2,0,0]=4 9330 B15R1.758 Cc1ccc(cc1F)C(=O)N[C@H](C)CF 527a_100102880703_100000212313 [0,2,0,0,0,0|2,0,0]=4 9331 B15R1.758 Cc1ccc(cc1F)C(=O)N[C@H](C)CO 240690a_100000737577_100000212313 [0,2,0,0,0,0|1,0,0]=3 9332 B15R1.758 Cc1ccc(cc1F)C(=O)N[C@H](C)CO 527a_100000737577_100000212313 [0,2,0,0,0,0|1,0,0]=3 9333 B15R1.758 Cc1ccc(cc1I)C(=O)C[C@@H](C)CO 1458a_100000751299_100000059175 [0,2,0,0,0,0|2,0,0]=4 9334 B15R1.758 Cc1ccc(cc1I)C(=O)N[C@H](C)CF 11a_100102880703_100000751299 [0,2,0,0,0,0|2,0,0]=4 9335 B15R1.758 Cc1ccc(cc1I)C(=O)N[C@H](C)CF 1626a_100102880703_100000751299 [0,2,0,0,0,0|2,0,0]=4 9336 B15R1.758 Cc1ccc(cc1I)C(=O)N[C@H](C)CF 240690a_100102880703_100000751299 [0,2,0,0,0,0|2,0,0]=4 9337 B15R1.758 Cc1ccc(cc1I)C(=O)N[C@H](C)CF 527a_100102880703_100000751299 [0,2,0,0,0,0|2,0,0]=4 9338 B15R1.758 Cc1ccc(cc1I)C(=O)N[C@H](C)CO 240690a_100000737577_100000751299 [0,2,0,0,0,0|1,0,0]=3 9339 B15R1.758 Cc1ccc(cc1I)C(=O)N[C@H](C)CO 527a_100000737577_100000751299 [0,2,0,0,0,0|1,0,0]=3 9340 B15R1.758 Cc1ccc(cc1O)C(=O)C[C@@H](C)CO 1458a_100000233767_100000059175 [0,2,0,0,0,0|2,0,0]=4 9341 B15R1.758 Cc1ccc(cc1O)C(=O)N[C@H](C)CF 240690a_100102880703_100000233767 [0,2,0,0,0,0|2,0,0]=4 9342 B15R1.758 Cc1ccc(cc1O)C(=O)N[C@H](C)CO 240690a_100000737577_100000233767 [0,2,0,0,0,0|1,0,0]=3 9343 B15R1.758 O=C(CO)CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210174_100000211430 [0,2,0,0,0,0|1,0,1]=4 9344 B15R1.758 O=C(CO)CC(=O)c1ccc(c(c1)F)Cl 1458a_100000210174_100012351892 [0,2,0,0,0,0|1,0,1]=4 9345 B15R1.881 CC(=O)[C@H](C)NC(=O)c1ccc(cc1)Cl 1458a_100011416790_200000210301 [0,2,0,0,0,0|0,0,2]=4 9346 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 11a_100000211541_100000185839 [0,2,0,0,0,0|1,1,0]=4 9347 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 1626a_100000211541_100000185839 [0,2,0,0,0,0|1,1,0]=4 9348 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 240690a_100000211541_100000185839 [0,2,0,0,0,0|1,1,0]=4 9349 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Br 527a_100000211541_100000185839 [0,2,0,0,0,0|1,1,0]=4 9350 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 11a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9351 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 1626a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9352 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 240690a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9353 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)Cl 527a_100000211541_100000210187 [0,2,0,0,0,0|1,0,0]=3 9354 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 11a_100000211541_100000187176 [0,2,0,0,0,0|1,1,0]=4 9355 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 1626a_100000211541_100000187176 [0,2,0,0,0,0|1,1,0]=4 9356 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 240690a_100000211541_100000187176 [0,2,0,0,0,0|1,1,0]=4 9357 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)F 527a_100000211541_100000187176 [0,2,0,0,0,0|1,1,0]=4 9358 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 11a_100000211541_100000187904 [0,2,0,0,0,0|1,1,0]=4 9359 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 1626a_100000211541_100000187904 [0,2,0,0,0,0|1,1,0]=4 9360 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 240690a_100000211541_100000187904 [0,2,0,0,0,0|1,1,0]=4 9361 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)I 527a_100000211541_100000187904 [0,2,0,0,0,0|1,1,0]=4 9362 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)O 240690a_100000211541_100000212099 [0,2,0,0,0,0|2,0,0]=4 9363 B15R1.881 CC(C)C(C)NC(=O)c1ccc(cc1)O 527a_100000211541_100000212099 [0,2,0,0,0,0|2,0,0]=4 9364 B15R1.881 C[C@@H](NC(=O)c1ccc(cc1)Cl)C(=O)N 11a_100000119354_100000210187 [0,2,0,0,0,0|0,0,2]=4 9365 B15R1.881 C[C@@H](NC(=O)c1ccc(cc1)Cl)C(=O)N 240690a_100000119354_100000210187 [0,2,0,0,0,0|0,0,2]=4 9366 B15R1.881 C[C@@H](NC(=O)c1ccc(cc1)Cl)C(=O)N 527a_100000119354_100000210187 [0,2,0,0,0,0|0,0,2]=4 9367 B15R1.881 C[C@@H](O)C(=O)CC(=O)c1ccc(cc1)Cl 1458a_100000717761_100000211071 [0,2,0,0,0,0|1,0,1]=4 9368 B15R1.881 C[C@H](NC(=O)c1ccc(cc1)Cl)C(=O)[13CH3] 1458a_100011416790_200025704644 [0,2,0,0,0,0|0,0,2]=4 9369 B15R1.881 C[C@H](O)C(=O)CC(=O)c1ccc(cc1)Cl 1458a_217856618621_100000211071 [0,2,0,0,0,0|1,0,1]=4 9370 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 11a_100000211541_100000188618 [0,2,0,0,0,0|2,0,0]=4 9371 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 1626a_100000211541_100000188618 [0,2,0,0,0,0|2,0,0]=4 9372 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 240690a_100000211541_100000188618 [0,2,0,0,0,0|2,0,0]=4 9373 B15R1.881 Cc1ccc(cc1)C(=O)NC(C)C(C)C 527a_100000211541_100000188618 [0,2,0,0,0,0|2,0,0]=4 9374 B15R1.881 O=C(CC(=O)C(O)O)c1ccc(cc1)Cl 1458a_100000233687_100000211071 [0,2,0,0,0,0|1,0,1]=4 9375 B15R1.979 CC(CO)NC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_100012180447 [0,2,0,0,0,0|1,0,1]=4 9376 B15R1.979 CCC(C)NS(=O)(=O)c1ccc(cc1)Cl 270084a_100000209981_100000209962 [0,2,0,0,0,0|2,0,0]=4 9377 B15R1.979 CCC(C)NS(=O)(=O)c1ccc(cc1)Cl 274078a_100000209981_100000209962 [0,2,0,0,0,0|2,0,0]=4 9378 B15R1.979 CCC(C)NS(=O)(=O)c1ccc(cc1)Cl 40a_100000209981_100000077732 [0,2,0,0,0,0|2,0,0]=4 9379 B15R1.979 C[C@H](CF)NS(=O)(=O)c1ccc(cc1)Cl 270084a_100102880703_100000209962 [0,2,0,0,0,0|2,0,0]=4 9380 B15R1.979 C[C@H](CF)NS(=O)(=O)c1ccc(cc1)Cl 274078a_100102880703_100000209962 [0,2,0,0,0,0|2,0,0]=4 9381 B15R1.979 C[C@H](CF)NS(=O)(=O)c1ccc(cc1)Cl 40a_100102880703_100000077732 [0,2,0,0,0,0|2,0,0]=4 9382 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)Br 270084a_100000737577_100000182491 [0,2,0,0,0,0|1,1,0]=4 9383 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)Br 274078a_100000737577_100000182491 [0,2,0,0,0,0|1,1,0]=4 9384 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)Br 40a_100000737577_100010306709 [0,2,0,0,0,0|1,1,0]=4 9385 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)Cl 270084a_100000737577_100000209962 [0,2,0,0,0,0|1,0,0]=3 9386 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)Cl 274078a_100000737577_100000209962 [0,2,0,0,0,0|1,0,0]=3 9387 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)Cl 40a_100000737577_100000077732 [0,2,0,0,0,0|1,0,0]=3 9388 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)F 270084a_100000737577_100000184267 [0,2,0,0,0,0|1,1,0]=4 9389 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)F 274078a_100000737577_100000184267 [0,2,0,0,0,0|1,1,0]=4 9390 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)F 40a_100000737577_100000081159 [0,2,0,0,0,0|1,1,0]=4 9391 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)I 270084a_100000737577_100011205396 [0,2,0,0,0,0|1,1,0]=4 9392 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)I 274078a_100000737577_100011205396 [0,2,0,0,0,0|1,1,0]=4 9393 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)N 40a_100000737577_100000054796 [0,2,0,0,0,0|2,0,0]=4 9394 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)O 270084a_100000737577_100020667864 [0,2,0,0,0,0|2,0,0]=4 9395 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(cc1)O 274078a_100000737577_100020667864 [0,2,0,0,0,0|2,0,0]=4 9396 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(nc1)Cl 270084a_100000737577_100000184283 [0,2,0,0,0,0|2,0,0]=4 9397 B15R1.979 C[C@H](CO)NS(=O)(=O)c1ccc(nc1)Cl 274078a_100000737577_100000184283 [0,2,0,0,0,0|2,0,0]=4 9398 B15R1.979 Cc1ccc(cc1)S(=O)(=O)N[C@H](C)CO 270084a_100000737577_100000211267 [0,2,0,0,0,0|2,0,0]=4 9399 B15R1.979 Cc1ccc(cc1)S(=O)(=O)N[C@H](C)CO 274078a_100000737577_100000211267 [0,2,0,0,0,0|2,0,0]=4 9400 B15R1.979 Cc1ccc(cc1)S(=O)(=O)N[C@H](C)CO 40a_100000737577_100000039673 [0,2,0,0,0,0|2,0,0]=4 9401 B15R1.979 O=C(CO)NS(=O)(=O)c1ccc(cc1)Cl 2740a_100000164505_100000210174 [0,2,0,0,0,0|1,0,1]=4 9402 B15R1.3826 CC(CO)NC(C#N)c1ccc(cc1)Cl 2230a_100000747793_100012180447 [0,2,0,0,0,0|1,0,1]=4 9403 B15R1.3826 CC(CO)N[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100012180447 [0,2,0,0,0,0|0,0,2]=4 9404 B15R1.3826 CC(CO)N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100012180447 [0,2,0,0,0,0|0,0,2]=4 9405 B15R1.3826 CCC(N[C@H](C)CO)c1ccc(cc1)Cl 269862a_100000737577_100000210983 [0,2,0,0,0,0|1,0,1]=4 9406 B15R1.3826 CC[C@H](NC(C)CO)c1ccc(cc1)Cl 2230a_100015186824_100012180447 [0,2,0,0,0,0|1,0,1]=4 9407 B15R1.3826 CC[C@H](NC(C)CO)c1ccc(cc1)Cl 34a_100015186824_100012180447 [0,2,0,0,0,0|1,0,1]=4 9408 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Br)Cl 11a_100000707721_100000766353 [0,2,0,0,0,0|1,0,1]=4 9409 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Br)Cl 1626a_100000707721_100000766353 [0,2,0,0,0,0|1,0,1]=4 9410 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Br)Cl 240690a_100000707721_100000766353 [0,2,0,0,0,0|1,0,1]=4 9411 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Br)Cl 527a_100000707721_100000766353 [0,2,0,0,0,0|1,0,1]=4 9412 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1C)Cl 11a_100000707721_100000688705 [0,2,0,0,0,0|1,0,1]=4 9413 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1C)Cl 1626a_100000707721_100000688705 [0,2,0,0,0,0|1,0,1]=4 9414 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1C)Cl 240690a_100000707721_100000688705 [0,2,0,0,0,0|1,0,1]=4 9415 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1C)Cl 527a_100000707721_100000688705 [0,2,0,0,0,0|1,0,1]=4 9416 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Cl)Cl 11a_100000707721_100000185840 [0,2,0,0,0,0|1,0,1]=4 9417 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Cl)Cl 1626a_100000707721_100000185840 [0,2,0,0,0,0|1,0,1]=4 9418 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Cl)Cl 240690a_100000707721_100000185840 [0,2,0,0,0,0|1,0,1]=4 9419 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1Cl)Cl 527a_100000707721_100000185840 [0,2,0,0,0,0|1,0,1]=4 9420 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1F)Cl 11a_100000707721_100000212326 [0,2,0,0,0,0|1,0,1]=4 9421 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1F)Cl 1626a_100000707721_100000212326 [0,2,0,0,0,0|1,0,1]=4 9422 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1F)Cl 240690a_100000707721_100000212326 [0,2,0,0,0,0|1,0,1]=4 9423 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1F)Cl 527a_100000707721_100000212326 [0,2,0,0,0,0|1,0,1]=4 9424 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1I)Cl 11a_100000707721_100000739380 [0,2,0,0,0,0|1,0,1]=4 9425 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1I)Cl 1626a_100000707721_100000739380 [0,2,0,0,0,0|1,0,1]=4 9426 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1I)Cl 240690a_100000707721_100000739380 [0,2,0,0,0,0|1,0,1]=4 9427 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1I)Cl 527a_100000707721_100000739380 [0,2,0,0,0,0|1,0,1]=4 9428 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1O)Cl 11a_100000707721_100000188622 [0,2,0,0,0,0|1,0,1]=4 9429 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1O)Cl 240690a_100000707721_100000188622 [0,2,0,0,0,0|1,0,1]=4 9430 B15R1.10256 C#CC(C)NC(=O)c1ccc(cc1O)Cl 527a_100000707721_100000188622 [0,2,0,0,0,0|1,0,1]=4 9431 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1Br)Cl 11a_100000737613_100000766353 [0,2,0,0,0,0|1,0,1]=4 9432 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1Br)Cl 1626a_100000737613_100000766353 [0,2,0,0,0,0|1,0,1]=4 9433 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1Br)Cl 527a_100000737613_100000766353 [0,2,0,0,0,0|1,0,1]=4 9434 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1Cl)Cl 11a_100000737613_100000185840 [0,2,0,0,0,0|1,0,1]=4 9435 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1Cl)Cl 1626a_100000737613_100000185840 [0,2,0,0,0,0|1,0,1]=4 9436 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1Cl)Cl 527a_100000737613_100000185840 [0,2,0,0,0,0|1,0,1]=4 9437 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1F)Cl 11a_100000737613_100000212326 [0,2,0,0,0,0|1,0,1]=4 9438 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1F)Cl 1626a_100000737613_100000212326 [0,2,0,0,0,0|1,0,1]=4 9439 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1F)Cl 527a_100000737613_100000212326 [0,2,0,0,0,0|1,0,1]=4 9440 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1I)Cl 11a_100000737613_100000739380 [0,2,0,0,0,0|1,0,1]=4 9441 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1I)Cl 1626a_100000737613_100000739380 [0,2,0,0,0,0|1,0,1]=4 9442 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1I)Cl 527a_100000737613_100000739380 [0,2,0,0,0,0|1,0,1]=4 9443 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1O)Cl 11a_100000737613_100000188622 [0,2,0,0,0,0|1,0,1]=4 9444 B15R1.10256 CC(C#N)NC(=O)c1ccc(cc1O)Cl 527a_100000737613_100000188622 [0,2,0,0,0,0|1,0,1]=4 9445 B15R1.10256 CC(CO)NC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_100012180447 [0,2,0,0,0,0|1,0,1]=4 9446 B15R1.10256 CC(CO)NC(C)c1ccc(cc1Cl)Cl 34a_100000179772_100012180447 [0,2,0,0,0,0|1,0,1]=4 9447 B15R1.10256 CC(N[C@H](C)CO)c1ccc(cc1Br)Cl 269862a_100000737577_100011934292 [0,2,0,0,0,0|1,0,1]=4 9448 B15R1.10256 CC(N[C@H](C)CO)c1ccc(cc1Cl)Cl 269862a_100000737577_100000210972 [0,2,0,0,0,0|1,0,1]=4 9449 B15R1.10256 CC(N[C@H](C)CO)c1ccc(cc1F)Cl 269862a_100000737577_100011805184 [0,2,0,0,0,0|1,0,1]=4 9450 B15R1.10256 CC(N[C@H](C)CO)c1ccc(cc1O)Cl 269862a_100000737577_100000061402 [0,2,0,0,0,0|1,0,1]=4 9451 B15R1.10256 CCC(C)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000748023 [0,2,0,0,0,0|2,0,0]=4 9452 B15R1.10256 CCC(C)CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000748023 [0,2,0,0,0,0|2,0,0]=4 9453 B15R1.10256 CCC(C)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000748023 [0,2,0,0,0,0|2,0,0]=4 9454 B15R1.10256 CCC(C)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000748023 [0,2,0,0,0,0|2,0,0]=4 9455 B15R1.10256 CCC(C)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000748023 [0,2,0,0,0,0|2,0,0]=4 9456 B15R1.10256 CCC(C)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000748023 [0,2,0,0,0,0|2,0,0]=4 9457 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Br 11a_100000209981_100000762965 [0,2,0,0,0,0|1,1,0]=4 9458 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Br 1626a_100000209981_100000762965 [0,2,0,0,0,0|1,1,0]=4 9459 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Br 240690a_100000209981_100000762965 [0,2,0,0,0,0|1,1,0]=4 9460 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Br 527a_100000209981_100000762965 [0,2,0,0,0,0|1,1,0]=4 9461 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)C 11a_100000209981_100000685072 [0,2,0,0,0,0|2,0,0]=4 9462 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)C 1626a_100000209981_100000685072 [0,2,0,0,0,0|2,0,0]=4 9463 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)C 240690a_100000209981_100000685072 [0,2,0,0,0,0|2,0,0]=4 9464 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)C 527a_100000209981_100000685072 [0,2,0,0,0,0|2,0,0]=4 9465 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Cl 11a_100000209981_100000766353 [0,2,0,0,0,0|1,0,0]=3 9466 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Cl 1626a_100000209981_100000766353 [0,2,0,0,0,0|1,0,0]=3 9467 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Cl 240690a_100000209981_100000766353 [0,2,0,0,0,0|1,0,0]=3 9468 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)Cl 527a_100000209981_100000766353 [0,2,0,0,0,0|1,0,0]=3 9469 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)F 11a_100000209981_100000212304 [0,2,0,0,0,0|1,1,0]=4 9470 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)F 1626a_100000209981_100000212304 [0,2,0,0,0,0|1,1,0]=4 9471 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)F 240690a_100000209981_100000212304 [0,2,0,0,0,0|1,1,0]=4 9472 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)F 527a_100000209981_100000212304 [0,2,0,0,0,0|1,1,0]=4 9473 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)I 11a_100000209981_100012360512 [0,2,0,0,0,0|1,1,0]=4 9474 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)I 1626a_100000209981_100012360512 [0,2,0,0,0,0|1,1,0]=4 9475 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)I 240690a_100000209981_100012360512 [0,2,0,0,0,0|1,1,0]=4 9476 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)I 527a_100000209981_100012360512 [0,2,0,0,0,0|1,1,0]=4 9477 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)O 240690a_100000209981_100012344906 [0,2,0,0,0,0|2,0,0]=4 9478 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Br)O 527a_100000209981_100012344906 [0,2,0,0,0,0|2,0,0]=4 9479 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Br 11a_100000209981_100000741311 [0,2,0,0,0,0|1,1,0]=4 9480 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Br 1626a_100000209981_100000741311 [0,2,0,0,0,0|1,1,0]=4 9481 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Br 240690a_100000209981_100000741311 [0,2,0,0,0,0|1,1,0]=4 9482 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Br 527a_100000209981_100000741311 [0,2,0,0,0,0|1,1,0]=4 9483 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)C 11a_100000209981_100000211164 [0,2,0,0,0,0|2,0,0]=4 9484 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)C 1626a_100000209981_100000211164 [0,2,0,0,0,0|2,0,0]=4 9485 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)C 240690a_100000209981_100000211164 [0,2,0,0,0,0|2,0,0]=4 9486 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)C 527a_100000209981_100000211164 [0,2,0,0,0,0|2,0,0]=4 9487 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Cl 11a_100000209981_100000688705 [0,2,0,0,0,0|1,0,0]=3 9488 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Cl 1626a_100000209981_100000688705 [0,2,0,0,0,0|1,0,0]=3 9489 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Cl 240690a_100000209981_100000688705 [0,2,0,0,0,0|1,0,0]=3 9490 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)Cl 527a_100000209981_100000688705 [0,2,0,0,0,0|1,0,0]=3 9491 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)F 11a_100000209981_100000686989 [0,2,0,0,0,0|1,1,0]=4 9492 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)F 1626a_100000209981_100000686989 [0,2,0,0,0,0|1,1,0]=4 9493 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)F 240690a_100000209981_100000686989 [0,2,0,0,0,0|1,1,0]=4 9494 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)F 527a_100000209981_100000686989 [0,2,0,0,0,0|1,1,0]=4 9495 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)I 11a_100000209981_100010189873 [0,2,0,0,0,0|1,1,0]=4 9496 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)I 1626a_100000209981_100010189873 [0,2,0,0,0,0|1,1,0]=4 9497 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)I 240690a_100000209981_100010189873 [0,2,0,0,0,0|1,1,0]=4 9498 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)I 527a_100000209981_100010189873 [0,2,0,0,0,0|1,1,0]=4 9499 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)O 240690a_100000209981_100000692822 [0,2,0,0,0,0|2,0,0]=4 9500 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1C)O 527a_100000209981_100000692822 [0,2,0,0,0,0|2,0,0]=4 9501 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Br 11a_100000209981_100000741628 [0,2,0,0,0,0|1,1,0]=4 9502 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Br 1626a_100000209981_100000741628 [0,2,0,0,0,0|1,1,0]=4 9503 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Br 240690a_100000209981_100000741628 [0,2,0,0,0,0|1,1,0]=4 9504 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Br 527a_100000209981_100000741628 [0,2,0,0,0,0|1,1,0]=4 9505 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)C 11a_100000209981_100000766932 [0,2,0,0,0,0|2,0,0]=4 9506 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)C 1626a_100000209981_100000766932 [0,2,0,0,0,0|2,0,0]=4 9507 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)C 240690a_100000209981_100000766932 [0,2,0,0,0,0|2,0,0]=4 9508 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)C 527a_100000209981_100000766932 [0,2,0,0,0,0|2,0,0]=4 9509 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Cl 11a_100000209981_100000185840 [0,2,0,0,0,0|1,0,0]=3 9510 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Cl 1626a_100000209981_100000185840 [0,2,0,0,0,0|1,0,0]=3 9511 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Cl 240690a_100000209981_100000185840 [0,2,0,0,0,0|1,0,0]=3 9512 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)Cl 527a_100000209981_100000185840 [0,2,0,0,0,0|1,0,0]=3 9513 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)F 11a_100000209981_100000211397 [0,2,0,0,0,0|1,1,0]=4 9514 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)F 1626a_100000209981_100000211397 [0,2,0,0,0,0|1,1,0]=4 9515 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)F 240690a_100000209981_100000211397 [0,2,0,0,0,0|1,1,0]=4 9516 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)F 527a_100000209981_100000211397 [0,2,0,0,0,0|1,1,0]=4 9517 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)I 11a_100000209981_100000751301 [0,2,0,0,0,0|1,1,0]=4 9518 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)I 1626a_100000209981_100000751301 [0,2,0,0,0,0|1,1,0]=4 9519 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)I 240690a_100000209981_100000751301 [0,2,0,0,0,0|1,1,0]=4 9520 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)I 527a_100000209981_100000751301 [0,2,0,0,0,0|1,1,0]=4 9521 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)O 240690a_100000209981_100000702456 [0,2,0,0,0,0|2,0,0]=4 9522 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1Cl)O 527a_100000209981_100000702456 [0,2,0,0,0,0|2,0,0]=4 9523 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Br 11a_100000209981_100000214689 [0,2,0,0,0,0|1,1,0]=4 9524 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Br 1626a_100000209981_100000214689 [0,2,0,0,0,0|1,1,0]=4 9525 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Br 240690a_100000209981_100000214689 [0,2,0,0,0,0|1,1,0]=4 9526 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Br 527a_100000209981_100000214689 [0,2,0,0,0,0|1,1,0]=4 9527 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)C 11a_100000209981_100000766033 [0,2,0,0,0,0|2,0,0]=4 9528 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)C 1626a_100000209981_100000766033 [0,2,0,0,0,0|2,0,0]=4 9529 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)C 240690a_100000209981_100000766033 [0,2,0,0,0,0|2,0,0]=4 9530 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)C 527a_100000209981_100000766033 [0,2,0,0,0,0|2,0,0]=4 9531 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Cl 11a_100000209981_100000212326 [0,2,0,0,0,0|1,0,0]=3 9532 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Cl 1626a_100000209981_100000212326 [0,2,0,0,0,0|1,0,0]=3 9533 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Cl 240690a_100000209981_100000212326 [0,2,0,0,0,0|1,0,0]=3 9534 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)Cl 527a_100000209981_100000212326 [0,2,0,0,0,0|1,0,0]=3 9535 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)F 11a_100000209981_100000211022 [0,2,0,0,0,0|1,1,0]=4 9536 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)F 1626a_100000209981_100000211022 [0,2,0,0,0,0|1,1,0]=4 9537 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)F 240690a_100000209981_100000211022 [0,2,0,0,0,0|1,1,0]=4 9538 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)F 527a_100000209981_100000211022 [0,2,0,0,0,0|1,1,0]=4 9539 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)I 11a_100000209981_100000037189 [0,2,0,0,0,0|1,1,0]=4 9540 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)I 1626a_100000209981_100000037189 [0,2,0,0,0,0|1,1,0]=4 9541 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)I 240690a_100000209981_100000037189 [0,2,0,0,0,0|1,1,0]=4 9542 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)I 527a_100000209981_100000037189 [0,2,0,0,0,0|1,1,0]=4 9543 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)O 240690a_100000209981_100000689029 [0,2,0,0,0,0|2,0,0]=4 9544 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1F)O 527a_100000209981_100000689029 [0,2,0,0,0,0|2,0,0]=4 9545 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Br 11a_100000209981_100000751167 [0,2,0,0,0,0|1,1,0]=4 9546 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Br 1626a_100000209981_100000751167 [0,2,0,0,0,0|1,1,0]=4 9547 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Br 240690a_100000209981_100000751167 [0,2,0,0,0,0|1,1,0]=4 9548 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Br 527a_100000209981_100000751167 [0,2,0,0,0,0|1,1,0]=4 9549 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)C 11a_100000209981_100009999607 [0,2,0,0,0,0|2,0,0]=4 9550 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)C 1626a_100000209981_100009999607 [0,2,0,0,0,0|2,0,0]=4 9551 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)C 240690a_100000209981_100009999607 [0,2,0,0,0,0|2,0,0]=4 9552 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)C 527a_100000209981_100009999607 [0,2,0,0,0,0|2,0,0]=4 9553 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Cl 11a_100000209981_100000739380 [0,2,0,0,0,0|1,0,0]=3 9554 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Cl 1626a_100000209981_100000739380 [0,2,0,0,0,0|1,0,0]=3 9555 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Cl 240690a_100000209981_100000739380 [0,2,0,0,0,0|1,0,0]=3 9556 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)Cl 527a_100000209981_100000739380 [0,2,0,0,0,0|1,0,0]=3 9557 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)F 11a_100000209981_100000739341 [0,2,0,0,0,0|1,1,0]=4 9558 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)F 1626a_100000209981_100000739341 [0,2,0,0,0,0|1,1,0]=4 9559 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)F 240690a_100000209981_100000739341 [0,2,0,0,0,0|1,1,0]=4 9560 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1I)F 527a_100000209981_100000739341 [0,2,0,0,0,0|1,1,0]=4 9561 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)Br 240690a_100000209981_100000744433 [0,2,0,0,0,0|1,1,0]=4 9562 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)Br 527a_100000209981_100000744433 [0,2,0,0,0,0|1,1,0]=4 9563 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)C 1626a_100000209981_100000212137 [0,2,0,0,0,0|2,0,0]=4 9564 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)C 240690a_100000209981_100000212137 [0,2,0,0,0,0|2,0,0]=4 9565 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)C 527a_100000209981_100000212137 [0,2,0,0,0,0|2,0,0]=4 9566 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)Cl 11a_100000209981_100000188622 [0,2,0,0,0,0|1,0,0]=3 9567 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)Cl 240690a_100000209981_100000188622 [0,2,0,0,0,0|1,0,0]=3 9568 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)Cl 527a_100000209981_100000188622 [0,2,0,0,0,0|1,0,0]=3 9569 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)F 240690a_100000209981_100000746061 [0,2,0,0,0,0|1,1,0]=4 9570 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)F 527a_100000209981_100000746061 [0,2,0,0,0,0|1,1,0]=4 9571 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)I 240690a_100000209981_100000091984 [0,2,0,0,0,0|1,1,0]=4 9572 B15R1.10256 CCC(C)NC(=O)c1ccc(cc1O)I 527a_100000209981_100000091984 [0,2,0,0,0,0|1,1,0]=4 9573 B15R1.10256 CCC(O)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011218378 [0,2,0,0,0,0|2,0,0]=4 9574 B15R1.10256 CCC(O)CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011218378 [0,2,0,0,0,0|2,0,0]=4 9575 B15R1.10256 CCC(O)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011218378 [0,2,0,0,0,0|2,0,0]=4 9576 B15R1.10256 CCC(O)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011218378 [0,2,0,0,0,0|2,0,0]=4 9577 B15R1.10256 CCC(O)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011218378 [0,2,0,0,0,0|2,0,0]=4 9578 B15R1.10256 CCC(O)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011218378 [0,2,0,0,0,0|2,0,0]=4 9579 B15R1.10256 CC[C@H](C)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100009816398 [0,2,0,0,0,0|2,0,0]=4 9580 B15R1.10256 CC[C@H](C)CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100009816398 [0,2,0,0,0,0|2,0,0]=4 9581 B15R1.10256 CC[C@H](C)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100009816398 [0,2,0,0,0,0|2,0,0]=4 9582 B15R1.10256 CC[C@H](C)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100009816398 [0,2,0,0,0,0|2,0,0]=4 9583 B15R1.10256 CC[C@H](C)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100009816398 [0,2,0,0,0,0|2,0,0]=4 9584 B15R1.10256 CC[C@H](C)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100009816398 [0,2,0,0,0,0|2,0,0]=4 9585 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000059175 [0,2,0,0,0,0|1,1,0]=4 9586 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000059175 [0,2,0,0,0,0|1,0,0]=3 9587 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000059175 [0,2,0,0,0,0|1,1,0]=4 9588 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000059175 [0,2,0,0,0,0|1,1,0]=4 9589 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000059175 [0,2,0,0,0,0|2,0,0]=4 9590 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000059175 [0,2,0,0,0,0|1,1,0]=4 9591 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000059175 [0,2,0,0,0,0|1,0,0]=3 9592 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000059175 [0,2,0,0,0,0|1,1,0]=4 9593 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000059175 [0,2,0,0,0,0|1,1,0]=4 9594 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000059175 [0,2,0,0,0,0|2,0,0]=4 9595 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000059175 [0,2,0,0,0,0|1,1,0]=4 9596 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000059175 [0,2,0,0,0,0|1,0,0]=3 9597 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1F)F 1458a_100000211022_100000059175 [0,2,0,0,0,0|1,1,0]=4 9598 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1F)I 1458a_100000037189_100000059175 [0,2,0,0,0,0|1,1,0]=4 9599 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1F)O 1458a_100000689029_100000059175 [0,2,0,0,0,0|2,0,0]=4 9600 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000059175 [0,2,0,0,0,0|1,1,0]=4 9601 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000059175 [0,2,0,0,0,0|1,0,0]=3 9602 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1I)F 1458a_100000739341_100000059175 [0,2,0,0,0,0|1,1,0]=4 9603 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000059175 [0,2,0,0,0,0|1,1,0]=4 9604 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000059175 [0,2,0,0,0,0|1,0,0]=3 9605 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1O)F 1458a_100000746061_100000059175 [0,2,0,0,0,0|1,1,0]=4 9606 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1O)I 1458a_100000091984_100000059175 [0,2,0,0,0,0|1,1,0]=4 9607 B15R1.10256 C[C@@H](CO)CC(=O)c1ccc(cc1O)O 1458a_100000212172_100000059175 [0,2,0,0,0,0|2,0,0]=4 9608 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Br 11a_100102880703_100000762965 [0,2,0,0,0,0|1,1,0]=4 9609 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Br 1626a_100102880703_100000762965 [0,2,0,0,0,0|1,1,0]=4 9610 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Br 240690a_100102880703_100000762965 [0,2,0,0,0,0|1,1,0]=4 9611 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Br 527a_100102880703_100000762965 [0,2,0,0,0,0|1,1,0]=4 9612 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Cl 11a_100102880703_100000766353 [0,2,0,0,0,0|1,0,0]=3 9613 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Cl 1626a_100102880703_100000766353 [0,2,0,0,0,0|1,0,0]=3 9614 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Cl 240690a_100102880703_100000766353 [0,2,0,0,0,0|1,0,0]=3 9615 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)Cl 527a_100102880703_100000766353 [0,2,0,0,0,0|1,0,0]=3 9616 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)F 11a_100102880703_100000212304 [0,2,0,0,0,0|1,1,0]=4 9617 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)F 1626a_100102880703_100000212304 [0,2,0,0,0,0|1,1,0]=4 9618 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)F 240690a_100102880703_100000212304 [0,2,0,0,0,0|1,1,0]=4 9619 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)F 527a_100102880703_100000212304 [0,2,0,0,0,0|1,1,0]=4 9620 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)I 11a_100102880703_100012360512 [0,2,0,0,0,0|1,1,0]=4 9621 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)I 1626a_100102880703_100012360512 [0,2,0,0,0,0|1,1,0]=4 9622 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)I 240690a_100102880703_100012360512 [0,2,0,0,0,0|1,1,0]=4 9623 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)I 527a_100102880703_100012360512 [0,2,0,0,0,0|1,1,0]=4 9624 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)O 240690a_100102880703_100012344906 [0,2,0,0,0,0|2,0,0]=4 9625 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Br)O 527a_100102880703_100012344906 [0,2,0,0,0,0|2,0,0]=4 9626 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Br 11a_100102880703_100000741628 [0,2,0,0,0,0|1,1,0]=4 9627 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Br 1626a_100102880703_100000741628 [0,2,0,0,0,0|1,1,0]=4 9628 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Br 240690a_100102880703_100000741628 [0,2,0,0,0,0|1,1,0]=4 9629 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Br 527a_100102880703_100000741628 [0,2,0,0,0,0|1,1,0]=4 9630 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Cl 11a_100102880703_100000185840 [0,2,0,0,0,0|1,0,0]=3 9631 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Cl 1626a_100102880703_100000185840 [0,2,0,0,0,0|1,0,0]=3 9632 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Cl 240690a_100102880703_100000185840 [0,2,0,0,0,0|1,0,0]=3 9633 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)Cl 527a_100102880703_100000185840 [0,2,0,0,0,0|1,0,0]=3 9634 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)F 11a_100102880703_100000211397 [0,2,0,0,0,0|1,1,0]=4 9635 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)F 1626a_100102880703_100000211397 [0,2,0,0,0,0|1,1,0]=4 9636 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)F 240690a_100102880703_100000211397 [0,2,0,0,0,0|1,1,0]=4 9637 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)F 527a_100102880703_100000211397 [0,2,0,0,0,0|1,1,0]=4 9638 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)I 11a_100102880703_100000751301 [0,2,0,0,0,0|1,1,0]=4 9639 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)I 1626a_100102880703_100000751301 [0,2,0,0,0,0|1,1,0]=4 9640 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)I 240690a_100102880703_100000751301 [0,2,0,0,0,0|1,1,0]=4 9641 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)I 527a_100102880703_100000751301 [0,2,0,0,0,0|1,1,0]=4 9642 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)O 240690a_100102880703_100000702456 [0,2,0,0,0,0|2,0,0]=4 9643 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1Cl)O 527a_100102880703_100000702456 [0,2,0,0,0,0|2,0,0]=4 9644 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Br 11a_100102880703_100000214689 [0,2,0,0,0,0|1,1,0]=4 9645 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Br 1626a_100102880703_100000214689 [0,2,0,0,0,0|1,1,0]=4 9646 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Br 240690a_100102880703_100000214689 [0,2,0,0,0,0|1,1,0]=4 9647 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Br 527a_100102880703_100000214689 [0,2,0,0,0,0|1,1,0]=4 9648 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Cl 11a_100102880703_100000212326 [0,2,0,0,0,0|1,0,0]=3 9649 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Cl 1626a_100102880703_100000212326 [0,2,0,0,0,0|1,0,0]=3 9650 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Cl 240690a_100102880703_100000212326 [0,2,0,0,0,0|1,0,0]=3 9651 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)Cl 527a_100102880703_100000212326 [0,2,0,0,0,0|1,0,0]=3 9652 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)F 11a_100102880703_100000211022 [0,2,0,0,0,0|1,1,0]=4 9653 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)F 1626a_100102880703_100000211022 [0,2,0,0,0,0|1,1,0]=4 9654 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)F 240690a_100102880703_100000211022 [0,2,0,0,0,0|1,1,0]=4 9655 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)F 527a_100102880703_100000211022 [0,2,0,0,0,0|1,1,0]=4 9656 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)I 11a_100102880703_100000037189 [0,2,0,0,0,0|1,1,0]=4 9657 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)I 1626a_100102880703_100000037189 [0,2,0,0,0,0|1,1,0]=4 9658 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)I 240690a_100102880703_100000037189 [0,2,0,0,0,0|1,1,0]=4 9659 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)I 527a_100102880703_100000037189 [0,2,0,0,0,0|1,1,0]=4 9660 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)O 240690a_100102880703_100000689029 [0,2,0,0,0,0|2,0,0]=4 9661 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1F)O 527a_100102880703_100000689029 [0,2,0,0,0,0|2,0,0]=4 9662 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Br 11a_100102880703_100000751167 [0,2,0,0,0,0|1,1,0]=4 9663 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Br 1626a_100102880703_100000751167 [0,2,0,0,0,0|1,1,0]=4 9664 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Br 240690a_100102880703_100000751167 [0,2,0,0,0,0|1,1,0]=4 9665 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Br 527a_100102880703_100000751167 [0,2,0,0,0,0|1,1,0]=4 9666 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Cl 11a_100102880703_100000739380 [0,2,0,0,0,0|1,0,0]=3 9667 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Cl 1626a_100102880703_100000739380 [0,2,0,0,0,0|1,0,0]=3 9668 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Cl 240690a_100102880703_100000739380 [0,2,0,0,0,0|1,0,0]=3 9669 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)Cl 527a_100102880703_100000739380 [0,2,0,0,0,0|1,0,0]=3 9670 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)F 11a_100102880703_100000739341 [0,2,0,0,0,0|1,1,0]=4 9671 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)F 1626a_100102880703_100000739341 [0,2,0,0,0,0|1,1,0]=4 9672 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)F 240690a_100102880703_100000739341 [0,2,0,0,0,0|1,1,0]=4 9673 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1I)F 527a_100102880703_100000739341 [0,2,0,0,0,0|1,1,0]=4 9674 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)Br 240690a_100102880703_100000744433 [0,2,0,0,0,0|1,1,0]=4 9675 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)Br 527a_100102880703_100000744433 [0,2,0,0,0,0|1,1,0]=4 9676 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)Cl 11a_100102880703_100000188622 [0,2,0,0,0,0|1,0,0]=3 9677 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)Cl 240690a_100102880703_100000188622 [0,2,0,0,0,0|1,0,0]=3 9678 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)Cl 527a_100102880703_100000188622 [0,2,0,0,0,0|1,0,0]=3 9679 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)F 240690a_100102880703_100000746061 [0,2,0,0,0,0|1,1,0]=4 9680 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)F 527a_100102880703_100000746061 [0,2,0,0,0,0|1,1,0]=4 9681 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)I 240690a_100102880703_100000091984 [0,2,0,0,0,0|1,1,0]=4 9682 B15R1.10256 C[C@H](CF)NC(=O)c1ccc(cc1O)I 527a_100102880703_100000091984 [0,2,0,0,0,0|1,1,0]=4 9683 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)Br 240690a_100000737577_100000762965 [0,2,0,0,0,0|0,1,0]=3 9684 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)Br 527a_100000737577_100000762965 [0,2,0,0,0,0|0,1,0]=3 9685 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)Cl 240690a_100000737577_100000766353 [0,2,0,0,0,0|0,0,0]=2 9686 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)Cl 527a_100000737577_100000766353 [0,2,0,0,0,0|0,0,0]=2 9687 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)F 240690a_100000737577_100000212304 [0,2,0,0,0,0|0,1,0]=3 9688 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)F 527a_100000737577_100000212304 [0,2,0,0,0,0|0,1,0]=3 9689 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)I 240690a_100000737577_100012360512 [0,2,0,0,0,0|0,1,0]=3 9690 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)I 527a_100000737577_100012360512 [0,2,0,0,0,0|0,1,0]=3 9691 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)O 240690a_100000737577_100012344906 [0,2,0,0,0,0|1,0,0]=3 9692 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Br)O 527a_100000737577_100012344906 [0,2,0,0,0,0|1,0,0]=3 9693 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)Br 240690a_100000737577_100000741628 [0,2,0,0,0,0|0,1,0]=3 9694 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)Br 527a_100000737577_100000741628 [0,2,0,0,0,0|0,1,0]=3 9695 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)Cl 240690a_100000737577_100000185840 [0,2,0,0,0,0|0,0,0]=2 9696 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)Cl 527a_100000737577_100000185840 [0,2,0,0,0,0|0,0,0]=2 9697 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)F 240690a_100000737577_100000211397 [0,2,0,0,0,0|0,1,0]=3 9698 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)F 527a_100000737577_100000211397 [0,2,0,0,0,0|0,1,0]=3 9699 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)I 240690a_100000737577_100000751301 [0,2,0,0,0,0|0,1,0]=3 9700 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)I 527a_100000737577_100000751301 [0,2,0,0,0,0|0,1,0]=3 9701 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)O 240690a_100000737577_100000702456 [0,2,0,0,0,0|1,0,0]=3 9702 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1Cl)O 527a_100000737577_100000702456 [0,2,0,0,0,0|1,0,0]=3 9703 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)Br 240690a_100000737577_100000214689 [0,2,0,0,0,0|0,1,0]=3 9704 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)Br 527a_100000737577_100000214689 [0,2,0,0,0,0|0,1,0]=3 9705 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)Cl 240690a_100000737577_100000212326 [0,2,0,0,0,0|0,0,0]=2 9706 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)Cl 527a_100000737577_100000212326 [0,2,0,0,0,0|0,0,0]=2 9707 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)F 240690a_100000737577_100000211022 [0,2,0,0,0,0|0,1,0]=3 9708 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)F 527a_100000737577_100000211022 [0,2,0,0,0,0|0,1,0]=3 9709 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)I 240690a_100000737577_100000037189 [0,2,0,0,0,0|0,1,0]=3 9710 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)I 527a_100000737577_100000037189 [0,2,0,0,0,0|0,1,0]=3 9711 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)O 240690a_100000737577_100000689029 [0,2,0,0,0,0|1,0,0]=3 9712 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1F)O 527a_100000737577_100000689029 [0,2,0,0,0,0|1,0,0]=3 9713 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1I)Br 240690a_100000737577_100000751167 [0,2,0,0,0,0|0,1,0]=3 9714 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1I)Br 527a_100000737577_100000751167 [0,2,0,0,0,0|0,1,0]=3 9715 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1I)Cl 240690a_100000737577_100000739380 [0,2,0,0,0,0|0,0,0]=2 9716 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1I)Cl 527a_100000737577_100000739380 [0,2,0,0,0,0|0,0,0]=2 9717 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1I)F 240690a_100000737577_100000739341 [0,2,0,0,0,0|0,1,0]=3 9718 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1I)F 527a_100000737577_100000739341 [0,2,0,0,0,0|0,1,0]=3 9719 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)Br 240690a_100000737577_100000744433 [0,2,0,0,0,0|0,1,0]=3 9720 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)Br 527a_100000737577_100000744433 [0,2,0,0,0,0|0,1,0]=3 9721 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)Cl 240690a_100000737577_100000188622 [0,2,0,0,0,0|0,0,0]=2 9722 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)Cl 527a_100000737577_100000188622 [0,2,0,0,0,0|0,0,0]=2 9723 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)F 240690a_100000737577_100000746061 [0,2,0,0,0,0|0,1,0]=3 9724 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)F 527a_100000737577_100000746061 [0,2,0,0,0,0|0,1,0]=3 9725 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)I 240690a_100000737577_100000091984 [0,2,0,0,0,0|0,1,0]=3 9726 B15R1.10256 C[C@H](CO)NC(=O)c1ccc(cc1O)I 527a_100000737577_100000091984 [0,2,0,0,0,0|0,1,0]=3 9727 B15R1.10256 Cc1cc(ccc1C(=O)C[C@@H](C)CO)Br 1458a_100000741311_100000059175 [0,2,0,0,0,0|1,1,0]=4 9728 B15R1.10256 Cc1cc(ccc1C(=O)C[C@@H](C)CO)Cl 1458a_100000688705_100000059175 [0,2,0,0,0,0|1,0,0]=3 9729 B15R1.10256 Cc1cc(ccc1C(=O)C[C@@H](C)CO)F 1458a_100000686989_100000059175 [0,2,0,0,0,0|1,1,0]=4 9730 B15R1.10256 Cc1cc(ccc1C(=O)C[C@@H](C)CO)I 1458a_100010189873_100000059175 [0,2,0,0,0,0|1,1,0]=4 9731 B15R1.10256 Cc1cc(ccc1C(=O)C[C@@H](C)CO)O 1458a_100000692822_100000059175 [0,2,0,0,0,0|2,0,0]=4 9732 B15R1.10256 Cc1cc(ccc1C(=O)NC(C)C#N)Cl 11a_100000737613_100000688705 [0,2,0,0,0,0|1,0,1]=4 9733 B15R1.10256 Cc1cc(ccc1C(=O)NC(C)C#N)Cl 1626a_100000737613_100000688705 [0,2,0,0,0,0|1,0,1]=4 9734 B15R1.10256 Cc1cc(ccc1C(=O)NC(C)C#N)Cl 527a_100000737613_100000688705 [0,2,0,0,0,0|1,0,1]=4 9735 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Br 11a_100102880703_100000741311 [0,2,0,0,0,0|1,1,0]=4 9736 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Br 1626a_100102880703_100000741311 [0,2,0,0,0,0|1,1,0]=4 9737 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Br 240690a_100102880703_100000741311 [0,2,0,0,0,0|1,1,0]=4 9738 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Br 527a_100102880703_100000741311 [0,2,0,0,0,0|1,1,0]=4 9739 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Cl 11a_100102880703_100000688705 [0,2,0,0,0,0|1,0,0]=3 9740 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Cl 1626a_100102880703_100000688705 [0,2,0,0,0,0|1,0,0]=3 9741 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Cl 240690a_100102880703_100000688705 [0,2,0,0,0,0|1,0,0]=3 9742 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)Cl 527a_100102880703_100000688705 [0,2,0,0,0,0|1,0,0]=3 9743 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)F 11a_100102880703_100000686989 [0,2,0,0,0,0|1,1,0]=4 9744 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)F 1626a_100102880703_100000686989 [0,2,0,0,0,0|1,1,0]=4 9745 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)F 240690a_100102880703_100000686989 [0,2,0,0,0,0|1,1,0]=4 9746 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)F 527a_100102880703_100000686989 [0,2,0,0,0,0|1,1,0]=4 9747 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)I 11a_100102880703_100010189873 [0,2,0,0,0,0|1,1,0]=4 9748 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)I 1626a_100102880703_100010189873 [0,2,0,0,0,0|1,1,0]=4 9749 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)I 240690a_100102880703_100010189873 [0,2,0,0,0,0|1,1,0]=4 9750 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)I 527a_100102880703_100010189873 [0,2,0,0,0,0|1,1,0]=4 9751 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)O 240690a_100102880703_100000692822 [0,2,0,0,0,0|2,0,0]=4 9752 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CF)O 527a_100102880703_100000692822 [0,2,0,0,0,0|2,0,0]=4 9753 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)Br 240690a_100000737577_100000741311 [0,2,0,0,0,0|0,1,0]=3 9754 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)Br 527a_100000737577_100000741311 [0,2,0,0,0,0|0,1,0]=3 9755 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)Cl 240690a_100000737577_100000688705 [0,2,0,0,0,0|0,0,0]=2 9756 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)Cl 527a_100000737577_100000688705 [0,2,0,0,0,0|0,0,0]=2 9757 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)F 240690a_100000737577_100000686989 [0,2,0,0,0,0|0,1,0]=3 9758 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)F 527a_100000737577_100000686989 [0,2,0,0,0,0|0,1,0]=3 9759 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)I 240690a_100000737577_100010189873 [0,2,0,0,0,0|0,1,0]=3 9760 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)I 527a_100000737577_100010189873 [0,2,0,0,0,0|0,1,0]=3 9761 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)O 240690a_100000737577_100000692822 [0,2,0,0,0,0|1,0,0]=3 9762 B15R1.10256 Cc1cc(ccc1C(=O)N[C@H](C)CO)O 527a_100000737577_100000692822 [0,2,0,0,0,0|1,0,0]=3 9763 B15R1.10256 Cc1cc(ccc1C(C)N[C@H](C)CO)Cl 269862a_100000737577_100011998434 [0,2,0,0,0,0|1,0,1]=4 9764 B15R1.10256 Cc1cc(ccc1[C@H](C)NC(C)CO)Cl 2230a_100020633667_100012180447 [0,2,0,0,0,0|1,0,1]=4 9765 B15R1.10256 Cc1cc(ccc1[C@H](C)NC(C)CO)Cl 34a_100020633667_100012180447 [0,2,0,0,0,0|1,0,1]=4 9766 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)C[C@@H](C)CO 1458a_100000685072_100000059175 [0,2,0,0,0,0|2,0,0]=4 9767 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)N[C@H](C)CF 11a_100102880703_100000685072 [0,2,0,0,0,0|2,0,0]=4 9768 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)N[C@H](C)CF 1626a_100102880703_100000685072 [0,2,0,0,0,0|2,0,0]=4 9769 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)N[C@H](C)CF 240690a_100102880703_100000685072 [0,2,0,0,0,0|2,0,0]=4 9770 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)N[C@H](C)CF 527a_100102880703_100000685072 [0,2,0,0,0,0|2,0,0]=4 9771 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)N[C@H](C)CO 240690a_100000737577_100000685072 [0,2,0,0,0,0|1,0,0]=3 9772 B15R1.10256 Cc1ccc(c(c1)Br)C(=O)N[C@H](C)CO 527a_100000737577_100000685072 [0,2,0,0,0,0|1,0,0]=3 9773 B15R1.10256 Cc1ccc(c(c1)C)C(=O)C[C@@H](C)CO 1458a_100000211164_100000059175 [0,2,0,0,0,0|2,0,0]=4 9774 B15R1.10256 Cc1ccc(c(c1)C)C(=O)N[C@H](C)CF 11a_100102880703_100000211164 [0,2,0,0,0,0|2,0,0]=4 9775 B15R1.10256 Cc1ccc(c(c1)C)C(=O)N[C@H](C)CF 1626a_100102880703_100000211164 [0,2,0,0,0,0|2,0,0]=4 9776 B15R1.10256 Cc1ccc(c(c1)C)C(=O)N[C@H](C)CF 240690a_100102880703_100000211164 [0,2,0,0,0,0|2,0,0]=4 9777 B15R1.10256 Cc1ccc(c(c1)C)C(=O)N[C@H](C)CF 527a_100102880703_100000211164 [0,2,0,0,0,0|2,0,0]=4 9778 B15R1.10256 Cc1ccc(c(c1)C)C(=O)N[C@H](C)CO 240690a_100000737577_100000211164 [0,2,0,0,0,0|1,0,0]=3 9779 B15R1.10256 Cc1ccc(c(c1)C)C(=O)N[C@H](C)CO 527a_100000737577_100000211164 [0,2,0,0,0,0|1,0,0]=3 9780 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)C[C@@H](C)CO 1458a_100000766932_100000059175 [0,2,0,0,0,0|2,0,0]=4 9781 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)N[C@H](C)CF 11a_100102880703_100000766932 [0,2,0,0,0,0|2,0,0]=4 9782 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)N[C@H](C)CF 1626a_100102880703_100000766932 [0,2,0,0,0,0|2,0,0]=4 9783 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)N[C@H](C)CF 240690a_100102880703_100000766932 [0,2,0,0,0,0|2,0,0]=4 9784 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)N[C@H](C)CF 527a_100102880703_100000766932 [0,2,0,0,0,0|2,0,0]=4 9785 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)N[C@H](C)CO 240690a_100000737577_100000766932 [0,2,0,0,0,0|1,0,0]=3 9786 B15R1.10256 Cc1ccc(c(c1)Cl)C(=O)N[C@H](C)CO 527a_100000737577_100000766932 [0,2,0,0,0,0|1,0,0]=3 9787 B15R1.10256 Cc1ccc(c(c1)F)C(=O)C[C@@H](C)CO 1458a_100000766033_100000059175 [0,2,0,0,0,0|2,0,0]=4 9788 B15R1.10256 Cc1ccc(c(c1)F)C(=O)N[C@H](C)CF 11a_100102880703_100000766033 [0,2,0,0,0,0|2,0,0]=4 9789 B15R1.10256 Cc1ccc(c(c1)F)C(=O)N[C@H](C)CF 1626a_100102880703_100000766033 [0,2,0,0,0,0|2,0,0]=4 9790 B15R1.10256 Cc1ccc(c(c1)F)C(=O)N[C@H](C)CF 240690a_100102880703_100000766033 [0,2,0,0,0,0|2,0,0]=4 9791 B15R1.10256 Cc1ccc(c(c1)F)C(=O)N[C@H](C)CF 527a_100102880703_100000766033 [0,2,0,0,0,0|2,0,0]=4 9792 B15R1.10256 Cc1ccc(c(c1)F)C(=O)N[C@H](C)CO 240690a_100000737577_100000766033 [0,2,0,0,0,0|1,0,0]=3 9793 B15R1.10256 Cc1ccc(c(c1)F)C(=O)N[C@H](C)CO 527a_100000737577_100000766033 [0,2,0,0,0,0|1,0,0]=3 9794 B15R1.10256 Cc1ccc(c(c1)I)C(=O)C[C@@H](C)CO 1458a_100009999607_100000059175 [0,2,0,0,0,0|2,0,0]=4 9795 B15R1.10256 Cc1ccc(c(c1)I)C(=O)N[C@H](C)CF 11a_100102880703_100009999607 [0,2,0,0,0,0|2,0,0]=4 9796 B15R1.10256 Cc1ccc(c(c1)I)C(=O)N[C@H](C)CF 1626a_100102880703_100009999607 [0,2,0,0,0,0|2,0,0]=4 9797 B15R1.10256 Cc1ccc(c(c1)I)C(=O)N[C@H](C)CF 240690a_100102880703_100009999607 [0,2,0,0,0,0|2,0,0]=4 9798 B15R1.10256 Cc1ccc(c(c1)I)C(=O)N[C@H](C)CF 527a_100102880703_100009999607 [0,2,0,0,0,0|2,0,0]=4 9799 B15R1.10256 Cc1ccc(c(c1)I)C(=O)N[C@H](C)CO 240690a_100000737577_100009999607 [0,2,0,0,0,0|1,0,0]=3 9800 B15R1.10256 Cc1ccc(c(c1)I)C(=O)N[C@H](C)CO 527a_100000737577_100009999607 [0,2,0,0,0,0|1,0,0]=3 9801 B15R1.10256 Cc1ccc(c(c1)O)C(=O)C[C@@H](C)CO 1458a_100000212137_100000059175 [0,2,0,0,0,0|2,0,0]=4 9802 B15R1.10256 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CF 1626a_100102880703_100000212137 [0,2,0,0,0,0|2,0,0]=4 9803 B15R1.10256 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CF 240690a_100102880703_100000212137 [0,2,0,0,0,0|2,0,0]=4 9804 B15R1.10256 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CF 527a_100102880703_100000212137 [0,2,0,0,0,0|2,0,0]=4 9805 B15R1.10256 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CO 240690a_100000737577_100000212137 [0,2,0,0,0,0|1,0,0]=3 9806 B15R1.10256 Cc1ccc(c(c1)O)C(=O)N[C@H](C)CO 527a_100000737577_100000212137 [0,2,0,0,0,0|1,0,0]=3 9807 B15R1.10256 O=C(CO)CC(=O)c1ccc(cc1Cl)Cl 1458a_100000210174_100000185731 [0,2,0,0,0,0|1,0,1]=4 9808 B15R1.10256 O=C(CO)CC(=O)c1ccc(cc1F)Cl 1458a_100000210174_100012351891 [0,2,0,0,0,0|1,0,1]=4 9809 B15R1.30 C#CCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100010269958 [0,2,0,0,0,0|2,0,0]=4 9810 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Br 11a_100000718082_100000185839 [0,2,0,0,0,0|1,1,0]=4 9811 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Br 1626a_100000718082_100000185839 [0,2,0,0,0,0|1,1,0]=4 9812 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Br 240690a_100000718082_100000185839 [0,2,0,0,0,0|1,1,0]=4 9813 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Br 527a_100000718082_100000185839 [0,2,0,0,0,0|1,1,0]=4 9814 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)C 11a_100000718082_100000188618 [0,2,0,0,0,0|2,0,0]=4 9815 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)C 1626a_100000718082_100000188618 [0,2,0,0,0,0|2,0,0]=4 9816 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)C 240690a_100000718082_100000188618 [0,2,0,0,0,0|2,0,0]=4 9817 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)C 527a_100000718082_100000188618 [0,2,0,0,0,0|2,0,0]=4 9818 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Cl 11a_100000718082_100000210187 [0,2,0,0,0,0|1,0,0]=3 9819 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Cl 1626a_100000718082_100000210187 [0,2,0,0,0,0|1,0,0]=3 9820 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Cl 240690a_100000718082_100000210187 [0,2,0,0,0,0|1,0,0]=3 9821 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)Cl 527a_100000718082_100000210187 [0,2,0,0,0,0|1,0,0]=3 9822 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)F 11a_100000718082_100000187176 [0,2,0,0,0,0|1,1,0]=4 9823 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)F 1626a_100000718082_100000187176 [0,2,0,0,0,0|1,1,0]=4 9824 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)F 240690a_100000718082_100000187176 [0,2,0,0,0,0|1,1,0]=4 9825 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)F 527a_100000718082_100000187176 [0,2,0,0,0,0|1,1,0]=4 9826 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)I 11a_100000718082_100000187904 [0,2,0,0,0,0|1,1,0]=4 9827 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)I 1626a_100000718082_100000187904 [0,2,0,0,0,0|1,1,0]=4 9828 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)I 240690a_100000718082_100000187904 [0,2,0,0,0,0|1,1,0]=4 9829 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)I 527a_100000718082_100000187904 [0,2,0,0,0,0|1,1,0]=4 9830 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)O 240690a_100000718082_100000212099 [0,2,0,0,0,0|2,0,0]=4 9831 B15R1.30 C#CCCCNC(=O)c1ccc(cc1)O 527a_100000718082_100000212099 [0,2,0,0,0,0|2,0,0]=4 9832 B15R1.30 C#CCCNCC(=O)c1ccc(cc1)Br 34a_100000755551_100000188085 [0,2,0,0,0,0|1,1,0]=4 9833 B15R1.30 C#CCCNCC(=O)c1ccc(cc1)C 34a_100000755551_100000211441 [0,2,0,0,0,0|2,0,0]=4 9834 B15R1.30 C#CCCNCC(=O)c1ccc(cc1)I 34a_100000755551_100011216261 [0,2,0,0,0,0|1,1,0]=4 9835 B15R1.30 C#CCCNCC(=O)c1ccc(cc1)O 34a_100000755551_100009814261 [0,2,0,0,0,0|2,0,0]=4 9836 B15R1.30 C#CCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000688953 [0,2,0,0,0,0|2,0,0]=4 9837 B15R1.30 C#CCCSCC(=O)c1ccc(cc1)Cl 62a_100000688953_100000211071 [0,2,0,0,0,0|2,0,0]=4 9838 B15R1.30 C#CCOCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100010402529 [0,2,0,0,0,0|2,0,0]=4 9839 B15R1.30 C#CCSCCC(=O)c1ccc(cc1)Cl 62a_100000038162_100011216492 [0,2,0,0,0,0|2,0,0]=4 9840 B15R1.30 C=CCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215482 [0,2,0,0,0,0|2,0,0]=4 9841 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Br 11a_100000700776_100000185839 [0,2,0,0,0,0|1,1,0]=4 9842 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Br 1626a_100000700776_100000185839 [0,2,0,0,0,0|1,1,0]=4 9843 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Br 240690a_100000700776_100000185839 [0,2,0,0,0,0|1,1,0]=4 9844 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Br 527a_100000700776_100000185839 [0,2,0,0,0,0|1,1,0]=4 9845 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)C 11a_100000700776_100000188618 [0,2,0,0,0,0|2,0,0]=4 9846 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)C 1626a_100000700776_100000188618 [0,2,0,0,0,0|2,0,0]=4 9847 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)C 240690a_100000700776_100000188618 [0,2,0,0,0,0|2,0,0]=4 9848 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)C 527a_100000700776_100000188618 [0,2,0,0,0,0|2,0,0]=4 9849 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Cl 11a_100000700776_100000210187 [0,2,0,0,0,0|1,0,0]=3 9850 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Cl 1626a_100000700776_100000210187 [0,2,0,0,0,0|1,0,0]=3 9851 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Cl 240690a_100000700776_100000210187 [0,2,0,0,0,0|1,0,0]=3 9852 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)Cl 527a_100000700776_100000210187 [0,2,0,0,0,0|1,0,0]=3 9853 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)F 11a_100000700776_100000187176 [0,2,0,0,0,0|1,1,0]=4 9854 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)F 1626a_100000700776_100000187176 [0,2,0,0,0,0|1,1,0]=4 9855 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)F 240690a_100000700776_100000187176 [0,2,0,0,0,0|1,1,0]=4 9856 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)F 527a_100000700776_100000187176 [0,2,0,0,0,0|1,1,0]=4 9857 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)I 11a_100000700776_100000187904 [0,2,0,0,0,0|1,1,0]=4 9858 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)I 1626a_100000700776_100000187904 [0,2,0,0,0,0|1,1,0]=4 9859 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)I 240690a_100000700776_100000187904 [0,2,0,0,0,0|1,1,0]=4 9860 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)I 527a_100000700776_100000187904 [0,2,0,0,0,0|1,1,0]=4 9861 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)O 240690a_100000700776_100000212099 [0,2,0,0,0,0|2,0,0]=4 9862 B15R1.30 C=CCCCNC(=O)c1ccc(cc1)O 527a_100000700776_100000212099 [0,2,0,0,0,0|2,0,0]=4 9863 B15R1.30 C=CCCNCC(=O)c1ccc(cc1)C 2230a_100015191253_100000211441 [0,2,0,0,0,0|2,0,0]=4 9864 B15R1.30 C=CCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000754431 [0,2,0,0,0,0|2,0,0]=4 9865 B15R1.30 C=CCCSCC(=O)c1ccc(cc1)Cl 62a_100000754431_100000211071 [0,2,0,0,0,0|2,0,0]=4 9866 B15R1.30 C=CCSCCC(=O)c1ccc(cc1)Cl 62a_100000210623_100011216492 [0,2,0,0,0,0|2,0,0]=4 9867 B15R1.30 C=CCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210623 [0,2,0,0,0,0|2,0,0]=4 9868 B15R1.30 C=COCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000039644 [0,2,0,0,0,0|1,0,1]=4 9869 B15R1.30 C=COCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000039644 [0,2,0,0,0,0|1,0,1]=4 9870 B15R1.30 CC(=NNCCC#N)c1ccc(cc1)Cl 4a_100000229987_100000185797 [0,2,0,0,0,0|2,0,0]=4 9871 B15R1.30 CC(NCCCCO)c1ccc(cc1)Cl 2230a_100000750430_100000684792 [0,2,0,0,0,0|1,0,1]=4 9872 B15R1.30 CC(NCCCCO)c1ccc(cc1)Cl 269862a_100000750430_100000185797 [0,2,0,0,0,0|1,0,1]=4 9873 B15R1.30 CC/C=C\CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100015370543 [0,2,0,0,0,0|2,0,0]=4 9874 B15R1.30 CCCC=NNC(=O)c1ccc(cc1)Br 4a_100000183614_100000185831 [0,2,0,0,0,0|1,1,0]=4 9875 B15R1.30 CCCC=NNC(=O)c1ccc(cc1)C 4a_100000189790_100000185831 [0,2,0,0,0,0|2,0,0]=4 9876 B15R1.30 CCCC=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_100000185831 [0,2,0,0,0,0|1,0,0]=3 9877 B15R1.30 CCCC=NNC(=O)c1ccc(cc1)F 4a_100000182866_100000185831 [0,2,0,0,0,0|1,1,0]=4 9878 B15R1.30 CCCC=NNC(=O)c1ccc(cc1)I 4a_100000189773_100000185831 [0,2,0,0,0,0|1,1,0]=4 9879 B15R1.30 CCCC=NNC(=O)c1ccc(cn1)Cl 4a_100012017650_100000185831 [0,2,0,0,0,0|2,0,0]=4 9880 B15R1.30 CCCC=NNC(=O)c1ccc(nc1)Cl 4a_100000189807_100000185831 [0,2,0,0,0,0|2,0,0]=4 9881 B15R1.30 CCCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210757 [0,2,0,0,0,0|2,0,0]=4 9882 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Br 11a_100000209983_100000185839 [0,2,0,0,0,0|1,1,0]=4 9883 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Br 1626a_100000209983_100000185839 [0,2,0,0,0,0|1,1,0]=4 9884 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Br 240690a_100000209983_100000185839 [0,2,0,0,0,0|1,1,0]=4 9885 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Br 527a_100000209983_100000185839 [0,2,0,0,0,0|1,1,0]=4 9886 B15R1.30 CCCCCNC(=O)c1ccc(cc1)C 11a_100000209983_100000188618 [0,2,0,0,0,0|2,0,0]=4 9887 B15R1.30 CCCCCNC(=O)c1ccc(cc1)C 1626a_100000209983_100000188618 [0,2,0,0,0,0|2,0,0]=4 9888 B15R1.30 CCCCCNC(=O)c1ccc(cc1)C 240690a_100000209983_100000188618 [0,2,0,0,0,0|2,0,0]=4 9889 B15R1.30 CCCCCNC(=O)c1ccc(cc1)C 527a_100000209983_100000188618 [0,2,0,0,0,0|2,0,0]=4 9890 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Cl 11a_100000209983_100000210187 [0,2,0,0,0,0|1,0,0]=3 9891 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Cl 1626a_100000209983_100000210187 [0,2,0,0,0,0|1,0,0]=3 9892 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Cl 240690a_100000209983_100000210187 [0,2,0,0,0,0|1,0,0]=3 9893 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Cl 527a_100000209983_100000210187 [0,2,0,0,0,0|1,0,0]=3 9894 B15R1.30 CCCCCNC(=O)c1ccc(cc1)F 11a_100000209983_100000187176 [0,2,0,0,0,0|1,1,0]=4 9895 B15R1.30 CCCCCNC(=O)c1ccc(cc1)F 1626a_100000209983_100000187176 [0,2,0,0,0,0|1,1,0]=4 9896 B15R1.30 CCCCCNC(=O)c1ccc(cc1)F 240690a_100000209983_100000187176 [0,2,0,0,0,0|1,1,0]=4 9897 B15R1.30 CCCCCNC(=O)c1ccc(cc1)F 527a_100000209983_100000187176 [0,2,0,0,0,0|1,1,0]=4 9898 B15R1.30 CCCCCNC(=O)c1ccc(cc1)I 11a_100000209983_100000187904 [0,2,0,0,0,0|1,1,0]=4 9899 B15R1.30 CCCCCNC(=O)c1ccc(cc1)I 1626a_100000209983_100000187904 [0,2,0,0,0,0|1,1,0]=4 9900 B15R1.30 CCCCCNC(=O)c1ccc(cc1)I 240690a_100000209983_100000187904 [0,2,0,0,0,0|1,1,0]=4 9901 B15R1.30 CCCCCNC(=O)c1ccc(cc1)I 527a_100000209983_100000187904 [0,2,0,0,0,0|1,1,0]=4 9902 B15R1.30 CCCCCNC(=O)c1ccc(cc1)O 240690a_100000209983_100000212099 [0,2,0,0,0,0|2,0,0]=4 9903 B15R1.30 CCCCCNC(=O)c1ccc(cc1)O 527a_100000209983_100000212099 [0,2,0,0,0,0|2,0,0]=4 9904 B15R1.30 CCCCNCC(=O)c1ccc(cc1)Br 7a_106832991798_100000188085 [0,2,0,0,0,0|1,1,0]=4 9905 B15R1.30 CCCCNCC(=O)c1ccc(cc1)C 2230a_100000102301_100000211441 [0,2,0,0,0,0|2,0,0]=4 9906 B15R1.30 CCCCNCC(=O)c1ccc(cc1)C 7a_106832991798_100000211441 [0,2,0,0,0,0|2,0,0]=4 9907 B15R1.30 CCCCNCC(=O)c1ccc(cc1)Cl 7a_106832991798_100000211071 [0,2,0,0,0,0|1,0,0]=3 9908 B15R1.30 CCCCNCC(=O)c1ccc(cc1)F 7a_106832991798_100000211279 [0,2,0,0,0,0|1,1,0]=4 9909 B15R1.30 CCCCNCC(=O)c1ccc(cc1)I 7a_106832991798_100011216261 [0,2,0,0,0,0|1,1,0]=4 9910 B15R1.30 CCCCNCC(=O)c1ccc(cc1)O 7a_106832991798_100000018856 [0,2,0,0,0,0|2,0,0]=4 9911 B15R1.30 CCCCNCC(=O)c1ccc(cn1)Cl 7a_106832991798_100016989621 [0,2,0,0,0,0|2,0,0]=4 9912 B15R1.30 CCCCNN=C(C)c1ccc(cc1)Cl 4a_100025702795_100000185797 [0,2,0,0,0,0|2,0,0]=4 9913 B15R1.30 CCCCNNC(=O)c1ccc(cc1)Br 22a_100025702795_100000185839 [0,2,0,0,0,0|1,1,0]=4 9914 B15R1.30 CCCCNNC(=O)c1ccc(cc1)C 22a_100025702795_100000188618 [0,2,0,0,0,0|2,0,0]=4 9915 B15R1.30 CCCCNNC(=O)c1ccc(cc1)Cl 22a_100025702795_100000210187 [0,2,0,0,0,0|1,0,0]=3 9916 B15R1.30 CCCCNNC(=O)c1ccc(cc1)F 22a_100025702795_100000187176 [0,2,0,0,0,0|1,1,0]=4 9917 B15R1.30 CCCCNNC(=O)c1ccc(cc1)I 22a_100025702795_100000187904 [0,2,0,0,0,0|1,1,0]=4 9918 B15R1.30 CCCCNNC(=O)c1ccc(cc1)O 22a_100025702795_100000212099 [0,2,0,0,0,0|2,0,0]=4 9919 B15R1.30 CCCCOCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011995733 [0,2,0,0,0,0|2,0,0]=4 9920 B15R1.30 CCCCOCC(=O)c1ccc(cc1)Cl 7a_100000210227_100000211071 [0,2,0,0,0,0|2,0,0]=4 9921 B15R1.30 CCCCSCC(=O)c1ccc(cc1)Cl 62a_100000210211_100000211071 [0,2,0,0,0,0|2,0,0]=4 9922 B15R1.30 CCCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210210 [0,2,0,0,0,0|2,0,0]=4 9923 B15R1.30 CCCOCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215938 [0,2,0,0,0,0|2,0,0]=4 9924 B15R1.30 CCCSCCC(=O)c1ccc(cc1)Cl 62a_100000210303_100011216492 [0,2,0,0,0,0|2,0,0]=4 9925 B15R1.30 CCCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210303 [0,2,0,0,0,0|2,0,0]=4 9926 B15R1.30 CCNCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_100000210202 [0,2,0,0,0,0|1,0,0]=3 9927 B15R1.30 CCNCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_100000210202 [0,2,0,0,0,0|1,0,0]=3 9928 B15R1.30 CCNCCNC(=O)c1ccc(cc1)F 2230a_100000753910_100000210202 [0,2,0,0,0,0|1,1,0]=4 9929 B15R1.30 CCNCCNC(=O)c1ccc(cc1)F 34a_100000753910_100000210202 [0,2,0,0,0,0|1,1,0]=4 9930 B15R1.30 CCOCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100012232248 [0,2,0,0,0,0|1,1,0]=4 9931 B15R1.30 CCOCCCC(=O)c1ccc(cc1)Br 34a_100121572206_100000211046 [0,2,0,0,0,0|1,1,0]=4 9932 B15R1.30 CCOCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100012232248 [0,2,0,0,0,0|2,0,0]=4 9933 B15R1.30 CCOCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100012232248 [0,2,0,0,0,0|1,0,0]=3 9934 B15R1.30 CCOCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100012232248 [0,2,0,0,0,0|1,1,0]=4 9935 B15R1.30 CCOCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100012232248 [0,2,0,0,0,0|1,1,0]=4 9936 B15R1.30 CCOCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100012232248 [0,2,0,0,0,0|2,0,0]=4 9937 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Br 11a_100011200944_100000185839 [0,2,0,0,0,0|0,1,0]=3 9938 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Br 1626a_102516460346_100000185839 [0,2,0,0,0,0|0,1,0]=3 9939 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Br 240690a_100011200944_100000185839 [0,2,0,0,0,0|0,1,0]=3 9940 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Br 34a_200000158904_100000210202 [0,2,0,0,0,0|0,1,0]=3 9941 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Br 527a_100011200944_100000185839 [0,2,0,0,0,0|0,1,0]=3 9942 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 11a_100011200944_100000188618 [0,2,0,0,0,0|1,0,0]=3 9943 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 1626a_102516460346_100000188618 [0,2,0,0,0,0|1,0,0]=3 9944 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 240690a_100011200944_100000188618 [0,2,0,0,0,0|1,0,0]=3 9945 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 34a_200000158910_100000210202 [0,2,0,0,0,0|1,0,0]=3 9946 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 527a_100011200944_100000188618 [0,2,0,0,0,0|1,0,0]=3 9947 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 7a_200000158910_100000210202 [0,2,0,0,0,0|1,0,0]=3 9948 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Cl 11a_100011200944_100000210187 [0,2,0,0,0,0|0,0,0]=2 9949 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Cl 1626a_102516460346_100000210187 [0,2,0,0,0,0|0,0,0]=2 9950 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Cl 240690a_100011200944_100000210187 [0,2,0,0,0,0|0,0,0]=2 9951 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Cl 527a_100011200944_100000210187 [0,2,0,0,0,0|0,0,0]=2 9952 B15R1.30 CCOCCNC(=O)c1ccc(cc1)F 11a_100011200944_100000187176 [0,2,0,0,0,0|0,1,0]=3 9953 B15R1.30 CCOCCNC(=O)c1ccc(cc1)F 1626a_102516460346_100000187176 [0,2,0,0,0,0|0,1,0]=3 9954 B15R1.30 CCOCCNC(=O)c1ccc(cc1)F 240690a_100011200944_100000187176 [0,2,0,0,0,0|0,1,0]=3 9955 B15R1.30 CCOCCNC(=O)c1ccc(cc1)F 527a_100011200944_100000187176 [0,2,0,0,0,0|0,1,0]=3 9956 B15R1.30 CCOCCNC(=O)c1ccc(cc1)I 11a_100011200944_100000187904 [0,2,0,0,0,0|0,1,0]=3 9957 B15R1.30 CCOCCNC(=O)c1ccc(cc1)I 1626a_102516460346_100000187904 [0,2,0,0,0,0|0,1,0]=3 9958 B15R1.30 CCOCCNC(=O)c1ccc(cc1)I 240690a_100011200944_100000187904 [0,2,0,0,0,0|0,1,0]=3 9959 B15R1.30 CCOCCNC(=O)c1ccc(cc1)I 527a_100011200944_100000187904 [0,2,0,0,0,0|0,1,0]=3 9960 B15R1.30 CCOCCNC(=O)c1ccc(cc1)N 34a_100000740983_100000210202 [0,2,0,0,0,0|1,0,0]=3 9961 B15R1.30 CCOCCNC(=O)c1ccc(cc1)O 240690a_100011200944_100000212099 [0,2,0,0,0,0|1,0,0]=3 9962 B15R1.30 CCOCCNC(=O)c1ccc(cc1)O 527a_100011200944_100000212099 [0,2,0,0,0,0|1,0,0]=3 9963 B15R1.30 CCOCCNC(C)c1ccc(cc1)Cl 2230a_102516460346_100000684792 [0,2,0,0,0,0|1,0,1]=4 9964 B15R1.30 CCOCCNC(C)c1ccc(cc1)Cl 269862a_100011200944_100000185797 [0,2,0,0,0,0|1,0,1]=4 9965 B15R1.30 CCOCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100011215890 [0,2,0,0,0,0|1,0,1]=4 9966 B15R1.30 CCOCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210147 [0,2,0,0,0,0|1,0,1]=4 9967 B15R1.30 CCOCCOC(=O)c1ccc(cc1)C 7a_200000031072_100000210202 [0,2,0,0,0,0|2,0,0]=4 9968 B15R1.30 CCOCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000739092 [0,2,0,0,0,0|2,0,0]=4 9969 B15R1.30 CCOCSCC(=O)c1ccc(cc1)Cl 62a_100000739092_100000211071 [0,2,0,0,0,0|2,0,0]=4 9970 B15R1.30 CCSCCCC(=O)c1ccc(cc1)Cl 62a_100000210202_200011217871 [0,2,0,0,0,0|1,1,0]=4 9971 B15R1.30 CCSCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_100000210202 [0,2,0,0,0,0|1,1,0]=4 9972 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Br 11a_100000106463_100000185839 [0,2,0,0,0,0|0,2,0]=4 9973 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Br 1626a_100000106463_100000185839 [0,2,0,0,0,0|0,2,0]=4 9974 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Br 240690a_100000106463_100000185839 [0,2,0,0,0,0|0,2,0]=4 9975 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Br 527a_100000106463_100000185839 [0,2,0,0,0,0|0,2,0]=4 9976 B15R1.30 CCSCCNC(=O)c1ccc(cc1)C 11a_100000106463_100000188618 [0,2,0,0,0,0|1,1,0]=4 9977 B15R1.30 CCSCCNC(=O)c1ccc(cc1)C 1626a_100000106463_100000188618 [0,2,0,0,0,0|1,1,0]=4 9978 B15R1.30 CCSCCNC(=O)c1ccc(cc1)C 240690a_100000106463_100000188618 [0,2,0,0,0,0|1,1,0]=4 9979 B15R1.30 CCSCCNC(=O)c1ccc(cc1)C 527a_100000106463_100000188618 [0,2,0,0,0,0|1,1,0]=4 9980 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Cl 11a_100000106463_100000210187 [0,2,0,0,0,0|0,1,0]=3 9981 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Cl 1626a_100000106463_100000210187 [0,2,0,0,0,0|0,1,0]=3 9982 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Cl 240690a_100000106463_100000210187 [0,2,0,0,0,0|0,1,0]=3 9983 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Cl 527a_100000106463_100000210187 [0,2,0,0,0,0|0,1,0]=3 9984 B15R1.30 CCSCCNC(=O)c1ccc(cc1)F 11a_100000106463_100000187176 [0,2,0,0,0,0|0,2,0]=4 9985 B15R1.30 CCSCCNC(=O)c1ccc(cc1)F 1626a_100000106463_100000187176 [0,2,0,0,0,0|0,2,0]=4 9986 B15R1.30 CCSCCNC(=O)c1ccc(cc1)F 240690a_100000106463_100000187176 [0,2,0,0,0,0|0,2,0]=4 9987 B15R1.30 CCSCCNC(=O)c1ccc(cc1)F 527a_100000106463_100000187176 [0,2,0,0,0,0|0,2,0]=4 9988 B15R1.30 CCSCCNC(=O)c1ccc(cc1)I 11a_100000106463_100000187904 [0,2,0,0,0,0|0,2,0]=4 9989 B15R1.30 CCSCCNC(=O)c1ccc(cc1)I 1626a_100000106463_100000187904 [0,2,0,0,0,0|0,2,0]=4 9990 B15R1.30 CCSCCNC(=O)c1ccc(cc1)I 240690a_100000106463_100000187904 [0,2,0,0,0,0|0,2,0]=4 9991 B15R1.30 CCSCCNC(=O)c1ccc(cc1)I 527a_100000106463_100000187904 [0,2,0,0,0,0|0,2,0]=4 9992 B15R1.30 CCSCCNC(=O)c1ccc(cc1)O 240690a_100000106463_100000212099 [0,2,0,0,0,0|1,1,0]=4 9993 B15R1.30 CCSCCNC(=O)c1ccc(cc1)O 527a_100000106463_100000212099 [0,2,0,0,0,0|1,1,0]=4 9994 B15R1.30 COCCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000755781 [0,2,0,0,0,0|1,1,0]=4 9995 B15R1.30 COCCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000755781 [0,2,0,0,0,0|2,0,0]=4 9996 B15R1.30 COCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000755781 [0,2,0,0,0,0|1,0,0]=3 9997 B15R1.30 COCCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000755781 [0,2,0,0,0,0|1,1,0]=4 9998 B15R1.30 COCCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000755781 [0,2,0,0,0,0|1,1,0]=4 9999 B15R1.30 COCCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000755781 [0,2,0,0,0,0|2,0,0]=4 10000 B15R1.30 COCCCNC(=O)c1ccc(cc1)Br 1626a_100150723488_100000185839 [0,2,0,0,0,0|0,1,0]=3 10001 B15R1.30 COCCCNC(=O)c1ccc(cc1)Br 240690a_100150723488_100000185839 [0,2,0,0,0,0|0,1,0]=3 10002 B15R1.30 COCCCNC(=O)c1ccc(cc1)Br 527a_100150723488_100000185839 [0,2,0,0,0,0|0,1,0]=3 10003 B15R1.30 COCCCNC(=O)c1ccc(cc1)C 1626a_100150723488_100000188618 [0,2,0,0,0,0|1,0,0]=3 10004 B15R1.30 COCCCNC(=O)c1ccc(cc1)C 240690a_100150723488_100000188618 [0,2,0,0,0,0|1,0,0]=3 10005 B15R1.30 COCCCNC(=O)c1ccc(cc1)C 527a_100150723488_100000188618 [0,2,0,0,0,0|1,0,0]=3 10006 B15R1.30 COCCCNC(=O)c1ccc(cc1)Cl 1626a_100150723488_100000210187 [0,2,0,0,0,0|0,0,0]=2 10007 B15R1.30 COCCCNC(=O)c1ccc(cc1)Cl 240690a_100150723488_100000210187 [0,2,0,0,0,0|0,0,0]=2 10008 B15R1.30 COCCCNC(=O)c1ccc(cc1)Cl 527a_100150723488_100000210187 [0,2,0,0,0,0|0,0,0]=2 10009 B15R1.30 COCCCNC(=O)c1ccc(cc1)F 1626a_100150723488_100000187176 [0,2,0,0,0,0|0,1,0]=3 10010 B15R1.30 COCCCNC(=O)c1ccc(cc1)F 240690a_100150723488_100000187176 [0,2,0,0,0,0|0,1,0]=3 10011 B15R1.30 COCCCNC(=O)c1ccc(cc1)F 527a_100150723488_100000187176 [0,2,0,0,0,0|0,1,0]=3 10012 B15R1.30 COCCCNC(=O)c1ccc(cc1)I 1626a_100150723488_100000187904 [0,2,0,0,0,0|0,1,0]=3 10013 B15R1.30 COCCCNC(=O)c1ccc(cc1)I 240690a_100150723488_100000187904 [0,2,0,0,0,0|0,1,0]=3 10014 B15R1.30 COCCCNC(=O)c1ccc(cc1)I 527a_100150723488_100000187904 [0,2,0,0,0,0|0,1,0]=3 10015 B15R1.30 COCCCNC(=O)c1ccc(cc1)O 240690a_100150723488_100000212099 [0,2,0,0,0,0|1,0,0]=3 10016 B15R1.30 COCCCNC(=O)c1ccc(cc1)O 527a_100150723488_100000212099 [0,2,0,0,0,0|1,0,0]=3 10017 B15R1.30 COCCCNC(C)c1ccc(cc1)Cl 269862a_100150723488_100000185797 [0,2,0,0,0,0|1,0,1]=4 10018 B15R1.30 COCCCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000740836 [0,2,0,0,0,0|1,0,1]=4 10019 B15R1.30 COCCCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000740836 [0,2,0,0,0,0|1,0,1]=4 10020 B15R1.30 COCCNCC(=O)c1ccc(cc1)C 2230a_100000209980_100000211441 [0,2,0,0,0,0|1,0,0]=3 10021 B15R1.30 COCCNCC(O)c1ccc(cc1)Cl 2230a_100000209980_200011996143 [0,2,0,0,0,0|0,0,2]=4 10022 B15R1.30 COCCNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100011201679 [0,2,0,0,0,0|0,0,2]=4 10023 B15R1.30 COCCNCC(O)c1ccc(cc1)Cl 34a_100000736658_100011201679 [0,2,0,0,0,0|0,0,2]=4 10024 B15R1.30 COCCNNC(=O)c1ccc(cc1)Br 22a_100000741390_100000185839 [0,2,0,0,0,0|0,1,0]=3 10025 B15R1.30 COCCNNC(=O)c1ccc(cc1)C 22a_100000741390_100000188618 [0,2,0,0,0,0|1,0,0]=3 10026 B15R1.30 COCCNNC(=O)c1ccc(cc1)Cl 22a_100000741390_100000210187 [0,2,0,0,0,0|0,0,0]=2 10027 B15R1.30 COCCNNC(=O)c1ccc(cc1)F 22a_100000741390_100000187176 [0,2,0,0,0,0|0,1,0]=3 10028 B15R1.30 COCCNNC(=O)c1ccc(cc1)I 22a_100000741390_100000187904 [0,2,0,0,0,0|0,1,0]=3 10029 B15R1.30 COCCNNC(=O)c1ccc(cc1)O 22a_100000741390_100000212099 [0,2,0,0,0,0|1,0,0]=3 10030 B15R1.30 COCCOCC(=O)c1ccc(cc1)Br 34a_100000210237_100000188085 [0,2,0,0,0,0|1,1,0]=4 10031 B15R1.30 COCCOCC(=O)c1ccc(cc1)C 34a_100000210237_100000211441 [0,2,0,0,0,0|2,0,0]=4 10032 B15R1.30 COCCOCC(=O)c1ccc(cc1)F 34a_100000246311_100011201679 [0,2,0,0,0,0|1,1,0]=4 10033 B15R1.30 COCCOCC(=O)c1ccc(cc1)I 34a_100000210237_100011216261 [0,2,0,0,0,0|1,1,0]=4 10034 B15R1.30 COCCOCC(=O)c1ccc(cc1)O 34a_100000210237_100009814261 [0,2,0,0,0,0|2,0,0]=4 10035 B15R1.30 COCCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000233755 [0,2,0,0,0,0|1,1,0]=4 10036 B15R1.30 COCCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000233755 [0,2,0,0,0,0|2,0,0]=4 10037 B15R1.30 COCCSCC(=O)c1ccc(cc1)C 62a_100000233755_100000211441 [0,2,0,0,0,0|2,0,0]=4 10038 B15R1.30 COCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000233755 [0,2,0,0,0,0|1,0,0]=3 10039 B15R1.30 COCCSCC(=O)c1ccc(cc1)Cl 62a_100000233755_100000211071 [0,2,0,0,0,0|1,0,0]=3 10040 B15R1.30 COCCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000233755 [0,2,0,0,0,0|1,1,0]=4 10041 B15R1.30 COCCSCC(=O)c1ccc(cc1)F 62a_100000233755_100000211279 [0,2,0,0,0,0|1,1,0]=4 10042 B15R1.30 COCCSCC(=O)c1ccc(cc1)I 62a_100000233755_100011216261 [0,2,0,0,0,0|1,1,0]=4 10043 B15R1.30 COCCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000233755 [0,2,0,0,0,0|1,1,0]=4 10044 B15R1.30 COCCSCC(=O)c1ccc(cc1)O 62a_100000233755_100009814261 [0,2,0,0,0,0|2,0,0]=4 10045 B15R1.30 COCCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000233755 [0,2,0,0,0,0|2,0,0]=4 10046 B15R1.30 COCCSCC(=O)c1ccc(cn1)Cl 62a_100000233755_100016989621 [0,2,0,0,0,0|2,0,0]=4 10047 B15R1.30 COCCSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100000233755 [0,2,0,0,0,0|2,0,0]=4 10048 B15R1.30 COCCSCC(=O)c1ccc(nc1)Cl 62a_100000233755_100009864725 [0,2,0,0,0,0|2,0,0]=4 10049 B15R1.30 COCCSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100000233755 [0,2,0,0,0,0|2,0,0]=4 10050 B15R1.30 COCSCCC(=O)c1ccc(cc1)Br 62a_100000766300_100011215963 [0,2,0,0,0,0|1,1,0]=4 10051 B15R1.30 COCSCCC(=O)c1ccc(cc1)Br 62a_100011215963_100000766300 [0,2,0,0,0,0|1,1,0]=4 10052 B15R1.30 COCSCCC(=O)c1ccc(cc1)C 62a_100000701375_100000766300 [0,2,0,0,0,0|2,0,0]=4 10053 B15R1.30 COCSCCC(=O)c1ccc(cc1)C 62a_100000766300_100000701375 [0,2,0,0,0,0|2,0,0]=4 10054 B15R1.30 COCSCCC(=O)c1ccc(cc1)Cl 62a_100000766300_100011216492 [0,2,0,0,0,0|1,0,0]=3 10055 B15R1.30 COCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000766300 [0,2,0,0,0,0|1,0,0]=3 10056 B15R1.30 COCSCCC(=O)c1ccc(cc1)F 62a_100000211231_100000766300 [0,2,0,0,0,0|1,1,0]=4 10057 B15R1.30 COCSCCC(=O)c1ccc(cc1)F 62a_100000766300_100000211231 [0,2,0,0,0,0|1,1,0]=4 10058 B15R1.30 COCSCCC(=O)c1ccc(cc1)O 62a_100000766300_100009879949 [0,2,0,0,0,0|2,0,0]=4 10059 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Br 11a_100000749238_100000185839 [0,2,0,0,0,0|0,2,0]=4 10060 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Br 1626a_100000749238_100000185839 [0,2,0,0,0,0|0,2,0]=4 10061 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Br 240690a_100000749238_100000185839 [0,2,0,0,0,0|0,2,0]=4 10062 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Br 527a_100000749238_100000185839 [0,2,0,0,0,0|0,2,0]=4 10063 B15R1.30 CSCCCNC(=O)c1ccc(cc1)C 11a_100000749238_100000188618 [0,2,0,0,0,0|1,1,0]=4 10064 B15R1.30 CSCCCNC(=O)c1ccc(cc1)C 1626a_100000749238_100000188618 [0,2,0,0,0,0|1,1,0]=4 10065 B15R1.30 CSCCCNC(=O)c1ccc(cc1)C 240690a_100000749238_100000188618 [0,2,0,0,0,0|1,1,0]=4 10066 B15R1.30 CSCCCNC(=O)c1ccc(cc1)C 527a_100000749238_100000188618 [0,2,0,0,0,0|1,1,0]=4 10067 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Cl 11a_100000749238_100000210187 [0,2,0,0,0,0|0,1,0]=3 10068 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Cl 1626a_100000749238_100000210187 [0,2,0,0,0,0|0,1,0]=3 10069 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Cl 240690a_100000749238_100000210187 [0,2,0,0,0,0|0,1,0]=3 10070 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Cl 527a_100000749238_100000210187 [0,2,0,0,0,0|0,1,0]=3 10071 B15R1.30 CSCCCNC(=O)c1ccc(cc1)F 11a_100000749238_100000187176 [0,2,0,0,0,0|0,2,0]=4 10072 B15R1.30 CSCCCNC(=O)c1ccc(cc1)F 1626a_100000749238_100000187176 [0,2,0,0,0,0|0,2,0]=4 10073 B15R1.30 CSCCCNC(=O)c1ccc(cc1)F 240690a_100000749238_100000187176 [0,2,0,0,0,0|0,2,0]=4 10074 B15R1.30 CSCCCNC(=O)c1ccc(cc1)F 527a_100000749238_100000187176 [0,2,0,0,0,0|0,2,0]=4 10075 B15R1.30 CSCCCNC(=O)c1ccc(cc1)I 11a_100000749238_100000187904 [0,2,0,0,0,0|0,2,0]=4 10076 B15R1.30 CSCCCNC(=O)c1ccc(cc1)I 1626a_100000749238_100000187904 [0,2,0,0,0,0|0,2,0]=4 10077 B15R1.30 CSCCCNC(=O)c1ccc(cc1)I 240690a_100000749238_100000187904 [0,2,0,0,0,0|0,2,0]=4 10078 B15R1.30 CSCCCNC(=O)c1ccc(cc1)I 527a_100000749238_100000187904 [0,2,0,0,0,0|0,2,0]=4 10079 B15R1.30 CSCCCNC(=O)c1ccc(cc1)O 240690a_100000749238_100000212099 [0,2,0,0,0,0|1,1,0]=4 10080 B15R1.30 CSCCCNC(=O)c1ccc(cc1)O 527a_100000749238_100000212099 [0,2,0,0,0,0|1,1,0]=4 10081 B15R1.30 CSCCNCC(=O)c1ccc(cc1)C 2230a_100020590264_100000211441 [0,2,0,0,0,0|1,1,0]=4 10082 B15R1.30 CSCCOCC(=O)c1ccc(cc1)Cl 7a_100000230434_100000211071 [0,2,0,0,0,0|1,1,0]=4 10083 B15R1.30 CSCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000751147 [0,2,0,0,0,0|1,1,0]=4 10084 B15R1.30 CSCCSCC(=O)c1ccc(cc1)Cl 62a_100000212216_100000211071 [0,2,0,0,0,0|1,1,0]=4 10085 B15R1.30 CSCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100011218213 [0,2,0,0,0,0|1,1,0]=4 10086 B15R1.30 CSCSCCC(=O)c1ccc(cc1)Cl 62a_100011218213_100011216492 [0,2,0,0,0,0|1,1,0]=4 10087 B15R1.30 C[C@@H](NCC#CCO)c1ccc(cc1)Cl 2230a_100015205461_200000047223 [0,2,0,0,0,0|1,0,1]=4 10088 B15R1.30 C[C@@H](NCC#CCO)c1ccc(cc1)Cl 34a_100015205461_200000047223 [0,2,0,0,0,0|1,0,1]=4 10089 B15R1.30 C[C@@H](NCCCCO)c1ccc(cc1)Cl 2230a_100015205461_100000210776 [0,2,0,0,0,0|1,0,1]=4 10090 B15R1.30 C[C@@H](NCCCCO)c1ccc(cc1)Cl 34a_100015205461_100011216708 [0,2,0,0,0,0|1,0,1]=4 10091 B15R1.30 Cc1ccc(cc1)C(=O)CCCCCO 1458a_100000188618_100000746330 [0,2,0,0,0,0|2,0,0]=4 10092 B15R1.30 Cc1ccc(cc1)C(=O)CCNCCO 2230a_100016997473_100000701375 [0,2,0,0,0,0|1,0,0]=3 10093 B15R1.30 Cc1ccc(cc1)C(=O)CCOCCO 1458a_100000188618_100011215305 [0,2,0,0,0,0|2,0,0]=4 10094 B15R1.30 Cc1ccc(cc1)C(=O)CCSCCO 62a_100000211926_100000701375 [0,2,0,0,0,0|2,0,0]=4 10095 B15R1.30 Cc1ccc(cc1)C(=O)CCSCCO 62a_100000701375_100000211926 [0,2,0,0,0,0|2,0,0]=4 10096 B15R1.30 Cc1ccc(cc1)C(=O)CNCCCF 2230a_100015189416_100000211441 [0,2,0,0,0,0|2,0,0]=4 10097 B15R1.30 Cc1ccc(cc1)C(=O)CNCCCF 34a_100015189416_100000211441 [0,2,0,0,0,0|2,0,0]=4 10098 B15R1.30 Cc1ccc(cc1)C(=O)COCCON 34a_100000700252_100000211441 [0,2,0,0,0,0|2,0,0]=4 10099 B15R1.30 Cc1ccc(cc1)C(=O)CSCCCO 62a_100000211441_100011215043 [0,2,0,0,0,0|2,0,0]=4 10100 B15R1.30 Cc1ccc(cc1)C(=O)CSCCCO 62a_100011215043_100000211441 [0,2,0,0,0,0|2,0,0]=4 10101 B15R1.30 Cc1ccc(cc1)C(=O)NCCCCO 240690a_100000750430_100000188618 [0,2,0,0,0,0|1,0,0]=3 10102 B15R1.30 Cc1ccc(cc1)C(=O)NCCCCO 527a_100000750430_100000188618 [0,2,0,0,0,0|1,0,0]=3 10103 B15R1.30 Cc1ccc(cc1)C(=O)NCCOCF 34a_200000158910_100015361967 [0,2,0,0,0,0|1,0,0]=3 10104 B15R1.30 Cc1ccc(cc1)C(=O)NCCOCF 7a_200000158910_100015361967 [0,2,0,0,0,0|1,0,0]=3 10105 B15R1.30 Cc1ccc(cc1)C(=O)NNCCC#N 22a_100000229987_100000188618 [0,2,0,0,0,0|2,0,0]=4 10106 B15R1.30 Cc1ccc(cc1)C(=O)OCCOCF 7a_200000031072_100015361967 [0,2,0,0,0,0|2,0,0]=4 10107 B15R1.30 N#CCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000211819 [0,2,0,0,0,0|2,0,0]=4 10108 B15R1.30 N#CCCNNC(=O)c1ccc(cc1)Br 22a_100000229987_100000185839 [0,2,0,0,0,0|1,1,0]=4 10109 B15R1.30 N#CCCNNC(=O)c1ccc(cc1)Cl 22a_100000229987_100000210187 [0,2,0,0,0,0|1,0,0]=3 10110 B15R1.30 N#CCCNNC(=O)c1ccc(cc1)F 22a_100000229987_100000187176 [0,2,0,0,0,0|1,1,0]=4 10111 B15R1.30 N#CCCNNC(=O)c1ccc(cc1)I 22a_100000229987_100000187904 [0,2,0,0,0,0|1,1,0]=4 10112 B15R1.30 N#CCCNNC(=O)c1ccc(cc1)O 22a_100000229987_100000212099 [0,2,0,0,0,0|2,0,0]=4 10113 B15R1.30 N#CCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100011215226 [0,2,0,0,0,0|2,0,0]=4 10114 B15R1.30 N#CCCSCC(=O)c1ccc(cc1)Cl 62a_100011215226_100000211071 [0,2,0,0,0,0|2,0,0]=4 10115 B15R1.30 N#CCOCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000047693 [0,2,0,0,0,0|2,0,0]=4 10116 B15R1.30 N#CCSCCC(=O)c1ccc(cc1)Cl 62a_100011215382_100011216492 [0,2,0,0,0,0|2,0,0]=4 10117 B15R1.30 N#CCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100011215382 [0,2,0,0,0,0|2,0,0]=4 10118 B15R1.30 NOCCOCC(=O)c1ccc(cc1)Br 34a_100000700252_100000188085 [0,2,0,0,0,0|1,1,0]=4 10119 B15R1.30 NOCCOCC(=O)c1ccc(cc1)I 34a_100000700252_100011216261 [0,2,0,0,0,0|1,1,0]=4 10120 B15R1.30 NOCCOCC(=O)c1ccc(cc1)O 34a_100000700252_100009814261 [0,2,0,0,0,0|2,0,0]=4 10121 B15R1.30 Nc1ccc(cc1)C(=O)NCCOCF 34a_100000740983_100015361967 [0,2,0,0,0,0|1,0,0]=3 10122 B15R1.30 O=C(CCCCCF)c1ccc(cc1)Cl 1458a_100000210187_100000729378 [0,2,0,0,0,0|2,0,0]=4 10123 B15R1.30 O=C(CCCCCO)c1ccc(cc1)Br 1458a_100000185839_100000746330 [0,2,0,0,0,0|1,1,0]=4 10124 B15R1.30 O=C(CCCCCO)c1ccc(cc1)Cl 1458a_100000210187_100000746330 [0,2,0,0,0,0|1,0,0]=3 10125 B15R1.30 O=C(CCCCCO)c1ccc(cc1)F 1458a_100000187176_100000746330 [0,2,0,0,0,0|1,1,0]=4 10126 B15R1.30 O=C(CCCCCO)c1ccc(cc1)I 1458a_100000187904_100000746330 [0,2,0,0,0,0|1,1,0]=4 10127 B15R1.30 O=C(CCCCCO)c1ccc(cc1)O 1458a_100000212099_100000746330 [0,2,0,0,0,0|2,0,0]=4 10128 B15R1.30 O=C(CCCSCF)c1ccc(cc1)Cl 62a_100015361967_200011217871 [0,2,0,0,0,0|1,1,0]=4 10129 B15R1.30 O=C(CCCSCF)c1ccc(cc1)Cl 62a_200011217871_100015361967 [0,2,0,0,0,0|1,1,0]=4 10130 B15R1.30 O=C(CCNCCO)c1ccc(cc1)F 2230a_100016997473_100000211231 [0,2,0,0,0,0|0,1,0]=3 10131 B15R1.30 O=C(CCNCCO)c1ccc(cc1)O 2230a_100016997473_100009879949 [0,2,0,0,0,0|1,0,0]=3 10132 B15R1.30 O=C(CCOCCO)c1ccc(cc1)Br 1458a_100000185839_100011215305 [0,2,0,0,0,0|1,1,0]=4 10133 B15R1.30 O=C(CCOCCO)c1ccc(cc1)Cl 1458a_100000210187_100011215305 [0,2,0,0,0,0|1,0,0]=3 10134 B15R1.30 O=C(CCOCCO)c1ccc(cc1)F 1458a_100000187176_100011215305 [0,2,0,0,0,0|1,1,0]=4 10135 B15R1.30 O=C(CCOCCO)c1ccc(cc1)I 1458a_100000187904_100011215305 [0,2,0,0,0,0|1,1,0]=4 10136 B15R1.30 O=C(CCOCCO)c1ccc(cc1)O 1458a_100000212099_100011215305 [0,2,0,0,0,0|2,0,0]=4 10137 B15R1.30 O=C(CCSCCF)c1ccc(cc1)Cl 62a_100011216492_100011217306 [0,2,0,0,0,0|2,0,0]=4 10138 B15R1.30 O=C(CCSCCF)c1ccc(cc1)Cl 62a_100011217306_100011216492 [0,2,0,0,0,0|2,0,0]=4 10139 B15R1.30 O=C(CCSCCO)c1ccc(cc1)Br 62a_100000211926_100011215963 [0,2,0,0,0,0|1,1,0]=4 10140 B15R1.30 O=C(CCSCCO)c1ccc(cc1)Br 62a_100011215963_100000211926 [0,2,0,0,0,0|1,1,0]=4 10141 B15R1.30 O=C(CCSCCO)c1ccc(cc1)Cl 62a_100000211926_100011216492 [0,2,0,0,0,0|1,0,0]=3 10142 B15R1.30 O=C(CCSCCO)c1ccc(cc1)Cl 62a_100011216492_100000211926 [0,2,0,0,0,0|1,0,0]=3 10143 B15R1.30 O=C(CCSCCO)c1ccc(cc1)F 62a_100000211231_100000211926 [0,2,0,0,0,0|1,1,0]=4 10144 B15R1.30 O=C(CCSCCO)c1ccc(cc1)F 62a_100000211926_100000211231 [0,2,0,0,0,0|1,1,0]=4 10145 B15R1.30 O=C(CCSCCO)c1ccc(cc1)O 62a_100000211926_100009879949 [0,2,0,0,0,0|2,0,0]=4 10146 B15R1.30 O=C(CNCCCF)c1ccc(cc1)Br 34a_100015189416_100000188085 [0,2,0,0,0,0|1,1,0]=4 10147 B15R1.30 O=C(CNCCCF)c1ccc(cc1)I 34a_100015189416_100011216261 [0,2,0,0,0,0|1,1,0]=4 10148 B15R1.30 O=C(CNCCCF)c1ccc(cc1)O 34a_100015189416_100009814261 [0,2,0,0,0,0|2,0,0]=4 10149 B15R1.30 O=C(COCCCO)c1ccc(cc1)F 34a_100000246311_100000230001 [0,2,0,0,0,0|1,1,0]=4 10150 B15R1.30 O=C(CSCCCF)c1ccc(cc1)Cl 62a_100000211071_100011934791 [0,2,0,0,0,0|2,0,0]=4 10151 B15R1.30 O=C(CSCCCF)c1ccc(cc1)Cl 62a_100011934791_100000211071 [0,2,0,0,0,0|2,0,0]=4 10152 B15R1.30 O=C(CSCCCO)c1ccc(cc1)Br 62a_100000188085_100011215043 [0,2,0,0,0,0|1,1,0]=4 10153 B15R1.30 O=C(CSCCCO)c1ccc(cc1)Cl 62a_100000211071_100011215043 [0,2,0,0,0,0|1,0,0]=3 10154 B15R1.30 O=C(CSCCCO)c1ccc(cc1)Cl 62a_100011215043_100000211071 [0,2,0,0,0,0|1,0,0]=3 10155 B15R1.30 O=C(CSCCCO)c1ccc(cc1)F 62a_100000211279_100011215043 [0,2,0,0,0,0|1,1,0]=4 10156 B15R1.30 O=C(CSCCCO)c1ccc(cc1)F 62a_100011215043_100000211279 [0,2,0,0,0,0|1,1,0]=4 10157 B15R1.30 O=C(CSCCCO)c1ccc(cc1)I 62a_100011215043_100011216261 [0,2,0,0,0,0|1,1,0]=4 10158 B15R1.30 O=C(CSCCCO)c1ccc(cc1)I 62a_100011216261_100011215043 [0,2,0,0,0,0|1,1,0]=4 10159 B15R1.30 O=C(CSCCCO)c1ccc(cc1)O 62a_100009814261_100011215043 [0,2,0,0,0,0|2,0,0]=4 10160 B15R1.30 O=C(CSCCCO)c1ccc(cc1)O 62a_100011215043_100009814261 [0,2,0,0,0,0|2,0,0]=4 10161 B15R1.30 O=C(CSCCCO)c1ccc(cn1)Cl 62a_100011215043_100016989621 [0,2,0,0,0,0|2,0,0]=4 10162 B15R1.30 O=C(CSCCCO)c1ccc(cn1)Cl 62a_100016989621_100011215043 [0,2,0,0,0,0|2,0,0]=4 10163 B15R1.30 O=C(CSCCCO)c1ccc(nc1)Cl 62a_100009864725_100011215043 [0,2,0,0,0,0|2,0,0]=4 10164 B15R1.30 O=C(CSCCCO)c1ccc(nc1)Cl 62a_100011215043_100009864725 [0,2,0,0,0,0|2,0,0]=4 10165 B15R1.30 O=C(NCCCCO)c1ccc(cc1)Br 240690a_100000750430_100000185839 [0,2,0,0,0,0|0,1,0]=3 10166 B15R1.30 O=C(NCCCCO)c1ccc(cc1)Br 527a_100000750430_100000185839 [0,2,0,0,0,0|0,1,0]=3 10167 B15R1.30 O=C(NCCCCO)c1ccc(cc1)Cl 240690a_100000750430_100000210187 [0,2,0,0,0,0|0,0,0]=2 10168 B15R1.30 O=C(NCCCCO)c1ccc(cc1)Cl 527a_100000750430_100000210187 [0,2,0,0,0,0|0,0,0]=2 10169 B15R1.30 O=C(NCCCCO)c1ccc(cc1)F 240690a_100000750430_100000187176 [0,2,0,0,0,0|0,1,0]=3 10170 B15R1.30 O=C(NCCCCO)c1ccc(cc1)F 527a_100000750430_100000187176 [0,2,0,0,0,0|0,1,0]=3 10171 B15R1.30 O=C(NCCCCO)c1ccc(cc1)I 240690a_100000750430_100000187904 [0,2,0,0,0,0|0,1,0]=3 10172 B15R1.30 O=C(NCCCCO)c1ccc(cc1)I 527a_100000750430_100000187904 [0,2,0,0,0,0|0,1,0]=3 10173 B15R1.30 O=C(NCCCCO)c1ccc(cc1)O 240690a_100000750430_100000212099 [0,2,0,0,0,0|1,0,0]=3 10174 B15R1.30 O=C(NCCCCO)c1ccc(cc1)O 527a_100000750430_100000212099 [0,2,0,0,0,0|1,0,0]=3 10175 B15R1.30 O=C(NCCNCF)c1ccc(cc1)Cl 34a_100000736292_100015361967 [0,2,0,0,0,0|1,0,0]=3 10176 B15R1.30 O=C(NCCNCF)c1ccc(cc1)F 34a_100000753910_100015361967 [0,2,0,0,0,0|1,1,0]=4 10177 B15R1.30 O=C(NCCOCF)c1ccc(cc1)Br 34a_200000158904_100015361967 [0,2,0,0,0,0|0,1,0]=3 10178 B15R1.30 O=CCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_200015260668 [0,2,0,0,0,0|1,0,1]=4 10179 B15R1.30 O=CCSCCC(=O)c1ccc(cc1)Cl 62a_200015260668_100011216492 [0,2,0,0,0,0|1,0,1]=4 10180 B15R1.30 OCCCNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100000230001 [0,2,0,0,0,0|0,0,2]=4 10181 B15R1.30 OCCCNCC(O)c1ccc(cc1)Cl 34a_100000736658_100000230001 [0,2,0,0,0,0|0,0,2]=4 10182 B15R1.38 C#CCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000755551_100000209962 [0,2,0,0,0,0|2,0,0]=4 10183 B15R1.38 C#CCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100000755551_100000077732 [0,2,0,0,0,0|2,0,0]=4 10184 B15R1.38 C=CCCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100015191253_100000209962 [0,2,0,0,0,0|2,0,0]=4 10185 B15R1.38 C=CCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100015191253_100000209962 [0,2,0,0,0,0|2,0,0]=4 10186 B15R1.38 C=CCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100015191253_100000077732 [0,2,0,0,0,0|2,0,0]=4 10187 B15R1.38 CC(C)(CNCCO)c1ccc(cc1)Cl 2230a_100000742012_100000211926 [0,2,0,0,0,0|1,0,1]=4 10188 B15R1.38 CC(C)(NCCCO)c1ccc(cc1)Cl 2230a_100000750703_100000230001 [0,2,0,0,0,0|1,0,1]=4 10189 B15R1.38 CCCCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100000102301_100000209962 [0,2,0,0,0,0|2,0,0]=4 10190 B15R1.38 CCCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000102301_100000209962 [0,2,0,0,0,0|2,0,0]=4 10191 B15R1.38 CCCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100000102301_100000077732 [0,2,0,0,0,0|2,0,0]=4 10192 B15R1.38 CCCNNS(=O)(=O)c1ccc(cc1)Cl 40a_100000740057_100000077732 [0,2,0,0,0,0|2,0,0]=4 10193 B15R1.38 CNCCNS(=O)(=O)c1ccc(cc1)Cl 2230a_100011208938_200000210301 [0,2,0,0,0,0|2,0,0]=4 10194 B15R1.38 CNCCNS(=O)(=O)c1ccc(cc1)Cl 34a_100011208938_200000210301 [0,2,0,0,0,0|2,0,0]=4 10195 B15R1.38 COCCNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_100011201679 [0,2,0,0,0,0|1,0,1]=4 10196 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Br 270084a_100000209980_100000182491 [0,2,0,0,0,0|1,1,0]=4 10197 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Br 274078a_100000209980_100000182491 [0,2,0,0,0,0|1,1,0]=4 10198 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Br 34a_100000186246_200000210301 [0,2,0,0,0,0|1,1,0]=4 10199 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Br 40a_100000209980_100010306709 [0,2,0,0,0,0|1,1,0]=4 10200 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)C 270084a_100000209980_100000211267 [0,2,0,0,0,0|2,0,0]=4 10201 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)C 274078a_100000209980_100000211267 [0,2,0,0,0,0|2,0,0]=4 10202 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)C 34a_100000188368_200000210301 [0,2,0,0,0,0|2,0,0]=4 10203 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)C 40a_100000209980_100000039673 [0,2,0,0,0,0|2,0,0]=4 10204 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100000209980_100000209962 [0,2,0,0,0,0|1,0,0]=3 10205 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000209980_100000209962 [0,2,0,0,0,0|1,0,0]=3 10206 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100000209980_100000077732 [0,2,0,0,0,0|1,0,0]=3 10207 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)F 270084a_100000209980_100000184267 [0,2,0,0,0,0|1,1,0]=4 10208 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)F 274078a_100000209980_100000184267 [0,2,0,0,0,0|1,1,0]=4 10209 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)F 40a_100000209980_100000081159 [0,2,0,0,0,0|1,1,0]=4 10210 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)I 270084a_100000209980_100011205396 [0,2,0,0,0,0|1,1,0]=4 10211 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)I 274078a_100000209980_100011205396 [0,2,0,0,0,0|1,1,0]=4 10212 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)N 34a_200000239647_200000210301 [0,2,0,0,0,0|2,0,0]=4 10213 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)N 40a_100000209980_100000054796 [0,2,0,0,0,0|2,0,0]=4 10214 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)O 270084a_100000209980_100020667864 [0,2,0,0,0,0|2,0,0]=4 10215 B15R1.38 COCCNS(=O)(=O)c1ccc(cc1)O 274078a_100000209980_100020667864 [0,2,0,0,0,0|2,0,0]=4 10216 B15R1.38 COCCNS(=O)(=O)c1ccc(nc1)Cl 270084a_100000209980_100000184283 [0,2,0,0,0,0|2,0,0]=4 10217 B15R1.38 COCCNS(=O)(=O)c1ccc(nc1)Cl 274078a_100000209980_100000184283 [0,2,0,0,0,0|2,0,0]=4 10218 B15R1.38 CSCCNS(=O)(=O)c1ccc(cc1)Cl 270084a_100020590264_100000209962 [0,2,0,0,0,0|1,1,0]=4 10219 B15R1.38 CSCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100020590264_100000209962 [0,2,0,0,0,0|1,1,0]=4 10220 B15R1.38 CSCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100020590264_100000077732 [0,2,0,0,0,0|1,1,0]=4 10221 B15R1.38 Cc1ccc(cc1)S(=O)(=O)CNCCO 34a_100016990907_100000183660 [0,2,0,0,0,0|2,0,0]=4 10222 B15R1.38 Cc1ccc(cc1)S(=O)(=O)NCCCO 270084a_100000182051_100000211267 [0,2,0,0,0,0|2,0,0]=4 10223 B15R1.38 Cc1ccc(cc1)S(=O)(=O)NCCCO 274078a_100000182051_100000211267 [0,2,0,0,0,0|2,0,0]=4 10224 B15R1.38 Cc1ccc(cc1)S(=O)(=O)NCCCO 40a_100000182051_100000039673 [0,2,0,0,0,0|2,0,0]=4 10225 B15R1.38 Cc1ccc(cc1)S(=O)(=O)NCCO[13CH3] 34a_100000188368_200025704644 [0,2,0,0,0,0|2,0,0]=4 10226 B15R1.38 N#CCCNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000720768_100000209962 [0,2,0,0,0,0|2,0,0]=4 10227 B15R1.38 N#CCCNS(=O)(=O)c1ccc(cc1)Cl 40a_100000720768_100000077732 [0,2,0,0,0,0|2,0,0]=4 10228 B15R1.38 Nc1ccc(cc1)S(=O)(=O)NCCCO 40a_100000182051_100000054796 [0,2,0,0,0,0|2,0,0]=4 10229 B15R1.38 O=S(=O)(NCCCF)c1ccc(cc1)Cl 270084a_100015189416_100000209962 [0,2,0,0,0,0|2,0,0]=4 10230 B15R1.38 O=S(=O)(NCCCF)c1ccc(cc1)Cl 274078a_100015189416_100000209962 [0,2,0,0,0,0|2,0,0]=4 10231 B15R1.38 O=S(=O)(NCCCF)c1ccc(cc1)Cl 40a_100015189416_100000077732 [0,2,0,0,0,0|2,0,0]=4 10232 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)Br 270084a_100000182051_100000182491 [0,2,0,0,0,0|1,1,0]=4 10233 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)Br 274078a_100000182051_100000182491 [0,2,0,0,0,0|1,1,0]=4 10234 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)Br 40a_100000182051_100010306709 [0,2,0,0,0,0|1,1,0]=4 10235 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)Cl 270084a_100000182051_100000209962 [0,2,0,0,0,0|1,0,0]=3 10236 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)Cl 274078a_100000182051_100000209962 [0,2,0,0,0,0|1,0,0]=3 10237 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)Cl 40a_100000182051_100000077732 [0,2,0,0,0,0|1,0,0]=3 10238 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)F 270084a_100000182051_100000184267 [0,2,0,0,0,0|1,1,0]=4 10239 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)F 274078a_100000182051_100000184267 [0,2,0,0,0,0|1,1,0]=4 10240 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)F 40a_100000182051_100000081159 [0,2,0,0,0,0|1,1,0]=4 10241 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)I 270084a_100000182051_100011205396 [0,2,0,0,0,0|1,1,0]=4 10242 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)I 274078a_100000182051_100011205396 [0,2,0,0,0,0|1,1,0]=4 10243 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)O 270084a_100000182051_100020667864 [0,2,0,0,0,0|2,0,0]=4 10244 B15R1.38 O=S(=O)(NCCCO)c1ccc(cc1)O 274078a_100000182051_100020667864 [0,2,0,0,0,0|2,0,0]=4 10245 B15R1.38 O=S(=O)(NCCCO)c1ccc(nc1)Cl 270084a_100000182051_100000184283 [0,2,0,0,0,0|2,0,0]=4 10246 B15R1.38 O=S(=O)(NCCCO)c1ccc(nc1)Cl 274078a_100000182051_100000184283 [0,2,0,0,0,0|2,0,0]=4 10247 B15R1.38 [13CH3]NCCNS(=O)(=O)c1ccc(cc1)Cl 2230a_100011208938_200025704644 [0,2,0,0,0,0|2,0,0]=4 10248 B15R1.38 [13CH3]NCCNS(=O)(=O)c1ccc(cc1)Cl 34a_100011208938_200025704644 [0,2,0,0,0,0|2,0,0]=4 10249 B15R1.38 [13CH3]OCCNS(=O)(=O)c1ccc(cc1)Br 34a_100000186246_200025704644 [0,2,0,0,0,0|1,1,0]=4 10250 B15R1.38 [13CH3]OCCNS(=O)(=O)c1ccc(cc1)N 34a_200000239647_200025704644 [0,2,0,0,0,0|2,0,0]=4 10251 B15R1.101 CCC(=NNCCO)c1ccc(cc1)Br 4a_100000210001_100000211647 [0,2,0,0,0,0|1,1,0]=4 10252 B15R1.101 CCC(=NNCCO)c1ccc(cc1)C 4a_100000210001_100000185863 [0,2,0,0,0,0|2,0,0]=4 10253 B15R1.101 CCC(=NNCCO)c1ccc(cc1)Cl 4a_100000210001_100000210983 [0,2,0,0,0,0|1,0,0]=3 10254 B15R1.101 CCC(=NNCCO)c1ccc(cc1)F 4a_100000210001_100000211089 [0,2,0,0,0,0|1,1,0]=4 10255 B15R1.101 CCC(=NNCCO)c1ccc(cc1)I 4a_100000210001_100000763097 [0,2,0,0,0,0|1,1,0]=4 10256 B15R1.101 CCC(=NNCCO)c1ccc(cc1)O 4a_100000210001_100000212119 [0,2,0,0,0,0|2,0,0]=4 10257 B15R1.101 CCC(NCCCO)c1ccc(cc1)Cl 269862a_100000182051_100000210983 [0,2,0,0,0,0|1,0,1]=4 10258 B15R1.101 CCC(NCCOC)c1ccc(cc1)Cl 269862a_100000209980_100000210983 [0,2,0,0,0,0|1,0,1]=4 10259 B15R1.101 CCCNN=C(CC)c1ccc(cc1)Cl 4a_100000740057_100000210983 [0,2,0,0,0,0|2,0,0]=4 10260 B15R1.101 CCCNN=C(CF)c1ccc(cc1)Cl 4a_100000740057_200000004628 [0,2,0,0,0,0|2,0,0]=4 10261 B15R1.101 CC[C@H](NCCCO)c1ccc(cc1)Cl 2230a_100015186824_100000230001 [0,2,0,0,0,0|1,0,1]=4 10262 B15R1.101 CC[C@H](NCCCO)c1ccc(cc1)Cl 34a_100015186824_100000230001 [0,2,0,0,0,0|1,0,1]=4 10263 B15R1.101 CC[C@H](NCCOC)c1ccc(cc1)Cl 2230a_100015186824_100011201679 [0,2,0,0,0,0|1,0,1]=4 10264 B15R1.101 CC[C@H](NCCOC)c1ccc(cc1)Cl 34a_100015186824_100011201679 [0,2,0,0,0,0|1,0,1]=4 10265 B15R1.101 COCCNC(C#N)c1ccc(cc1)Cl 2230a_100000747793_100011201679 [0,2,0,0,0,0|1,0,1]=4 10266 B15R1.101 COCCN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100011201679 [0,2,0,0,0,0|0,0,2]=4 10267 B15R1.101 COCCN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100011201679 [0,2,0,0,0,0|0,0,2]=4 10268 B15R1.101 Cc1ccc(cc1)C(=NNCCO)CO 4a_100000210001_100000246368 [0,2,0,0,0,0|1,0,1]=4 10269 B15R1.101 N#CC(NCCCO)c1ccc(cc1)Cl 2230a_100000747793_100000230001 [0,2,0,0,0,0|1,0,1]=4 10270 B15R1.101 OCCCN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100000230001 [0,2,0,0,0,0|0,0,2]=4 10271 B15R1.101 OCCCN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000230001 [0,2,0,0,0,0|0,0,2]=4 10272 B15R1.101 OCCNN=C(CF)c1ccc(cc1)Cl 4a_100000210001_200000004628 [0,2,0,0,0,0|1,0,0]=3 10273 B15R1.101 OCCNN=C(CF)c1ccc(cc1)O 4a_100000210001_200010654591 [0,2,0,0,0,0|2,0,0]=4 10274 B15R1.101 OCCNN=C(CO)c1ccc(cc1)Br 4a_100000210001_100011219529 [0,2,0,0,0,0|0,1,1]=4 10275 B15R1.101 OCCNN=C(CO)c1ccc(cc1)F 4a_100000210001_100000246311 [0,2,0,0,0,0|0,1,1]=4 10276 B15R1.132 C=CC(O)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000730141 [0,2,0,0,0,0|1,0,1]=4 10277 B15R1.132 C=CC(O)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000730141 [0,2,0,0,0,0|1,0,1]=4 10278 B15R1.132 CC(=NNC(=O)c1ccc(cc1)Br)CO 4a_100000183614_100000211253 [0,2,0,0,0,0|0,1,1]=4 10279 B15R1.132 CC(=NNC(=O)c1ccc(cc1)C)CO 4a_100000189790_100000211253 [0,2,0,0,0,0|1,0,1]=4 10280 B15R1.132 CC(=NNC(=O)c1ccc(cc1)Cl)CF 4a_100000184390_100000039719 [0,2,0,0,0,0|1,0,1]=4 10281 B15R1.132 CC(=NNC(=O)c1ccc(cc1)Cl)CO 4a_100000184390_100000211253 [0,2,0,0,0,0|0,0,1]=3 10282 B15R1.132 CC(=NNC(=O)c1ccc(cc1)F)CO 4a_100000182866_100000211253 [0,2,0,0,0,0|0,1,1]=4 10283 B15R1.132 CC(=NNC(=O)c1ccc(cc1)I)CO 4a_100000189773_100000211253 [0,2,0,0,0,0|0,1,1]=4 10284 B15R1.132 CC(=NNC(=O)c1ccc(cn1)Cl)CO 4a_100012017650_100000211253 [0,2,0,0,0,0|1,0,1]=4 10285 B15R1.132 CC(=NNC(=O)c1ccc(nc1)Cl)CO 4a_100000189807_100000211253 [0,2,0,0,0,0|1,0,1]=4 10286 B15R1.132 CC(CF)OCC(=O)c1ccc(cc1)Cl 7a_100016041109_100000211071 [0,2,0,0,0,0|2,0,0]=4 10287 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Br 240690a_100000744482_100000185839 [0,2,0,0,0,0|0,1,0]=3 10288 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Br 527a_100000744482_100000185839 [0,2,0,0,0,0|0,1,0]=3 10289 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Cl 240690a_100000744482_100000210187 [0,2,0,0,0,0|0,0,0]=2 10290 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)Cl 527a_100000744482_100000210187 [0,2,0,0,0,0|0,0,0]=2 10291 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)F 240690a_100000744482_100000187176 [0,2,0,0,0,0|0,1,0]=3 10292 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)F 527a_100000744482_100000187176 [0,2,0,0,0,0|0,1,0]=3 10293 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)I 240690a_100000744482_100000187904 [0,2,0,0,0,0|0,1,0]=3 10294 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)I 527a_100000744482_100000187904 [0,2,0,0,0,0|0,1,0]=3 10295 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)O 240690a_100000744482_100000212099 [0,2,0,0,0,0|1,0,0]=3 10296 B15R1.132 CC(CO)CNC(=O)c1ccc(cc1)O 527a_100000744482_100000212099 [0,2,0,0,0,0|1,0,0]=3 10297 B15R1.132 CC(CO)CNC(C)c1ccc(cc1)Cl 269862a_100000744482_100000185797 [0,2,0,0,0,0|1,0,1]=4 10298 B15R1.132 CC(CO)NCC(O)c1ccc(cc1)Cl 2230a_100000736658_100012180447 [0,2,0,0,0,0|0,0,2]=4 10299 B15R1.132 CC(CO)NCC(O)c1ccc(cc1)Cl 34a_100000736658_100012180447 [0,2,0,0,0,0|0,0,2]=4 10300 B15R1.132 CC(CO)OCC(=O)c1ccc(cc1)F 34a_100000246311_100012180447 [0,2,0,0,0,0|1,1,0]=4 10301 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)Cl 62a_100012180447_100000211071 [0,2,0,0,0,0|1,0,0]=3 10302 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)F 62a_100012180447_100000211279 [0,2,0,0,0,0|1,1,0]=4 10303 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)I 62a_100012180447_100011216261 [0,2,0,0,0,0|1,1,0]=4 10304 B15R1.132 CC(CO)SCC(=O)c1ccc(cc1)O 62a_100012180447_100009814261 [0,2,0,0,0,0|2,0,0]=4 10305 B15R1.132 CC(CO)SCC(=O)c1ccc(cn1)Cl 62a_100012180447_100016989621 [0,2,0,0,0,0|2,0,0]=4 10306 B15R1.132 CC(CO)SCC(=O)c1ccc(nc1)Cl 62a_100012180447_100009864725 [0,2,0,0,0,0|2,0,0]=4 10307 B15R1.132 CC(NC[C@@H](F)CO)c1ccc(cc1)Cl 269862a_100015665980_100000185797 [0,2,0,0,0,0|1,0,1]=4 10308 B15R1.132 CC(NC[C@H](O)CO)c1ccc(cc1)Cl 2230a_100020644852_100000684792 [0,2,0,0,0,0|1,0,1]=4 10309 B15R1.132 CC(NC[C@H](O)CO)c1ccc(cc1)Cl 269862a_100020644852_100000185797 [0,2,0,0,0,0|1,0,1]=4 10310 B15R1.132 CCC(=O)CNC(=O)c1ccc(cc1)C 1458a_100000183637_100000210202 [0,2,0,0,0,0|2,0,0]=4 10311 B15R1.132 CCC(=O)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_100000210202 [0,2,0,0,0,0|1,0,0]=3 10312 B15R1.132 CCC(=O)CNC(=O)c1ccc(cc1)F 1458a_100000183488_100000210202 [0,2,0,0,0,0|1,1,0]=4 10313 B15R1.132 CCC(=O)CNC(=O)c1ccc(cc1)O 1458a_100000205570_100000210202 [0,2,0,0,0,0|2,0,0]=4 10314 B15R1.132 CCC(=O)NNC(=O)c1ccc(cc1)Cl 22a_100000183195_100000210187 [0,2,0,0,0,0|1,0,1]=4 10315 B15R1.132 CCC(=O)NNC(=O)c1ccc(cc1)Cl 22a_100000184390_100000210414 [0,2,0,0,0,0|1,0,1]=4 10316 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 11a_100020588543_100000185839 [0,2,0,0,0,0|1,1,0]=4 10317 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 1626a_100020588543_100000185839 [0,2,0,0,0,0|1,1,0]=4 10318 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 240690a_100020588543_100000185839 [0,2,0,0,0,0|1,1,0]=4 10319 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Br 527a_100020588543_100000185839 [0,2,0,0,0,0|1,1,0]=4 10320 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 11a_100020588543_100000188618 [0,2,0,0,0,0|2,0,0]=4 10321 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 1626a_100020588543_100000188618 [0,2,0,0,0,0|2,0,0]=4 10322 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 240690a_100020588543_100000188618 [0,2,0,0,0,0|2,0,0]=4 10323 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)C 527a_100020588543_100000188618 [0,2,0,0,0,0|2,0,0]=4 10324 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 11a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 10325 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 1626a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 10326 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 240690a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 10327 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)Cl 527a_100020588543_100000210187 [0,2,0,0,0,0|1,0,0]=3 10328 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 11a_100020588543_100000187176 [0,2,0,0,0,0|1,1,0]=4 10329 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 1626a_100020588543_100000187176 [0,2,0,0,0,0|1,1,0]=4 10330 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 240690a_100020588543_100000187176 [0,2,0,0,0,0|1,1,0]=4 10331 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)F 527a_100020588543_100000187176 [0,2,0,0,0,0|1,1,0]=4 10332 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 11a_100020588543_100000187904 [0,2,0,0,0,0|1,1,0]=4 10333 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 1626a_100020588543_100000187904 [0,2,0,0,0,0|1,1,0]=4 10334 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 240690a_100020588543_100000187904 [0,2,0,0,0,0|1,1,0]=4 10335 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)I 527a_100020588543_100000187904 [0,2,0,0,0,0|1,1,0]=4 10336 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)O 240690a_100020588543_100000212099 [0,2,0,0,0,0|2,0,0]=4 10337 B15R1.132 CCC(C)CNC(=O)c1ccc(cc1)O 527a_100020588543_100000212099 [0,2,0,0,0,0|2,0,0]=4 10338 B15R1.132 CCC(C)NCC(=O)c1ccc(cc1)C 2230a_100000209981_100000211441 [0,2,0,0,0,0|2,0,0]=4 10339 B15R1.132 CCC(C)NN=C(C)c1ccc(cc1)Cl 4a_100000718999_100000185797 [0,2,0,0,0,0|2,0,0]=4 10340 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)Br 22a_100000718999_100000185839 [0,2,0,0,0,0|1,1,0]=4 10341 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)C 22a_100000718999_100000188618 [0,2,0,0,0,0|2,0,0]=4 10342 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)Cl 22a_100000718999_100000210187 [0,2,0,0,0,0|1,0,0]=3 10343 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)F 22a_100000718999_100000187176 [0,2,0,0,0,0|1,1,0]=4 10344 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)I 22a_100000718999_100000187904 [0,2,0,0,0,0|1,1,0]=4 10345 B15R1.132 CCC(C)NNC(=O)c1ccc(cc1)O 22a_100000718999_100000212099 [0,2,0,0,0,0|2,0,0]=4 10346 B15R1.132 CCC(C)OCC(=O)c1ccc(cc1)Cl 7a_100000210228_100000211071 [0,2,0,0,0,0|2,0,0]=4 10347 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000758301 [0,2,0,0,0,0|2,0,0]=4 10348 B15R1.132 CCC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000758301_100000211071 [0,2,0,0,0,0|2,0,0]=4 10349 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Br 11a_100011218483_100000185839 [0,2,0,0,0,0|0,1,0]=3 10350 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Br 240690a_100011218483_100000185839 [0,2,0,0,0,0|0,1,0]=3 10351 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Br 527a_100011218483_100000185839 [0,2,0,0,0,0|0,1,0]=3 10352 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)C 11a_100011218483_100000188618 [0,2,0,0,0,0|1,0,0]=3 10353 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)C 240690a_100011218483_100000188618 [0,2,0,0,0,0|1,0,0]=3 10354 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)C 527a_100011218483_100000188618 [0,2,0,0,0,0|1,0,0]=3 10355 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Cl 11a_100011218483_100000210187 [0,2,0,0,0,0|0,0,0]=2 10356 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Cl 240690a_100011218483_100000210187 [0,2,0,0,0,0|0,0,0]=2 10357 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)Cl 527a_100011218483_100000210187 [0,2,0,0,0,0|0,0,0]=2 10358 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)F 11a_100011218483_100000187176 [0,2,0,0,0,0|0,1,0]=3 10359 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)F 240690a_100011218483_100000187176 [0,2,0,0,0,0|0,1,0]=3 10360 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)F 527a_100011218483_100000187176 [0,2,0,0,0,0|0,1,0]=3 10361 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)I 11a_100011218483_100000187904 [0,2,0,0,0,0|0,1,0]=3 10362 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)I 240690a_100011218483_100000187904 [0,2,0,0,0,0|0,1,0]=3 10363 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)I 527a_100011218483_100000187904 [0,2,0,0,0,0|0,1,0]=3 10364 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)O 240690a_100011218483_100000212099 [0,2,0,0,0,0|1,0,0]=3 10365 B15R1.132 CCC(O)CNC(=O)c1ccc(cc1)O 527a_100011218483_100000212099 [0,2,0,0,0,0|1,0,0]=3 10366 B15R1.132 CCC(O)CNC(C)c1ccc(cc1)Cl 2230a_100011218483_100000684792 [0,2,0,0,0,0|1,0,1]=4 10367 B15R1.132 CCC(O)CNC(C)c1ccc(cc1)Cl 269862a_100011218483_100000185797 [0,2,0,0,0,0|1,0,1]=4 10368 B15R1.132 CCC(O)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100011218378 [0,2,0,0,0,0|1,0,1]=4 10369 B15R1.132 CCC(O)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100011218378 [0,2,0,0,0,0|1,0,1]=4 10370 B15R1.132 CCN(C)CCC(=O)c1ccc(cc1)Cl 269982a_100000225621_100011216492 [0,2,0,0,0,0|2,0,0]=4 10371 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 11a_100000693194_100000210187 [0,2,0,0,0,0|0,0,2]=4 10372 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000182666 [0,2,0,0,0,0|0,0,2]=4 10373 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000182666 [0,2,0,0,0,0|0,0,2]=4 10374 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 240690a_100000693194_100000210187 [0,2,0,0,0,0|0,0,2]=4 10375 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000182666 [0,2,0,0,0,0|0,0,2]=4 10376 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 527a_100000693194_100000210187 [0,2,0,0,0,0|0,0,2]=4 10377 B15R1.132 CNC(=O)CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000182666 [0,2,0,0,0,0|0,0,2]=4 10378 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)Br 188690a_100000185156_100000185839 [0,2,0,0,0,0|0,1,1]=4 10379 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)C 188690a_100000185156_100000188618 [0,2,0,0,0,0|1,0,1]=4 10380 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)Cl 188690a_100000185156_100000210187 [0,2,0,0,0,0|0,0,1]=3 10381 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)F 188690a_100000185156_100000187176 [0,2,0,0,0,0|0,1,1]=4 10382 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)I 188690a_100000185156_100000187904 [0,2,0,0,0,0|0,1,1]=4 10383 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)O 188690a_100000185156_100000212099 [0,2,0,0,0,0|1,0,1]=4 10384 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100009879195 [0,2,0,0,0,0|2,0,0]=4 10385 B15R1.132 COC(C)SCC(=O)c1ccc(cc1)Cl 62a_100009879195_100000211071 [0,2,0,0,0,0|2,0,0]=4 10386 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 11a_100020591295_100000185839 [0,2,0,0,0,0|0,1,0]=3 10387 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 1626a_100020591295_100000185839 [0,2,0,0,0,0|0,1,0]=3 10388 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 240690a_100020591295_100000185839 [0,2,0,0,0,0|0,1,0]=3 10389 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Br 527a_100020591295_100000185839 [0,2,0,0,0,0|0,1,0]=3 10390 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 11a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 10391 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 1626a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 10392 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 240690a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 10393 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)C 527a_100020591295_100000188618 [0,2,0,0,0,0|1,0,0]=3 10394 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 11a_100020591295_100000210187 [0,2,0,0,0,0|0,0,0]=2 10395 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 1626a_100020591295_100000210187 [0,2,0,0,0,0|0,0,0]=2 10396 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 240690a_100020591295_100000210187 [0,2,0,0,0,0|0,0,0]=2 10397 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)Cl 527a_100020591295_100000210187 [0,2,0,0,0,0|0,0,0]=2 10398 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 11a_100020591295_100000187176 [0,2,0,0,0,0|0,1,0]=3 10399 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 1626a_100020591295_100000187176 [0,2,0,0,0,0|0,1,0]=3 10400 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 240690a_100020591295_100000187176 [0,2,0,0,0,0|0,1,0]=3 10401 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)F 527a_100020591295_100000187176 [0,2,0,0,0,0|0,1,0]=3 10402 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 11a_100020591295_100000187904 [0,2,0,0,0,0|0,1,0]=3 10403 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 1626a_100020591295_100000187904 [0,2,0,0,0,0|0,1,0]=3 10404 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 240690a_100020591295_100000187904 [0,2,0,0,0,0|0,1,0]=3 10405 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)I 527a_100020591295_100000187904 [0,2,0,0,0,0|0,1,0]=3 10406 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)O 240690a_100020591295_100000212099 [0,2,0,0,0,0|1,0,0]=3 10407 B15R1.132 CO[C@H](C)CNC(=O)c1ccc(cc1)O 527a_100020591295_100000212099 [0,2,0,0,0,0|1,0,0]=3 10408 B15R1.132 CO[C@H](C)CNC(C)c1ccc(cc1)Cl 2230a_100020591295_100000684792 [0,2,0,0,0,0|1,0,1]=4 10409 B15R1.132 CO[C@H](C)CNC(C)c1ccc(cc1)Cl 269862a_100020591295_100000185797 [0,2,0,0,0,0|1,0,1]=4 10410 B15R1.132 C[C@@H](CO)CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000059175 [0,2,0,0,0,0|1,0,1]=4 10411 B15R1.132 C[C@@H](CO)CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000059175 [0,2,0,0,0,0|1,0,1]=4 10412 B15R1.132 C[C@@H](NCC(O)CO)c1ccc(cc1)Cl 2230a_100015205461_100011219619 [0,2,0,0,0,0|1,0,1]=4 10413 B15R1.132 C[C@@H](NCC(O)CO)c1ccc(cc1)Cl 34a_100015205461_100011219619 [0,2,0,0,0,0|1,0,1]=4 10414 B15R1.132 C[C@@H](NC[C@@H](O)CF)c1ccc(cc1)Cl 2230a_100015205461_100015614560 [0,2,0,0,0,0|1,0,1]=4 10415 B15R1.132 C[C@@H](NC[C@@H](O)CF)c1ccc(cc1)Cl 34a_100015205461_100015614560 [0,2,0,0,0,0|1,0,1]=4 10416 B15R1.132 C[C@@H](NC[C@@H](O)CO)c1ccc(cc1)Cl 2230a_100015205461_100009815848 [0,2,0,0,0,0|1,0,1]=4 10417 B15R1.132 C[C@@H](NC[C@@H](O)CO)c1ccc(cc1)Cl 34a_100015205461_100009815848 [0,2,0,0,0,0|1,0,1]=4 10418 B15R1.132 C[C@H](CO)NCC(O)c1ccc(cc1)Cl 2230a_100000737577_200011996143 [0,2,0,0,0,0|0,0,2]=4 10419 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)Br 62a_100000188085_100016084084 [0,2,0,0,0,0|1,1,0]=4 10420 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)Cl 62a_100000211071_100016084084 [0,2,0,0,0,0|1,0,0]=3 10421 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)Cl 62a_100016084084_100000211071 [0,2,0,0,0,0|1,0,0]=3 10422 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)F 62a_100000211279_100016084084 [0,2,0,0,0,0|1,1,0]=4 10423 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)F 62a_100016084084_100000211279 [0,2,0,0,0,0|1,1,0]=4 10424 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)I 62a_100011216261_100016084084 [0,2,0,0,0,0|1,1,0]=4 10425 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)I 62a_100016084084_100011216261 [0,2,0,0,0,0|1,1,0]=4 10426 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)O 62a_100009814261_100016084084 [0,2,0,0,0,0|2,0,0]=4 10427 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cc1)O 62a_100016084084_100009814261 [0,2,0,0,0,0|2,0,0]=4 10428 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cn1)Cl 62a_100016084084_100016989621 [0,2,0,0,0,0|2,0,0]=4 10429 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(cn1)Cl 62a_100016989621_100016084084 [0,2,0,0,0,0|2,0,0]=4 10430 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(nc1)Cl 62a_100009864725_100016084084 [0,2,0,0,0,0|2,0,0]=4 10431 B15R1.132 C[C@H](CO)SCC(=O)c1ccc(nc1)Cl 62a_100016084084_100009864725 [0,2,0,0,0,0|2,0,0]=4 10432 B15R1.132 Cc1ccc(cc1)C(=O)CCC(=O)CO 1458a_100000210174_100000701375 [0,2,0,0,0,0|2,0,0]=4 10433 B15R1.132 Cc1ccc(cc1)C(=O)CN[C@H](C)CO 2230a_100000737577_100000211441 [0,2,0,0,0,0|1,0,0]=3 10434 B15R1.132 Cc1ccc(cc1)C(=O)CSC(C)CO 62a_100012180447_100000211441 [0,2,0,0,0,0|2,0,0]=4 10435 B15R1.132 Cc1ccc(cc1)C(=O)CS[C@H](C)CO 62a_100000211441_100016084084 [0,2,0,0,0,0|2,0,0]=4 10436 B15R1.132 Cc1ccc(cc1)C(=O)CS[C@H](C)CO 62a_100016084084_100000211441 [0,2,0,0,0,0|2,0,0]=4 10437 B15R1.132 Cc1ccc(cc1)C(=O)NCC(=O)CF 1458a_100000183637_100015361967 [0,2,0,0,0,0|2,0,0]=4 10438 B15R1.132 Cc1ccc(cc1)C(=O)NCC(C)CO 240690a_100000744482_100000188618 [0,2,0,0,0,0|1,0,0]=3 10439 B15R1.132 Cc1ccc(cc1)C(=O)NCC(C)CO 527a_100000744482_100000188618 [0,2,0,0,0,0|1,0,0]=3 10440 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@@H](F)CO 240690a_100015665980_100000188618 [0,2,0,0,0,0|1,0,0]=3 10441 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@@H](F)CO 527a_100015665980_100000188618 [0,2,0,0,0,0|1,0,0]=3 10442 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@H](O)CO 240690a_100020644852_100000188618 [0,2,0,0,0,0|1,0,0]=3 10443 B15R1.132 Cc1ccc(cc1)C(=O)NC[C@H](O)CO 527a_100020644852_100000188618 [0,2,0,0,0,0|1,0,0]=3 10444 B15R1.132 Cc1ccc(cc1)C(=O)NNC(=O)CO 22a_100000189790_100000210174 [0,2,0,0,0,0|1,0,1]=4 10445 B15R1.132 O=C(CF)CNC(=O)c1ccc(cc1)Cl 1458a_100000182666_100015361967 [0,2,0,0,0,0|1,0,0]=3 10446 B15R1.132 O=C(CF)CNC(=O)c1ccc(cc1)F 1458a_100000183488_100015361967 [0,2,0,0,0,0|1,1,0]=4 10447 B15R1.132 O=C(CF)CNC(=O)c1ccc(cc1)O 1458a_100000205570_100015361967 [0,2,0,0,0,0|2,0,0]=4 10448 B15R1.132 O=C(CO)CCC(=O)c1ccc(cc1)F 1458a_100000210174_100000211231 [0,2,0,0,0,0|1,1,0]=4 10449 B15R1.132 O=C(CO)NNC(=O)c1ccc(cc1)Br 22a_100000183614_100000210174 [0,2,0,0,0,0|0,1,1]=4 10450 B15R1.132 O=C(CO)NNC(=O)c1ccc(cc1)Cl 22a_100000184390_100000210174 [0,2,0,0,0,0|0,0,1]=3 10451 B15R1.132 O=C(CO)NNC(=O)c1ccc(cc1)F 22a_100000182866_100000210174 [0,2,0,0,0,0|0,1,1]=4 10452 B15R1.132 O=C(CO)NNC(=O)c1ccc(cc1)I 22a_100000189773_100000210174 [0,2,0,0,0,0|0,1,1]=4 10453 B15R1.132 O=C(CO)NNC(=O)c1ccc(cn1)Cl 22a_100012017650_100000210174 [0,2,0,0,0,0|1,0,1]=4 10454 B15R1.132 O=C(CO)NNC(=O)c1ccc(nc1)Cl 22a_100000189807_100000210174 [0,2,0,0,0,0|1,0,1]=4 10455 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Br 240690a_100015665980_100000185839 [0,2,0,0,0,0|0,1,0]=3 10456 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Br 527a_100015665980_100000185839 [0,2,0,0,0,0|0,1,0]=3 10457 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Cl 240690a_100015665980_100000210187 [0,2,0,0,0,0|0,0,0]=2 10458 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)Cl 527a_100015665980_100000210187 [0,2,0,0,0,0|0,0,0]=2 10459 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)F 240690a_100015665980_100000187176 [0,2,0,0,0,0|0,1,0]=3 10460 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)F 527a_100015665980_100000187176 [0,2,0,0,0,0|0,1,0]=3 10461 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)I 240690a_100015665980_100000187904 [0,2,0,0,0,0|0,1,0]=3 10462 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)I 527a_100015665980_100000187904 [0,2,0,0,0,0|0,1,0]=3 10463 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)O 240690a_100015665980_100000212099 [0,2,0,0,0,0|1,0,0]=3 10464 B15R1.132 O=C(NC[C@@H](F)CO)c1ccc(cc1)O 527a_100015665980_100000212099 [0,2,0,0,0,0|1,0,0]=3 10465 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Br 240690a_100020644852_100000185839 [0,2,0,0,0,0|0,1,0]=3 10466 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Br 527a_100020644852_100000185839 [0,2,0,0,0,0|0,1,0]=3 10467 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Cl 240690a_100020644852_100000210187 [0,2,0,0,0,0|0,0,0]=2 10468 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)Cl 527a_100020644852_100000210187 [0,2,0,0,0,0|0,0,0]=2 10469 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)F 240690a_100020644852_100000187176 [0,2,0,0,0,0|0,1,0]=3 10470 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)F 527a_100020644852_100000187176 [0,2,0,0,0,0|0,1,0]=3 10471 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)I 240690a_100020644852_100000187904 [0,2,0,0,0,0|0,1,0]=3 10472 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)I 527a_100020644852_100000187904 [0,2,0,0,0,0|0,1,0]=3 10473 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)O 240690a_100020644852_100000212099 [0,2,0,0,0,0|1,0,0]=3 10474 B15R1.132 O=C(NC[C@H](O)CO)c1ccc(cc1)O 527a_100020644852_100000212099 [0,2,0,0,0,0|1,0,0]=3 10475 B15R1.882 C=C(C)CNNC(=O)c1ccc(cc1)Cl 22a_100000729518_100000210187 [0,2,0,0,0,0|1,0,1]=4 10476 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Cl)C 11a_100000718196_100000210187 [0,2,0,0,0,0|1,0,1]=4 10477 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Cl)C 1626a_100000718196_100000210187 [0,2,0,0,0,0|1,0,1]=4 10478 B15R1.882 CC(=CCNC(=O)c1ccc(cc1)Cl)C 527a_100000718196_100000210187 [0,2,0,0,0,0|1,0,1]=4 10479 B15R1.882 CC(=NNCC(C)O)c1ccc(cc1)Br 4a_200000730056_100000185794 [0,2,0,0,0,0|1,1,0]=4 10480 B15R1.882 CC(=NNCC(C)O)c1ccc(cc1)C 4a_200000730056_100000185793 [0,2,0,0,0,0|2,0,0]=4 10481 B15R1.882 CC(=NNCC(C)O)c1ccc(cc1)Cl 4a_200000730056_100000185797 [0,2,0,0,0,0|1,0,0]=3 10482 B15R1.882 CC(=NNCC(C)O)c1ccc(cc1)F 4a_200000730056_100000185800 [0,2,0,0,0,0|1,1,0]=4 10483 B15R1.882 CC(=NNCC(C)O)c1ccc(cc1)I 4a_200000730056_100000185465 [0,2,0,0,0,0|1,1,0]=4 10484 B15R1.882 CC(=NNCC(C)O)c1ccc(cc1)O 4a_200000730056_100000185113 [0,2,0,0,0,0|2,0,0]=4 10485 B15R1.882 CC(=NNCC(C)O)c1ccc(cn1)Cl 4a_200000730056_100000692432 [0,2,0,0,0,0|2,0,0]=4 10486 B15R1.882 CC(=NNCC(C)O)c1ccc(nc1)Cl 4a_200000730056_100000690552 [0,2,0,0,0,0|2,0,0]=4 10487 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000070787_200011217871 [0,2,0,0,0,0|1,0,1]=4 10488 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215641 [0,2,0,0,0,0|1,0,1]=4 10489 B15R1.882 CC(=O)CCNC(=O)c1ccc(cc1)Br 1458a_100000184271_200000210301 [0,2,0,0,0,0|0,1,1]=4 10490 B15R1.882 CC(=O)CCNC(=O)c1ccc(cc1)Cl 1458a_100000184362_200000210301 [0,2,0,0,0,0|0,0,1]=3 10491 B15R1.882 CC(=O)CCNC(=O)c1ccc(cc1)F 1458a_100000195280_200000210301 [0,2,0,0,0,0|0,1,1]=4 10492 B15R1.882 CC(C)C=NNC(=O)c1ccc(cc1)Cl 4a_100000184390_100000210432 [0,2,0,0,0,0|1,0,1]=4 10493 B15R1.882 CC(C)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011214892 [0,2,0,0,0,0|2,0,0]=4 10494 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 11a_100000210545_100000185839 [0,2,0,0,0,0|1,1,0]=4 10495 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 1626a_100000210545_100000185839 [0,2,0,0,0,0|1,1,0]=4 10496 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 240690a_100000210545_100000185839 [0,2,0,0,0,0|1,1,0]=4 10497 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Br 527a_100000210545_100000185839 [0,2,0,0,0,0|1,1,0]=4 10498 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 11a_100000210545_100000210187 [0,2,0,0,0,0|1,0,0]=3 10499 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 1626a_100000210545_100000210187 [0,2,0,0,0,0|1,0,0]=3 10500 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 240690a_100000210545_100000210187 [0,2,0,0,0,0|1,0,0]=3 10501 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)Cl 527a_100000210545_100000210187 [0,2,0,0,0,0|1,0,0]=3 10502 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 11a_100000210545_100000187176 [0,2,0,0,0,0|1,1,0]=4 10503 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 1626a_100000210545_100000187176 [0,2,0,0,0,0|1,1,0]=4 10504 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 240690a_100000210545_100000187176 [0,2,0,0,0,0|1,1,0]=4 10505 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F 527a_100000210545_100000187176 [0,2,0,0,0,0|1,1,0]=4 10506 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 11a_100000210545_100000187904 [0,2,0,0,0,0|1,1,0]=4 10507 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 1626a_100000210545_100000187904 [0,2,0,0,0,0|1,1,0]=4 10508 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 240690a_100000210545_100000187904 [0,2,0,0,0,0|1,1,0]=4 10509 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)I 527a_100000210545_100000187904 [0,2,0,0,0,0|1,1,0]=4 10510 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)O 240690a_100000210545_100000212099 [0,2,0,0,0,0|2,0,0]=4 10511 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)O 527a_100000210545_100000212099 [0,2,0,0,0,0|2,0,0]=4 10512 B15R1.882 CC(C)CNCC(=O)c1ccc(cc1)Br 34a_100000210953_100000188085 [0,2,0,0,0,0|1,1,0]=4 10513 B15R1.882 CC(C)CNCC(=O)c1ccc(cc1)I 34a_100000210953_100011216261 [0,2,0,0,0,0|1,1,0]=4 10514 B15R1.882 CC(C)CNCC(=O)c1ccc(cc1)O 34a_100000210953_100009814261 [0,2,0,0,0,0|2,0,0]=4 10515 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)Br 22a_100000696102_100000185839 [0,2,0,0,0,0|1,1,0]=4 10516 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)Cl 22a_100000696102_100000210187 [0,2,0,0,0,0|1,0,0]=3 10517 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)F 22a_100000696102_100000187176 [0,2,0,0,0,0|1,1,0]=4 10518 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)I 22a_100000696102_100000187904 [0,2,0,0,0,0|1,1,0]=4 10519 B15R1.882 CC(C)CNNC(=O)c1ccc(cc1)O 22a_100000696102_100000212099 [0,2,0,0,0,0|2,0,0]=4 10520 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)Cl 62a_100000210624_100000211071 [0,2,0,0,0,0|2,0,0]=4 10521 B15R1.882 CC(C)CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210760 [0,2,0,0,0,0|2,0,0]=4 10522 B15R1.882 CC(C)OCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000211751 [0,2,0,0,0,0|2,0,0]=4 10523 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000730970 [0,2,0,0,0,0|2,0,0]=4 10524 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Cl 62a_100000210206_100011216492 [0,2,0,0,0,0|2,0,0]=4 10525 B15R1.882 CC(C)SCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210206 [0,2,0,0,0,0|2,0,0]=4 10526 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_200000718107 [0,2,0,0,0,0|1,1,0]=4 10527 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000718107 [0,2,0,0,0,0|1,0,0]=3 10528 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)F 1458a_100000187176_200000718107 [0,2,0,0,0,0|1,1,0]=4 10529 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)I 1458a_100000187904_200000718107 [0,2,0,0,0,0|1,1,0]=4 10530 B15R1.882 CC(O)CCCC(=O)c1ccc(cc1)O 1458a_100000212099_200000718107 [0,2,0,0,0,0|2,0,0]=4 10531 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Br 240690a_200000755665_100000185839 [0,2,0,0,0,0|0,1,0]=3 10532 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Br 527a_200000755665_100000185839 [0,2,0,0,0,0|0,1,0]=3 10533 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Cl 240690a_200000755665_100000210187 [0,2,0,0,0,0|0,0,0]=2 10534 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)Cl 527a_200000755665_100000210187 [0,2,0,0,0,0|0,0,0]=2 10535 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)F 240690a_200000755665_100000187176 [0,2,0,0,0,0|0,1,0]=3 10536 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)F 527a_200000755665_100000187176 [0,2,0,0,0,0|0,1,0]=3 10537 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)I 240690a_200000755665_100000187904 [0,2,0,0,0,0|0,1,0]=3 10538 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)I 527a_200000755665_100000187904 [0,2,0,0,0,0|0,1,0]=3 10539 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)O 240690a_200000755665_100000212099 [0,2,0,0,0,0|1,0,0]=3 10540 B15R1.882 CC(O)CCNC(=O)c1ccc(cc1)O 527a_200000755665_100000212099 [0,2,0,0,0,0|1,0,0]=3 10541 B15R1.882 CC(O)CCNC(C)c1ccc(cc1)Cl 2230a_200000755665_100000684792 [0,2,0,0,0,0|1,0,1]=4 10542 B15R1.882 CC(O)CCNC(C)c1ccc(cc1)Cl 269862a_200000755665_100000185797 [0,2,0,0,0,0|1,0,1]=4 10543 B15R1.882 CC(O)CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100012276601 [0,2,0,0,0,0|1,0,1]=4 10544 B15R1.882 CC(O)CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100012276601 [0,2,0,0,0,0|1,0,1]=4 10545 B15R1.882 CC(O)CNCC(=O)c1ccc(cc1)Br 34a_100000210904_100000188085 [0,2,0,0,0,0|0,1,0]=3 10546 B15R1.882 CC(O)CNCC(=O)c1ccc(cc1)I 34a_100000210904_100011216261 [0,2,0,0,0,0|0,1,0]=3 10547 B15R1.882 CC(O)CNCC(=O)c1ccc(cc1)O 34a_100000210904_100009814261 [0,2,0,0,0,0|1,0,0]=3 10548 B15R1.882 CC(O)CNCC(O)c1ccc(cc1)Cl 2230a_100000210904_200011996143 [0,2,0,0,0,0|0,0,2]=4 10549 B15R1.882 CC(O)CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100011218427 [0,2,0,0,0,0|0,0,2]=4 10550 B15R1.882 CC(O)CNCC(O)c1ccc(cc1)Cl 34a_100000210904_200011996143 [0,2,0,0,0,0|0,0,2]=4 10551 B15R1.882 CC(O)CNCC(O)c1ccc(cc1)Cl 34a_100000736658_100011218427 [0,2,0,0,0,0|0,0,2]=4 10552 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)Br 22a_200000730056_100000185839 [0,2,0,0,0,0|0,1,0]=3 10553 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)Cl 22a_200000730056_100000210187 [0,2,0,0,0,0|0,0,0]=2 10554 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)F 22a_200000730056_100000187176 [0,2,0,0,0,0|0,1,0]=3 10555 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)I 22a_200000730056_100000187904 [0,2,0,0,0,0|0,1,0]=3 10556 B15R1.882 CC(O)CNNC(=O)c1ccc(cc1)O 22a_200000730056_100000212099 [0,2,0,0,0,0|1,0,0]=3 10557 B15R1.882 CC(O)COCC(=O)c1ccc(cc1)F 34a_100000246311_100011218427 [0,2,0,0,0,0|1,1,0]=4 10558 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)Br 62a_100000188085_100011218427 [0,2,0,0,0,0|1,1,0]=4 10559 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100011218427 [0,2,0,0,0,0|1,0,0]=3 10560 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)Cl 62a_100011218427_100000211071 [0,2,0,0,0,0|1,0,0]=3 10561 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)F 62a_100000211279_100011218427 [0,2,0,0,0,0|1,1,0]=4 10562 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)F 62a_100011218427_100000211279 [0,2,0,0,0,0|1,1,0]=4 10563 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)I 62a_100011216261_100011218427 [0,2,0,0,0,0|1,1,0]=4 10564 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)I 62a_100011218427_100011216261 [0,2,0,0,0,0|1,1,0]=4 10565 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)O 62a_100009814261_100011218427 [0,2,0,0,0,0|2,0,0]=4 10566 B15R1.882 CC(O)CSCC(=O)c1ccc(cc1)O 62a_100011218427_100009814261 [0,2,0,0,0,0|2,0,0]=4 10567 B15R1.882 CC(O)CSCC(=O)c1ccc(cn1)Cl 62a_100011218427_100016989621 [0,2,0,0,0,0|2,0,0]=4 10568 B15R1.882 CC(O)CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100011218427 [0,2,0,0,0,0|2,0,0]=4 10569 B15R1.882 CC(O)CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100011218427 [0,2,0,0,0,0|2,0,0]=4 10570 B15R1.882 CC(O)CSCC(=O)c1ccc(nc1)Cl 62a_100011218427_100009864725 [0,2,0,0,0,0|2,0,0]=4 10571 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000695564 [0,2,0,0,0,0|2,0,0]=4 10572 B15R1.882 CN(C)CCCC(=O)c1ccc(cc1)Cl 269982a_100102631434_200011217871 [0,2,0,0,0,0|2,0,0]=4 10573 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Br 240690a_100000210585_100000185839 [0,2,0,0,0,0|1,1,0]=4 10574 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Br 527a_100000210585_100000185839 [0,2,0,0,0,0|1,1,0]=4 10575 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Cl 240690a_100000210585_100000210187 [0,2,0,0,0,0|1,0,0]=3 10576 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)Cl 527a_100000210585_100000210187 [0,2,0,0,0,0|1,0,0]=3 10577 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)F 240690a_100000210585_100000187176 [0,2,0,0,0,0|1,1,0]=4 10578 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)F 527a_100000210585_100000187176 [0,2,0,0,0,0|1,1,0]=4 10579 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)I 240690a_100000210585_100000187904 [0,2,0,0,0,0|1,1,0]=4 10580 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)I 527a_100000210585_100000187904 [0,2,0,0,0,0|1,1,0]=4 10581 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)O 240690a_100000210585_100000212099 [0,2,0,0,0,0|2,0,0]=4 10582 B15R1.882 CN(C)CCNC(=O)c1ccc(cc1)O 527a_100000210585_100000212099 [0,2,0,0,0,0|2,0,0]=4 10583 B15R1.882 C[C@@H](O)CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100009817552 [0,2,0,0,0,0|0,0,2]=4 10584 B15R1.882 C[C@@H](O)CNCC(O)c1ccc(cc1)Cl 34a_100000736658_100009817552 [0,2,0,0,0,0|0,0,2]=4 10585 B15R1.882 C[C@@H](O)COCC(=O)c1ccc(cc1)F 34a_100000246311_100009817552 [0,2,0,0,0,0|1,1,0]=4 10586 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)Br 62a_100000188085_100009817552 [0,2,0,0,0,0|1,1,0]=4 10587 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100009817552 [0,2,0,0,0,0|1,0,0]=3 10588 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)Cl 62a_100009817552_100000211071 [0,2,0,0,0,0|1,0,0]=3 10589 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)F 62a_100000211279_100009817552 [0,2,0,0,0,0|1,1,0]=4 10590 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)F 62a_100009817552_100000211279 [0,2,0,0,0,0|1,1,0]=4 10591 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)I 62a_100009817552_100011216261 [0,2,0,0,0,0|1,1,0]=4 10592 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)I 62a_100011216261_100009817552 [0,2,0,0,0,0|1,1,0]=4 10593 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)O 62a_100009814261_100009817552 [0,2,0,0,0,0|2,0,0]=4 10594 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cc1)O 62a_100009817552_100009814261 [0,2,0,0,0,0|2,0,0]=4 10595 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cn1)Cl 62a_100009817552_100016989621 [0,2,0,0,0,0|2,0,0]=4 10596 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_100009817552 [0,2,0,0,0,0|2,0,0]=4 10597 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(nc1)Cl 62a_100009817552_100009864725 [0,2,0,0,0,0|2,0,0]=4 10598 B15R1.882 C[C@@H](O)CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_100009817552 [0,2,0,0,0,0|2,0,0]=4 10599 B15R1.882 Cc1ccc(cc1)C(=O)CCCC(C)O 1458a_100000188618_200000718107 [0,2,0,0,0,0|2,0,0]=4 10600 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(=O)O 269956a_100016091260_100000211441 [0,2,0,0,0,0|1,0,1]=4 10601 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)C 2230a_100000210953_100000211441 [0,2,0,0,0,0|2,0,0]=4 10602 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)C 34a_100000210953_100000211441 [0,2,0,0,0,0|2,0,0]=4 10603 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)O 2230a_100000210904_100000211441 [0,2,0,0,0,0|1,0,0]=3 10604 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(C)O 34a_100000210904_100000211441 [0,2,0,0,0,0|1,0,0]=3 10605 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(F)F 34a_100000765723_100000211441 [0,2,0,0,0,0|2,0,0]=4 10606 B15R1.882 Cc1ccc(cc1)C(=O)CSCC(C)O 62a_100000211441_100011218427 [0,2,0,0,0,0|2,0,0]=4 10607 B15R1.882 Cc1ccc(cc1)C(=O)CSCC(C)O 62a_100011218427_100000211441 [0,2,0,0,0,0|2,0,0]=4 10608 B15R1.882 Cc1ccc(cc1)C(=O)CSC[C@@H](C)O 62a_100000211441_100009817552 [0,2,0,0,0,0|2,0,0]=4 10609 B15R1.882 Cc1ccc(cc1)C(=O)CSC[C@@H](C)O 62a_100009817552_100000211441 [0,2,0,0,0,0|2,0,0]=4 10610 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(=O)N 11a_100000740010_100000188618 [0,2,0,0,0,0|1,0,1]=4 10611 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(=O)N 240690a_100000740010_100000188618 [0,2,0,0,0,0|1,0,1]=4 10612 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(=O)N 527a_100000740010_100000188618 [0,2,0,0,0,0|1,0,1]=4 10613 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 11a_100000210545_100000188618 [0,2,0,0,0,0|2,0,0]=4 10614 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 1626a_100000210545_100000188618 [0,2,0,0,0,0|2,0,0]=4 10615 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 240690a_100000210545_100000188618 [0,2,0,0,0,0|2,0,0]=4 10616 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C 527a_100000210545_100000188618 [0,2,0,0,0,0|2,0,0]=4 10617 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)O 240690a_200000755665_100000188618 [0,2,0,0,0,0|1,0,0]=3 10618 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)O 527a_200000755665_100000188618 [0,2,0,0,0,0|1,0,0]=3 10619 B15R1.882 Cc1ccc(cc1)C(=O)NCCN(C)C 240690a_100000210585_100000188618 [0,2,0,0,0,0|2,0,0]=4 10620 B15R1.882 Cc1ccc(cc1)C(=O)NCCN(C)C 527a_100000210585_100000188618 [0,2,0,0,0,0|2,0,0]=4 10621 B15R1.882 Cc1ccc(cc1)C(=O)NNCC(C)C 22a_100000696102_100000188618 [0,2,0,0,0,0|2,0,0]=4 10622 B15R1.882 Cc1ccc(cc1)C(=O)NNCC(C)O 22a_200000730056_100000188618 [0,2,0,0,0,0|1,0,0]=3 10623 B15R1.882 NC(=O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100102525003 [0,2,0,0,0,0|1,0,1]=4 10624 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)Br 11a_100000740010_100000185839 [0,2,0,0,0,0|0,1,1]=4 10625 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)Br 240690a_100000740010_100000185839 [0,2,0,0,0,0|0,1,1]=4 10626 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)Br 527a_100000740010_100000185839 [0,2,0,0,0,0|0,1,1]=4 10627 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)Cl 11a_100000740010_100000210187 [0,2,0,0,0,0|0,0,1]=3 10628 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)Cl 240690a_100000740010_100000210187 [0,2,0,0,0,0|0,0,1]=3 10629 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)Cl 527a_100000740010_100000210187 [0,2,0,0,0,0|0,0,1]=3 10630 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)F 11a_100000740010_100000187176 [0,2,0,0,0,0|0,1,1]=4 10631 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)F 240690a_100000740010_100000187176 [0,2,0,0,0,0|0,1,1]=4 10632 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)F 527a_100000740010_100000187176 [0,2,0,0,0,0|0,1,1]=4 10633 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)I 11a_100000740010_100000187904 [0,2,0,0,0,0|0,1,1]=4 10634 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)I 240690a_100000740010_100000187904 [0,2,0,0,0,0|0,1,1]=4 10635 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)I 527a_100000740010_100000187904 [0,2,0,0,0,0|0,1,1]=4 10636 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)O 240690a_100000740010_100000212099 [0,2,0,0,0,0|1,0,1]=4 10637 B15R1.882 NC(=O)CCNC(=O)c1ccc(cc1)O 527a_100000740010_100000212099 [0,2,0,0,0,0|1,0,1]=4 10638 B15R1.882 O=C(CNCC(F)F)c1ccc(cc1)Br 34a_100000765723_100000188085 [0,2,0,0,0,0|1,1,0]=4 10639 B15R1.882 O=C(CNCC(F)F)c1ccc(cc1)I 34a_100000765723_100011216261 [0,2,0,0,0,0|1,1,0]=4 10640 B15R1.882 O=C(CNCC(F)F)c1ccc(cc1)O 34a_100000765723_100009814261 [0,2,0,0,0,0|2,0,0]=4 10641 B15R1.882 O=C(CSCC(F)F)c1ccc(cc1)Cl 62a_100000211071_100011934356 [0,2,0,0,0,0|2,0,0]=4 10642 B15R1.882 O=C(CSCC(F)F)c1ccc(cc1)Cl 62a_100011934356_100000211071 [0,2,0,0,0,0|2,0,0]=4 10643 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)Br 269956a_100016091260_100000188085 [0,2,0,0,0,0|0,1,1]=4 10644 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)Cl 269956a_100016091260_100000211071 [0,2,0,0,0,0|0,0,1]=3 10645 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)F 269956a_100016091260_100000211279 [0,2,0,0,0,0|0,1,1]=4 10646 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)I 269956a_100016091260_100011216261 [0,2,0,0,0,0|0,1,1]=4 10647 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)O 269956a_100016091260_100009814261 [0,2,0,0,0,0|1,0,1]=4 10648 B15R1.882 O=C(O)CNCC(=O)c1ccc(cn1)Cl 269956a_100016091260_100016989621 [0,2,0,0,0,0|1,0,1]=4 10649 B15R1.882 O=C(O)CNCC(=O)c1ccc(nc1)Cl 269956a_100016091260_100009864725 [0,2,0,0,0,0|1,0,1]=4 10650 B15R1.882 [13CH3]C(=O)CCNC(=O)c1ccc(cc1)Br 1458a_100000184271_200025704644 [0,2,0,0,0,0|0,1,1]=4 10651 B15R1.882 [13CH3]C(=O)CCNC(=O)c1ccc(cc1)Cl 1458a_100000184362_200025704644 [0,2,0,0,0,0|0,0,1]=3 10652 B15R1.882 [13CH3]C(=O)CCNC(=O)c1ccc(cc1)F 1458a_100000195280_200025704644 [0,2,0,0,0,0|0,1,1]=4 10653 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#C 11a_100000755551_100011217615 [0,2,0,0,0,0|2,0,0]=4 10654 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#C 1626a_100000755551_100011217615 [0,2,0,0,0,0|2,0,0]=4 10655 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#C 240690a_100000755551_100011217615 [0,2,0,0,0,0|2,0,0]=4 10656 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#C 527a_100000755551_100011217615 [0,2,0,0,0,0|2,0,0]=4 10657 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#N 11a_100000755551_100000210717 [0,2,0,0,0,0|2,0,0]=4 10658 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#N 1626a_100000755551_100000210717 [0,2,0,0,0,0|2,0,0]=4 10659 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#N 240690a_100000755551_100000210717 [0,2,0,0,0,0|2,0,0]=4 10660 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C#N 527a_100000755551_100000210717 [0,2,0,0,0,0|2,0,0]=4 10661 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C=C 11a_100000755551_100000687532 [0,2,0,0,0,0|2,0,0]=4 10662 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C=C 1626a_100000755551_100000687532 [0,2,0,0,0,0|2,0,0]=4 10663 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C=C 240690a_100000755551_100000687532 [0,2,0,0,0,0|2,0,0]=4 10664 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)C=C 527a_100000755551_100000687532 [0,2,0,0,0,0|2,0,0]=4 10665 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)CC 11a_100000755551_100000211226 [0,2,0,0,0,0|2,0,0]=4 10666 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)CC 1626a_100000755551_100000211226 [0,2,0,0,0,0|2,0,0]=4 10667 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)CC 240690a_100000755551_100000211226 [0,2,0,0,0,0|2,0,0]=4 10668 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)CC 527a_100000755551_100000211226 [0,2,0,0,0,0|2,0,0]=4 10669 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)CO 1626a_100000755551_100000183892 [0,2,0,0,0,0|2,0,0]=4 10670 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)CO 240690a_100000755551_100000183892 [0,2,0,0,0,0|2,0,0]=4 10671 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)OC 11a_100000755551_100000184203 [0,2,0,0,0,0|2,0,0]=4 10672 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)OC 1626a_100000755551_100000184203 [0,2,0,0,0,0|2,0,0]=4 10673 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)OC 240690a_100000755551_100000184203 [0,2,0,0,0,0|2,0,0]=4 10674 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)OC 527a_100000755551_100000184203 [0,2,0,0,0,0|2,0,0]=4 10675 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)SC 11a_100000755551_100000189692 [0,2,0,0,0,0|2,0,0]=4 10676 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)SC 1626a_100000755551_100000189692 [0,2,0,0,0,0|2,0,0]=4 10677 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)SC 240690a_100000755551_100000189692 [0,2,0,0,0,0|2,0,0]=4 10678 B15R1.1389 C#CCCNC(=O)c1ccc(cc1)SC 527a_100000755551_100000189692 [0,2,0,0,0,0|2,0,0]=4 10679 B15R1.1389 C#Cc1ccc(cc1)C(=NNCCO)C 4a_100000210001_100011470579 [0,2,0,0,0,0|2,0,0]=4 10680 B15R1.1389 C#Cc1ccc(cc1)C(=O)CCCCO 1458a_100011217615_100000210776 [0,2,0,0,0,0|2,0,0]=4 10681 B15R1.1389 C#Cc1ccc(cc1)C(=O)CCCOC 1458a_100011217615_100000740836 [0,2,0,0,0,0|2,0,0]=4 10682 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC#N 11a_100000720768_100011217615 [0,2,0,0,0,0|2,0,0]=4 10683 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC#N 1626a_100000720768_100011217615 [0,2,0,0,0,0|2,0,0]=4 10684 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC#N 240690a_100000720768_100011217615 [0,2,0,0,0,0|2,0,0]=4 10685 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC#N 527a_100000720768_100011217615 [0,2,0,0,0,0|2,0,0]=4 10686 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC=C 11a_100015191253_100011217615 [0,2,0,0,0,0|2,0,0]=4 10687 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC=C 1626a_100015191253_100011217615 [0,2,0,0,0,0|2,0,0]=4 10688 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC=C 240690a_100015191253_100011217615 [0,2,0,0,0,0|2,0,0]=4 10689 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCC=C 527a_100015191253_100011217615 [0,2,0,0,0,0|2,0,0]=4 10690 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCC 11a_100000102301_100011217615 [0,2,0,0,0,0|2,0,0]=4 10691 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCC 1626a_100000102301_100011217615 [0,2,0,0,0,0|2,0,0]=4 10692 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCC 240690a_100000102301_100011217615 [0,2,0,0,0,0|2,0,0]=4 10693 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCC 527a_100000102301_100011217615 [0,2,0,0,0,0|2,0,0]=4 10694 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100011217615 [0,2,0,0,0,0|2,0,0]=4 10695 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100011217615 [0,2,0,0,0,0|2,0,0]=4 10696 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100011217615 [0,2,0,0,0,0|2,0,0]=4 10697 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100011217615 [0,2,0,0,0,0|2,0,0]=4 10698 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100011217615 [0,2,0,0,0,0|1,0,0]=3 10699 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100011217615 [0,2,0,0,0,0|1,0,0]=3 10700 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCOC 1626a_100000209980_100011217615 [0,2,0,0,0,0|1,0,0]=3 10701 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCOC 240690a_100000209980_100011217615 [0,2,0,0,0,0|1,0,0]=3 10702 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCOC 527a_100000209980_100011217615 [0,2,0,0,0,0|1,0,0]=3 10703 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCSC 11a_100020590264_100011217615 [0,2,0,0,0,0|1,1,0]=4 10704 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCSC 1626a_100020590264_100011217615 [0,2,0,0,0,0|1,1,0]=4 10705 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCSC 240690a_100020590264_100011217615 [0,2,0,0,0,0|1,1,0]=4 10706 B15R1.1389 C#Cc1ccc(cc1)C(=O)NCCSC 527a_100020590264_100011217615 [0,2,0,0,0,0|1,1,0]=4 10707 B15R1.1389 C#Cc1ccc(cc1)C(=O)NNCCC 22a_100000740057_100011217615 [0,2,0,0,0,0|2,0,0]=4 10708 B15R1.1389 C#Cc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100011217615 [0,2,0,0,0,0|1,0,0]=3 10709 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C#N 11a_100015191253_100000210717 [0,2,0,0,0,0|2,0,0]=4 10710 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C#N 1626a_100015191253_100000210717 [0,2,0,0,0,0|2,0,0]=4 10711 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C#N 240690a_100015191253_100000210717 [0,2,0,0,0,0|2,0,0]=4 10712 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C#N 527a_100015191253_100000210717 [0,2,0,0,0,0|2,0,0]=4 10713 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C=C 11a_100015191253_100000687532 [0,2,0,0,0,0|2,0,0]=4 10714 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C=C 1626a_100015191253_100000687532 [0,2,0,0,0,0|2,0,0]=4 10715 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C=C 240690a_100015191253_100000687532 [0,2,0,0,0,0|2,0,0]=4 10716 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)C=C 527a_100015191253_100000687532 [0,2,0,0,0,0|2,0,0]=4 10717 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)CC 11a_100015191253_100000211226 [0,2,0,0,0,0|2,0,0]=4 10718 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)CC 1626a_100015191253_100000211226 [0,2,0,0,0,0|2,0,0]=4 10719 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)CC 240690a_100015191253_100000211226 [0,2,0,0,0,0|2,0,0]=4 10720 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)CC 527a_100015191253_100000211226 [0,2,0,0,0,0|2,0,0]=4 10721 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)CO 1626a_100015191253_100000183892 [0,2,0,0,0,0|2,0,0]=4 10722 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)CO 240690a_100015191253_100000183892 [0,2,0,0,0,0|2,0,0]=4 10723 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)OC 11a_100015191253_100000184203 [0,2,0,0,0,0|2,0,0]=4 10724 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)OC 1626a_100015191253_100000184203 [0,2,0,0,0,0|2,0,0]=4 10725 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)OC 240690a_100015191253_100000184203 [0,2,0,0,0,0|2,0,0]=4 10726 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)OC 527a_100015191253_100000184203 [0,2,0,0,0,0|2,0,0]=4 10727 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)SC 11a_100015191253_100000189692 [0,2,0,0,0,0|2,0,0]=4 10728 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)SC 1626a_100015191253_100000189692 [0,2,0,0,0,0|2,0,0]=4 10729 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)SC 240690a_100015191253_100000189692 [0,2,0,0,0,0|2,0,0]=4 10730 B15R1.1389 C=CCCNC(=O)c1ccc(cc1)SC 527a_100015191253_100000189692 [0,2,0,0,0,0|2,0,0]=4 10731 B15R1.1389 C=Cc1ccc(cc1)C(=O)CCCCO 1458a_100000687532_100000210776 [0,2,0,0,0,0|2,0,0]=4 10732 B15R1.1389 C=Cc1ccc(cc1)C(=O)CCCOC 1458a_100000687532_100000740836 [0,2,0,0,0,0|2,0,0]=4 10733 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCC#N 11a_100000720768_100000687532 [0,2,0,0,0,0|2,0,0]=4 10734 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCC#N 1626a_100000720768_100000687532 [0,2,0,0,0,0|2,0,0]=4 10735 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCC#N 240690a_100000720768_100000687532 [0,2,0,0,0,0|2,0,0]=4 10736 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCC#N 527a_100000720768_100000687532 [0,2,0,0,0,0|2,0,0]=4 10737 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCC 11a_100000102301_100000687532 [0,2,0,0,0,0|2,0,0]=4 10738 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCC 1626a_100000102301_100000687532 [0,2,0,0,0,0|2,0,0]=4 10739 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCC 240690a_100000102301_100000687532 [0,2,0,0,0,0|2,0,0]=4 10740 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCC 271570a_100011290941_200000154866 [0,2,0,0,0,0|2,0,0]=4 10741 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCC 527a_100000102301_100000687532 [0,2,0,0,0,0|2,0,0]=4 10742 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000687532 [0,2,0,0,0,0|2,0,0]=4 10743 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000687532 [0,2,0,0,0,0|2,0,0]=4 10744 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000687532 [0,2,0,0,0,0|2,0,0]=4 10745 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000687532 [0,2,0,0,0,0|2,0,0]=4 10746 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000687532 [0,2,0,0,0,0|1,0,0]=3 10747 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000687532 [0,2,0,0,0,0|1,0,0]=3 10748 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCOC 1626a_100000209980_100000687532 [0,2,0,0,0,0|1,0,0]=3 10749 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCOC 240690a_100000209980_100000687532 [0,2,0,0,0,0|1,0,0]=3 10750 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCOC 527a_100000209980_100000687532 [0,2,0,0,0,0|1,0,0]=3 10751 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCSC 11a_100020590264_100000687532 [0,2,0,0,0,0|1,1,0]=4 10752 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCSC 1626a_100020590264_100000687532 [0,2,0,0,0,0|1,1,0]=4 10753 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCSC 240690a_100020590264_100000687532 [0,2,0,0,0,0|1,1,0]=4 10754 B15R1.1389 C=Cc1ccc(cc1)C(=O)NCCSC 527a_100020590264_100000687532 [0,2,0,0,0,0|1,1,0]=4 10755 B15R1.1389 C=Cc1ccc(cc1)C(=O)NNCCC 22a_100000740057_100000687532 [0,2,0,0,0,0|2,0,0]=4 10756 B15R1.1389 C=Cc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100000687532 [0,2,0,0,0,0|1,0,0]=3 10757 B15R1.1389 C=Cc1ccc(cn1)C(=O)NCCOC 271570a_100011290941_100000157854 [0,2,0,0,0,0|2,0,0]=4 10758 B15R1.1389 CC(=NNCCO)c1ccc(cc1)C#N 4a_100000210001_100000182420 [0,2,0,0,0,0|2,0,0]=4 10759 B15R1.1389 CC(=NNCCO)c1ccc(cc1)CO 4a_100000210001_100000082505 [0,2,0,0,0,0|2,0,0]=4 10760 B15R1.1389 CCCCNC(=O)c1ccc(cc1)C#N 11a_100000102301_100000210717 [0,2,0,0,0,0|2,0,0]=4 10761 B15R1.1389 CCCCNC(=O)c1ccc(cc1)C#N 1626a_100000102301_100000210717 [0,2,0,0,0,0|2,0,0]=4 10762 B15R1.1389 CCCCNC(=O)c1ccc(cc1)C#N 240690a_100000102301_100000210717 [0,2,0,0,0,0|2,0,0]=4 10763 B15R1.1389 CCCCNC(=O)c1ccc(cc1)C#N 527a_100000102301_100000210717 [0,2,0,0,0,0|2,0,0]=4 10764 B15R1.1389 CCCCNC(=O)c1ccc(cc1)CC 11a_100000102301_100000211226 [0,2,0,0,0,0|2,0,0]=4 10765 B15R1.1389 CCCCNC(=O)c1ccc(cc1)CC 1626a_100000102301_100000211226 [0,2,0,0,0,0|2,0,0]=4 10766 B15R1.1389 CCCCNC(=O)c1ccc(cc1)CC 240690a_100000102301_100000211226 [0,2,0,0,0,0|2,0,0]=4 10767 B15R1.1389 CCCCNC(=O)c1ccc(cc1)CC 527a_100000102301_100000211226 [0,2,0,0,0,0|2,0,0]=4 10768 B15R1.1389 CCCCNC(=O)c1ccc(cc1)CO 1626a_100000102301_100000183892 [0,2,0,0,0,0|2,0,0]=4 10769 B15R1.1389 CCCCNC(=O)c1ccc(cc1)CO 240690a_100000102301_100000183892 [0,2,0,0,0,0|2,0,0]=4 10770 B15R1.1389 CCCCNC(=O)c1ccc(cc1)NC 27a_100102657272_200000154866 [0,2,0,0,0,0|2,0,0]=4 10771 B15R1.1389 CCCCNC(=O)c1ccc(cc1)OC 11a_100000102301_100000184203 [0,2,0,0,0,0|2,0,0]=4 10772 B15R1.1389 CCCCNC(=O)c1ccc(cc1)OC 1626a_100000102301_100000184203 [0,2,0,0,0,0|2,0,0]=4 10773 B15R1.1389 CCCCNC(=O)c1ccc(cc1)OC 240690a_100000102301_100000184203 [0,2,0,0,0,0|2,0,0]=4 10774 B15R1.1389 CCCCNC(=O)c1ccc(cc1)OC 527a_100000102301_100000184203 [0,2,0,0,0,0|2,0,0]=4 10775 B15R1.1389 CCCCNC(=O)c1ccc(cc1)SC 11a_100000102301_100000189692 [0,2,0,0,0,0|2,0,0]=4 10776 B15R1.1389 CCCCNC(=O)c1ccc(cc1)SC 1626a_100000102301_100000189692 [0,2,0,0,0,0|2,0,0]=4 10777 B15R1.1389 CCCCNC(=O)c1ccc(cc1)SC 240690a_100000102301_100000189692 [0,2,0,0,0,0|2,0,0]=4 10778 B15R1.1389 CCCCNC(=O)c1ccc(cc1)SC 527a_100000102301_100000189692 [0,2,0,0,0,0|2,0,0]=4 10779 B15R1.1389 CCCCNC(=O)c1ccc(cc1)SC 62a_200000154866_200000210301 [0,2,0,0,0,0|2,0,0]=4 10780 B15R1.1389 CCCCNC(=O)c1ccc(cc1)SC 62a_200000210301_200000154866 [0,2,0,0,0,0|2,0,0]=4 10781 B15R1.1389 CCCCNC(=O)c1ccc(cc1)S[13CH3] 62a_200000154866_200025704644 [0,2,0,0,0,0|2,0,0]=4 10782 B15R1.1389 CCCCNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_200000154866 [0,2,0,0,0,0|2,0,0]=4 10783 B15R1.1389 CCCNNC(=O)c1ccc(cc1)C#N 22a_100000740057_100000210717 [0,2,0,0,0,0|2,0,0]=4 10784 B15R1.1389 CCCNNC(=O)c1ccc(cc1)CC 22a_100000740057_100000211226 [0,2,0,0,0,0|2,0,0]=4 10785 B15R1.1389 CCCNNC(=O)c1ccc(cc1)CO 22a_100000740057_100000183892 [0,2,0,0,0,0|2,0,0]=4 10786 B15R1.1389 CCCNNC(=O)c1ccc(cc1)OC 22a_100000740057_100000184203 [0,2,0,0,0,0|2,0,0]=4 10787 B15R1.1389 CCCNNC(=O)c1ccc(cc1)SC 22a_100000740057_100000189692 [0,2,0,0,0,0|2,0,0]=4 10788 B15R1.1389 CCc1ccc(cc1)C(=NNCCO)C 4a_100000210001_100000211630 [0,2,0,0,0,0|2,0,0]=4 10789 B15R1.1389 CCc1ccc(cc1)C(=O)CCCCO 1458a_100000211226_100000210776 [0,2,0,0,0,0|2,0,0]=4 10790 B15R1.1389 CCc1ccc(cc1)C(=O)CCCOC 1458a_100000211226_100000740836 [0,2,0,0,0,0|2,0,0]=4 10791 B15R1.1389 CCc1ccc(cc1)C(=O)CNCCO 2230a_100016997473_100000689809 [0,2,0,0,0,0|1,0,0]=3 10792 B15R1.1389 CCc1ccc(cc1)C(=O)CSCCO 62a_100000211926_100000689809 [0,2,0,0,0,0|2,0,0]=4 10793 B15R1.1389 CCc1ccc(cc1)C(=O)CSCCO 62a_100000689809_100000211926 [0,2,0,0,0,0|2,0,0]=4 10794 B15R1.1389 CCc1ccc(cc1)C(=O)NCCC#N 11a_100000720768_100000211226 [0,2,0,0,0,0|2,0,0]=4 10795 B15R1.1389 CCc1ccc(cc1)C(=O)NCCC#N 1626a_100000720768_100000211226 [0,2,0,0,0,0|2,0,0]=4 10796 B15R1.1389 CCc1ccc(cc1)C(=O)NCCC#N 240690a_100000720768_100000211226 [0,2,0,0,0,0|2,0,0]=4 10797 B15R1.1389 CCc1ccc(cc1)C(=O)NCCC#N 527a_100000720768_100000211226 [0,2,0,0,0,0|2,0,0]=4 10798 B15R1.1389 CCc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000211226 [0,2,0,0,0,0|2,0,0]=4 10799 B15R1.1389 CCc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000211226 [0,2,0,0,0,0|2,0,0]=4 10800 B15R1.1389 CCc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000211226 [0,2,0,0,0,0|2,0,0]=4 10801 B15R1.1389 CCc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000211226 [0,2,0,0,0,0|2,0,0]=4 10802 B15R1.1389 CCc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000211226 [0,2,0,0,0,0|1,0,0]=3 10803 B15R1.1389 CCc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000211226 [0,2,0,0,0,0|1,0,0]=3 10804 B15R1.1389 CCc1ccc(cc1)C(=O)NCCOC 1626a_100000209980_100000211226 [0,2,0,0,0,0|1,0,0]=3 10805 B15R1.1389 CCc1ccc(cc1)C(=O)NCCOC 240690a_100000209980_100000211226 [0,2,0,0,0,0|1,0,0]=3 10806 B15R1.1389 CCc1ccc(cc1)C(=O)NCCOC 527a_100000209980_100000211226 [0,2,0,0,0,0|1,0,0]=3 10807 B15R1.1389 CCc1ccc(cc1)C(=O)NCCSC 11a_100020590264_100000211226 [0,2,0,0,0,0|1,1,0]=4 10808 B15R1.1389 CCc1ccc(cc1)C(=O)NCCSC 1626a_100020590264_100000211226 [0,2,0,0,0,0|1,1,0]=4 10809 B15R1.1389 CCc1ccc(cc1)C(=O)NCCSC 240690a_100020590264_100000211226 [0,2,0,0,0,0|1,1,0]=4 10810 B15R1.1389 CCc1ccc(cc1)C(=O)NCCSC 527a_100020590264_100000211226 [0,2,0,0,0,0|1,1,0]=4 10811 B15R1.1389 CCc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100000211226 [0,2,0,0,0,0|1,0,0]=3 10812 B15R1.1389 CNCCNC(=O)c1ccc(cc1)OC 2230a_100000741995_200000210301 [0,2,0,0,0,0|2,0,0]=4 10813 B15R1.1389 CNc1ccc(cc1)C(=NNCCO)C 4a_100000210001_100011806243 [0,2,0,0,0,0|2,0,0]=4 10814 B15R1.1389 CNc1ccc(cc1)C(=O)NCCOC 2230a_200011193738_200000210301 [0,2,0,0,0,0|1,0,0]=3 10815 B15R1.1389 CNc1ccc(cc1)C(=O)NCCOC 34a_200011193738_200000210301 [0,2,0,0,0,0|1,0,0]=3 10816 B15R1.1389 CNc1ccc(cn1)C(=O)NCCOC 27a_100102657272_100000157854 [0,2,0,0,0,0|2,0,0]=4 10817 B15R1.1389 COCCCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000740836 [0,2,0,0,0,0|2,0,0]=4 10818 B15R1.1389 COCCCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000740836 [0,2,0,0,0,0|2,0,0]=4 10819 B15R1.1389 COCCCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000740836 [0,2,0,0,0,0|2,0,0]=4 10820 B15R1.1389 COCCCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000740836 [0,2,0,0,0,0|2,0,0]=4 10821 B15R1.1389 COCCNC(=O)c1ccc(cc1)C#N 1626a_100000209980_100000210717 [0,2,0,0,0,0|1,0,0]=3 10822 B15R1.1389 COCCNC(=O)c1ccc(cc1)C#N 240690a_100000209980_100000210717 [0,2,0,0,0,0|1,0,0]=3 10823 B15R1.1389 COCCNC(=O)c1ccc(cc1)C#N 527a_100000209980_100000210717 [0,2,0,0,0,0|1,0,0]=3 10824 B15R1.1389 COCCNC(=O)c1ccc(cc1)CO 1626a_100000209980_100000183892 [0,2,0,0,0,0|1,0,0]=3 10825 B15R1.1389 COCCNC(=O)c1ccc(cc1)CO 240690a_100000209980_100000183892 [0,2,0,0,0,0|1,0,0]=3 10826 B15R1.1389 COCCNC(=O)c1ccc(cc1)N[13CH3] 2230a_200011193738_200025704644 [0,2,0,0,0,0|1,0,0]=3 10827 B15R1.1389 COCCNC(=O)c1ccc(cc1)N[13CH3] 34a_200011193738_200025704644 [0,2,0,0,0,0|1,0,0]=3 10828 B15R1.1389 COCCNC(=O)c1ccc(cc1)OC 1626a_100000209980_100000184203 [0,2,0,0,0,0|1,0,0]=3 10829 B15R1.1389 COCCNC(=O)c1ccc(cc1)OC 240690a_100000209980_100000184203 [0,2,0,0,0,0|1,0,0]=3 10830 B15R1.1389 COCCNC(=O)c1ccc(cc1)OC 527a_100000209980_100000184203 [0,2,0,0,0,0|1,0,0]=3 10831 B15R1.1389 COCCNC(=O)c1ccc(cc1)SC 1626a_100000209980_100000189692 [0,2,0,0,0,0|1,0,0]=3 10832 B15R1.1389 COCCNC(=O)c1ccc(cc1)SC 240690a_100000209980_100000189692 [0,2,0,0,0,0|1,0,0]=3 10833 B15R1.1389 COCCNC(=O)c1ccc(cc1)SC 527a_100000209980_100000189692 [0,2,0,0,0,0|1,0,0]=3 10834 B15R1.1389 COCCNC(=O)c1ccc(nc1)SC 62a_100000157854_200000210301 [0,2,0,0,0,0|2,0,0]=4 10835 B15R1.1389 COCCNC(=O)c1ccc(nc1)SC 62a_200000210301_100000157854 [0,2,0,0,0,0|2,0,0]=4 10836 B15R1.1389 COCCNC(=O)c1ccc(nc1)S[13CH3] 62a_100000157854_200025704644 [0,2,0,0,0,0|2,0,0]=4 10837 B15R1.1389 COCCNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000157854 [0,2,0,0,0,0|2,0,0]=4 10838 B15R1.1389 COc1ccc(cc1)C(=NNCCO)C 4a_100000210001_100000169859 [0,2,0,0,0,0|2,0,0]=4 10839 B15R1.1389 COc1ccc(cc1)C(=O)CCCCO 1458a_100000184203_100000210776 [0,2,0,0,0,0|2,0,0]=4 10840 B15R1.1389 COc1ccc(cc1)C(=O)CNCCO 2230a_100016997473_100000212054 [0,2,0,0,0,0|1,0,0]=3 10841 B15R1.1389 COc1ccc(cc1)C(=O)CSCCO 62a_100000211926_100000212054 [0,2,0,0,0,0|2,0,0]=4 10842 B15R1.1389 COc1ccc(cc1)C(=O)CSCCO 62a_100000212054_100000211926 [0,2,0,0,0,0|2,0,0]=4 10843 B15R1.1389 COc1ccc(cc1)C(=O)NCCC#N 11a_100000720768_100000184203 [0,2,0,0,0,0|2,0,0]=4 10844 B15R1.1389 COc1ccc(cc1)C(=O)NCCC#N 1626a_100000720768_100000184203 [0,2,0,0,0,0|2,0,0]=4 10845 B15R1.1389 COc1ccc(cc1)C(=O)NCCC#N 240690a_100000720768_100000184203 [0,2,0,0,0,0|2,0,0]=4 10846 B15R1.1389 COc1ccc(cc1)C(=O)NCCC#N 527a_100000720768_100000184203 [0,2,0,0,0,0|2,0,0]=4 10847 B15R1.1389 COc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000184203 [0,2,0,0,0,0|2,0,0]=4 10848 B15R1.1389 COc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000184203 [0,2,0,0,0,0|2,0,0]=4 10849 B15R1.1389 COc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000184203 [0,2,0,0,0,0|2,0,0]=4 10850 B15R1.1389 COc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000184203 [0,2,0,0,0,0|2,0,0]=4 10851 B15R1.1389 COc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000184203 [0,2,0,0,0,0|1,0,0]=3 10852 B15R1.1389 COc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000184203 [0,2,0,0,0,0|1,0,0]=3 10853 B15R1.1389 COc1ccc(cc1)C(=O)NCCN[13CH3] 2230a_100000741995_200025704644 [0,2,0,0,0,0|2,0,0]=4 10854 B15R1.1389 COc1ccc(cc1)C(=O)NCCSC 11a_100020590264_100000184203 [0,2,0,0,0,0|1,1,0]=4 10855 B15R1.1389 COc1ccc(cc1)C(=O)NCCSC 1626a_100020590264_100000184203 [0,2,0,0,0,0|1,1,0]=4 10856 B15R1.1389 COc1ccc(cc1)C(=O)NCCSC 240690a_100020590264_100000184203 [0,2,0,0,0,0|1,1,0]=4 10857 B15R1.1389 COc1ccc(cc1)C(=O)NCCSC 527a_100020590264_100000184203 [0,2,0,0,0,0|1,1,0]=4 10858 B15R1.1389 COc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100000184203 [0,2,0,0,0,0|1,0,0]=3 10859 B15R1.1389 CSCCNC(=O)c1ccc(cc1)C#N 11a_100020590264_100000210717 [0,2,0,0,0,0|1,1,0]=4 10860 B15R1.1389 CSCCNC(=O)c1ccc(cc1)C#N 1626a_100020590264_100000210717 [0,2,0,0,0,0|1,1,0]=4 10861 B15R1.1389 CSCCNC(=O)c1ccc(cc1)C#N 240690a_100020590264_100000210717 [0,2,0,0,0,0|1,1,0]=4 10862 B15R1.1389 CSCCNC(=O)c1ccc(cc1)C#N 527a_100020590264_100000210717 [0,2,0,0,0,0|1,1,0]=4 10863 B15R1.1389 CSCCNC(=O)c1ccc(cc1)CO 1626a_100020590264_100000183892 [0,2,0,0,0,0|1,1,0]=4 10864 B15R1.1389 CSCCNC(=O)c1ccc(cc1)CO 240690a_100020590264_100000183892 [0,2,0,0,0,0|1,1,0]=4 10865 B15R1.1389 CSCCNC(=O)c1ccc(cc1)SC 11a_100020590264_100000189692 [0,2,0,0,0,0|1,1,0]=4 10866 B15R1.1389 CSCCNC(=O)c1ccc(cc1)SC 1626a_100020590264_100000189692 [0,2,0,0,0,0|1,1,0]=4 10867 B15R1.1389 CSCCNC(=O)c1ccc(cc1)SC 240690a_100020590264_100000189692 [0,2,0,0,0,0|1,1,0]=4 10868 B15R1.1389 CSCCNC(=O)c1ccc(cc1)SC 527a_100020590264_100000189692 [0,2,0,0,0,0|1,1,0]=4 10869 B15R1.1389 CSc1ccc(cc1)C(=NNCCO)C 4a_100000210001_100000185071 [0,2,0,0,0,0|2,0,0]=4 10870 B15R1.1389 CSc1ccc(cc1)C(=O)CCCCO 1458a_100000189692_100000210776 [0,2,0,0,0,0|2,0,0]=4 10871 B15R1.1389 CSc1ccc(cc1)C(=O)CNCCF 34a_100000724931_100011216809 [0,2,0,0,0,0|2,0,0]=4 10872 B15R1.1389 CSc1ccc(cc1)C(=O)CNCCO 2230a_100016997473_100011216809 [0,2,0,0,0,0|1,0,0]=3 10873 B15R1.1389 CSc1ccc(cc1)C(=O)CNCCO 34a_100016990907_100011216809 [0,2,0,0,0,0|1,0,0]=3 10874 B15R1.1389 CSc1ccc(cc1)C(=O)CSCCO 62a_100000211926_100011216809 [0,2,0,0,0,0|2,0,0]=4 10875 B15R1.1389 CSc1ccc(cc1)C(=O)CSCCO 62a_100011216809_100000211926 [0,2,0,0,0,0|2,0,0]=4 10876 B15R1.1389 CSc1ccc(cc1)C(=O)NCCC#N 11a_100000720768_100000189692 [0,2,0,0,0,0|2,0,0]=4 10877 B15R1.1389 CSc1ccc(cc1)C(=O)NCCC#N 1626a_100000720768_100000189692 [0,2,0,0,0,0|2,0,0]=4 10878 B15R1.1389 CSc1ccc(cc1)C(=O)NCCC#N 240690a_100000720768_100000189692 [0,2,0,0,0,0|2,0,0]=4 10879 B15R1.1389 CSc1ccc(cc1)C(=O)NCCC#N 527a_100000720768_100000189692 [0,2,0,0,0,0|2,0,0]=4 10880 B15R1.1389 CSc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000189692 [0,2,0,0,0,0|2,0,0]=4 10881 B15R1.1389 CSc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000189692 [0,2,0,0,0,0|2,0,0]=4 10882 B15R1.1389 CSc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000189692 [0,2,0,0,0,0|2,0,0]=4 10883 B15R1.1389 CSc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000189692 [0,2,0,0,0,0|2,0,0]=4 10884 B15R1.1389 CSc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000189692 [0,2,0,0,0,0|1,0,0]=3 10885 B15R1.1389 CSc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000189692 [0,2,0,0,0,0|1,0,0]=3 10886 B15R1.1389 CSc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100000189692 [0,2,0,0,0,0|1,0,0]=3 10887 B15R1.1389 N#CCCNC(=O)c1ccc(cc1)C#N 11a_100000720768_100000210717 [0,2,0,0,0,0|2,0,0]=4 10888 B15R1.1389 N#CCCNC(=O)c1ccc(cc1)C#N 1626a_100000720768_100000210717 [0,2,0,0,0,0|2,0,0]=4 10889 B15R1.1389 N#CCCNC(=O)c1ccc(cc1)C#N 240690a_100000720768_100000210717 [0,2,0,0,0,0|2,0,0]=4 10890 B15R1.1389 N#CCCNC(=O)c1ccc(cc1)C#N 527a_100000720768_100000210717 [0,2,0,0,0,0|2,0,0]=4 10891 B15R1.1389 N#CCCNC(=O)c1ccc(cc1)CO 1626a_100000720768_100000183892 [0,2,0,0,0,0|2,0,0]=4 10892 B15R1.1389 N#CCCNC(=O)c1ccc(cc1)CO 240690a_100000720768_100000183892 [0,2,0,0,0,0|2,0,0]=4 10893 B15R1.1389 N#Cc1ccc(cc1)C(=O)CCCCO 1458a_100000210717_100000210776 [0,2,0,0,0,0|2,0,0]=4 10894 B15R1.1389 N#Cc1ccc(cc1)C(=O)CNCCO 2230a_100016997473_100000212069 [0,2,0,0,0,0|1,0,0]=3 10895 B15R1.1389 N#Cc1ccc(cc1)C(=O)COCCO 34a_100011592799_100000211926 [0,2,0,0,0,0|2,0,0]=4 10896 B15R1.1389 N#Cc1ccc(cc1)C(=O)CSCCO 62a_100000211926_100000212069 [0,2,0,0,0,0|2,0,0]=4 10897 B15R1.1389 N#Cc1ccc(cc1)C(=O)CSCCO 62a_100000212069_100000211926 [0,2,0,0,0,0|2,0,0]=4 10898 B15R1.1389 N#Cc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000210717 [0,2,0,0,0,0|2,0,0]=4 10899 B15R1.1389 N#Cc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000210717 [0,2,0,0,0,0|2,0,0]=4 10900 B15R1.1389 N#Cc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000210717 [0,2,0,0,0,0|2,0,0]=4 10901 B15R1.1389 N#Cc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000210717 [0,2,0,0,0,0|2,0,0]=4 10902 B15R1.1389 N#Cc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000210717 [0,2,0,0,0,0|1,0,0]=3 10903 B15R1.1389 N#Cc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000210717 [0,2,0,0,0,0|1,0,0]=3 10904 B15R1.1389 N#Cc1ccc(cc1)C(=O)NNCCO 22a_100000210001_100000210717 [0,2,0,0,0,0|1,0,0]=3 10905 B15R1.1389 O=C(CCCCO)c1ccc(cc1)CO 1458a_100000183892_100000210776 [0,2,0,0,0,0|2,0,0]=4 10906 B15R1.1389 O=C(NCCCF)c1ccc(cc1)CO 1626a_100015189416_100000183892 [0,2,0,0,0,0|2,0,0]=4 10907 B15R1.1389 O=C(NCCCF)c1ccc(cc1)CO 240690a_100015189416_100000183892 [0,2,0,0,0,0|2,0,0]=4 10908 B15R1.1389 O=C(NCCCO)c1ccc(cc1)CO 240690a_100000182051_100000183892 [0,2,0,0,0,0|1,0,0]=3 10909 B15R1.1389 O=C(NNCCO)c1ccc(cc1)CO 22a_100000210001_100000183892 [0,2,0,0,0,0|1,0,0]=3 10910 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000731252 [0,2,0,0,0,0|2,0,0]=4 10911 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000731252 [0,2,0,0,0,0|2,0,0]=4 10912 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000731252 [0,2,0,0,0,0|2,0,0]=4 10913 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000731252 [0,2,0,0,0,0|2,0,0]=4 10914 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000731252 [0,2,0,0,0,0|2,0,0]=4 10915 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000731252 [0,2,0,0,0,0|2,0,0]=4 10916 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Br 11a_100000755551_100012339404 [0,2,0,0,0,0|1,1,0]=4 10917 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100000755551_100012339404 [0,2,0,0,0,0|1,1,0]=4 10918 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100000755551_100012339404 [0,2,0,0,0,0|1,1,0]=4 10919 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Br 527a_100000755551_100012339404 [0,2,0,0,0,0|1,1,0]=4 10920 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)C 11a_100000755551_100000186397 [0,2,0,0,0,0|2,0,0]=4 10921 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)C 1626a_100000755551_100000186397 [0,2,0,0,0,0|2,0,0]=4 10922 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)C 240690a_100000755551_100000186397 [0,2,0,0,0,0|2,0,0]=4 10923 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)C 527a_100000755551_100000186397 [0,2,0,0,0,0|2,0,0]=4 10924 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100000755551_100000691181 [0,2,0,0,0,0|1,0,0]=3 10925 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000755551_100000691181 [0,2,0,0,0,0|1,0,0]=3 10926 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000755551_100000691181 [0,2,0,0,0,0|1,0,0]=3 10927 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000755551_100000691181 [0,2,0,0,0,0|1,0,0]=3 10928 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)F 11a_100000755551_100000760357 [0,2,0,0,0,0|1,1,0]=4 10929 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)F 1626a_100000755551_100000760357 [0,2,0,0,0,0|1,1,0]=4 10930 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)F 240690a_100000755551_100000760357 [0,2,0,0,0,0|1,1,0]=4 10931 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)F 527a_100000755551_100000760357 [0,2,0,0,0,0|1,1,0]=4 10932 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)I 11a_100000755551_100000739115 [0,2,0,0,0,0|1,1,0]=4 10933 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)I 1626a_100000755551_100000739115 [0,2,0,0,0,0|1,1,0]=4 10934 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)I 240690a_100000755551_100000739115 [0,2,0,0,0,0|1,1,0]=4 10935 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)I 527a_100000755551_100000739115 [0,2,0,0,0,0|1,1,0]=4 10936 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Br)O 240690a_100000755551_100000189672 [0,2,0,0,0,0|2,0,0]=4 10937 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Br 11a_100000755551_100000692631 [0,2,0,0,0,0|1,1,0]=4 10938 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Br 1626a_100000755551_100000692631 [0,2,0,0,0,0|1,1,0]=4 10939 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Br 240690a_100000755551_100000692631 [0,2,0,0,0,0|1,1,0]=4 10940 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Br 527a_100000755551_100000692631 [0,2,0,0,0,0|1,1,0]=4 10941 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)C 11a_100000755551_100000210898 [0,2,0,0,0,0|2,0,0]=4 10942 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)C 1626a_100000755551_100000210898 [0,2,0,0,0,0|2,0,0]=4 10943 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)C 240690a_100000755551_100000210898 [0,2,0,0,0,0|2,0,0]=4 10944 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)C 527a_100000755551_100000210898 [0,2,0,0,0,0|2,0,0]=4 10945 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Cl 11a_100000755551_100000686306 [0,2,0,0,0,0|1,0,0]=3 10946 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100000755551_100000686306 [0,2,0,0,0,0|1,0,0]=3 10947 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100000755551_100000686306 [0,2,0,0,0,0|1,0,0]=3 10948 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)Cl 527a_100000755551_100000686306 [0,2,0,0,0,0|1,0,0]=3 10949 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)F 11a_100000755551_100000751819 [0,2,0,0,0,0|1,1,0]=4 10950 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)F 1626a_100000755551_100000751819 [0,2,0,0,0,0|1,1,0]=4 10951 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)F 240690a_100000755551_100000751819 [0,2,0,0,0,0|1,1,0]=4 10952 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)F 527a_100000755551_100000751819 [0,2,0,0,0,0|1,1,0]=4 10953 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)I 11a_100000755551_100000751300 [0,2,0,0,0,0|1,1,0]=4 10954 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)I 1626a_100000755551_100000751300 [0,2,0,0,0,0|1,1,0]=4 10955 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)I 240690a_100000755551_100000751300 [0,2,0,0,0,0|1,1,0]=4 10956 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)I 527a_100000755551_100000751300 [0,2,0,0,0,0|1,1,0]=4 10957 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)C)O 240690a_100000755551_100000685612 [0,2,0,0,0,0|2,0,0]=4 10958 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100000755551_100000687082 [0,2,0,0,0,0|1,1,0]=4 10959 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000755551_100000687082 [0,2,0,0,0,0|1,1,0]=4 10960 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000755551_100000687082 [0,2,0,0,0,0|1,1,0]=4 10961 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100000755551_100000687082 [0,2,0,0,0,0|1,1,0]=4 10962 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)C 11a_100000755551_100000751740 [0,2,0,0,0,0|2,0,0]=4 10963 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100000755551_100000751740 [0,2,0,0,0,0|2,0,0]=4 10964 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100000755551_100000751740 [0,2,0,0,0,0|2,0,0]=4 10965 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)C 527a_100000755551_100000751740 [0,2,0,0,0,0|2,0,0]=4 10966 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000755551_100000210401 [0,2,0,0,0,0|1,0,0]=3 10967 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000755551_100000210401 [0,2,0,0,0,0|1,0,0]=3 10968 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000755551_100000210401 [0,2,0,0,0,0|1,0,0]=3 10969 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000755551_100000210401 [0,2,0,0,0,0|1,0,0]=3 10970 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)F 11a_100000755551_100000686462 [0,2,0,0,0,0|1,1,0]=4 10971 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100000755551_100000686462 [0,2,0,0,0,0|1,1,0]=4 10972 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100000755551_100000686462 [0,2,0,0,0,0|1,1,0]=4 10973 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)F 527a_100000755551_100000686462 [0,2,0,0,0,0|1,1,0]=4 10974 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)I 11a_100000755551_100000684831 [0,2,0,0,0,0|1,1,0]=4 10975 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100000755551_100000684831 [0,2,0,0,0,0|1,1,0]=4 10976 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100000755551_100000684831 [0,2,0,0,0,0|1,1,0]=4 10977 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)I 527a_100000755551_100000684831 [0,2,0,0,0,0|1,1,0]=4 10978 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000755551_100000212196 [0,2,0,0,0,0|2,0,0]=4 10979 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)Cl)O 527a_100000755551_100000212196 [0,2,0,0,0,0|2,0,0]=4 10980 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Br 11a_100000755551_100000743946 [0,2,0,0,0,0|1,1,0]=4 10981 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Br 1626a_100000755551_100000743946 [0,2,0,0,0,0|1,1,0]=4 10982 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Br 240690a_100000755551_100000743946 [0,2,0,0,0,0|1,1,0]=4 10983 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Br 527a_100000755551_100000743946 [0,2,0,0,0,0|1,1,0]=4 10984 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)C 11a_100000755551_100000212313 [0,2,0,0,0,0|2,0,0]=4 10985 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)C 1626a_100000755551_100000212313 [0,2,0,0,0,0|2,0,0]=4 10986 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)C 240690a_100000755551_100000212313 [0,2,0,0,0,0|2,0,0]=4 10987 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)C 527a_100000755551_100000212313 [0,2,0,0,0,0|2,0,0]=4 10988 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Cl 11a_100000755551_100000743183 [0,2,0,0,0,0|1,0,0]=3 10989 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000755551_100000743183 [0,2,0,0,0,0|1,0,0]=3 10990 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100000755551_100000743183 [0,2,0,0,0,0|1,0,0]=3 10991 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)Cl 527a_100000755551_100000743183 [0,2,0,0,0,0|1,0,0]=3 10992 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)F 11a_100000755551_100000209822 [0,2,0,0,0,0|1,1,0]=4 10993 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)F 1626a_100000755551_100000209822 [0,2,0,0,0,0|1,1,0]=4 10994 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)F 240690a_100000755551_100000209822 [0,2,0,0,0,0|1,1,0]=4 10995 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)F 527a_100000755551_100000209822 [0,2,0,0,0,0|1,1,0]=4 10996 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)I 11a_100000755551_100000062624 [0,2,0,0,0,0|1,1,0]=4 10997 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)I 1626a_100000755551_100000062624 [0,2,0,0,0,0|1,1,0]=4 10998 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)I 240690a_100000755551_100000062624 [0,2,0,0,0,0|1,1,0]=4 10999 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)I 527a_100000755551_100000062624 [0,2,0,0,0,0|1,1,0]=4 11000 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)O 240690a_100000755551_100000185466 [0,2,0,0,0,0|2,0,0]=4 11001 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)F)O 527a_100000755551_100000185466 [0,2,0,0,0,0|2,0,0]=4 11002 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Br 11a_100000755551_100012343876 [0,2,0,0,0,0|1,1,0]=4 11003 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Br 1626a_100000755551_100012343876 [0,2,0,0,0,0|1,1,0]=4 11004 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Br 240690a_100000755551_100012343876 [0,2,0,0,0,0|1,1,0]=4 11005 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Br 527a_100000755551_100012343876 [0,2,0,0,0,0|1,1,0]=4 11006 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)C 11a_100000755551_100000751299 [0,2,0,0,0,0|2,0,0]=4 11007 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)C 1626a_100000755551_100000751299 [0,2,0,0,0,0|2,0,0]=4 11008 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)C 240690a_100000755551_100000751299 [0,2,0,0,0,0|2,0,0]=4 11009 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)C 527a_100000755551_100000751299 [0,2,0,0,0,0|2,0,0]=4 11010 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Cl 11a_100000755551_100000739381 [0,2,0,0,0,0|1,0,0]=3 11011 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000755551_100000739381 [0,2,0,0,0,0|1,0,0]=3 11012 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100000755551_100000739381 [0,2,0,0,0,0|1,0,0]=3 11013 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)Cl 527a_100000755551_100000739381 [0,2,0,0,0,0|1,0,0]=3 11014 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)F 11a_100000755551_100000688015 [0,2,0,0,0,0|1,1,0]=4 11015 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)F 1626a_100000755551_100000688015 [0,2,0,0,0,0|1,1,0]=4 11016 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)F 240690a_100000755551_100000688015 [0,2,0,0,0,0|1,1,0]=4 11017 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)F 527a_100000755551_100000688015 [0,2,0,0,0,0|1,1,0]=4 11018 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)I 11a_100000755551_100000725830 [0,2,0,0,0,0|1,1,0]=4 11019 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)I 1626a_100000755551_100000725830 [0,2,0,0,0,0|1,1,0]=4 11020 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)I 240690a_100000755551_100000725830 [0,2,0,0,0,0|1,1,0]=4 11021 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)I 527a_100000755551_100000725830 [0,2,0,0,0,0|1,1,0]=4 11022 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)O 1626a_100000755551_100000037485 [0,2,0,0,0,0|2,0,0]=4 11023 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)I)O 240690a_100000755551_100000037485 [0,2,0,0,0,0|2,0,0]=4 11024 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)Br 240690a_100000755551_100000689001 [0,2,0,0,0,0|1,1,0]=4 11025 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)Br 527a_100000755551_100000689001 [0,2,0,0,0,0|1,1,0]=4 11026 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)C 240690a_100000755551_100000233767 [0,2,0,0,0,0|2,0,0]=4 11027 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000755551_100011933997 [0,2,0,0,0,0|1,0,0]=3 11028 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)Cl 527a_100000755551_100011933997 [0,2,0,0,0,0|1,0,0]=3 11029 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)F 240690a_100000755551_100000035894 [0,2,0,0,0,0|1,1,0]=4 11030 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)F 527a_100000755551_100000035894 [0,2,0,0,0,0|1,1,0]=4 11031 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)I 1626a_100000755551_100000239334 [0,2,0,0,0,0|1,1,0]=4 11032 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)I 240690a_100000755551_100000239334 [0,2,0,0,0,0|1,1,0]=4 11033 B15R1.1404 C#CCCNC(=O)c1ccc(c(c1)O)I 527a_100000755551_100000239334 [0,2,0,0,0,0|1,1,0]=4 11034 B15R1.1404 C#CCNCC(=O)c1ccc(c(c1)F)Cl 34a_100000212058_100012351892 [0,2,0,0,0,0|1,0,1]=4 11035 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000757094 [0,2,0,0,0,0|2,0,0]=4 11036 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000757094 [0,2,0,0,0,0|2,0,0]=4 11037 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000757094 [0,2,0,0,0,0|2,0,0]=4 11038 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000757094 [0,2,0,0,0,0|2,0,0]=4 11039 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000757094 [0,2,0,0,0,0|2,0,0]=4 11040 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000757094 [0,2,0,0,0,0|2,0,0]=4 11041 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Br 11a_100015191253_100012339404 [0,2,0,0,0,0|1,1,0]=4 11042 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100015191253_100012339404 [0,2,0,0,0,0|1,1,0]=4 11043 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100015191253_100012339404 [0,2,0,0,0,0|1,1,0]=4 11044 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Br 527a_100015191253_100012339404 [0,2,0,0,0,0|1,1,0]=4 11045 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)C 11a_100015191253_100000186397 [0,2,0,0,0,0|2,0,0]=4 11046 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)C 1626a_100015191253_100000186397 [0,2,0,0,0,0|2,0,0]=4 11047 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)C 240690a_100015191253_100000186397 [0,2,0,0,0,0|2,0,0]=4 11048 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)C 527a_100015191253_100000186397 [0,2,0,0,0,0|2,0,0]=4 11049 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100015191253_100000691181 [0,2,0,0,0,0|1,0,0]=3 11050 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100015191253_100000691181 [0,2,0,0,0,0|1,0,0]=3 11051 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100015191253_100000691181 [0,2,0,0,0,0|1,0,0]=3 11052 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100015191253_100000691181 [0,2,0,0,0,0|1,0,0]=3 11053 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)F 11a_100015191253_100000760357 [0,2,0,0,0,0|1,1,0]=4 11054 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)F 1626a_100015191253_100000760357 [0,2,0,0,0,0|1,1,0]=4 11055 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)F 240690a_100015191253_100000760357 [0,2,0,0,0,0|1,1,0]=4 11056 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)F 527a_100015191253_100000760357 [0,2,0,0,0,0|1,1,0]=4 11057 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)I 11a_100015191253_100000739115 [0,2,0,0,0,0|1,1,0]=4 11058 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)I 1626a_100015191253_100000739115 [0,2,0,0,0,0|1,1,0]=4 11059 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)I 240690a_100015191253_100000739115 [0,2,0,0,0,0|1,1,0]=4 11060 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)I 527a_100015191253_100000739115 [0,2,0,0,0,0|1,1,0]=4 11061 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Br)O 240690a_100015191253_100000189672 [0,2,0,0,0,0|2,0,0]=4 11062 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Br 11a_100015191253_100000692631 [0,2,0,0,0,0|1,1,0]=4 11063 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Br 1626a_100015191253_100000692631 [0,2,0,0,0,0|1,1,0]=4 11064 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Br 240690a_100015191253_100000692631 [0,2,0,0,0,0|1,1,0]=4 11065 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Br 527a_100015191253_100000692631 [0,2,0,0,0,0|1,1,0]=4 11066 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)C 11a_100015191253_100000210898 [0,2,0,0,0,0|2,0,0]=4 11067 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)C 1626a_100015191253_100000210898 [0,2,0,0,0,0|2,0,0]=4 11068 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)C 240690a_100015191253_100000210898 [0,2,0,0,0,0|2,0,0]=4 11069 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)C 527a_100015191253_100000210898 [0,2,0,0,0,0|2,0,0]=4 11070 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Cl 11a_100015191253_100000686306 [0,2,0,0,0,0|1,0,0]=3 11071 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100015191253_100000686306 [0,2,0,0,0,0|1,0,0]=3 11072 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100015191253_100000686306 [0,2,0,0,0,0|1,0,0]=3 11073 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)Cl 527a_100015191253_100000686306 [0,2,0,0,0,0|1,0,0]=3 11074 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)F 11a_100015191253_100000751819 [0,2,0,0,0,0|1,1,0]=4 11075 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)F 1626a_100015191253_100000751819 [0,2,0,0,0,0|1,1,0]=4 11076 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)F 240690a_100015191253_100000751819 [0,2,0,0,0,0|1,1,0]=4 11077 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)F 527a_100015191253_100000751819 [0,2,0,0,0,0|1,1,0]=4 11078 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)I 11a_100015191253_100000751300 [0,2,0,0,0,0|1,1,0]=4 11079 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)I 1626a_100015191253_100000751300 [0,2,0,0,0,0|1,1,0]=4 11080 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)I 240690a_100015191253_100000751300 [0,2,0,0,0,0|1,1,0]=4 11081 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)I 527a_100015191253_100000751300 [0,2,0,0,0,0|1,1,0]=4 11082 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)C)O 240690a_100015191253_100000685612 [0,2,0,0,0,0|2,0,0]=4 11083 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100015191253_100000687082 [0,2,0,0,0,0|1,1,0]=4 11084 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100015191253_100000687082 [0,2,0,0,0,0|1,1,0]=4 11085 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100015191253_100000687082 [0,2,0,0,0,0|1,1,0]=4 11086 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100015191253_100000687082 [0,2,0,0,0,0|1,1,0]=4 11087 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)C 11a_100015191253_100000751740 [0,2,0,0,0,0|2,0,0]=4 11088 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100015191253_100000751740 [0,2,0,0,0,0|2,0,0]=4 11089 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100015191253_100000751740 [0,2,0,0,0,0|2,0,0]=4 11090 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)C 527a_100015191253_100000751740 [0,2,0,0,0,0|2,0,0]=4 11091 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100015191253_100000210401 [0,2,0,0,0,0|1,0,0]=3 11092 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100015191253_100000210401 [0,2,0,0,0,0|1,0,0]=3 11093 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100015191253_100000210401 [0,2,0,0,0,0|1,0,0]=3 11094 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100015191253_100000210401 [0,2,0,0,0,0|1,0,0]=3 11095 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)F 11a_100015191253_100000686462 [0,2,0,0,0,0|1,1,0]=4 11096 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100015191253_100000686462 [0,2,0,0,0,0|1,1,0]=4 11097 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100015191253_100000686462 [0,2,0,0,0,0|1,1,0]=4 11098 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)F 527a_100015191253_100000686462 [0,2,0,0,0,0|1,1,0]=4 11099 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)I 11a_100015191253_100000684831 [0,2,0,0,0,0|1,1,0]=4 11100 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100015191253_100000684831 [0,2,0,0,0,0|1,1,0]=4 11101 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100015191253_100000684831 [0,2,0,0,0,0|1,1,0]=4 11102 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)I 527a_100015191253_100000684831 [0,2,0,0,0,0|1,1,0]=4 11103 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100015191253_100000212196 [0,2,0,0,0,0|2,0,0]=4 11104 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)Cl)O 527a_100015191253_100000212196 [0,2,0,0,0,0|2,0,0]=4 11105 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Br 11a_100015191253_100000743946 [0,2,0,0,0,0|1,1,0]=4 11106 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Br 1626a_100015191253_100000743946 [0,2,0,0,0,0|1,1,0]=4 11107 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Br 240690a_100015191253_100000743946 [0,2,0,0,0,0|1,1,0]=4 11108 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Br 527a_100015191253_100000743946 [0,2,0,0,0,0|1,1,0]=4 11109 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)C 11a_100015191253_100000212313 [0,2,0,0,0,0|2,0,0]=4 11110 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)C 1626a_100015191253_100000212313 [0,2,0,0,0,0|2,0,0]=4 11111 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)C 240690a_100015191253_100000212313 [0,2,0,0,0,0|2,0,0]=4 11112 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)C 527a_100015191253_100000212313 [0,2,0,0,0,0|2,0,0]=4 11113 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Cl 11a_100015191253_100000743183 [0,2,0,0,0,0|1,0,0]=3 11114 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100015191253_100000743183 [0,2,0,0,0,0|1,0,0]=3 11115 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100015191253_100000743183 [0,2,0,0,0,0|1,0,0]=3 11116 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)Cl 527a_100015191253_100000743183 [0,2,0,0,0,0|1,0,0]=3 11117 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)F 11a_100015191253_100000209822 [0,2,0,0,0,0|1,1,0]=4 11118 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)F 1626a_100015191253_100000209822 [0,2,0,0,0,0|1,1,0]=4 11119 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)F 240690a_100015191253_100000209822 [0,2,0,0,0,0|1,1,0]=4 11120 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)F 527a_100015191253_100000209822 [0,2,0,0,0,0|1,1,0]=4 11121 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)I 11a_100015191253_100000062624 [0,2,0,0,0,0|1,1,0]=4 11122 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)I 1626a_100015191253_100000062624 [0,2,0,0,0,0|1,1,0]=4 11123 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)I 240690a_100015191253_100000062624 [0,2,0,0,0,0|1,1,0]=4 11124 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)I 527a_100015191253_100000062624 [0,2,0,0,0,0|1,1,0]=4 11125 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)O 240690a_100015191253_100000185466 [0,2,0,0,0,0|2,0,0]=4 11126 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)F)O 527a_100015191253_100000185466 [0,2,0,0,0,0|2,0,0]=4 11127 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Br 11a_100015191253_100012343876 [0,2,0,0,0,0|1,1,0]=4 11128 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Br 1626a_100015191253_100012343876 [0,2,0,0,0,0|1,1,0]=4 11129 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Br 240690a_100015191253_100012343876 [0,2,0,0,0,0|1,1,0]=4 11130 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Br 527a_100015191253_100012343876 [0,2,0,0,0,0|1,1,0]=4 11131 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)C 11a_100015191253_100000751299 [0,2,0,0,0,0|2,0,0]=4 11132 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)C 1626a_100015191253_100000751299 [0,2,0,0,0,0|2,0,0]=4 11133 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)C 240690a_100015191253_100000751299 [0,2,0,0,0,0|2,0,0]=4 11134 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)C 527a_100015191253_100000751299 [0,2,0,0,0,0|2,0,0]=4 11135 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Cl 11a_100015191253_100000739381 [0,2,0,0,0,0|1,0,0]=3 11136 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100015191253_100000739381 [0,2,0,0,0,0|1,0,0]=3 11137 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100015191253_100000739381 [0,2,0,0,0,0|1,0,0]=3 11138 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)Cl 527a_100015191253_100000739381 [0,2,0,0,0,0|1,0,0]=3 11139 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)F 11a_100015191253_100000688015 [0,2,0,0,0,0|1,1,0]=4 11140 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)F 1626a_100015191253_100000688015 [0,2,0,0,0,0|1,1,0]=4 11141 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)F 240690a_100015191253_100000688015 [0,2,0,0,0,0|1,1,0]=4 11142 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)F 527a_100015191253_100000688015 [0,2,0,0,0,0|1,1,0]=4 11143 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)I 11a_100015191253_100000725830 [0,2,0,0,0,0|1,1,0]=4 11144 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)I 1626a_100015191253_100000725830 [0,2,0,0,0,0|1,1,0]=4 11145 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)I 240690a_100015191253_100000725830 [0,2,0,0,0,0|1,1,0]=4 11146 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)I 527a_100015191253_100000725830 [0,2,0,0,0,0|1,1,0]=4 11147 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)O 1626a_100015191253_100000037485 [0,2,0,0,0,0|2,0,0]=4 11148 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)I)O 240690a_100015191253_100000037485 [0,2,0,0,0,0|2,0,0]=4 11149 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)Br 240690a_100015191253_100000689001 [0,2,0,0,0,0|1,1,0]=4 11150 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)Br 527a_100015191253_100000689001 [0,2,0,0,0,0|1,1,0]=4 11151 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)C 240690a_100015191253_100000233767 [0,2,0,0,0,0|2,0,0]=4 11152 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100015191253_100011933997 [0,2,0,0,0,0|1,0,0]=3 11153 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)Cl 527a_100015191253_100011933997 [0,2,0,0,0,0|1,0,0]=3 11154 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)F 240690a_100015191253_100000035894 [0,2,0,0,0,0|1,1,0]=4 11155 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)F 527a_100015191253_100000035894 [0,2,0,0,0,0|1,1,0]=4 11156 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)I 1626a_100015191253_100000239334 [0,2,0,0,0,0|1,1,0]=4 11157 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)I 240690a_100015191253_100000239334 [0,2,0,0,0,0|1,1,0]=4 11158 B15R1.1404 C=CCCNC(=O)c1ccc(c(c1)O)I 527a_100015191253_100000239334 [0,2,0,0,0,0|1,1,0]=4 11159 B15R1.1404 C=CCNCC(=O)c1ccc(c(c1)Cl)Cl 2230a_100020586998_100000211430 [0,2,0,0,0,0|1,0,1]=4 11160 B15R1.1404 C=CCNCC(=O)c1ccc(c(c1)F)Cl 2230a_100020586998_100012351892 [0,2,0,0,0,0|1,0,1]=4 11161 B15R1.1404 C=CCNNC(=O)c1ccc(c(c1)Br)Cl 22a_100020588587_100000691181 [0,2,0,0,0,0|1,0,1]=4 11162 B15R1.1404 C=CCNNC(=O)c1ccc(c(c1)C)Cl 22a_100020588587_100000686306 [0,2,0,0,0,0|1,0,1]=4 11163 B15R1.1404 C=CCNNC(=O)c1ccc(c(c1)Cl)Cl 22a_100020588587_100000210401 [0,2,0,0,0,0|1,0,1]=4 11164 B15R1.1404 C=CCNNC(=O)c1ccc(c(c1)F)Cl 22a_100020588587_100000743183 [0,2,0,0,0,0|1,0,1]=4 11165 B15R1.1404 C=CCNNC(=O)c1ccc(c(c1)I)Cl 22a_100020588587_100000739381 [0,2,0,0,0,0|1,0,1]=4 11166 B15R1.1404 C=CCNNC(=O)c1ccc(c(c1)O)Cl 22a_100020588587_100011933997 [0,2,0,0,0,0|1,0,1]=4 11167 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)Br)Cl 11a_100000685387_100000691181 [0,2,0,0,0,0|1,0,1]=4 11168 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000685387_100000691181 [0,2,0,0,0,0|1,0,1]=4 11169 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000685387_100000691181 [0,2,0,0,0,0|1,0,1]=4 11170 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)C)Cl 11a_100000685387_100000686306 [0,2,0,0,0,0|1,0,1]=4 11171 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)C)Cl 1626a_100000685387_100000686306 [0,2,0,0,0,0|1,0,1]=4 11172 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)C)Cl 527a_100000685387_100000686306 [0,2,0,0,0,0|1,0,1]=4 11173 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000685387_100000210401 [0,2,0,0,0,0|1,0,1]=4 11174 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000685387_100000210401 [0,2,0,0,0,0|1,0,1]=4 11175 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000685387_100000210401 [0,2,0,0,0,0|1,0,1]=4 11176 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)F)Cl 11a_100000685387_100000743183 [0,2,0,0,0,0|1,0,1]=4 11177 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000685387_100000743183 [0,2,0,0,0,0|1,0,1]=4 11178 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)F)Cl 527a_100000685387_100000743183 [0,2,0,0,0,0|1,0,1]=4 11179 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)I)Cl 11a_100000685387_100000739381 [0,2,0,0,0,0|1,0,1]=4 11180 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000685387_100000739381 [0,2,0,0,0,0|1,0,1]=4 11181 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)I)Cl 527a_100000685387_100000739381 [0,2,0,0,0,0|1,0,1]=4 11182 B15R1.1404 CC#CCNC(=O)c1ccc(c(c1)O)Cl 527a_100000685387_100011933997 [0,2,0,0,0,0|1,0,1]=4 11183 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Br)Br 4a_100000210001_100009814466 [0,2,0,0,0,0|1,1,0]=4 11184 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Br)C 4a_100000210001_100011934287 [0,2,0,0,0,0|2,0,0]=4 11185 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Br)Cl 4a_100000210001_100012356427 [0,2,0,0,0,0|1,0,0]=3 11186 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Br)F 4a_100000210001_100000239719 [0,2,0,0,0,0|1,1,0]=4 11187 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Br)I 4a_100000210001_100010146554 [0,2,0,0,0,0|1,1,0]=4 11188 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Br)O 4a_100000210001_100011772453 [0,2,0,0,0,0|2,0,0]=4 11189 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)C)Br 4a_100000210001_100000697869 [0,2,0,0,0,0|1,1,0]=4 11190 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)C)C 4a_100000210001_100000210971 [0,2,0,0,0,0|2,0,0]=4 11191 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)C)Cl 4a_100000210001_100011216000 [0,2,0,0,0,0|1,0,0]=3 11192 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)C)F 4a_100000210001_100000754758 [0,2,0,0,0,0|1,1,0]=4 11193 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)C)O 4a_100000210001_100000188726 [0,2,0,0,0,0|2,0,0]=4 11194 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Cl)Br 4a_100000210001_100012353846 [0,2,0,0,0,0|1,1,0]=4 11195 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Cl)C 4a_100000210001_100012002458 [0,2,0,0,0,0|2,0,0]=4 11196 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Cl)Cl 4a_100000210001_100000210641 [0,2,0,0,0,0|1,0,0]=3 11197 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Cl)F 4a_100000210001_100000737303 [0,2,0,0,0,0|1,1,0]=4 11198 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)Cl)O 4a_100000210001_100000188625 [0,2,0,0,0,0|2,0,0]=4 11199 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)F)Br 4a_100000210001_100000690002 [0,2,0,0,0,0|1,1,0]=4 11200 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)F)C 4a_100000210001_100000767010 [0,2,0,0,0,0|2,0,0]=4 11201 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)F)Cl 4a_100000210001_100000693814 [0,2,0,0,0,0|1,0,0]=3 11202 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)F)F 4a_100000210001_100000184692 [0,2,0,0,0,0|1,1,0]=4 11203 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)F)O 4a_100000210001_100000751691 [0,2,0,0,0,0|2,0,0]=4 11204 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)I)Br 4a_100000210001_100010146556 [0,2,0,0,0,0|1,1,0]=4 11205 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)O)C 4a_100000210001_100000084092 [0,2,0,0,0,0|2,0,0]=4 11206 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)O)F 4a_100000210001_100000117923 [0,2,0,0,0,0|1,1,0]=4 11207 B15R1.1404 CC(=NNCCO)c1ccc(c(c1)O)O 4a_100000210001_100000025746 [0,2,0,0,0,0|2,0,0]=4 11208 B15R1.1404 CC(=NNCCO)c1cnc(c(c1)C)Cl 4a_100000210001_100009864263 [0,2,0,0,0,0|2,0,0]=4 11209 B15R1.1404 CC(=NNCCO)c1cnc(c(c1)Cl)Cl 4a_100000210001_100000099843 [0,2,0,0,0,0|2,0,0]=4 11210 B15R1.1404 CC(NCCCO)c1ccc(c(c1)Br)Cl 269862a_100000182051_100012356427 [0,2,0,0,0,0|1,0,1]=4 11211 B15R1.1404 CC(NCCCO)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100000230001 [0,2,0,0,0,0|1,0,1]=4 11212 B15R1.1404 CC(NCCCO)c1ccc(c(c1)Cl)Cl 269862a_100000182051_100000210641 [0,2,0,0,0,0|1,0,1]=4 11213 B15R1.1404 CC(NCCCO)c1ccc(c(c1)Cl)Cl 34a_100000743459_100000230001 [0,2,0,0,0,0|1,0,1]=4 11214 B15R1.1404 CC(NCCCO)c1ccc(c(c1)F)Cl 269862a_100000182051_100000693814 [0,2,0,0,0,0|1,0,1]=4 11215 B15R1.1404 CCC=NNC(=O)c1ccc(c(c1)C)Cl 4a_200011996897_100000210100 [0,2,0,0,0,0|1,0,1]=4 11216 B15R1.1404 CCC=NNC(=O)c1ccc(c(c1)Cl)Cl 4a_100000187931_100000210100 [0,2,0,0,0,0|1,0,1]=4 11217 B15R1.1404 CCC=NNC(=O)c1ccc(c(c1)I)Cl 4a_100000046573_100000210100 [0,2,0,0,0,0|1,0,1]=4 11218 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210326 [0,2,0,0,0,0|2,0,0]=4 11219 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210326 [0,2,0,0,0,0|2,0,0]=4 11220 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210326 [0,2,0,0,0,0|2,0,0]=4 11221 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210326 [0,2,0,0,0,0|2,0,0]=4 11222 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210326 [0,2,0,0,0,0|2,0,0]=4 11223 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210326 [0,2,0,0,0,0|2,0,0]=4 11224 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Br 11a_100000102301_100012339404 [0,2,0,0,0,0|1,1,0]=4 11225 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100000102301_100012339404 [0,2,0,0,0,0|1,1,0]=4 11226 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100000102301_100012339404 [0,2,0,0,0,0|1,1,0]=4 11227 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Br 527a_100000102301_100012339404 [0,2,0,0,0,0|1,1,0]=4 11228 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)C 11a_100000102301_100000186397 [0,2,0,0,0,0|2,0,0]=4 11229 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)C 1626a_100000102301_100000186397 [0,2,0,0,0,0|2,0,0]=4 11230 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)C 240690a_100000102301_100000186397 [0,2,0,0,0,0|2,0,0]=4 11231 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)C 527a_100000102301_100000186397 [0,2,0,0,0,0|2,0,0]=4 11232 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100000102301_100000691181 [0,2,0,0,0,0|1,0,0]=3 11233 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000102301_100000691181 [0,2,0,0,0,0|1,0,0]=3 11234 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000102301_100000691181 [0,2,0,0,0,0|1,0,0]=3 11235 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000102301_100000691181 [0,2,0,0,0,0|1,0,0]=3 11236 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)F 11a_100000102301_100000760357 [0,2,0,0,0,0|1,1,0]=4 11237 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)F 1626a_100000102301_100000760357 [0,2,0,0,0,0|1,1,0]=4 11238 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)F 240690a_100000102301_100000760357 [0,2,0,0,0,0|1,1,0]=4 11239 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)F 527a_100000102301_100000760357 [0,2,0,0,0,0|1,1,0]=4 11240 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)I 11a_100000102301_100000739115 [0,2,0,0,0,0|1,1,0]=4 11241 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)I 1626a_100000102301_100000739115 [0,2,0,0,0,0|1,1,0]=4 11242 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)I 240690a_100000102301_100000739115 [0,2,0,0,0,0|1,1,0]=4 11243 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)I 527a_100000102301_100000739115 [0,2,0,0,0,0|1,1,0]=4 11244 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)O 240690a_100000102301_100000189672 [0,2,0,0,0,0|2,0,0]=4 11245 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Br 11a_100000102301_100000692631 [0,2,0,0,0,0|1,1,0]=4 11246 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Br 1626a_100000102301_100000692631 [0,2,0,0,0,0|1,1,0]=4 11247 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Br 240690a_100000102301_100000692631 [0,2,0,0,0,0|1,1,0]=4 11248 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Br 527a_100000102301_100000692631 [0,2,0,0,0,0|1,1,0]=4 11249 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)C 11a_100000102301_100000210898 [0,2,0,0,0,0|2,0,0]=4 11250 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)C 1626a_100000102301_100000210898 [0,2,0,0,0,0|2,0,0]=4 11251 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)C 240690a_100000102301_100000210898 [0,2,0,0,0,0|2,0,0]=4 11252 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)C 527a_100000102301_100000210898 [0,2,0,0,0,0|2,0,0]=4 11253 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Cl 11a_100000102301_100000686306 [0,2,0,0,0,0|1,0,0]=3 11254 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100000102301_100000686306 [0,2,0,0,0,0|1,0,0]=3 11255 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100000102301_100000686306 [0,2,0,0,0,0|1,0,0]=3 11256 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)Cl 527a_100000102301_100000686306 [0,2,0,0,0,0|1,0,0]=3 11257 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)F 11a_100000102301_100000751819 [0,2,0,0,0,0|1,1,0]=4 11258 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)F 1626a_100000102301_100000751819 [0,2,0,0,0,0|1,1,0]=4 11259 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)F 240690a_100000102301_100000751819 [0,2,0,0,0,0|1,1,0]=4 11260 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)F 527a_100000102301_100000751819 [0,2,0,0,0,0|1,1,0]=4 11261 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)I 11a_100000102301_100000751300 [0,2,0,0,0,0|1,1,0]=4 11262 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)I 1626a_100000102301_100000751300 [0,2,0,0,0,0|1,1,0]=4 11263 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)I 240690a_100000102301_100000751300 [0,2,0,0,0,0|1,1,0]=4 11264 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)I 527a_100000102301_100000751300 [0,2,0,0,0,0|1,1,0]=4 11265 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)O 240690a_100000102301_100000685612 [0,2,0,0,0,0|2,0,0]=4 11266 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012359895 [0,2,0,0,0,0|2,0,0]=4 11267 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100000102301_100000687082 [0,2,0,0,0,0|1,1,0]=4 11268 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000102301_100000687082 [0,2,0,0,0,0|1,1,0]=4 11269 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000102301_100000687082 [0,2,0,0,0,0|1,1,0]=4 11270 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100000102301_100000687082 [0,2,0,0,0,0|1,1,0]=4 11271 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)C 11a_100000102301_100000751740 [0,2,0,0,0,0|2,0,0]=4 11272 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100000102301_100000751740 [0,2,0,0,0,0|2,0,0]=4 11273 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100000102301_100000751740 [0,2,0,0,0,0|2,0,0]=4 11274 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)C 527a_100000102301_100000751740 [0,2,0,0,0,0|2,0,0]=4 11275 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000102301_100000210401 [0,2,0,0,0,0|1,0,0]=3 11276 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000102301_100000210401 [0,2,0,0,0,0|1,0,0]=3 11277 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000102301_100000210401 [0,2,0,0,0,0|1,0,0]=3 11278 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000102301_100000210401 [0,2,0,0,0,0|1,0,0]=3 11279 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)F 11a_100000102301_100000686462 [0,2,0,0,0,0|1,1,0]=4 11280 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100000102301_100000686462 [0,2,0,0,0,0|1,1,0]=4 11281 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100000102301_100000686462 [0,2,0,0,0,0|1,1,0]=4 11282 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)F 527a_100000102301_100000686462 [0,2,0,0,0,0|1,1,0]=4 11283 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)I 11a_100000102301_100000684831 [0,2,0,0,0,0|1,1,0]=4 11284 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100000102301_100000684831 [0,2,0,0,0,0|1,1,0]=4 11285 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100000102301_100000684831 [0,2,0,0,0,0|1,1,0]=4 11286 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)I 527a_100000102301_100000684831 [0,2,0,0,0,0|1,1,0]=4 11287 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000102301_100000212196 [0,2,0,0,0,0|2,0,0]=4 11288 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)O 527a_100000102301_100000212196 [0,2,0,0,0,0|2,0,0]=4 11289 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Br 11a_100000102301_100000743946 [0,2,0,0,0,0|1,1,0]=4 11290 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Br 1626a_100000102301_100000743946 [0,2,0,0,0,0|1,1,0]=4 11291 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Br 240690a_100000102301_100000743946 [0,2,0,0,0,0|1,1,0]=4 11292 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Br 527a_100000102301_100000743946 [0,2,0,0,0,0|1,1,0]=4 11293 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)C 11a_100000102301_100000212313 [0,2,0,0,0,0|2,0,0]=4 11294 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)C 1626a_100000102301_100000212313 [0,2,0,0,0,0|2,0,0]=4 11295 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)C 240690a_100000102301_100000212313 [0,2,0,0,0,0|2,0,0]=4 11296 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)C 527a_100000102301_100000212313 [0,2,0,0,0,0|2,0,0]=4 11297 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Cl 11a_100000102301_100000743183 [0,2,0,0,0,0|1,0,0]=3 11298 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000102301_100000743183 [0,2,0,0,0,0|1,0,0]=3 11299 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100000102301_100000743183 [0,2,0,0,0,0|1,0,0]=3 11300 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)Cl 527a_100000102301_100000743183 [0,2,0,0,0,0|1,0,0]=3 11301 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)F 11a_100000102301_100000209822 [0,2,0,0,0,0|1,1,0]=4 11302 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)F 1626a_100000102301_100000209822 [0,2,0,0,0,0|1,1,0]=4 11303 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)F 240690a_100000102301_100000209822 [0,2,0,0,0,0|1,1,0]=4 11304 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)F 527a_100000102301_100000209822 [0,2,0,0,0,0|1,1,0]=4 11305 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)I 11a_100000102301_100000062624 [0,2,0,0,0,0|1,1,0]=4 11306 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)I 1626a_100000102301_100000062624 [0,2,0,0,0,0|1,1,0]=4 11307 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)I 240690a_100000102301_100000062624 [0,2,0,0,0,0|1,1,0]=4 11308 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)I 527a_100000102301_100000062624 [0,2,0,0,0,0|1,1,0]=4 11309 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)O 240690a_100000102301_100000185466 [0,2,0,0,0,0|2,0,0]=4 11310 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)O 527a_100000102301_100000185466 [0,2,0,0,0,0|2,0,0]=4 11311 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Br 11a_100000102301_100012343876 [0,2,0,0,0,0|1,1,0]=4 11312 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Br 1626a_100000102301_100012343876 [0,2,0,0,0,0|1,1,0]=4 11313 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Br 240690a_100000102301_100012343876 [0,2,0,0,0,0|1,1,0]=4 11314 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Br 527a_100000102301_100012343876 [0,2,0,0,0,0|1,1,0]=4 11315 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)C 11a_100000102301_100000751299 [0,2,0,0,0,0|2,0,0]=4 11316 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)C 1626a_100000102301_100000751299 [0,2,0,0,0,0|2,0,0]=4 11317 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)C 240690a_100000102301_100000751299 [0,2,0,0,0,0|2,0,0]=4 11318 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)C 527a_100000102301_100000751299 [0,2,0,0,0,0|2,0,0]=4 11319 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Cl 11a_100000102301_100000739381 [0,2,0,0,0,0|1,0,0]=3 11320 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000102301_100000739381 [0,2,0,0,0,0|1,0,0]=3 11321 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100000102301_100000739381 [0,2,0,0,0,0|1,0,0]=3 11322 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)Cl 527a_100000102301_100000739381 [0,2,0,0,0,0|1,0,0]=3 11323 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)F 11a_100000102301_100000688015 [0,2,0,0,0,0|1,1,0]=4 11324 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)F 1626a_100000102301_100000688015 [0,2,0,0,0,0|1,1,0]=4 11325 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)F 240690a_100000102301_100000688015 [0,2,0,0,0,0|1,1,0]=4 11326 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)F 527a_100000102301_100000688015 [0,2,0,0,0,0|1,1,0]=4 11327 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)I 11a_100000102301_100000725830 [0,2,0,0,0,0|1,1,0]=4 11328 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)I 1626a_100000102301_100000725830 [0,2,0,0,0,0|1,1,0]=4 11329 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)I 240690a_100000102301_100000725830 [0,2,0,0,0,0|1,1,0]=4 11330 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)I 527a_100000102301_100000725830 [0,2,0,0,0,0|1,1,0]=4 11331 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)O 1626a_100000102301_100000037485 [0,2,0,0,0,0|2,0,0]=4 11332 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)O 240690a_100000102301_100000037485 [0,2,0,0,0,0|2,0,0]=4 11333 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Br 240690a_100000102301_100000689001 [0,2,0,0,0,0|1,1,0]=4 11334 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Br 527a_100000102301_100000689001 [0,2,0,0,0,0|1,1,0]=4 11335 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)C 240690a_100000102301_100000233767 [0,2,0,0,0,0|2,0,0]=4 11336 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000102301_100011933997 [0,2,0,0,0,0|1,0,0]=3 11337 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Cl 527a_100000102301_100011933997 [0,2,0,0,0,0|1,0,0]=3 11338 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)F 240690a_100000102301_100000035894 [0,2,0,0,0,0|1,1,0]=4 11339 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359903 [0,2,0,0,0,0|1,1,0]=4 11340 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)F 527a_100000102301_100000035894 [0,2,0,0,0,0|1,1,0]=4 11341 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)I 1626a_100000102301_100000239334 [0,2,0,0,0,0|1,1,0]=4 11342 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)I 240690a_100000102301_100000239334 [0,2,0,0,0,0|1,1,0]=4 11343 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)I 527a_100000102301_100000239334 [0,2,0,0,0,0|1,1,0]=4 11344 B15R1.1404 CCCNN=C(C)c1ccc(c(c1)Br)Cl 4a_100000740057_100012356427 [0,2,0,0,0,0|2,0,0]=4 11345 B15R1.1404 CCCNN=C(C)c1ccc(c(c1)C)Cl 4a_100000740057_100011216000 [0,2,0,0,0,0|2,0,0]=4 11346 B15R1.1404 CCCNN=C(C)c1ccc(c(c1)Cl)Cl 4a_100000740057_100000210641 [0,2,0,0,0,0|2,0,0]=4 11347 B15R1.1404 CCCNN=C(C)c1ccc(c(c1)F)Cl 4a_100000740057_100000693814 [0,2,0,0,0,0|2,0,0]=4 11348 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)Br 22a_100000740057_100012339404 [0,2,0,0,0,0|1,1,0]=4 11349 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)C 22a_100000740057_100000186397 [0,2,0,0,0,0|2,0,0]=4 11350 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)Cl 22a_100000740057_100000691181 [0,2,0,0,0,0|1,0,0]=3 11351 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)F 22a_100000740057_100000760357 [0,2,0,0,0,0|1,1,0]=4 11352 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)I 22a_100000740057_100000739115 [0,2,0,0,0,0|1,1,0]=4 11353 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)O 22a_100000740057_100000189672 [0,2,0,0,0,0|2,0,0]=4 11354 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)Br 22a_100000740057_100000692631 [0,2,0,0,0,0|1,1,0]=4 11355 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)C 22a_100000740057_100000210898 [0,2,0,0,0,0|2,0,0]=4 11356 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)Cl 22a_100000740057_100000686306 [0,2,0,0,0,0|1,0,0]=3 11357 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)F 22a_100000740057_100000751819 [0,2,0,0,0,0|1,1,0]=4 11358 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)I 22a_100000740057_100000751300 [0,2,0,0,0,0|1,1,0]=4 11359 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)O 22a_100000740057_100000685612 [0,2,0,0,0,0|2,0,0]=4 11360 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)Br 22a_100000740057_100000687082 [0,2,0,0,0,0|1,1,0]=4 11361 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)C 22a_100000740057_100000751740 [0,2,0,0,0,0|2,0,0]=4 11362 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)Cl 22a_100000740057_100000210401 [0,2,0,0,0,0|1,0,0]=3 11363 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)F 22a_100000740057_100000686462 [0,2,0,0,0,0|1,1,0]=4 11364 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)I 22a_100000740057_100000684831 [0,2,0,0,0,0|1,1,0]=4 11365 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)O 22a_100000740057_100000212196 [0,2,0,0,0,0|2,0,0]=4 11366 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)Br 22a_100000740057_100000743946 [0,2,0,0,0,0|1,1,0]=4 11367 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)C 22a_100000740057_100000212313 [0,2,0,0,0,0|2,0,0]=4 11368 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)Cl 22a_100000740057_100000743183 [0,2,0,0,0,0|1,0,0]=3 11369 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)F 22a_100000740057_100000209822 [0,2,0,0,0,0|1,1,0]=4 11370 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)I 22a_100000740057_100000062624 [0,2,0,0,0,0|1,1,0]=4 11371 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)O 22a_100000740057_100000185466 [0,2,0,0,0,0|2,0,0]=4 11372 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)Br 22a_100000740057_100012343876 [0,2,0,0,0,0|1,1,0]=4 11373 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)C 22a_100000740057_100000751299 [0,2,0,0,0,0|2,0,0]=4 11374 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)Cl 22a_100000740057_100000739381 [0,2,0,0,0,0|1,0,0]=3 11375 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)F 22a_100000740057_100000688015 [0,2,0,0,0,0|1,1,0]=4 11376 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)I 22a_100000740057_100000725830 [0,2,0,0,0,0|1,1,0]=4 11377 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)O 22a_100000740057_100000037485 [0,2,0,0,0,0|2,0,0]=4 11378 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)Br 22a_100000740057_100000689001 [0,2,0,0,0,0|1,1,0]=4 11379 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)C 22a_100000740057_100000233767 [0,2,0,0,0,0|2,0,0]=4 11380 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)Cl 22a_100000740057_100011933997 [0,2,0,0,0,0|1,0,0]=3 11381 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)F 22a_100000740057_100000035894 [0,2,0,0,0,0|1,1,0]=4 11382 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)I 22a_100000740057_100000239334 [0,2,0,0,0,0|1,1,0]=4 11383 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_100000210303 [0,2,0,0,0,0|2,0,0]=4 11384 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)F)Cl 34a_100000210258_100012351892 [0,2,0,0,0,0|2,0,0]=4 11385 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)C)Cl 62a_100000210303_200011216723 [0,2,0,0,0,0|2,0,0]=4 11386 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)C)Cl 62a_200011216723_100000210303 [0,2,0,0,0,0|2,0,0]=4 11387 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000210303_100000211430 [0,2,0,0,0,0|2,0,0]=4 11388 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_100000210303 [0,2,0,0,0,0|2,0,0]=4 11389 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)F)Cl 62a_100000210303_100012351892 [0,2,0,0,0,0|2,0,0]=4 11390 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_100000210303 [0,2,0,0,0,0|2,0,0]=4 11391 B15R1.1404 CCNCCC(=O)c1ccc(c(c1)Cl)Cl 2230a_100015525214_100012356702 [0,2,0,0,0,0|2,0,0]=4 11392 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100011215890 [0,2,0,0,0,0|2,0,0]=4 11393 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100011215890 [0,2,0,0,0,0|2,0,0]=4 11394 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100011215890 [0,2,0,0,0,0|2,0,0]=4 11395 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100011215890 [0,2,0,0,0,0|2,0,0]=4 11396 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100011215890 [0,2,0,0,0,0|2,0,0]=4 11397 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100011215890 [0,2,0,0,0,0|2,0,0]=4 11398 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000757381 [0,2,0,0,0,0|2,0,0]=4 11399 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000757381 [0,2,0,0,0,0|2,0,0]=4 11400 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000757381 [0,2,0,0,0,0|2,0,0]=4 11401 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000210202_100012356702 [0,2,0,0,0,0|2,0,0]=4 11402 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)Cl)Cl 62a_100012356702_100000210202 [0,2,0,0,0,0|2,0,0]=4 11403 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000757381 [0,2,0,0,0,0|2,0,0]=4 11404 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000757381 [0,2,0,0,0,0|2,0,0]=4 11405 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000757381 [0,2,0,0,0,0|2,0,0]=4 11406 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000740836 [0,2,0,0,0,0|1,1,0]=4 11407 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000740836 [0,2,0,0,0,0|2,0,0]=4 11408 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000740836 [0,2,0,0,0,0|1,0,0]=3 11409 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000740836 [0,2,0,0,0,0|1,1,0]=4 11410 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000740836 [0,2,0,0,0,0|1,1,0]=4 11411 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000740836 [0,2,0,0,0,0|2,0,0]=4 11412 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000740836 [0,2,0,0,0,0|1,1,0]=4 11413 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000740836 [0,2,0,0,0,0|2,0,0]=4 11414 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000740836 [0,2,0,0,0,0|1,0,0]=3 11415 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000740836 [0,2,0,0,0,0|1,1,0]=4 11416 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000740836 [0,2,0,0,0,0|1,1,0]=4 11417 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000740836 [0,2,0,0,0,0|2,0,0]=4 11418 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000740836 [0,2,0,0,0,0|1,1,0]=4 11419 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000740836 [0,2,0,0,0,0|2,0,0]=4 11420 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000740836 [0,2,0,0,0,0|1,0,0]=3 11421 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000740836 [0,2,0,0,0,0|1,1,0]=4 11422 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000740836 [0,2,0,0,0,0|1,1,0]=4 11423 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000740836 [0,2,0,0,0,0|2,0,0]=4 11424 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000740836 [0,2,0,0,0,0|1,1,0]=4 11425 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000740836 [0,2,0,0,0,0|2,0,0]=4 11426 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000740836 [0,2,0,0,0,0|1,0,0]=3 11427 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000740836 [0,2,0,0,0,0|1,1,0]=4 11428 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000740836 [0,2,0,0,0,0|1,1,0]=4 11429 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000740836 [0,2,0,0,0,0|2,0,0]=4 11430 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000740836 [0,2,0,0,0,0|1,1,0]=4 11431 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000740836 [0,2,0,0,0,0|2,0,0]=4 11432 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000740836 [0,2,0,0,0,0|1,0,0]=3 11433 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000740836 [0,2,0,0,0,0|1,1,0]=4 11434 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000740836 [0,2,0,0,0,0|1,1,0]=4 11435 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000740836 [0,2,0,0,0,0|2,0,0]=4 11436 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000740836 [0,2,0,0,0,0|1,1,0]=4 11437 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000740836 [0,2,0,0,0,0|2,0,0]=4 11438 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000740836 [0,2,0,0,0,0|1,0,0]=3 11439 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000740836 [0,2,0,0,0,0|1,1,0]=4 11440 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000740836 [0,2,0,0,0,0|1,1,0]=4 11441 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000740836 [0,2,0,0,0,0|2,0,0]=4 11442 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100000209980_100012339404 [0,2,0,0,0,0|0,1,0]=3 11443 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100000209980_100012339404 [0,2,0,0,0,0|0,1,0]=3 11444 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)Br 527a_100000209980_100012339404 [0,2,0,0,0,0|0,1,0]=3 11445 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)C 1626a_100000209980_100000186397 [0,2,0,0,0,0|1,0,0]=3 11446 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)C 240690a_100000209980_100000186397 [0,2,0,0,0,0|1,0,0]=3 11447 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)C 527a_100000209980_100000186397 [0,2,0,0,0,0|1,0,0]=3 11448 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000209980_100000691181 [0,2,0,0,0,0|0,0,0]=2 11449 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000209980_100000691181 [0,2,0,0,0,0|0,0,0]=2 11450 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000209980_100000691181 [0,2,0,0,0,0|0,0,0]=2 11451 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)F 1626a_100000209980_100000760357 [0,2,0,0,0,0|0,1,0]=3 11452 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)F 240690a_100000209980_100000760357 [0,2,0,0,0,0|0,1,0]=3 11453 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)F 527a_100000209980_100000760357 [0,2,0,0,0,0|0,1,0]=3 11454 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)I 1626a_100000209980_100000739115 [0,2,0,0,0,0|0,1,0]=3 11455 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)I 240690a_100000209980_100000739115 [0,2,0,0,0,0|0,1,0]=3 11456 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)I 527a_100000209980_100000739115 [0,2,0,0,0,0|0,1,0]=3 11457 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)O 240690a_100000209980_100000189672 [0,2,0,0,0,0|1,0,0]=3 11458 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)Br 1626a_100000209980_100000692631 [0,2,0,0,0,0|0,1,0]=3 11459 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)Br 240690a_100000209980_100000692631 [0,2,0,0,0,0|0,1,0]=3 11460 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)Br 527a_100000209980_100000692631 [0,2,0,0,0,0|0,1,0]=3 11461 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)C 1626a_100000209980_100000210898 [0,2,0,0,0,0|1,0,0]=3 11462 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)C 240690a_100000209980_100000210898 [0,2,0,0,0,0|1,0,0]=3 11463 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)C 527a_100000209980_100000210898 [0,2,0,0,0,0|1,0,0]=3 11464 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100000209980_100000686306 [0,2,0,0,0,0|0,0,0]=2 11465 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100000209980_100000686306 [0,2,0,0,0,0|0,0,0]=2 11466 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)Cl 527a_100000209980_100000686306 [0,2,0,0,0,0|0,0,0]=2 11467 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)F 1626a_100000209980_100000751819 [0,2,0,0,0,0|0,1,0]=3 11468 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)F 240690a_100000209980_100000751819 [0,2,0,0,0,0|0,1,0]=3 11469 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)F 527a_100000209980_100000751819 [0,2,0,0,0,0|0,1,0]=3 11470 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)I 1626a_100000209980_100000751300 [0,2,0,0,0,0|0,1,0]=3 11471 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)I 240690a_100000209980_100000751300 [0,2,0,0,0,0|0,1,0]=3 11472 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)I 527a_100000209980_100000751300 [0,2,0,0,0,0|0,1,0]=3 11473 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)O 240690a_100000209980_100000685612 [0,2,0,0,0,0|1,0,0]=3 11474 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000209980_100000687082 [0,2,0,0,0,0|0,1,0]=3 11475 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000209980_100000687082 [0,2,0,0,0,0|0,1,0]=3 11476 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100000209980_100000687082 [0,2,0,0,0,0|0,1,0]=3 11477 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100000209980_100000751740 [0,2,0,0,0,0|1,0,0]=3 11478 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100000209980_100000751740 [0,2,0,0,0,0|1,0,0]=3 11479 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)C 527a_100000209980_100000751740 [0,2,0,0,0,0|1,0,0]=3 11480 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000209980_100000210401 [0,2,0,0,0,0|0,0,0]=2 11481 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000209980_100000210401 [0,2,0,0,0,0|0,0,0]=2 11482 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000209980_100000210401 [0,2,0,0,0,0|0,0,0]=2 11483 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100000209980_100000686462 [0,2,0,0,0,0|0,1,0]=3 11484 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100000209980_100000686462 [0,2,0,0,0,0|0,1,0]=3 11485 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)F 527a_100000209980_100000686462 [0,2,0,0,0,0|0,1,0]=3 11486 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100000209980_100000684831 [0,2,0,0,0,0|0,1,0]=3 11487 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100000209980_100000684831 [0,2,0,0,0,0|0,1,0]=3 11488 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)I 527a_100000209980_100000684831 [0,2,0,0,0,0|0,1,0]=3 11489 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000209980_100000212196 [0,2,0,0,0,0|1,0,0]=3 11490 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)O 527a_100000209980_100000212196 [0,2,0,0,0,0|1,0,0]=3 11491 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)Br 1626a_100000209980_100000743946 [0,2,0,0,0,0|0,1,0]=3 11492 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)Br 240690a_100000209980_100000743946 [0,2,0,0,0,0|0,1,0]=3 11493 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)Br 527a_100000209980_100000743946 [0,2,0,0,0,0|0,1,0]=3 11494 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)C 1626a_100000209980_100000212313 [0,2,0,0,0,0|1,0,0]=3 11495 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)C 240690a_100000209980_100000212313 [0,2,0,0,0,0|1,0,0]=3 11496 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)C 527a_100000209980_100000212313 [0,2,0,0,0,0|1,0,0]=3 11497 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000209980_100000743183 [0,2,0,0,0,0|0,0,0]=2 11498 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100000209980_100000743183 [0,2,0,0,0,0|0,0,0]=2 11499 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)Cl 527a_100000209980_100000743183 [0,2,0,0,0,0|0,0,0]=2 11500 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)F 1626a_100000209980_100000209822 [0,2,0,0,0,0|0,1,0]=3 11501 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)F 240690a_100000209980_100000209822 [0,2,0,0,0,0|0,1,0]=3 11502 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)F 527a_100000209980_100000209822 [0,2,0,0,0,0|0,1,0]=3 11503 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)I 1626a_100000209980_100000062624 [0,2,0,0,0,0|0,1,0]=3 11504 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)I 240690a_100000209980_100000062624 [0,2,0,0,0,0|0,1,0]=3 11505 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)I 527a_100000209980_100000062624 [0,2,0,0,0,0|0,1,0]=3 11506 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)O 240690a_100000209980_100000185466 [0,2,0,0,0,0|1,0,0]=3 11507 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)O 527a_100000209980_100000185466 [0,2,0,0,0,0|1,0,0]=3 11508 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)Br 1626a_100000209980_100012343876 [0,2,0,0,0,0|0,1,0]=3 11509 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)Br 240690a_100000209980_100012343876 [0,2,0,0,0,0|0,1,0]=3 11510 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)Br 527a_100000209980_100012343876 [0,2,0,0,0,0|0,1,0]=3 11511 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)C 1626a_100000209980_100000751299 [0,2,0,0,0,0|1,0,0]=3 11512 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)C 240690a_100000209980_100000751299 [0,2,0,0,0,0|1,0,0]=3 11513 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)C 527a_100000209980_100000751299 [0,2,0,0,0,0|1,0,0]=3 11514 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000209980_100000739381 [0,2,0,0,0,0|0,0,0]=2 11515 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100000209980_100000739381 [0,2,0,0,0,0|0,0,0]=2 11516 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)Cl 527a_100000209980_100000739381 [0,2,0,0,0,0|0,0,0]=2 11517 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)F 1626a_100000209980_100000688015 [0,2,0,0,0,0|0,1,0]=3 11518 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)F 240690a_100000209980_100000688015 [0,2,0,0,0,0|0,1,0]=3 11519 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)F 527a_100000209980_100000688015 [0,2,0,0,0,0|0,1,0]=3 11520 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)I 1626a_100000209980_100000725830 [0,2,0,0,0,0|0,1,0]=3 11521 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)I 240690a_100000209980_100000725830 [0,2,0,0,0,0|0,1,0]=3 11522 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)I 527a_100000209980_100000725830 [0,2,0,0,0,0|0,1,0]=3 11523 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)O 1626a_100000209980_100000037485 [0,2,0,0,0,0|1,0,0]=3 11524 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)O 240690a_100000209980_100000037485 [0,2,0,0,0,0|1,0,0]=3 11525 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Br 240690a_100000209980_100000689001 [0,2,0,0,0,0|0,1,0]=3 11526 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Br 527a_100000209980_100000689001 [0,2,0,0,0,0|0,1,0]=3 11527 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)C 240690a_100000209980_100000233767 [0,2,0,0,0,0|1,0,0]=3 11528 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000209980_100011933997 [0,2,0,0,0,0|0,0,0]=2 11529 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Cl 527a_100000209980_100011933997 [0,2,0,0,0,0|0,0,0]=2 11530 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)F 240690a_100000209980_100000035894 [0,2,0,0,0,0|0,1,0]=3 11531 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)F 527a_100000209980_100000035894 [0,2,0,0,0,0|0,1,0]=3 11532 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)I 1626a_100000209980_100000239334 [0,2,0,0,0,0|0,1,0]=3 11533 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)I 240690a_100000209980_100000239334 [0,2,0,0,0,0|0,1,0]=3 11534 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)I 527a_100000209980_100000239334 [0,2,0,0,0,0|0,1,0]=3 11535 B15R1.1404 COCCNC(C)c1ccc(c(c1)Br)Cl 269862a_100000209980_100012356427 [0,2,0,0,0,0|1,0,1]=4 11536 B15R1.1404 COCCNC(C)c1ccc(c(c1)C)Cl 269862a_100000209980_100011216000 [0,2,0,0,0,0|1,0,1]=4 11537 B15R1.1404 COCCNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100011201679 [0,2,0,0,0,0|1,0,1]=4 11538 B15R1.1404 COCCNC(C)c1ccc(c(c1)Cl)Cl 269862a_100000209980_100000210641 [0,2,0,0,0,0|1,0,1]=4 11539 B15R1.1404 COCCNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_100011201679 [0,2,0,0,0,0|1,0,1]=4 11540 B15R1.1404 COCCNC(C)c1ccc(c(c1)F)Cl 269862a_100000209980_100000693814 [0,2,0,0,0,0|1,0,1]=4 11541 B15R1.1404 COCCN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_100011201679 [0,2,0,0,0,0|1,0,1]=4 11542 B15R1.1404 COCCN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_100011201679 [0,2,0,0,0,0|1,0,1]=4 11543 B15R1.1404 COCSCC(=O)c1ccc(c(c1)C)Cl 62a_100000766300_200011216723 [0,2,0,0,0,0|2,0,0]=4 11544 B15R1.1404 COCSCC(=O)c1ccc(c(c1)C)Cl 62a_200011216723_100000766300 [0,2,0,0,0,0|2,0,0]=4 11545 B15R1.1404 COCSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000211430_100000766300 [0,2,0,0,0,0|2,0,0]=4 11546 B15R1.1404 COCSCC(=O)c1ccc(c(c1)Cl)Cl 62a_100000766300_100000211430 [0,2,0,0,0,0|2,0,0]=4 11547 B15R1.1404 COCSCC(=O)c1ccc(c(c1)F)Cl 62a_100000766300_100012351892 [0,2,0,0,0,0|2,0,0]=4 11548 B15R1.1404 COCSCC(=O)c1ccc(c(c1)F)Cl 62a_100012351892_100000766300 [0,2,0,0,0,0|2,0,0]=4 11549 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Br 11a_100020590264_100012339404 [0,2,0,0,0,0|0,2,0]=4 11550 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100020590264_100012339404 [0,2,0,0,0,0|0,2,0]=4 11551 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100020590264_100012339404 [0,2,0,0,0,0|0,2,0]=4 11552 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Br 527a_100020590264_100012339404 [0,2,0,0,0,0|0,2,0]=4 11553 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)C 11a_100020590264_100000186397 [0,2,0,0,0,0|1,1,0]=4 11554 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)C 1626a_100020590264_100000186397 [0,2,0,0,0,0|1,1,0]=4 11555 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)C 240690a_100020590264_100000186397 [0,2,0,0,0,0|1,1,0]=4 11556 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)C 527a_100020590264_100000186397 [0,2,0,0,0,0|1,1,0]=4 11557 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100020590264_100000691181 [0,2,0,0,0,0|0,1,0]=3 11558 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100020590264_100000691181 [0,2,0,0,0,0|0,1,0]=3 11559 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100020590264_100000691181 [0,2,0,0,0,0|0,1,0]=3 11560 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100020590264_100000691181 [0,2,0,0,0,0|0,1,0]=3 11561 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)F 11a_100020590264_100000760357 [0,2,0,0,0,0|0,2,0]=4 11562 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)F 1626a_100020590264_100000760357 [0,2,0,0,0,0|0,2,0]=4 11563 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)F 240690a_100020590264_100000760357 [0,2,0,0,0,0|0,2,0]=4 11564 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)F 527a_100020590264_100000760357 [0,2,0,0,0,0|0,2,0]=4 11565 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)I 11a_100020590264_100000739115 [0,2,0,0,0,0|0,2,0]=4 11566 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)I 1626a_100020590264_100000739115 [0,2,0,0,0,0|0,2,0]=4 11567 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)I 240690a_100020590264_100000739115 [0,2,0,0,0,0|0,2,0]=4 11568 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)I 527a_100020590264_100000739115 [0,2,0,0,0,0|0,2,0]=4 11569 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)O 240690a_100020590264_100000189672 [0,2,0,0,0,0|1,1,0]=4 11570 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Br 11a_100020590264_100000692631 [0,2,0,0,0,0|0,2,0]=4 11571 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Br 1626a_100020590264_100000692631 [0,2,0,0,0,0|0,2,0]=4 11572 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Br 240690a_100020590264_100000692631 [0,2,0,0,0,0|0,2,0]=4 11573 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Br 527a_100020590264_100000692631 [0,2,0,0,0,0|0,2,0]=4 11574 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)C 11a_100020590264_100000210898 [0,2,0,0,0,0|1,1,0]=4 11575 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)C 1626a_100020590264_100000210898 [0,2,0,0,0,0|1,1,0]=4 11576 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)C 240690a_100020590264_100000210898 [0,2,0,0,0,0|1,1,0]=4 11577 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)C 527a_100020590264_100000210898 [0,2,0,0,0,0|1,1,0]=4 11578 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Cl 11a_100020590264_100000686306 [0,2,0,0,0,0|0,1,0]=3 11579 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100020590264_100000686306 [0,2,0,0,0,0|0,1,0]=3 11580 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100020590264_100000686306 [0,2,0,0,0,0|0,1,0]=3 11581 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)Cl 527a_100020590264_100000686306 [0,2,0,0,0,0|0,1,0]=3 11582 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)F 11a_100020590264_100000751819 [0,2,0,0,0,0|0,2,0]=4 11583 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)F 1626a_100020590264_100000751819 [0,2,0,0,0,0|0,2,0]=4 11584 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)F 240690a_100020590264_100000751819 [0,2,0,0,0,0|0,2,0]=4 11585 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)F 527a_100020590264_100000751819 [0,2,0,0,0,0|0,2,0]=4 11586 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)I 11a_100020590264_100000751300 [0,2,0,0,0,0|0,2,0]=4 11587 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)I 1626a_100020590264_100000751300 [0,2,0,0,0,0|0,2,0]=4 11588 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)I 240690a_100020590264_100000751300 [0,2,0,0,0,0|0,2,0]=4 11589 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)I 527a_100020590264_100000751300 [0,2,0,0,0,0|0,2,0]=4 11590 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)O 240690a_100020590264_100000685612 [0,2,0,0,0,0|1,1,0]=4 11591 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100020590264_100000687082 [0,2,0,0,0,0|0,2,0]=4 11592 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100020590264_100000687082 [0,2,0,0,0,0|0,2,0]=4 11593 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100020590264_100000687082 [0,2,0,0,0,0|0,2,0]=4 11594 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100020590264_100000687082 [0,2,0,0,0,0|0,2,0]=4 11595 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)C 11a_100020590264_100000751740 [0,2,0,0,0,0|1,1,0]=4 11596 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100020590264_100000751740 [0,2,0,0,0,0|1,1,0]=4 11597 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100020590264_100000751740 [0,2,0,0,0,0|1,1,0]=4 11598 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)C 527a_100020590264_100000751740 [0,2,0,0,0,0|1,1,0]=4 11599 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100020590264_100000210401 [0,2,0,0,0,0|0,1,0]=3 11600 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100020590264_100000210401 [0,2,0,0,0,0|0,1,0]=3 11601 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100020590264_100000210401 [0,2,0,0,0,0|0,1,0]=3 11602 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100020590264_100000210401 [0,2,0,0,0,0|0,1,0]=3 11603 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)F 11a_100020590264_100000686462 [0,2,0,0,0,0|0,2,0]=4 11604 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100020590264_100000686462 [0,2,0,0,0,0|0,2,0]=4 11605 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100020590264_100000686462 [0,2,0,0,0,0|0,2,0]=4 11606 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)F 527a_100020590264_100000686462 [0,2,0,0,0,0|0,2,0]=4 11607 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)I 11a_100020590264_100000684831 [0,2,0,0,0,0|0,2,0]=4 11608 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100020590264_100000684831 [0,2,0,0,0,0|0,2,0]=4 11609 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100020590264_100000684831 [0,2,0,0,0,0|0,2,0]=4 11610 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)I 527a_100020590264_100000684831 [0,2,0,0,0,0|0,2,0]=4 11611 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100020590264_100000212196 [0,2,0,0,0,0|1,1,0]=4 11612 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)O 527a_100020590264_100000212196 [0,2,0,0,0,0|1,1,0]=4 11613 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Br 11a_100020590264_100000743946 [0,2,0,0,0,0|0,2,0]=4 11614 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Br 1626a_100020590264_100000743946 [0,2,0,0,0,0|0,2,0]=4 11615 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Br 240690a_100020590264_100000743946 [0,2,0,0,0,0|0,2,0]=4 11616 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Br 527a_100020590264_100000743946 [0,2,0,0,0,0|0,2,0]=4 11617 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)C 11a_100020590264_100000212313 [0,2,0,0,0,0|1,1,0]=4 11618 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)C 1626a_100020590264_100000212313 [0,2,0,0,0,0|1,1,0]=4 11619 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)C 240690a_100020590264_100000212313 [0,2,0,0,0,0|1,1,0]=4 11620 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)C 527a_100020590264_100000212313 [0,2,0,0,0,0|1,1,0]=4 11621 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Cl 11a_100020590264_100000743183 [0,2,0,0,0,0|0,1,0]=3 11622 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100020590264_100000743183 [0,2,0,0,0,0|0,1,0]=3 11623 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100020590264_100000743183 [0,2,0,0,0,0|0,1,0]=3 11624 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)Cl 527a_100020590264_100000743183 [0,2,0,0,0,0|0,1,0]=3 11625 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)F 11a_100020590264_100000209822 [0,2,0,0,0,0|0,2,0]=4 11626 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)F 1626a_100020590264_100000209822 [0,2,0,0,0,0|0,2,0]=4 11627 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)F 240690a_100020590264_100000209822 [0,2,0,0,0,0|0,2,0]=4 11628 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)F 527a_100020590264_100000209822 [0,2,0,0,0,0|0,2,0]=4 11629 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)I 11a_100020590264_100000062624 [0,2,0,0,0,0|0,2,0]=4 11630 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)I 1626a_100020590264_100000062624 [0,2,0,0,0,0|0,2,0]=4 11631 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)I 240690a_100020590264_100000062624 [0,2,0,0,0,0|0,2,0]=4 11632 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)I 527a_100020590264_100000062624 [0,2,0,0,0,0|0,2,0]=4 11633 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)O 240690a_100020590264_100000185466 [0,2,0,0,0,0|1,1,0]=4 11634 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)O 527a_100020590264_100000185466 [0,2,0,0,0,0|1,1,0]=4 11635 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Br 11a_100020590264_100012343876 [0,2,0,0,0,0|0,2,0]=4 11636 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Br 1626a_100020590264_100012343876 [0,2,0,0,0,0|0,2,0]=4 11637 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Br 240690a_100020590264_100012343876 [0,2,0,0,0,0|0,2,0]=4 11638 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Br 527a_100020590264_100012343876 [0,2,0,0,0,0|0,2,0]=4 11639 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)C 11a_100020590264_100000751299 [0,2,0,0,0,0|1,1,0]=4 11640 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)C 1626a_100020590264_100000751299 [0,2,0,0,0,0|1,1,0]=4 11641 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)C 240690a_100020590264_100000751299 [0,2,0,0,0,0|1,1,0]=4 11642 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)C 527a_100020590264_100000751299 [0,2,0,0,0,0|1,1,0]=4 11643 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Cl 11a_100020590264_100000739381 [0,2,0,0,0,0|0,1,0]=3 11644 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100020590264_100000739381 [0,2,0,0,0,0|0,1,0]=3 11645 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100020590264_100000739381 [0,2,0,0,0,0|0,1,0]=3 11646 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)Cl 527a_100020590264_100000739381 [0,2,0,0,0,0|0,1,0]=3 11647 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)F 11a_100020590264_100000688015 [0,2,0,0,0,0|0,2,0]=4 11648 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)F 1626a_100020590264_100000688015 [0,2,0,0,0,0|0,2,0]=4 11649 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)F 240690a_100020590264_100000688015 [0,2,0,0,0,0|0,2,0]=4 11650 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)F 527a_100020590264_100000688015 [0,2,0,0,0,0|0,2,0]=4 11651 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)I 11a_100020590264_100000725830 [0,2,0,0,0,0|0,2,0]=4 11652 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)I 1626a_100020590264_100000725830 [0,2,0,0,0,0|0,2,0]=4 11653 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)I 240690a_100020590264_100000725830 [0,2,0,0,0,0|0,2,0]=4 11654 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)I 527a_100020590264_100000725830 [0,2,0,0,0,0|0,2,0]=4 11655 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)O 1626a_100020590264_100000037485 [0,2,0,0,0,0|1,1,0]=4 11656 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)O 240690a_100020590264_100000037485 [0,2,0,0,0,0|1,1,0]=4 11657 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Br 240690a_100020590264_100000689001 [0,2,0,0,0,0|0,2,0]=4 11658 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Br 527a_100020590264_100000689001 [0,2,0,0,0,0|0,2,0]=4 11659 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)C 240690a_100020590264_100000233767 [0,2,0,0,0,0|1,1,0]=4 11660 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100020590264_100011933997 [0,2,0,0,0,0|0,1,0]=3 11661 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Cl 527a_100020590264_100011933997 [0,2,0,0,0,0|0,1,0]=3 11662 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)F 240690a_100020590264_100000035894 [0,2,0,0,0,0|0,2,0]=4 11663 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)F 527a_100020590264_100000035894 [0,2,0,0,0,0|0,2,0]=4 11664 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)I 1626a_100020590264_100000239334 [0,2,0,0,0,0|0,2,0]=4 11665 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)I 240690a_100020590264_100000239334 [0,2,0,0,0,0|0,2,0]=4 11666 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)I 527a_100020590264_100000239334 [0,2,0,0,0,0|0,2,0]=4 11667 B15R1.1404 C[C@@H](NCCCO)c1ccc(c(c1)F)Cl 2230a_100016987903_100000230001 [0,2,0,0,0,0|1,0,1]=4 11668 B15R1.1404 C[C@@H](NCCCO)c1ccc(c(c1)F)Cl 34a_100016987903_100000230001 [0,2,0,0,0,0|1,0,1]=4 11669 B15R1.1404 Cc1cc(ccc1Br)C(=O)CCCCO 1458a_100000692631_100000210776 [0,2,0,0,0,0|1,1,0]=4 11670 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCC#N 11a_100000720768_100000692631 [0,2,0,0,0,0|1,1,0]=4 11671 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCC#N 1626a_100000720768_100000692631 [0,2,0,0,0,0|1,1,0]=4 11672 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCC#N 240690a_100000720768_100000692631 [0,2,0,0,0,0|1,1,0]=4 11673 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCC#N 527a_100000720768_100000692631 [0,2,0,0,0,0|1,1,0]=4 11674 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCCF 11a_100015189416_100000692631 [0,2,0,0,0,0|1,1,0]=4 11675 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCCF 1626a_100015189416_100000692631 [0,2,0,0,0,0|1,1,0]=4 11676 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCCF 240690a_100015189416_100000692631 [0,2,0,0,0,0|1,1,0]=4 11677 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCCF 527a_100015189416_100000692631 [0,2,0,0,0,0|1,1,0]=4 11678 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCCO 240690a_100000182051_100000692631 [0,2,0,0,0,0|0,1,0]=3 11679 B15R1.1404 Cc1cc(ccc1Br)C(=O)NCCCO 527a_100000182051_100000692631 [0,2,0,0,0,0|0,1,0]=3 11680 B15R1.1404 Cc1cc(ccc1Br)C(=O)NNCCO 22a_100000210001_100000692631 [0,2,0,0,0,0|0,1,0]=3 11681 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CC#CCO 1458a_100000686306_200000047223 [0,2,0,0,0,0|1,0,1]=4 11682 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CCCC#N 1458a_100000686306_100000211468 [0,2,0,0,0,0|2,0,0]=4 11683 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CCCCF 1458a_100000686306_100000729493 [0,2,0,0,0,0|2,0,0]=4 11684 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CCCCO 1458a_100000686306_100000210776 [0,2,0,0,0,0|1,0,0]=3 11685 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CSCCF 62a_100011217306_200011216723 [0,2,0,0,0,0|2,0,0]=4 11686 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CSCCF 62a_200011216723_100011217306 [0,2,0,0,0,0|2,0,0]=4 11687 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CSCCO 62a_100000211926_200011216723 [0,2,0,0,0,0|1,0,0]=3 11688 B15R1.1404 Cc1cc(ccc1Cl)C(=O)CSCCO 62a_200011216723_100000211926 [0,2,0,0,0,0|1,0,0]=3 11689 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCC#N 11a_100000720768_100000686306 [0,2,0,0,0,0|1,0,0]=3 11690 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCC#N 1626a_100000720768_100000686306 [0,2,0,0,0,0|1,0,0]=3 11691 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCC#N 240690a_100000720768_100000686306 [0,2,0,0,0,0|1,0,0]=3 11692 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCC#N 527a_100000720768_100000686306 [0,2,0,0,0,0|1,0,0]=3 11693 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCCF 11a_100015189416_100000686306 [0,2,0,0,0,0|1,0,0]=3 11694 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCCF 1626a_100015189416_100000686306 [0,2,0,0,0,0|1,0,0]=3 11695 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCCF 240690a_100015189416_100000686306 [0,2,0,0,0,0|1,0,0]=3 11696 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCCF 527a_100015189416_100000686306 [0,2,0,0,0,0|1,0,0]=3 11697 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCCO 240690a_100000182051_100000686306 [0,2,0,0,0,0|0,0,0]=2 11698 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NCCCO 527a_100000182051_100000686306 [0,2,0,0,0,0|0,0,0]=2 11699 B15R1.1404 Cc1cc(ccc1Cl)C(=O)NNCCO 22a_100000210001_100000686306 [0,2,0,0,0,0|0,0,0]=2 11700 B15R1.1404 Cc1cc(ccc1Cl)C(C)NCCCO 269862a_100000182051_100011216000 [0,2,0,0,0,0|1,0,1]=4 11701 B15R1.1404 Cc1cc(ccc1F)C(=O)CCCCO 1458a_100000751819_100000210776 [0,2,0,0,0,0|1,1,0]=4 11702 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCC#N 11a_100000720768_100000751819 [0,2,0,0,0,0|1,1,0]=4 11703 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCC#N 1626a_100000720768_100000751819 [0,2,0,0,0,0|1,1,0]=4 11704 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCC#N 240690a_100000720768_100000751819 [0,2,0,0,0,0|1,1,0]=4 11705 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCC#N 527a_100000720768_100000751819 [0,2,0,0,0,0|1,1,0]=4 11706 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCCF 11a_100015189416_100000751819 [0,2,0,0,0,0|1,1,0]=4 11707 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCCF 1626a_100015189416_100000751819 [0,2,0,0,0,0|1,1,0]=4 11708 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCCF 240690a_100015189416_100000751819 [0,2,0,0,0,0|1,1,0]=4 11709 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCCF 527a_100015189416_100000751819 [0,2,0,0,0,0|1,1,0]=4 11710 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCCO 240690a_100000182051_100000751819 [0,2,0,0,0,0|0,1,0]=3 11711 B15R1.1404 Cc1cc(ccc1F)C(=O)NCCCO 527a_100000182051_100000751819 [0,2,0,0,0,0|0,1,0]=3 11712 B15R1.1404 Cc1cc(ccc1F)C(=O)NNCCO 22a_100000210001_100000751819 [0,2,0,0,0,0|0,1,0]=3 11713 B15R1.1404 Cc1cc(ccc1I)C(=O)CCCCO 1458a_100000751300_100000210776 [0,2,0,0,0,0|1,1,0]=4 11714 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCC#N 11a_100000720768_100000751300 [0,2,0,0,0,0|1,1,0]=4 11715 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCC#N 1626a_100000720768_100000751300 [0,2,0,0,0,0|1,1,0]=4 11716 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCC#N 240690a_100000720768_100000751300 [0,2,0,0,0,0|1,1,0]=4 11717 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCC#N 527a_100000720768_100000751300 [0,2,0,0,0,0|1,1,0]=4 11718 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCCF 11a_100015189416_100000751300 [0,2,0,0,0,0|1,1,0]=4 11719 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCCF 1626a_100015189416_100000751300 [0,2,0,0,0,0|1,1,0]=4 11720 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCCF 240690a_100015189416_100000751300 [0,2,0,0,0,0|1,1,0]=4 11721 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCCF 527a_100015189416_100000751300 [0,2,0,0,0,0|1,1,0]=4 11722 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCCO 240690a_100000182051_100000751300 [0,2,0,0,0,0|0,1,0]=3 11723 B15R1.1404 Cc1cc(ccc1I)C(=O)NCCCO 527a_100000182051_100000751300 [0,2,0,0,0,0|0,1,0]=3 11724 B15R1.1404 Cc1cc(ccc1I)C(=O)NNCCO 22a_100000210001_100000751300 [0,2,0,0,0,0|0,1,0]=3 11725 B15R1.1404 Cc1cc(ccc1O)C(=O)CCCCO 1458a_100000685612_100000210776 [0,2,0,0,0,0|2,0,0]=4 11726 B15R1.1404 Cc1cc(ccc1O)C(=O)NCCC#N 240690a_100000720768_100000685612 [0,2,0,0,0,0|2,0,0]=4 11727 B15R1.1404 Cc1cc(ccc1O)C(=O)NCCCF 240690a_100015189416_100000685612 [0,2,0,0,0,0|2,0,0]=4 11728 B15R1.1404 Cc1cc(ccc1O)C(=O)NCCCO 240690a_100000182051_100000685612 [0,2,0,0,0,0|1,0,0]=3 11729 B15R1.1404 Cc1cc(ccc1O)C(=O)NNCCO 22a_100000210001_100000685612 [0,2,0,0,0,0|1,0,0]=3 11730 B15R1.1404 Cc1ccc(cc1Br)C(=O)CCCCO 1458a_100000186397_100000210776 [0,2,0,0,0,0|2,0,0]=4 11731 B15R1.1404 Cc1ccc(cc1Br)C(=O)CNCCF 34a_100000724931_100012346676 [0,2,0,0,0,0|2,0,0]=4 11732 B15R1.1404 Cc1ccc(cc1Br)C(=O)CNCCO 2230a_100016997473_100012346676 [0,2,0,0,0,0|1,0,0]=3 11733 B15R1.1404 Cc1ccc(cc1Br)C(=O)CNCCO 34a_100016990907_100012346676 [0,2,0,0,0,0|1,0,0]=3 11734 B15R1.1404 Cc1ccc(cc1Br)C(=O)CSCCO 62a_100000211926_100012346676 [0,2,0,0,0,0|2,0,0]=4 11735 B15R1.1404 Cc1ccc(cc1Br)C(=O)CSCCO 62a_100012346676_100000211926 [0,2,0,0,0,0|2,0,0]=4 11736 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCC#N 11a_100000720768_100000186397 [0,2,0,0,0,0|2,0,0]=4 11737 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCC#N 1626a_100000720768_100000186397 [0,2,0,0,0,0|2,0,0]=4 11738 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCC#N 240690a_100000720768_100000186397 [0,2,0,0,0,0|2,0,0]=4 11739 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCC#N 527a_100000720768_100000186397 [0,2,0,0,0,0|2,0,0]=4 11740 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCCF 11a_100015189416_100000186397 [0,2,0,0,0,0|2,0,0]=4 11741 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCCF 1626a_100015189416_100000186397 [0,2,0,0,0,0|2,0,0]=4 11742 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCCF 240690a_100015189416_100000186397 [0,2,0,0,0,0|2,0,0]=4 11743 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCCF 527a_100015189416_100000186397 [0,2,0,0,0,0|2,0,0]=4 11744 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCCO 240690a_100000182051_100000186397 [0,2,0,0,0,0|1,0,0]=3 11745 B15R1.1404 Cc1ccc(cc1Br)C(=O)NCCCO 527a_100000182051_100000186397 [0,2,0,0,0,0|1,0,0]=3 11746 B15R1.1404 Cc1ccc(cc1Br)C(=O)NNCCO 22a_100000210001_100000186397 [0,2,0,0,0,0|1,0,0]=3 11747 B15R1.1404 Cc1ccc(cc1C)C(=O)CCCCO 1458a_100000210898_100000210776 [0,2,0,0,0,0|2,0,0]=4 11748 B15R1.1404 Cc1ccc(cc1C)C(=O)CNCCO 2230a_100016997473_100000183365 [0,2,0,0,0,0|1,0,0]=3 11749 B15R1.1404 Cc1ccc(cc1C)C(=O)CSCCO 62a_100000183365_100000211926 [0,2,0,0,0,0|2,0,0]=4 11750 B15R1.1404 Cc1ccc(cc1C)C(=O)CSCCO 62a_100000211926_100000183365 [0,2,0,0,0,0|2,0,0]=4 11751 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCC#N 11a_100000720768_100000210898 [0,2,0,0,0,0|2,0,0]=4 11752 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCC#N 1626a_100000720768_100000210898 [0,2,0,0,0,0|2,0,0]=4 11753 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCC#N 240690a_100000720768_100000210898 [0,2,0,0,0,0|2,0,0]=4 11754 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCC#N 527a_100000720768_100000210898 [0,2,0,0,0,0|2,0,0]=4 11755 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCCF 11a_100015189416_100000210898 [0,2,0,0,0,0|2,0,0]=4 11756 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCCF 1626a_100015189416_100000210898 [0,2,0,0,0,0|2,0,0]=4 11757 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCCF 240690a_100015189416_100000210898 [0,2,0,0,0,0|2,0,0]=4 11758 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCCF 527a_100015189416_100000210898 [0,2,0,0,0,0|2,0,0]=4 11759 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCCO 240690a_100000182051_100000210898 [0,2,0,0,0,0|1,0,0]=3 11760 B15R1.1404 Cc1ccc(cc1C)C(=O)NCCCO 527a_100000182051_100000210898 [0,2,0,0,0,0|1,0,0]=3 11761 B15R1.1404 Cc1ccc(cc1C)C(=O)NNCCO 22a_100000210001_100000210898 [0,2,0,0,0,0|1,0,0]=3 11762 B15R1.1404 Cc1ccc(cc1Cl)C(=O)CCCCO 1458a_100000751740_100000210776 [0,2,0,0,0,0|2,0,0]=4 11763 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCC#N 11a_100000720768_100000751740 [0,2,0,0,0,0|2,0,0]=4 11764 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCC#N 1626a_100000720768_100000751740 [0,2,0,0,0,0|2,0,0]=4 11765 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCC#N 240690a_100000720768_100000751740 [0,2,0,0,0,0|2,0,0]=4 11766 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCC#N 527a_100000720768_100000751740 [0,2,0,0,0,0|2,0,0]=4 11767 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCCF 11a_100015189416_100000751740 [0,2,0,0,0,0|2,0,0]=4 11768 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCCF 1626a_100015189416_100000751740 [0,2,0,0,0,0|2,0,0]=4 11769 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCCF 240690a_100015189416_100000751740 [0,2,0,0,0,0|2,0,0]=4 11770 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCCF 527a_100015189416_100000751740 [0,2,0,0,0,0|2,0,0]=4 11771 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCCO 240690a_100000182051_100000751740 [0,2,0,0,0,0|1,0,0]=3 11772 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NCCCO 527a_100000182051_100000751740 [0,2,0,0,0,0|1,0,0]=3 11773 B15R1.1404 Cc1ccc(cc1Cl)C(=O)NNCCO 22a_100000210001_100000751740 [0,2,0,0,0,0|1,0,0]=3 11774 B15R1.1404 Cc1ccc(cc1F)C(=O)CCCCO 1458a_100000212313_100000210776 [0,2,0,0,0,0|2,0,0]=4 11775 B15R1.1404 Cc1ccc(cc1F)C(=O)CNCCF 34a_100000724931_100011219196 [0,2,0,0,0,0|2,0,0]=4 11776 B15R1.1404 Cc1ccc(cc1F)C(=O)CNCCO 2230a_100016997473_100011219196 [0,2,0,0,0,0|1,0,0]=3 11777 B15R1.1404 Cc1ccc(cc1F)C(=O)CNCCO 34a_100016990907_100011219196 [0,2,0,0,0,0|1,0,0]=3 11778 B15R1.1404 Cc1ccc(cc1F)C(=O)CSCCO 62a_100000211926_100011219196 [0,2,0,0,0,0|2,0,0]=4 11779 B15R1.1404 Cc1ccc(cc1F)C(=O)CSCCO 62a_100011219196_100000211926 [0,2,0,0,0,0|2,0,0]=4 11780 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCC#N 11a_100000720768_100000212313 [0,2,0,0,0,0|2,0,0]=4 11781 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCC#N 1626a_100000720768_100000212313 [0,2,0,0,0,0|2,0,0]=4 11782 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCC#N 240690a_100000720768_100000212313 [0,2,0,0,0,0|2,0,0]=4 11783 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCC#N 527a_100000720768_100000212313 [0,2,0,0,0,0|2,0,0]=4 11784 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCCF 11a_100015189416_100000212313 [0,2,0,0,0,0|2,0,0]=4 11785 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCCF 1626a_100015189416_100000212313 [0,2,0,0,0,0|2,0,0]=4 11786 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCCF 240690a_100015189416_100000212313 [0,2,0,0,0,0|2,0,0]=4 11787 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCCF 527a_100015189416_100000212313 [0,2,0,0,0,0|2,0,0]=4 11788 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCCO 240690a_100000182051_100000212313 [0,2,0,0,0,0|1,0,0]=3 11789 B15R1.1404 Cc1ccc(cc1F)C(=O)NCCCO 527a_100000182051_100000212313 [0,2,0,0,0,0|1,0,0]=3 11790 B15R1.1404 Cc1ccc(cc1F)C(=O)NNCCO 22a_100000210001_100000212313 [0,2,0,0,0,0|1,0,0]=3 11791 B15R1.1404 Cc1ccc(cc1I)C(=O)CCCCO 1458a_100000751299_100000210776 [0,2,0,0,0,0|2,0,0]=4 11792 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCC#N 11a_100000720768_100000751299 [0,2,0,0,0,0|2,0,0]=4 11793 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCC#N 1626a_100000720768_100000751299 [0,2,0,0,0,0|2,0,0]=4 11794 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCC#N 240690a_100000720768_100000751299 [0,2,0,0,0,0|2,0,0]=4 11795 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCC#N 527a_100000720768_100000751299 [0,2,0,0,0,0|2,0,0]=4 11796 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCCF 11a_100015189416_100000751299 [0,2,0,0,0,0|2,0,0]=4 11797 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCCF 1626a_100015189416_100000751299 [0,2,0,0,0,0|2,0,0]=4 11798 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCCF 240690a_100015189416_100000751299 [0,2,0,0,0,0|2,0,0]=4 11799 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCCF 527a_100015189416_100000751299 [0,2,0,0,0,0|2,0,0]=4 11800 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCCO 240690a_100000182051_100000751299 [0,2,0,0,0,0|1,0,0]=3 11801 B15R1.1404 Cc1ccc(cc1I)C(=O)NCCCO 527a_100000182051_100000751299 [0,2,0,0,0,0|1,0,0]=3 11802 B15R1.1404 Cc1ccc(cc1I)C(=O)NNCCO 22a_100000210001_100000751299 [0,2,0,0,0,0|1,0,0]=3 11803 B15R1.1404 Cc1ccc(cc1O)C(=O)CCCCO 1458a_100000233767_100000210776 [0,2,0,0,0,0|2,0,0]=4 11804 B15R1.1404 Cc1ccc(cc1O)C(=O)NCCC#N 240690a_100000720768_100000233767 [0,2,0,0,0,0|2,0,0]=4 11805 B15R1.1404 Cc1ccc(cc1O)C(=O)NCCCF 240690a_100015189416_100000233767 [0,2,0,0,0,0|2,0,0]=4 11806 B15R1.1404 Cc1ccc(cc1O)C(=O)NCCCO 240690a_100000182051_100000233767 [0,2,0,0,0,0|1,0,0]=3 11807 B15R1.1404 Cc1ccc(cc1O)C(=O)NNCCO 22a_100000210001_100000233767 [0,2,0,0,0,0|1,0,0]=3 11808 B15R1.1404 N#CCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000211468 [0,2,0,0,0,0|2,0,0]=4 11809 B15R1.1404 N#CCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000211468 [0,2,0,0,0,0|2,0,0]=4 11810 B15R1.1404 N#CCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000211468 [0,2,0,0,0,0|2,0,0]=4 11811 B15R1.1404 N#CCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000211468 [0,2,0,0,0,0|2,0,0]=4 11812 B15R1.1404 N#CCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000211468 [0,2,0,0,0,0|2,0,0]=4 11813 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Br 11a_100000720768_100012339404 [0,2,0,0,0,0|1,1,0]=4 11814 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100000720768_100012339404 [0,2,0,0,0,0|1,1,0]=4 11815 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100000720768_100012339404 [0,2,0,0,0,0|1,1,0]=4 11816 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Br 527a_100000720768_100012339404 [0,2,0,0,0,0|1,1,0]=4 11817 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100000720768_100000691181 [0,2,0,0,0,0|1,0,0]=3 11818 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000720768_100000691181 [0,2,0,0,0,0|1,0,0]=3 11819 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000720768_100000691181 [0,2,0,0,0,0|1,0,0]=3 11820 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100000720768_100000691181 [0,2,0,0,0,0|1,0,0]=3 11821 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)F 11a_100000720768_100000760357 [0,2,0,0,0,0|1,1,0]=4 11822 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)F 1626a_100000720768_100000760357 [0,2,0,0,0,0|1,1,0]=4 11823 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)F 240690a_100000720768_100000760357 [0,2,0,0,0,0|1,1,0]=4 11824 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)F 527a_100000720768_100000760357 [0,2,0,0,0,0|1,1,0]=4 11825 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)I 11a_100000720768_100000739115 [0,2,0,0,0,0|1,1,0]=4 11826 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)I 1626a_100000720768_100000739115 [0,2,0,0,0,0|1,1,0]=4 11827 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)I 240690a_100000720768_100000739115 [0,2,0,0,0,0|1,1,0]=4 11828 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)I 527a_100000720768_100000739115 [0,2,0,0,0,0|1,1,0]=4 11829 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Br)O 240690a_100000720768_100000189672 [0,2,0,0,0,0|2,0,0]=4 11830 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100000720768_100000687082 [0,2,0,0,0,0|1,1,0]=4 11831 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000720768_100000687082 [0,2,0,0,0,0|1,1,0]=4 11832 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000720768_100000687082 [0,2,0,0,0,0|1,1,0]=4 11833 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100000720768_100000687082 [0,2,0,0,0,0|1,1,0]=4 11834 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000720768_100000210401 [0,2,0,0,0,0|1,0,0]=3 11835 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000720768_100000210401 [0,2,0,0,0,0|1,0,0]=3 11836 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000720768_100000210401 [0,2,0,0,0,0|1,0,0]=3 11837 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000720768_100000210401 [0,2,0,0,0,0|1,0,0]=3 11838 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)F 11a_100000720768_100000686462 [0,2,0,0,0,0|1,1,0]=4 11839 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100000720768_100000686462 [0,2,0,0,0,0|1,1,0]=4 11840 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100000720768_100000686462 [0,2,0,0,0,0|1,1,0]=4 11841 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)F 527a_100000720768_100000686462 [0,2,0,0,0,0|1,1,0]=4 11842 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)I 11a_100000720768_100000684831 [0,2,0,0,0,0|1,1,0]=4 11843 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100000720768_100000684831 [0,2,0,0,0,0|1,1,0]=4 11844 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100000720768_100000684831 [0,2,0,0,0,0|1,1,0]=4 11845 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)I 527a_100000720768_100000684831 [0,2,0,0,0,0|1,1,0]=4 11846 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000720768_100000212196 [0,2,0,0,0,0|2,0,0]=4 11847 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)Cl)O 527a_100000720768_100000212196 [0,2,0,0,0,0|2,0,0]=4 11848 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Br 11a_100000720768_100000743946 [0,2,0,0,0,0|1,1,0]=4 11849 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Br 1626a_100000720768_100000743946 [0,2,0,0,0,0|1,1,0]=4 11850 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Br 240690a_100000720768_100000743946 [0,2,0,0,0,0|1,1,0]=4 11851 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Br 527a_100000720768_100000743946 [0,2,0,0,0,0|1,1,0]=4 11852 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Cl 11a_100000720768_100000743183 [0,2,0,0,0,0|1,0,0]=3 11853 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100000720768_100000743183 [0,2,0,0,0,0|1,0,0]=3 11854 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100000720768_100000743183 [0,2,0,0,0,0|1,0,0]=3 11855 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)Cl 527a_100000720768_100000743183 [0,2,0,0,0,0|1,0,0]=3 11856 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)F 11a_100000720768_100000209822 [0,2,0,0,0,0|1,1,0]=4 11857 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)F 1626a_100000720768_100000209822 [0,2,0,0,0,0|1,1,0]=4 11858 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)F 240690a_100000720768_100000209822 [0,2,0,0,0,0|1,1,0]=4 11859 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)F 527a_100000720768_100000209822 [0,2,0,0,0,0|1,1,0]=4 11860 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)I 11a_100000720768_100000062624 [0,2,0,0,0,0|1,1,0]=4 11861 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)I 1626a_100000720768_100000062624 [0,2,0,0,0,0|1,1,0]=4 11862 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)I 240690a_100000720768_100000062624 [0,2,0,0,0,0|1,1,0]=4 11863 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)I 527a_100000720768_100000062624 [0,2,0,0,0,0|1,1,0]=4 11864 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)O 240690a_100000720768_100000185466 [0,2,0,0,0,0|2,0,0]=4 11865 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)F)O 527a_100000720768_100000185466 [0,2,0,0,0,0|2,0,0]=4 11866 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Br 11a_100000720768_100012343876 [0,2,0,0,0,0|1,1,0]=4 11867 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Br 1626a_100000720768_100012343876 [0,2,0,0,0,0|1,1,0]=4 11868 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Br 240690a_100000720768_100012343876 [0,2,0,0,0,0|1,1,0]=4 11869 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Br 527a_100000720768_100012343876 [0,2,0,0,0,0|1,1,0]=4 11870 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Cl 11a_100000720768_100000739381 [0,2,0,0,0,0|1,0,0]=3 11871 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100000720768_100000739381 [0,2,0,0,0,0|1,0,0]=3 11872 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100000720768_100000739381 [0,2,0,0,0,0|1,0,0]=3 11873 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)Cl 527a_100000720768_100000739381 [0,2,0,0,0,0|1,0,0]=3 11874 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)F 11a_100000720768_100000688015 [0,2,0,0,0,0|1,1,0]=4 11875 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)F 1626a_100000720768_100000688015 [0,2,0,0,0,0|1,1,0]=4 11876 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)F 240690a_100000720768_100000688015 [0,2,0,0,0,0|1,1,0]=4 11877 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)F 527a_100000720768_100000688015 [0,2,0,0,0,0|1,1,0]=4 11878 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)I 11a_100000720768_100000725830 [0,2,0,0,0,0|1,1,0]=4 11879 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)I 1626a_100000720768_100000725830 [0,2,0,0,0,0|1,1,0]=4 11880 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)I 240690a_100000720768_100000725830 [0,2,0,0,0,0|1,1,0]=4 11881 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)I 527a_100000720768_100000725830 [0,2,0,0,0,0|1,1,0]=4 11882 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)O 1626a_100000720768_100000037485 [0,2,0,0,0,0|2,0,0]=4 11883 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)I)O 240690a_100000720768_100000037485 [0,2,0,0,0,0|2,0,0]=4 11884 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)Br 240690a_100000720768_100000689001 [0,2,0,0,0,0|1,1,0]=4 11885 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)Br 527a_100000720768_100000689001 [0,2,0,0,0,0|1,1,0]=4 11886 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000720768_100011933997 [0,2,0,0,0,0|1,0,0]=3 11887 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)Cl 527a_100000720768_100011933997 [0,2,0,0,0,0|1,0,0]=3 11888 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)F 240690a_100000720768_100000035894 [0,2,0,0,0,0|1,1,0]=4 11889 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)F 527a_100000720768_100000035894 [0,2,0,0,0,0|1,1,0]=4 11890 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)I 1626a_100000720768_100000239334 [0,2,0,0,0,0|1,1,0]=4 11891 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)I 240690a_100000720768_100000239334 [0,2,0,0,0,0|1,1,0]=4 11892 B15R1.1404 N#CCCNC(=O)c1ccc(c(c1)O)I 527a_100000720768_100000239334 [0,2,0,0,0,0|1,1,0]=4 11893 B15R1.1404 NCCOCC(=O)c1ccc(c(c1)F)Cl 34a_100000210304_100012351892 [0,2,0,0,0,0|2,0,0]=4 11894 B15R1.1404 O=C(CC#CCO)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000047223 [0,2,0,0,0,0|1,0,1]=4 11895 B15R1.1404 O=C(CC#CCO)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000047223 [0,2,0,0,0,0|1,0,1]=4 11896 B15R1.1404 O=C(CC#CCO)c1ccc(c(c1)F)Cl 1458a_100000743183_200000047223 [0,2,0,0,0,0|1,0,1]=4 11897 B15R1.1404 O=C(CC#CCO)c1ccc(c(c1)I)Cl 1458a_100000739381_200000047223 [0,2,0,0,0,0|1,0,1]=4 11898 B15R1.1404 O=C(CC#CCO)c1ccc(c(c1)O)Cl 1458a_100011933997_200000047223 [0,2,0,0,0,0|1,0,1]=4 11899 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000729493 [0,2,0,0,0,0|2,0,0]=4 11900 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000729493 [0,2,0,0,0,0|2,0,0]=4 11901 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)F)Cl 1458a_100000743183_100000729493 [0,2,0,0,0,0|2,0,0]=4 11902 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)I)Cl 1458a_100000739381_100000729493 [0,2,0,0,0,0|2,0,0]=4 11903 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100000729493 [0,2,0,0,0,0|2,0,0]=4 11904 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210776 [0,2,0,0,0,0|1,1,0]=4 11905 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210776 [0,2,0,0,0,0|1,0,0]=3 11906 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Br)F 1458a_100000760357_100000210776 [0,2,0,0,0,0|1,1,0]=4 11907 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Br)I 1458a_100000739115_100000210776 [0,2,0,0,0,0|1,1,0]=4 11908 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Br)O 1458a_100000189672_100000210776 [0,2,0,0,0,0|2,0,0]=4 11909 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210776 [0,2,0,0,0,0|1,1,0]=4 11910 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210776 [0,2,0,0,0,0|1,0,0]=3 11911 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210776 [0,2,0,0,0,0|1,1,0]=4 11912 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210776 [0,2,0,0,0,0|1,1,0]=4 11913 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210776 [0,2,0,0,0,0|2,0,0]=4 11914 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)F)Br 1458a_100000743946_100000210776 [0,2,0,0,0,0|1,1,0]=4 11915 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210776 [0,2,0,0,0,0|1,0,0]=3 11916 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)F)F 1458a_100000209822_100000210776 [0,2,0,0,0,0|1,1,0]=4 11917 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)F)I 1458a_100000062624_100000210776 [0,2,0,0,0,0|1,1,0]=4 11918 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)F)O 1458a_100000185466_100000210776 [0,2,0,0,0,0|2,0,0]=4 11919 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)I)Br 1458a_100012343876_100000210776 [0,2,0,0,0,0|1,1,0]=4 11920 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210776 [0,2,0,0,0,0|1,0,0]=3 11921 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)I)F 1458a_100000688015_100000210776 [0,2,0,0,0,0|1,1,0]=4 11922 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)I)I 1458a_100000725830_100000210776 [0,2,0,0,0,0|1,1,0]=4 11923 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)I)O 1458a_100000037485_100000210776 [0,2,0,0,0,0|2,0,0]=4 11924 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)Br 1458a_100000689001_100000210776 [0,2,0,0,0,0|1,1,0]=4 11925 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210776 [0,2,0,0,0,0|1,0,0]=3 11926 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)F 1458a_100000035894_100000210776 [0,2,0,0,0,0|1,1,0]=4 11927 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)I 1458a_100000239334_100000210776 [0,2,0,0,0,0|1,1,0]=4 11928 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)O 1458a_100000212155_100000210776 [0,2,0,0,0,0|2,0,0]=4 11929 B15R1.1404 O=C(CCSCF)c1ccc(c(c1)Cl)Cl 62a_100012356702_100015361967 [0,2,0,0,0,0|2,0,0]=4 11930 B15R1.1404 O=C(CCSCF)c1ccc(c(c1)Cl)Cl 62a_100015361967_100012356702 [0,2,0,0,0,0|2,0,0]=4 11931 B15R1.1404 O=C(CNCCF)c1ccc(c(c1)Br)F 34a_100000724931_100011217175 [0,2,0,0,0,0|1,1,0]=4 11932 B15R1.1404 O=C(CNCCF)c1ccc(c(c1)Cl)Br 34a_100000724931_200012349649 [0,2,0,0,0,0|1,1,0]=4 11933 B15R1.1404 O=C(CNCCF)c1ccc(c(c1)Cl)F 34a_100000724931_100000757878 [0,2,0,0,0,0|1,1,0]=4 11934 B15R1.1404 O=C(CNCCF)c1ccc(c(c1)F)Br 34a_100000724931_100012361357 [0,2,0,0,0,0|1,1,0]=4 11935 B15R1.1404 O=C(CNCCF)c1ccc(c(c1)F)Cl 34a_100000724931_100012351892 [0,2,0,0,0,0|1,0,0]=3 11936 B15R1.1404 O=C(CNCCF)c1ccc(c(c1)F)F 34a_100000724931_100000183380 [0,2,0,0,0,0|1,1,0]=4 11937 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Br)F 2230a_100016997473_100011217175 [0,2,0,0,0,0|0,1,0]=3 11938 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Br)F 34a_100016990907_100011217175 [0,2,0,0,0,0|0,1,0]=3 11939 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Cl)Br 2230a_100016997473_200012349649 [0,2,0,0,0,0|0,1,0]=3 11940 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Cl)Br 34a_100016990907_200012349649 [0,2,0,0,0,0|0,1,0]=3 11941 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Cl)Cl 2230a_100016997473_100000211430 [0,2,0,0,0,0|0,0,0]=2 11942 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Cl)F 2230a_100016997473_100000757878 [0,2,0,0,0,0|0,1,0]=3 11943 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)Cl)F 34a_100016990907_100000757878 [0,2,0,0,0,0|0,1,0]=3 11944 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)F)Br 2230a_100016997473_100012361357 [0,2,0,0,0,0|0,1,0]=3 11945 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)F)Br 34a_100016990907_100012361357 [0,2,0,0,0,0|0,1,0]=3 11946 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)F)Cl 2230a_100016997473_100012351892 [0,2,0,0,0,0|0,0,0]=2 11947 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)F)Cl 34a_100016990907_100012351892 [0,2,0,0,0,0|0,0,0]=2 11948 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)F)F 2230a_100016997473_100000183380 [0,2,0,0,0,0|0,1,0]=3 11949 B15R1.1404 O=C(CNCCO)c1ccc(c(c1)F)F 34a_100016990907_100000183380 [0,2,0,0,0,0|0,1,0]=3 11950 B15R1.1404 O=C(COCCBr)c1ccc(c(c1)F)Cl 34a_100000211926_100012351892 [0,2,0,0,0,0|2,0,0]=4 11951 B15R1.1404 O=C(COCCF)c1ccc(c(c1)Cl)Cl 7a_100000246375_100011217306 [0,2,0,0,0,0|2,0,0]=4 11952 B15R1.1404 O=C(COCCO)c1ccc(c(c1)Cl)Cl 7a_100000246375_100000211926 [0,2,0,0,0,0|1,0,0]=3 11953 B15R1.1404 O=C(CSCCF)c1ccc(c(c1)Cl)Cl 62a_100000211430_100011217306 [0,2,0,0,0,0|2,0,0]=4 11954 B15R1.1404 O=C(CSCCF)c1ccc(c(c1)Cl)Cl 62a_100011217306_100000211430 [0,2,0,0,0,0|2,0,0]=4 11955 B15R1.1404 O=C(CSCCF)c1ccc(c(c1)F)Cl 62a_100011217306_100012351892 [0,2,0,0,0,0|2,0,0]=4 11956 B15R1.1404 O=C(CSCCF)c1ccc(c(c1)F)Cl 62a_100012351892_100011217306 [0,2,0,0,0,0|2,0,0]=4 11957 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Br)F 62a_100000211926_100011217175 [0,2,0,0,0,0|1,1,0]=4 11958 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Br)F 62a_100011217175_100000211926 [0,2,0,0,0,0|1,1,0]=4 11959 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)Br 62a_100000211926_200012349649 [0,2,0,0,0,0|1,1,0]=4 11960 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)Br 62a_200012349649_100000211926 [0,2,0,0,0,0|1,1,0]=4 11961 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)Cl 62a_100000211430_100000211926 [0,2,0,0,0,0|1,0,0]=3 11962 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)Cl 62a_100000211926_100000211430 [0,2,0,0,0,0|1,0,0]=3 11963 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)F 62a_100000211926_100000757878 [0,2,0,0,0,0|1,1,0]=4 11964 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)F 62a_100000757878_100000211926 [0,2,0,0,0,0|1,1,0]=4 11965 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)O 62a_100000211926_200010170092 [0,2,0,0,0,0|2,0,0]=4 11966 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)Cl)O 62a_200010170092_100000211926 [0,2,0,0,0,0|2,0,0]=4 11967 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)F)Br 62a_100000211926_100012361357 [0,2,0,0,0,0|1,1,0]=4 11968 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)F)Br 62a_100012361357_100000211926 [0,2,0,0,0,0|1,1,0]=4 11969 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)F)Cl 62a_100000211926_100012351892 [0,2,0,0,0,0|1,0,0]=3 11970 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)F)Cl 62a_100012351892_100000211926 [0,2,0,0,0,0|1,0,0]=3 11971 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)F)F 62a_100000183380_100000211926 [0,2,0,0,0,0|1,1,0]=4 11972 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)F)F 62a_100000211926_100000183380 [0,2,0,0,0,0|1,1,0]=4 11973 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)O)O 62a_100000211926_100000183813 [0,2,0,0,0,0|2,0,0]=4 11974 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Br 11a_100015189416_100012339404 [0,2,0,0,0,0|1,1,0]=4 11975 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Br 1626a_100015189416_100012339404 [0,2,0,0,0,0|1,1,0]=4 11976 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Br 240690a_100015189416_100012339404 [0,2,0,0,0,0|1,1,0]=4 11977 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Br 527a_100015189416_100012339404 [0,2,0,0,0,0|1,1,0]=4 11978 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Cl 11a_100015189416_100000691181 [0,2,0,0,0,0|1,0,0]=3 11979 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Cl 1626a_100015189416_100000691181 [0,2,0,0,0,0|1,0,0]=3 11980 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Cl 240690a_100015189416_100000691181 [0,2,0,0,0,0|1,0,0]=3 11981 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)Cl 527a_100015189416_100000691181 [0,2,0,0,0,0|1,0,0]=3 11982 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)F 11a_100015189416_100000760357 [0,2,0,0,0,0|1,1,0]=4 11983 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)F 1626a_100015189416_100000760357 [0,2,0,0,0,0|1,1,0]=4 11984 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)F 240690a_100015189416_100000760357 [0,2,0,0,0,0|1,1,0]=4 11985 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)F 527a_100015189416_100000760357 [0,2,0,0,0,0|1,1,0]=4 11986 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)I 11a_100015189416_100000739115 [0,2,0,0,0,0|1,1,0]=4 11987 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)I 1626a_100015189416_100000739115 [0,2,0,0,0,0|1,1,0]=4 11988 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)I 240690a_100015189416_100000739115 [0,2,0,0,0,0|1,1,0]=4 11989 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)I 527a_100015189416_100000739115 [0,2,0,0,0,0|1,1,0]=4 11990 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)O 240690a_100015189416_100000189672 [0,2,0,0,0,0|2,0,0]=4 11991 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Br 11a_100015189416_100000687082 [0,2,0,0,0,0|1,1,0]=4 11992 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Br 1626a_100015189416_100000687082 [0,2,0,0,0,0|1,1,0]=4 11993 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Br 240690a_100015189416_100000687082 [0,2,0,0,0,0|1,1,0]=4 11994 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Br 527a_100015189416_100000687082 [0,2,0,0,0,0|1,1,0]=4 11995 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Cl 11a_100015189416_100000210401 [0,2,0,0,0,0|1,0,0]=3 11996 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Cl 1626a_100015189416_100000210401 [0,2,0,0,0,0|1,0,0]=3 11997 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Cl 240690a_100015189416_100000210401 [0,2,0,0,0,0|1,0,0]=3 11998 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)Cl 527a_100015189416_100000210401 [0,2,0,0,0,0|1,0,0]=3 11999 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)F 11a_100015189416_100000686462 [0,2,0,0,0,0|1,1,0]=4 12000 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)F 1626a_100015189416_100000686462 [0,2,0,0,0,0|1,1,0]=4 12001 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)F 240690a_100015189416_100000686462 [0,2,0,0,0,0|1,1,0]=4 12002 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)F 527a_100015189416_100000686462 [0,2,0,0,0,0|1,1,0]=4 12003 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)I 11a_100015189416_100000684831 [0,2,0,0,0,0|1,1,0]=4 12004 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)I 1626a_100015189416_100000684831 [0,2,0,0,0,0|1,1,0]=4 12005 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)I 240690a_100015189416_100000684831 [0,2,0,0,0,0|1,1,0]=4 12006 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)I 527a_100015189416_100000684831 [0,2,0,0,0,0|1,1,0]=4 12007 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)O 240690a_100015189416_100000212196 [0,2,0,0,0,0|2,0,0]=4 12008 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)O 527a_100015189416_100000212196 [0,2,0,0,0,0|2,0,0]=4 12009 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Br 11a_100015189416_100000743946 [0,2,0,0,0,0|1,1,0]=4 12010 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Br 1626a_100015189416_100000743946 [0,2,0,0,0,0|1,1,0]=4 12011 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Br 240690a_100015189416_100000743946 [0,2,0,0,0,0|1,1,0]=4 12012 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Br 527a_100015189416_100000743946 [0,2,0,0,0,0|1,1,0]=4 12013 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Cl 11a_100015189416_100000743183 [0,2,0,0,0,0|1,0,0]=3 12014 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Cl 1626a_100015189416_100000743183 [0,2,0,0,0,0|1,0,0]=3 12015 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Cl 240690a_100015189416_100000743183 [0,2,0,0,0,0|1,0,0]=3 12016 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)Cl 527a_100015189416_100000743183 [0,2,0,0,0,0|1,0,0]=3 12017 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)F 11a_100015189416_100000209822 [0,2,0,0,0,0|1,1,0]=4 12018 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)F 1626a_100015189416_100000209822 [0,2,0,0,0,0|1,1,0]=4 12019 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)F 240690a_100015189416_100000209822 [0,2,0,0,0,0|1,1,0]=4 12020 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)F 527a_100015189416_100000209822 [0,2,0,0,0,0|1,1,0]=4 12021 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)I 11a_100015189416_100000062624 [0,2,0,0,0,0|1,1,0]=4 12022 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)I 1626a_100015189416_100000062624 [0,2,0,0,0,0|1,1,0]=4 12023 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)I 240690a_100015189416_100000062624 [0,2,0,0,0,0|1,1,0]=4 12024 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)I 527a_100015189416_100000062624 [0,2,0,0,0,0|1,1,0]=4 12025 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)O 240690a_100015189416_100000185466 [0,2,0,0,0,0|2,0,0]=4 12026 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)O 527a_100015189416_100000185466 [0,2,0,0,0,0|2,0,0]=4 12027 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Br 11a_100015189416_100012343876 [0,2,0,0,0,0|1,1,0]=4 12028 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Br 1626a_100015189416_100012343876 [0,2,0,0,0,0|1,1,0]=4 12029 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Br 240690a_100015189416_100012343876 [0,2,0,0,0,0|1,1,0]=4 12030 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Br 527a_100015189416_100012343876 [0,2,0,0,0,0|1,1,0]=4 12031 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Cl 11a_100015189416_100000739381 [0,2,0,0,0,0|1,0,0]=3 12032 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Cl 1626a_100015189416_100000739381 [0,2,0,0,0,0|1,0,0]=3 12033 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Cl 240690a_100015189416_100000739381 [0,2,0,0,0,0|1,0,0]=3 12034 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)Cl 527a_100015189416_100000739381 [0,2,0,0,0,0|1,0,0]=3 12035 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)F 11a_100015189416_100000688015 [0,2,0,0,0,0|1,1,0]=4 12036 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)F 1626a_100015189416_100000688015 [0,2,0,0,0,0|1,1,0]=4 12037 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)F 240690a_100015189416_100000688015 [0,2,0,0,0,0|1,1,0]=4 12038 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)F 527a_100015189416_100000688015 [0,2,0,0,0,0|1,1,0]=4 12039 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)I 11a_100015189416_100000725830 [0,2,0,0,0,0|1,1,0]=4 12040 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)I 1626a_100015189416_100000725830 [0,2,0,0,0,0|1,1,0]=4 12041 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)I 240690a_100015189416_100000725830 [0,2,0,0,0,0|1,1,0]=4 12042 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)I 527a_100015189416_100000725830 [0,2,0,0,0,0|1,1,0]=4 12043 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)O 1626a_100015189416_100000037485 [0,2,0,0,0,0|2,0,0]=4 12044 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)O 240690a_100015189416_100000037485 [0,2,0,0,0,0|2,0,0]=4 12045 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Br 240690a_100015189416_100000689001 [0,2,0,0,0,0|1,1,0]=4 12046 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Br 527a_100015189416_100000689001 [0,2,0,0,0,0|1,1,0]=4 12047 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Cl 240690a_100015189416_100011933997 [0,2,0,0,0,0|1,0,0]=3 12048 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Cl 527a_100015189416_100011933997 [0,2,0,0,0,0|1,0,0]=3 12049 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)F 240690a_100015189416_100000035894 [0,2,0,0,0,0|1,1,0]=4 12050 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)F 527a_100015189416_100000035894 [0,2,0,0,0,0|1,1,0]=4 12051 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)I 1626a_100015189416_100000239334 [0,2,0,0,0,0|1,1,0]=4 12052 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)I 240690a_100015189416_100000239334 [0,2,0,0,0,0|1,1,0]=4 12053 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)I 527a_100015189416_100000239334 [0,2,0,0,0,0|1,1,0]=4 12054 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)Br 240690a_100000182051_100012339404 [0,2,0,0,0,0|0,1,0]=3 12055 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)Br 527a_100000182051_100012339404 [0,2,0,0,0,0|0,1,0]=3 12056 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)Cl 240690a_100000182051_100000691181 [0,2,0,0,0,0|0,0,0]=2 12057 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)Cl 527a_100000182051_100000691181 [0,2,0,0,0,0|0,0,0]=2 12058 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)F 240690a_100000182051_100000760357 [0,2,0,0,0,0|0,1,0]=3 12059 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)F 527a_100000182051_100000760357 [0,2,0,0,0,0|0,1,0]=3 12060 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)I 240690a_100000182051_100000739115 [0,2,0,0,0,0|0,1,0]=3 12061 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)I 527a_100000182051_100000739115 [0,2,0,0,0,0|0,1,0]=3 12062 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)O 240690a_100000182051_100000189672 [0,2,0,0,0,0|1,0,0]=3 12063 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)Br 240690a_100000182051_100000687082 [0,2,0,0,0,0|0,1,0]=3 12064 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)Br 527a_100000182051_100000687082 [0,2,0,0,0,0|0,1,0]=3 12065 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)Cl 240690a_100000182051_100000210401 [0,2,0,0,0,0|0,0,0]=2 12066 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)Cl 527a_100000182051_100000210401 [0,2,0,0,0,0|0,0,0]=2 12067 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)F 240690a_100000182051_100000686462 [0,2,0,0,0,0|0,1,0]=3 12068 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)F 527a_100000182051_100000686462 [0,2,0,0,0,0|0,1,0]=3 12069 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)I 240690a_100000182051_100000684831 [0,2,0,0,0,0|0,1,0]=3 12070 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)I 527a_100000182051_100000684831 [0,2,0,0,0,0|0,1,0]=3 12071 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)O 240690a_100000182051_100000212196 [0,2,0,0,0,0|1,0,0]=3 12072 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)O 527a_100000182051_100000212196 [0,2,0,0,0,0|1,0,0]=3 12073 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)Br 240690a_100000182051_100000743946 [0,2,0,0,0,0|0,1,0]=3 12074 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)Br 527a_100000182051_100000743946 [0,2,0,0,0,0|0,1,0]=3 12075 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)Cl 240690a_100000182051_100000743183 [0,2,0,0,0,0|0,0,0]=2 12076 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)Cl 527a_100000182051_100000743183 [0,2,0,0,0,0|0,0,0]=2 12077 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)F 240690a_100000182051_100000209822 [0,2,0,0,0,0|0,1,0]=3 12078 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)F 527a_100000182051_100000209822 [0,2,0,0,0,0|0,1,0]=3 12079 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)I 240690a_100000182051_100000062624 [0,2,0,0,0,0|0,1,0]=3 12080 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)I 527a_100000182051_100000062624 [0,2,0,0,0,0|0,1,0]=3 12081 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)O 240690a_100000182051_100000185466 [0,2,0,0,0,0|1,0,0]=3 12082 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)O 527a_100000182051_100000185466 [0,2,0,0,0,0|1,0,0]=3 12083 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)Br 240690a_100000182051_100012343876 [0,2,0,0,0,0|0,1,0]=3 12084 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)Br 527a_100000182051_100012343876 [0,2,0,0,0,0|0,1,0]=3 12085 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)Cl 240690a_100000182051_100000739381 [0,2,0,0,0,0|0,0,0]=2 12086 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)Cl 527a_100000182051_100000739381 [0,2,0,0,0,0|0,0,0]=2 12087 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)F 240690a_100000182051_100000688015 [0,2,0,0,0,0|0,1,0]=3 12088 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)F 527a_100000182051_100000688015 [0,2,0,0,0,0|0,1,0]=3 12089 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)I 240690a_100000182051_100000725830 [0,2,0,0,0,0|0,1,0]=3 12090 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)I 527a_100000182051_100000725830 [0,2,0,0,0,0|0,1,0]=3 12091 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)O 240690a_100000182051_100000037485 [0,2,0,0,0,0|1,0,0]=3 12092 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Br 240690a_100000182051_100000689001 [0,2,0,0,0,0|0,1,0]=3 12093 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Br 527a_100000182051_100000689001 [0,2,0,0,0,0|0,1,0]=3 12094 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Cl 240690a_100000182051_100011933997 [0,2,0,0,0,0|0,0,0]=2 12095 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Cl 527a_100000182051_100011933997 [0,2,0,0,0,0|0,0,0]=2 12096 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)F 240690a_100000182051_100000035894 [0,2,0,0,0,0|0,1,0]=3 12097 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)F 527a_100000182051_100000035894 [0,2,0,0,0,0|0,1,0]=3 12098 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)I 240690a_100000182051_100000239334 [0,2,0,0,0,0|0,1,0]=3 12099 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)I 527a_100000182051_100000239334 [0,2,0,0,0,0|0,1,0]=3 12100 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Br)Br 22a_100000210001_100012339404 [0,2,0,0,0,0|0,1,0]=3 12101 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Br)Cl 22a_100000210001_100000691181 [0,2,0,0,0,0|0,0,0]=2 12102 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Br)F 22a_100000210001_100000760357 [0,2,0,0,0,0|0,1,0]=3 12103 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Br)I 22a_100000210001_100000739115 [0,2,0,0,0,0|0,1,0]=3 12104 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Br)O 22a_100000210001_100000189672 [0,2,0,0,0,0|1,0,0]=3 12105 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Cl)Br 22a_100000210001_100000687082 [0,2,0,0,0,0|0,1,0]=3 12106 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Cl)Cl 22a_100000210001_100000210401 [0,2,0,0,0,0|0,0,0]=2 12107 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Cl)F 22a_100000210001_100000686462 [0,2,0,0,0,0|0,1,0]=3 12108 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Cl)I 22a_100000210001_100000684831 [0,2,0,0,0,0|0,1,0]=3 12109 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)Cl)O 22a_100000210001_100000212196 [0,2,0,0,0,0|1,0,0]=3 12110 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)F)Br 22a_100000210001_100000743946 [0,2,0,0,0,0|0,1,0]=3 12111 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)F)Cl 22a_100000210001_100000743183 [0,2,0,0,0,0|0,0,0]=2 12112 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)F)F 22a_100000210001_100000209822 [0,2,0,0,0,0|0,1,0]=3 12113 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)F)I 22a_100000210001_100000062624 [0,2,0,0,0,0|0,1,0]=3 12114 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)F)O 22a_100000210001_100000185466 [0,2,0,0,0,0|1,0,0]=3 12115 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)I)Br 22a_100000210001_100012343876 [0,2,0,0,0,0|0,1,0]=3 12116 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)I)Cl 22a_100000210001_100000739381 [0,2,0,0,0,0|0,0,0]=2 12117 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)I)F 22a_100000210001_100000688015 [0,2,0,0,0,0|0,1,0]=3 12118 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)I)I 22a_100000210001_100000725830 [0,2,0,0,0,0|0,1,0]=3 12119 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)I)O 22a_100000210001_100000037485 [0,2,0,0,0,0|1,0,0]=3 12120 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)O)Br 22a_100000210001_100000689001 [0,2,0,0,0,0|0,1,0]=3 12121 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)O)Cl 22a_100000210001_100011933997 [0,2,0,0,0,0|0,0,0]=2 12122 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)O)F 22a_100000210001_100000035894 [0,2,0,0,0,0|0,1,0]=3 12123 B15R1.1404 O=C(NNCCO)c1ccc(c(c1)O)I 22a_100000210001_100000239334 [0,2,0,0,0,0|0,1,0]=3 12124 B15R1.3309 C#CCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000731252 [0,2,0,0,0,0|2,0,0]=4 12125 B15R1.3309 C#CCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000731252 [0,2,0,0,0,0|2,0,0]=4 12126 B15R1.3309 C#CCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000731252 [0,2,0,0,0,0|2,0,0]=4 12127 B15R1.3309 C#CCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000731252 [0,2,0,0,0,0|2,0,0]=4 12128 B15R1.3309 C#CCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000731252 [0,2,0,0,0,0|2,0,0]=4 12129 B15R1.3309 C#CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000731252 [0,2,0,0,0,0|2,0,0]=4 12130 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Br 11a_100000755551_100000762965 [0,2,0,0,0,0|1,1,0]=4 12131 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Br 1626a_100000755551_100000762965 [0,2,0,0,0,0|1,1,0]=4 12132 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Br 240690a_100000755551_100000762965 [0,2,0,0,0,0|1,1,0]=4 12133 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Br 527a_100000755551_100000762965 [0,2,0,0,0,0|1,1,0]=4 12134 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)C 11a_100000755551_100000685072 [0,2,0,0,0,0|2,0,0]=4 12135 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)C 1626a_100000755551_100000685072 [0,2,0,0,0,0|2,0,0]=4 12136 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)C 240690a_100000755551_100000685072 [0,2,0,0,0,0|2,0,0]=4 12137 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)C 527a_100000755551_100000685072 [0,2,0,0,0,0|2,0,0]=4 12138 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Cl 11a_100000755551_100000766353 [0,2,0,0,0,0|1,0,0]=3 12139 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000755551_100000766353 [0,2,0,0,0,0|1,0,0]=3 12140 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000755551_100000766353 [0,2,0,0,0,0|1,0,0]=3 12141 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)Cl 527a_100000755551_100000766353 [0,2,0,0,0,0|1,0,0]=3 12142 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)F 11a_100000755551_100000212304 [0,2,0,0,0,0|1,1,0]=4 12143 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)F 1626a_100000755551_100000212304 [0,2,0,0,0,0|1,1,0]=4 12144 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)F 240690a_100000755551_100000212304 [0,2,0,0,0,0|1,1,0]=4 12145 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)F 527a_100000755551_100000212304 [0,2,0,0,0,0|1,1,0]=4 12146 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)I 11a_100000755551_100012360512 [0,2,0,0,0,0|1,1,0]=4 12147 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)I 1626a_100000755551_100012360512 [0,2,0,0,0,0|1,1,0]=4 12148 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)I 240690a_100000755551_100012360512 [0,2,0,0,0,0|1,1,0]=4 12149 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)I 527a_100000755551_100012360512 [0,2,0,0,0,0|1,1,0]=4 12150 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)O 240690a_100000755551_100012344906 [0,2,0,0,0,0|2,0,0]=4 12151 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Br)O 527a_100000755551_100012344906 [0,2,0,0,0,0|2,0,0]=4 12152 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Br 11a_100000755551_100000741311 [0,2,0,0,0,0|1,1,0]=4 12153 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Br 1626a_100000755551_100000741311 [0,2,0,0,0,0|1,1,0]=4 12154 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Br 240690a_100000755551_100000741311 [0,2,0,0,0,0|1,1,0]=4 12155 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Br 527a_100000755551_100000741311 [0,2,0,0,0,0|1,1,0]=4 12156 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)C 11a_100000755551_100000211164 [0,2,0,0,0,0|2,0,0]=4 12157 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)C 1626a_100000755551_100000211164 [0,2,0,0,0,0|2,0,0]=4 12158 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)C 240690a_100000755551_100000211164 [0,2,0,0,0,0|2,0,0]=4 12159 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)C 527a_100000755551_100000211164 [0,2,0,0,0,0|2,0,0]=4 12160 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Cl 11a_100000755551_100000688705 [0,2,0,0,0,0|1,0,0]=3 12161 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Cl 1626a_100000755551_100000688705 [0,2,0,0,0,0|1,0,0]=3 12162 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Cl 240690a_100000755551_100000688705 [0,2,0,0,0,0|1,0,0]=3 12163 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)Cl 527a_100000755551_100000688705 [0,2,0,0,0,0|1,0,0]=3 12164 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)F 11a_100000755551_100000686989 [0,2,0,0,0,0|1,1,0]=4 12165 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)F 1626a_100000755551_100000686989 [0,2,0,0,0,0|1,1,0]=4 12166 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)F 240690a_100000755551_100000686989 [0,2,0,0,0,0|1,1,0]=4 12167 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)F 527a_100000755551_100000686989 [0,2,0,0,0,0|1,1,0]=4 12168 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)I 11a_100000755551_100010189873 [0,2,0,0,0,0|1,1,0]=4 12169 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)I 1626a_100000755551_100010189873 [0,2,0,0,0,0|1,1,0]=4 12170 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)I 240690a_100000755551_100010189873 [0,2,0,0,0,0|1,1,0]=4 12171 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)I 527a_100000755551_100010189873 [0,2,0,0,0,0|1,1,0]=4 12172 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)O 240690a_100000755551_100000692822 [0,2,0,0,0,0|2,0,0]=4 12173 B15R1.3309 C#CCCNC(=O)c1ccc(cc1C)O 527a_100000755551_100000692822 [0,2,0,0,0,0|2,0,0]=4 12174 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Br 11a_100000755551_100000741628 [0,2,0,0,0,0|1,1,0]=4 12175 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000755551_100000741628 [0,2,0,0,0,0|1,1,0]=4 12176 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000755551_100000741628 [0,2,0,0,0,0|1,1,0]=4 12177 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Br 527a_100000755551_100000741628 [0,2,0,0,0,0|1,1,0]=4 12178 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)C 11a_100000755551_100000766932 [0,2,0,0,0,0|2,0,0]=4 12179 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)C 1626a_100000755551_100000766932 [0,2,0,0,0,0|2,0,0]=4 12180 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)C 240690a_100000755551_100000766932 [0,2,0,0,0,0|2,0,0]=4 12181 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)C 527a_100000755551_100000766932 [0,2,0,0,0,0|2,0,0]=4 12182 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000755551_100000185840 [0,2,0,0,0,0|1,0,0]=3 12183 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000755551_100000185840 [0,2,0,0,0,0|1,0,0]=3 12184 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000755551_100000185840 [0,2,0,0,0,0|1,0,0]=3 12185 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000755551_100000185840 [0,2,0,0,0,0|1,0,0]=3 12186 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)F 11a_100000755551_100000211397 [0,2,0,0,0,0|1,1,0]=4 12187 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)F 1626a_100000755551_100000211397 [0,2,0,0,0,0|1,1,0]=4 12188 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)F 240690a_100000755551_100000211397 [0,2,0,0,0,0|1,1,0]=4 12189 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)F 527a_100000755551_100000211397 [0,2,0,0,0,0|1,1,0]=4 12190 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)I 11a_100000755551_100000751301 [0,2,0,0,0,0|1,1,0]=4 12191 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)I 1626a_100000755551_100000751301 [0,2,0,0,0,0|1,1,0]=4 12192 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)I 240690a_100000755551_100000751301 [0,2,0,0,0,0|1,1,0]=4 12193 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)I 527a_100000755551_100000751301 [0,2,0,0,0,0|1,1,0]=4 12194 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)O 240690a_100000755551_100000702456 [0,2,0,0,0,0|2,0,0]=4 12195 B15R1.3309 C#CCCNC(=O)c1ccc(cc1Cl)O 527a_100000755551_100000702456 [0,2,0,0,0,0|2,0,0]=4 12196 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Br 11a_100000755551_100000214689 [0,2,0,0,0,0|1,1,0]=4 12197 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Br 1626a_100000755551_100000214689 [0,2,0,0,0,0|1,1,0]=4 12198 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Br 240690a_100000755551_100000214689 [0,2,0,0,0,0|1,1,0]=4 12199 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Br 527a_100000755551_100000214689 [0,2,0,0,0,0|1,1,0]=4 12200 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)C 11a_100000755551_100000766033 [0,2,0,0,0,0|2,0,0]=4 12201 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)C 1626a_100000755551_100000766033 [0,2,0,0,0,0|2,0,0]=4 12202 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)C 240690a_100000755551_100000766033 [0,2,0,0,0,0|2,0,0]=4 12203 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)C 527a_100000755551_100000766033 [0,2,0,0,0,0|2,0,0]=4 12204 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Cl 11a_100000755551_100000212326 [0,2,0,0,0,0|1,0,0]=3 12205 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Cl 1626a_100000755551_100000212326 [0,2,0,0,0,0|1,0,0]=3 12206 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Cl 240690a_100000755551_100000212326 [0,2,0,0,0,0|1,0,0]=3 12207 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)Cl 527a_100000755551_100000212326 [0,2,0,0,0,0|1,0,0]=3 12208 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)F 11a_100000755551_100000211022 [0,2,0,0,0,0|1,1,0]=4 12209 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)F 1626a_100000755551_100000211022 [0,2,0,0,0,0|1,1,0]=4 12210 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)F 240690a_100000755551_100000211022 [0,2,0,0,0,0|1,1,0]=4 12211 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)F 527a_100000755551_100000211022 [0,2,0,0,0,0|1,1,0]=4 12212 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)I 11a_100000755551_100000037189 [0,2,0,0,0,0|1,1,0]=4 12213 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)I 1626a_100000755551_100000037189 [0,2,0,0,0,0|1,1,0]=4 12214 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)I 240690a_100000755551_100000037189 [0,2,0,0,0,0|1,1,0]=4 12215 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)I 527a_100000755551_100000037189 [0,2,0,0,0,0|1,1,0]=4 12216 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)O 240690a_100000755551_100000689029 [0,2,0,0,0,0|2,0,0]=4 12217 B15R1.3309 C#CCCNC(=O)c1ccc(cc1F)O 527a_100000755551_100000689029 [0,2,0,0,0,0|2,0,0]=4 12218 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Br 11a_100000755551_100000751167 [0,2,0,0,0,0|1,1,0]=4 12219 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Br 1626a_100000755551_100000751167 [0,2,0,0,0,0|1,1,0]=4 12220 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Br 240690a_100000755551_100000751167 [0,2,0,0,0,0|1,1,0]=4 12221 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Br 527a_100000755551_100000751167 [0,2,0,0,0,0|1,1,0]=4 12222 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)C 11a_100000755551_100009999607 [0,2,0,0,0,0|2,0,0]=4 12223 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)C 1626a_100000755551_100009999607 [0,2,0,0,0,0|2,0,0]=4 12224 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)C 240690a_100000755551_100009999607 [0,2,0,0,0,0|2,0,0]=4 12225 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)C 527a_100000755551_100009999607 [0,2,0,0,0,0|2,0,0]=4 12226 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Cl 11a_100000755551_100000739380 [0,2,0,0,0,0|1,0,0]=3 12227 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Cl 1626a_100000755551_100000739380 [0,2,0,0,0,0|1,0,0]=3 12228 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Cl 240690a_100000755551_100000739380 [0,2,0,0,0,0|1,0,0]=3 12229 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)Cl 527a_100000755551_100000739380 [0,2,0,0,0,0|1,0,0]=3 12230 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)F 11a_100000755551_100000739341 [0,2,0,0,0,0|1,1,0]=4 12231 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)F 1626a_100000755551_100000739341 [0,2,0,0,0,0|1,1,0]=4 12232 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)F 240690a_100000755551_100000739341 [0,2,0,0,0,0|1,1,0]=4 12233 B15R1.3309 C#CCCNC(=O)c1ccc(cc1I)F 527a_100000755551_100000739341 [0,2,0,0,0,0|1,1,0]=4 12234 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Br 240690a_100000755551_100000744433 [0,2,0,0,0,0|1,1,0]=4 12235 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Br 527a_100000755551_100000744433 [0,2,0,0,0,0|1,1,0]=4 12236 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)C 1626a_100000755551_100000212137 [0,2,0,0,0,0|2,0,0]=4 12237 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)C 240690a_100000755551_100000212137 [0,2,0,0,0,0|2,0,0]=4 12238 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)C 527a_100000755551_100000212137 [0,2,0,0,0,0|2,0,0]=4 12239 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Cl 11a_100000755551_100000188622 [0,2,0,0,0,0|1,0,0]=3 12240 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Cl 240690a_100000755551_100000188622 [0,2,0,0,0,0|1,0,0]=3 12241 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)Cl 527a_100000755551_100000188622 [0,2,0,0,0,0|1,0,0]=3 12242 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)F 240690a_100000755551_100000746061 [0,2,0,0,0,0|1,1,0]=4 12243 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)F 527a_100000755551_100000746061 [0,2,0,0,0,0|1,1,0]=4 12244 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)I 240690a_100000755551_100000091984 [0,2,0,0,0,0|1,1,0]=4 12245 B15R1.3309 C#CCCNC(=O)c1ccc(cc1O)I 527a_100000755551_100000091984 [0,2,0,0,0,0|1,1,0]=4 12246 B15R1.3309 C#CCNCC(=O)c1ccc(cc1F)Cl 34a_100000212058_100012351891 [0,2,0,0,0,0|1,0,1]=4 12247 B15R1.3309 C=CCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000757094 [0,2,0,0,0,0|2,0,0]=4 12248 B15R1.3309 C=CCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000757094 [0,2,0,0,0,0|2,0,0]=4 12249 B15R1.3309 C=CCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000757094 [0,2,0,0,0,0|2,0,0]=4 12250 B15R1.3309 C=CCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000757094 [0,2,0,0,0,0|2,0,0]=4 12251 B15R1.3309 C=CCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000757094 [0,2,0,0,0,0|2,0,0]=4 12252 B15R1.3309 C=CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000757094 [0,2,0,0,0,0|2,0,0]=4 12253 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Br 11a_100015191253_100000762965 [0,2,0,0,0,0|1,1,0]=4 12254 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Br 1626a_100015191253_100000762965 [0,2,0,0,0,0|1,1,0]=4 12255 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Br 240690a_100015191253_100000762965 [0,2,0,0,0,0|1,1,0]=4 12256 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Br 527a_100015191253_100000762965 [0,2,0,0,0,0|1,1,0]=4 12257 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)C 11a_100015191253_100000685072 [0,2,0,0,0,0|2,0,0]=4 12258 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)C 1626a_100015191253_100000685072 [0,2,0,0,0,0|2,0,0]=4 12259 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)C 240690a_100015191253_100000685072 [0,2,0,0,0,0|2,0,0]=4 12260 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)C 527a_100015191253_100000685072 [0,2,0,0,0,0|2,0,0]=4 12261 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Cl 11a_100015191253_100000766353 [0,2,0,0,0,0|1,0,0]=3 12262 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Cl 1626a_100015191253_100000766353 [0,2,0,0,0,0|1,0,0]=3 12263 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Cl 240690a_100015191253_100000766353 [0,2,0,0,0,0|1,0,0]=3 12264 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)Cl 527a_100015191253_100000766353 [0,2,0,0,0,0|1,0,0]=3 12265 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)F 11a_100015191253_100000212304 [0,2,0,0,0,0|1,1,0]=4 12266 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)F 1626a_100015191253_100000212304 [0,2,0,0,0,0|1,1,0]=4 12267 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)F 240690a_100015191253_100000212304 [0,2,0,0,0,0|1,1,0]=4 12268 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)F 527a_100015191253_100000212304 [0,2,0,0,0,0|1,1,0]=4 12269 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)I 11a_100015191253_100012360512 [0,2,0,0,0,0|1,1,0]=4 12270 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)I 1626a_100015191253_100012360512 [0,2,0,0,0,0|1,1,0]=4 12271 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)I 240690a_100015191253_100012360512 [0,2,0,0,0,0|1,1,0]=4 12272 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)I 527a_100015191253_100012360512 [0,2,0,0,0,0|1,1,0]=4 12273 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)O 240690a_100015191253_100012344906 [0,2,0,0,0,0|2,0,0]=4 12274 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Br)O 527a_100015191253_100012344906 [0,2,0,0,0,0|2,0,0]=4 12275 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Br 11a_100015191253_100000741311 [0,2,0,0,0,0|1,1,0]=4 12276 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Br 1626a_100015191253_100000741311 [0,2,0,0,0,0|1,1,0]=4 12277 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Br 240690a_100015191253_100000741311 [0,2,0,0,0,0|1,1,0]=4 12278 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Br 527a_100015191253_100000741311 [0,2,0,0,0,0|1,1,0]=4 12279 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)C 11a_100015191253_100000211164 [0,2,0,0,0,0|2,0,0]=4 12280 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)C 1626a_100015191253_100000211164 [0,2,0,0,0,0|2,0,0]=4 12281 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)C 240690a_100015191253_100000211164 [0,2,0,0,0,0|2,0,0]=4 12282 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)C 527a_100015191253_100000211164 [0,2,0,0,0,0|2,0,0]=4 12283 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Cl 11a_100015191253_100000688705 [0,2,0,0,0,0|1,0,0]=3 12284 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Cl 1626a_100015191253_100000688705 [0,2,0,0,0,0|1,0,0]=3 12285 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Cl 240690a_100015191253_100000688705 [0,2,0,0,0,0|1,0,0]=3 12286 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)Cl 527a_100015191253_100000688705 [0,2,0,0,0,0|1,0,0]=3 12287 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)F 11a_100015191253_100000686989 [0,2,0,0,0,0|1,1,0]=4 12288 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)F 1626a_100015191253_100000686989 [0,2,0,0,0,0|1,1,0]=4 12289 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)F 240690a_100015191253_100000686989 [0,2,0,0,0,0|1,1,0]=4 12290 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)F 527a_100015191253_100000686989 [0,2,0,0,0,0|1,1,0]=4 12291 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)I 11a_100015191253_100010189873 [0,2,0,0,0,0|1,1,0]=4 12292 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)I 1626a_100015191253_100010189873 [0,2,0,0,0,0|1,1,0]=4 12293 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)I 240690a_100015191253_100010189873 [0,2,0,0,0,0|1,1,0]=4 12294 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)I 527a_100015191253_100010189873 [0,2,0,0,0,0|1,1,0]=4 12295 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)O 240690a_100015191253_100000692822 [0,2,0,0,0,0|2,0,0]=4 12296 B15R1.3309 C=CCCNC(=O)c1ccc(cc1C)O 527a_100015191253_100000692822 [0,2,0,0,0,0|2,0,0]=4 12297 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Br 11a_100015191253_100000741628 [0,2,0,0,0,0|1,1,0]=4 12298 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Br 1626a_100015191253_100000741628 [0,2,0,0,0,0|1,1,0]=4 12299 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Br 240690a_100015191253_100000741628 [0,2,0,0,0,0|1,1,0]=4 12300 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Br 527a_100015191253_100000741628 [0,2,0,0,0,0|1,1,0]=4 12301 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)C 11a_100015191253_100000766932 [0,2,0,0,0,0|2,0,0]=4 12302 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)C 1626a_100015191253_100000766932 [0,2,0,0,0,0|2,0,0]=4 12303 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)C 240690a_100015191253_100000766932 [0,2,0,0,0,0|2,0,0]=4 12304 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)C 527a_100015191253_100000766932 [0,2,0,0,0,0|2,0,0]=4 12305 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Cl 11a_100015191253_100000185840 [0,2,0,0,0,0|1,0,0]=3 12306 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100015191253_100000185840 [0,2,0,0,0,0|1,0,0]=3 12307 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100015191253_100000185840 [0,2,0,0,0,0|1,0,0]=3 12308 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)Cl 527a_100015191253_100000185840 [0,2,0,0,0,0|1,0,0]=3 12309 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)F 11a_100015191253_100000211397 [0,2,0,0,0,0|1,1,0]=4 12310 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)F 1626a_100015191253_100000211397 [0,2,0,0,0,0|1,1,0]=4 12311 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)F 240690a_100015191253_100000211397 [0,2,0,0,0,0|1,1,0]=4 12312 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)F 527a_100015191253_100000211397 [0,2,0,0,0,0|1,1,0]=4 12313 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)I 11a_100015191253_100000751301 [0,2,0,0,0,0|1,1,0]=4 12314 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)I 1626a_100015191253_100000751301 [0,2,0,0,0,0|1,1,0]=4 12315 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)I 240690a_100015191253_100000751301 [0,2,0,0,0,0|1,1,0]=4 12316 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)I 527a_100015191253_100000751301 [0,2,0,0,0,0|1,1,0]=4 12317 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)O 240690a_100015191253_100000702456 [0,2,0,0,0,0|2,0,0]=4 12318 B15R1.3309 C=CCCNC(=O)c1ccc(cc1Cl)O 527a_100015191253_100000702456 [0,2,0,0,0,0|2,0,0]=4 12319 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Br 11a_100015191253_100000214689 [0,2,0,0,0,0|1,1,0]=4 12320 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Br 1626a_100015191253_100000214689 [0,2,0,0,0,0|1,1,0]=4 12321 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Br 240690a_100015191253_100000214689 [0,2,0,0,0,0|1,1,0]=4 12322 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Br 527a_100015191253_100000214689 [0,2,0,0,0,0|1,1,0]=4 12323 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)C 11a_100015191253_100000766033 [0,2,0,0,0,0|2,0,0]=4 12324 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)C 1626a_100015191253_100000766033 [0,2,0,0,0,0|2,0,0]=4 12325 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)C 240690a_100015191253_100000766033 [0,2,0,0,0,0|2,0,0]=4 12326 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)C 527a_100015191253_100000766033 [0,2,0,0,0,0|2,0,0]=4 12327 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Cl 11a_100015191253_100000212326 [0,2,0,0,0,0|1,0,0]=3 12328 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Cl 1626a_100015191253_100000212326 [0,2,0,0,0,0|1,0,0]=3 12329 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Cl 240690a_100015191253_100000212326 [0,2,0,0,0,0|1,0,0]=3 12330 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)Cl 527a_100015191253_100000212326 [0,2,0,0,0,0|1,0,0]=3 12331 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)F 11a_100015191253_100000211022 [0,2,0,0,0,0|1,1,0]=4 12332 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)F 1626a_100015191253_100000211022 [0,2,0,0,0,0|1,1,0]=4 12333 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)F 240690a_100015191253_100000211022 [0,2,0,0,0,0|1,1,0]=4 12334 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)F 527a_100015191253_100000211022 [0,2,0,0,0,0|1,1,0]=4 12335 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)I 11a_100015191253_100000037189 [0,2,0,0,0,0|1,1,0]=4 12336 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)I 1626a_100015191253_100000037189 [0,2,0,0,0,0|1,1,0]=4 12337 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)I 240690a_100015191253_100000037189 [0,2,0,0,0,0|1,1,0]=4 12338 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)I 527a_100015191253_100000037189 [0,2,0,0,0,0|1,1,0]=4 12339 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)O 240690a_100015191253_100000689029 [0,2,0,0,0,0|2,0,0]=4 12340 B15R1.3309 C=CCCNC(=O)c1ccc(cc1F)O 527a_100015191253_100000689029 [0,2,0,0,0,0|2,0,0]=4 12341 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Br 11a_100015191253_100000751167 [0,2,0,0,0,0|1,1,0]=4 12342 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Br 1626a_100015191253_100000751167 [0,2,0,0,0,0|1,1,0]=4 12343 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Br 240690a_100015191253_100000751167 [0,2,0,0,0,0|1,1,0]=4 12344 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Br 527a_100015191253_100000751167 [0,2,0,0,0,0|1,1,0]=4 12345 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)C 11a_100015191253_100009999607 [0,2,0,0,0,0|2,0,0]=4 12346 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)C 1626a_100015191253_100009999607 [0,2,0,0,0,0|2,0,0]=4 12347 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)C 240690a_100015191253_100009999607 [0,2,0,0,0,0|2,0,0]=4 12348 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)C 527a_100015191253_100009999607 [0,2,0,0,0,0|2,0,0]=4 12349 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Cl 11a_100015191253_100000739380 [0,2,0,0,0,0|1,0,0]=3 12350 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Cl 1626a_100015191253_100000739380 [0,2,0,0,0,0|1,0,0]=3 12351 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Cl 240690a_100015191253_100000739380 [0,2,0,0,0,0|1,0,0]=3 12352 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)Cl 527a_100015191253_100000739380 [0,2,0,0,0,0|1,0,0]=3 12353 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)F 11a_100015191253_100000739341 [0,2,0,0,0,0|1,1,0]=4 12354 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)F 1626a_100015191253_100000739341 [0,2,0,0,0,0|1,1,0]=4 12355 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)F 240690a_100015191253_100000739341 [0,2,0,0,0,0|1,1,0]=4 12356 B15R1.3309 C=CCCNC(=O)c1ccc(cc1I)F 527a_100015191253_100000739341 [0,2,0,0,0,0|1,1,0]=4 12357 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Br 240690a_100015191253_100000744433 [0,2,0,0,0,0|1,1,0]=4 12358 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Br 527a_100015191253_100000744433 [0,2,0,0,0,0|1,1,0]=4 12359 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)C 1626a_100015191253_100000212137 [0,2,0,0,0,0|2,0,0]=4 12360 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)C 240690a_100015191253_100000212137 [0,2,0,0,0,0|2,0,0]=4 12361 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)C 527a_100015191253_100000212137 [0,2,0,0,0,0|2,0,0]=4 12362 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Cl 11a_100015191253_100000188622 [0,2,0,0,0,0|1,0,0]=3 12363 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Cl 240690a_100015191253_100000188622 [0,2,0,0,0,0|1,0,0]=3 12364 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)Cl 527a_100015191253_100000188622 [0,2,0,0,0,0|1,0,0]=3 12365 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)F 240690a_100015191253_100000746061 [0,2,0,0,0,0|1,1,0]=4 12366 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)F 527a_100015191253_100000746061 [0,2,0,0,0,0|1,1,0]=4 12367 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)I 240690a_100015191253_100000091984 [0,2,0,0,0,0|1,1,0]=4 12368 B15R1.3309 C=CCCNC(=O)c1ccc(cc1O)I 527a_100015191253_100000091984 [0,2,0,0,0,0|1,1,0]=4 12369 B15R1.3309 C=CCNCC(=O)c1ccc(cc1Cl)Cl 2230a_100020586998_100011218845 [0,2,0,0,0,0|1,0,1]=4 12370 B15R1.3309 C=CCNNC(=O)c1ccc(cc1Br)Cl 22a_100020588587_100000766353 [0,2,0,0,0,0|1,0,1]=4 12371 B15R1.3309 C=CCNNC(=O)c1ccc(cc1C)Cl 22a_100020588587_100000688705 [0,2,0,0,0,0|1,0,1]=4 12372 B15R1.3309 C=CCNNC(=O)c1ccc(cc1Cl)Cl 22a_100020588587_100000185840 [0,2,0,0,0,0|1,0,1]=4 12373 B15R1.3309 C=CCNNC(=O)c1ccc(cc1F)Cl 22a_100020588587_100000212326 [0,2,0,0,0,0|1,0,1]=4 12374 B15R1.3309 C=CCNNC(=O)c1ccc(cc1I)Cl 22a_100020588587_100000739380 [0,2,0,0,0,0|1,0,1]=4 12375 B15R1.3309 C=CCNNC(=O)c1ccc(cc1O)Cl 22a_100020588587_100000188622 [0,2,0,0,0,0|1,0,1]=4 12376 B15R1.3309 CC#CCNC(=O)c1ccc(cc1Br)Cl 11a_100000685387_100000766353 [0,2,0,0,0,0|1,0,1]=4 12377 B15R1.3309 CC#CCNC(=O)c1ccc(cc1Br)Cl 1626a_100000685387_100000766353 [0,2,0,0,0,0|1,0,1]=4 12378 B15R1.3309 CC#CCNC(=O)c1ccc(cc1Br)Cl 527a_100000685387_100000766353 [0,2,0,0,0,0|1,0,1]=4 12379 B15R1.3309 CC#CCNC(=O)c1ccc(cc1C)Cl 11a_100000685387_100000688705 [0,2,0,0,0,0|1,0,1]=4 12380 B15R1.3309 CC#CCNC(=O)c1ccc(cc1C)Cl 1626a_100000685387_100000688705 [0,2,0,0,0,0|1,0,1]=4 12381 B15R1.3309 CC#CCNC(=O)c1ccc(cc1C)Cl 527a_100000685387_100000688705 [0,2,0,0,0,0|1,0,1]=4 12382 B15R1.3309 CC#CCNC(=O)c1ccc(cc1Cl)Cl 11a_100000685387_100000185840 [0,2,0,0,0,0|1,0,1]=4 12383 B15R1.3309 CC#CCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000685387_100000185840 [0,2,0,0,0,0|1,0,1]=4 12384 B15R1.3309 CC#CCNC(=O)c1ccc(cc1Cl)Cl 527a_100000685387_100000185840 [0,2,0,0,0,0|1,0,1]=4 12385 B15R1.3309 CC#CCNC(=O)c1ccc(cc1F)Cl 11a_100000685387_100000212326 [0,2,0,0,0,0|1,0,1]=4 12386 B15R1.3309 CC#CCNC(=O)c1ccc(cc1F)Cl 1626a_100000685387_100000212326 [0,2,0,0,0,0|1,0,1]=4 12387 B15R1.3309 CC#CCNC(=O)c1ccc(cc1F)Cl 527a_100000685387_100000212326 [0,2,0,0,0,0|1,0,1]=4 12388 B15R1.3309 CC#CCNC(=O)c1ccc(cc1I)Cl 11a_100000685387_100000739380 [0,2,0,0,0,0|1,0,1]=4 12389 B15R1.3309 CC#CCNC(=O)c1ccc(cc1I)Cl 1626a_100000685387_100000739380 [0,2,0,0,0,0|1,0,1]=4 12390 B15R1.3309 CC#CCNC(=O)c1ccc(cc1I)Cl 527a_100000685387_100000739380 [0,2,0,0,0,0|1,0,1]=4 12391 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)Cl 11a_100000685387_100000188622 [0,2,0,0,0,0|1,0,1]=4 12392 B15R1.3309 CC#CCNC(=O)c1ccc(cc1O)Cl 527a_100000685387_100000188622 [0,2,0,0,0,0|1,0,1]=4 12393 B15R1.3309 CC(=NNCCO)c1ccc(cc1Br)Br 4a_100000210001_100000183147 [0,2,0,0,0,0|1,1,0]=4 12394 B15R1.3309 CC(=NNCCO)c1ccc(cc1Br)C 4a_100000210001_100012353930 [0,2,0,0,0,0|2,0,0]=4 12395 B15R1.3309 CC(=NNCCO)c1ccc(cc1Br)Cl 4a_100000210001_100011934292 [0,2,0,0,0,0|1,0,0]=3 12396 B15R1.3309 CC(=NNCCO)c1ccc(cc1Br)F 4a_100000210001_100000686192 [0,2,0,0,0,0|1,1,0]=4 12397 B15R1.3309 CC(=NNCCO)c1ccc(cc1Br)O 4a_100000210001_100012340537 [0,2,0,0,0,0|2,0,0]=4 12398 B15R1.3309 CC(=NNCCO)c1ccc(cc1C)Br 4a_100000210001_100012360112 [0,2,0,0,0,0|1,1,0]=4 12399 B15R1.3309 CC(=NNCCO)c1ccc(cc1C)C 4a_100000210001_100000211561 [0,2,0,0,0,0|2,0,0]=4 12400 B15R1.3309 CC(=NNCCO)c1ccc(cc1C)Cl 4a_100000210001_100011998434 [0,2,0,0,0,0|1,0,0]=3 12401 B15R1.3309 CC(=NNCCO)c1ccc(cc1C)F 4a_100000210001_100000753884 [0,2,0,0,0,0|1,1,0]=4 12402 B15R1.3309 CC(=NNCCO)c1ccc(cc1C)O 4a_100000210001_100000702595 [0,2,0,0,0,0|2,0,0]=4 12403 B15R1.3309 CC(=NNCCO)c1ccc(cc1Cl)Br 4a_100000210001_100000693907 [0,2,0,0,0,0|1,1,0]=4 12404 B15R1.3309 CC(=NNCCO)c1ccc(cc1Cl)Cl 4a_100000210001_100000210972 [0,2,0,0,0,0|1,0,0]=3 12405 B15R1.3309 CC(=NNCCO)c1ccc(cc1Cl)F 4a_100000210001_100000214953 [0,2,0,0,0,0|1,1,0]=4 12406 B15R1.3309 CC(=NNCCO)c1ccc(cc1Cl)O 4a_100000210001_100011933989 [0,2,0,0,0,0|2,0,0]=4 12407 B15R1.3309 CC(=NNCCO)c1ccc(cc1F)Br 4a_100000210001_100000690205 [0,2,0,0,0,0|1,1,0]=4 12408 B15R1.3309 CC(=NNCCO)c1ccc(cc1F)C 4a_100000210001_100011216410 [0,2,0,0,0,0|2,0,0]=4 12409 B15R1.3309 CC(=NNCCO)c1ccc(cc1F)Cl 4a_100000210001_100011805184 [0,2,0,0,0,0|1,0,0]=3 12410 B15R1.3309 CC(=NNCCO)c1ccc(cc1F)F 4a_100000210001_100000185200 [0,2,0,0,0,0|1,1,0]=4 12411 B15R1.3309 CC(=NNCCO)c1ccc(cc1F)O 4a_100000210001_100000752407 [0,2,0,0,0,0|2,0,0]=4 12412 B15R1.3309 CC(=NNCCO)c1ccc(cc1O)Br 4a_100000210001_100000188348 [0,2,0,0,0,0|1,1,0]=4 12413 B15R1.3309 CC(=NNCCO)c1ccc(cc1O)C 4a_100000210001_100000234885 [0,2,0,0,0,0|2,0,0]=4 12414 B15R1.3309 CC(=NNCCO)c1ccc(cc1O)Cl 4a_100000210001_100000061402 [0,2,0,0,0,0|1,0,0]=3 12415 B15R1.3309 CC(=NNCCO)c1ccc(cc1O)F 4a_100000210001_100011215782 [0,2,0,0,0,0|1,1,0]=4 12416 B15R1.3309 CC(=NNCCO)c1ccc(cc1O)O 4a_100000210001_100000189368 [0,2,0,0,0,0|2,0,0]=4 12417 B15R1.3309 CC(=NNCCO)c1ccc(nc1Cl)Cl 4a_100000210001_100009857747 [0,2,0,0,0,0|2,0,0]=4 12418 B15R1.3309 CC(=NNCCO)c1cnc(cc1Cl)Cl 4a_100000210001_100000699909 [0,2,0,0,0,0|2,0,0]=4 12419 B15R1.3309 CC(=NNCCO)c1ncc(cc1Br)Cl 4a_100000210001_100010135484 [0,2,0,0,0,0|2,0,0]=4 12420 B15R1.3309 CC(=NNCCO)c1ncc(cc1Cl)Cl 4a_100000210001_100012184579 [0,2,0,0,0,0|2,0,0]=4 12421 B15R1.3309 CC(=NNCCO)c1ncc(cc1F)Cl 4a_100000210001_100009855508 [0,2,0,0,0,0|2,0,0]=4 12422 B15R1.3309 CC(NCCCO)c1ccc(cc1Br)Cl 269862a_100000182051_100011934292 [0,2,0,0,0,0|1,0,1]=4 12423 B15R1.3309 CC(NCCCO)c1ccc(cc1Cl)Cl 2230a_100000179772_100000230001 [0,2,0,0,0,0|1,0,1]=4 12424 B15R1.3309 CC(NCCCO)c1ccc(cc1Cl)Cl 269862a_100000182051_100000210972 [0,2,0,0,0,0|1,0,1]=4 12425 B15R1.3309 CC(NCCCO)c1ccc(cc1Cl)Cl 34a_100000179772_100000230001 [0,2,0,0,0,0|1,0,1]=4 12426 B15R1.3309 CC(NCCCO)c1ccc(cc1F)Cl 269862a_100000182051_100011805184 [0,2,0,0,0,0|1,0,1]=4 12427 B15R1.3309 CC(NCCCO)c1ccc(cc1O)Cl 269862a_100000182051_100000061402 [0,2,0,0,0,0|1,0,1]=4 12428 B15R1.3309 CCC=NNC(=O)c1ccc(cc1Br)Cl 4a_200012340523_100000210100 [0,2,0,0,0,0|1,0,1]=4 12429 B15R1.3309 CCC=NNC(=O)c1ccc(cc1C)Cl 4a_200011996896_100000210100 [0,2,0,0,0,0|1,0,1]=4 12430 B15R1.3309 CCC=NNC(=O)c1ccc(cc1Cl)Cl 4a_100000184908_100000210100 [0,2,0,0,0,0|1,0,1]=4 12431 B15R1.3309 CCC=NNC(=O)c1ccc(cc1F)Cl 4a_100000215448_100000210100 [0,2,0,0,0,0|1,0,1]=4 12432 B15R1.3309 CCCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210326 [0,2,0,0,0,0|2,0,0]=4 12433 B15R1.3309 CCCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210326 [0,2,0,0,0,0|2,0,0]=4 12434 B15R1.3309 CCCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210326 [0,2,0,0,0,0|2,0,0]=4 12435 B15R1.3309 CCCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210326 [0,2,0,0,0,0|2,0,0]=4 12436 B15R1.3309 CCCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210326 [0,2,0,0,0,0|2,0,0]=4 12437 B15R1.3309 CCCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210326 [0,2,0,0,0,0|2,0,0]=4 12438 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 11a_100000102301_100000762965 [0,2,0,0,0,0|1,1,0]=4 12439 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 1626a_100000102301_100000762965 [0,2,0,0,0,0|1,1,0]=4 12440 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 240690a_100000102301_100000762965 [0,2,0,0,0,0|1,1,0]=4 12441 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Br 527a_100000102301_100000762965 [0,2,0,0,0,0|1,1,0]=4 12442 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 11a_100000102301_100000685072 [0,2,0,0,0,0|2,0,0]=4 12443 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 1626a_100000102301_100000685072 [0,2,0,0,0,0|2,0,0]=4 12444 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 240690a_100000102301_100000685072 [0,2,0,0,0,0|2,0,0]=4 12445 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)C 527a_100000102301_100000685072 [0,2,0,0,0,0|2,0,0]=4 12446 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 11a_100000102301_100000766353 [0,2,0,0,0,0|1,0,0]=3 12447 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000102301_100000766353 [0,2,0,0,0,0|1,0,0]=3 12448 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000102301_100000766353 [0,2,0,0,0,0|1,0,0]=3 12449 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)Cl 527a_100000102301_100000766353 [0,2,0,0,0,0|1,0,0]=3 12450 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 11a_100000102301_100000212304 [0,2,0,0,0,0|1,1,0]=4 12451 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 1626a_100000102301_100000212304 [0,2,0,0,0,0|1,1,0]=4 12452 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 240690a_100000102301_100000212304 [0,2,0,0,0,0|1,1,0]=4 12453 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)F 527a_100000102301_100000212304 [0,2,0,0,0,0|1,1,0]=4 12454 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 11a_100000102301_100012360512 [0,2,0,0,0,0|1,1,0]=4 12455 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 1626a_100000102301_100012360512 [0,2,0,0,0,0|1,1,0]=4 12456 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 240690a_100000102301_100012360512 [0,2,0,0,0,0|1,1,0]=4 12457 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)I 527a_100000102301_100012360512 [0,2,0,0,0,0|1,1,0]=4 12458 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)O 240690a_100000102301_100012344906 [0,2,0,0,0,0|2,0,0]=4 12459 B15R1.3309 CCCCNC(=O)c1ccc(cc1Br)O 527a_100000102301_100012344906 [0,2,0,0,0,0|2,0,0]=4 12460 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 11a_100000102301_100000741311 [0,2,0,0,0,0|1,1,0]=4 12461 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 1626a_100000102301_100000741311 [0,2,0,0,0,0|1,1,0]=4 12462 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 240690a_100000102301_100000741311 [0,2,0,0,0,0|1,1,0]=4 12463 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Br 527a_100000102301_100000741311 [0,2,0,0,0,0|1,1,0]=4 12464 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 11a_100000102301_100000211164 [0,2,0,0,0,0|2,0,0]=4 12465 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 1626a_100000102301_100000211164 [0,2,0,0,0,0|2,0,0]=4 12466 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 240690a_100000102301_100000211164 [0,2,0,0,0,0|2,0,0]=4 12467 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)C 527a_100000102301_100000211164 [0,2,0,0,0,0|2,0,0]=4 12468 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 11a_100000102301_100000688705 [0,2,0,0,0,0|1,0,0]=3 12469 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 1626a_100000102301_100000688705 [0,2,0,0,0,0|1,0,0]=3 12470 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 240690a_100000102301_100000688705 [0,2,0,0,0,0|1,0,0]=3 12471 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)Cl 527a_100000102301_100000688705 [0,2,0,0,0,0|1,0,0]=3 12472 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 11a_100000102301_100000686989 [0,2,0,0,0,0|1,1,0]=4 12473 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 1626a_100000102301_100000686989 [0,2,0,0,0,0|1,1,0]=4 12474 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 240690a_100000102301_100000686989 [0,2,0,0,0,0|1,1,0]=4 12475 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)F 527a_100000102301_100000686989 [0,2,0,0,0,0|1,1,0]=4 12476 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 11a_100000102301_100010189873 [0,2,0,0,0,0|1,1,0]=4 12477 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 1626a_100000102301_100010189873 [0,2,0,0,0,0|1,1,0]=4 12478 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 240690a_100000102301_100010189873 [0,2,0,0,0,0|1,1,0]=4 12479 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)I 527a_100000102301_100010189873 [0,2,0,0,0,0|1,1,0]=4 12480 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)O 240690a_100000102301_100000692822 [0,2,0,0,0,0|2,0,0]=4 12481 B15R1.3309 CCCCNC(=O)c1ccc(cc1C)O 527a_100000102301_100000692822 [0,2,0,0,0,0|2,0,0]=4 12482 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 11a_100000102301_100000741628 [0,2,0,0,0,0|1,1,0]=4 12483 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000102301_100000741628 [0,2,0,0,0,0|1,1,0]=4 12484 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000102301_100000741628 [0,2,0,0,0,0|1,1,0]=4 12485 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Br 527a_100000102301_100000741628 [0,2,0,0,0,0|1,1,0]=4 12486 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 11a_100000102301_100000766932 [0,2,0,0,0,0|2,0,0]=4 12487 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 1626a_100000102301_100000766932 [0,2,0,0,0,0|2,0,0]=4 12488 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 240690a_100000102301_100000766932 [0,2,0,0,0,0|2,0,0]=4 12489 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)C 527a_100000102301_100000766932 [0,2,0,0,0,0|2,0,0]=4 12490 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000102301_100000185840 [0,2,0,0,0,0|1,0,0]=3 12491 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000102301_100000185840 [0,2,0,0,0,0|1,0,0]=3 12492 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000102301_100000185840 [0,2,0,0,0,0|1,0,0]=3 12493 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000102301_100000185840 [0,2,0,0,0,0|1,0,0]=3 12494 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 11a_100000102301_100000211397 [0,2,0,0,0,0|1,1,0]=4 12495 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 1626a_100000102301_100000211397 [0,2,0,0,0,0|1,1,0]=4 12496 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 240690a_100000102301_100000211397 [0,2,0,0,0,0|1,1,0]=4 12497 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)F 527a_100000102301_100000211397 [0,2,0,0,0,0|1,1,0]=4 12498 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 11a_100000102301_100000751301 [0,2,0,0,0,0|1,1,0]=4 12499 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 1626a_100000102301_100000751301 [0,2,0,0,0,0|1,1,0]=4 12500 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 240690a_100000102301_100000751301 [0,2,0,0,0,0|1,1,0]=4 12501 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)I 527a_100000102301_100000751301 [0,2,0,0,0,0|1,1,0]=4 12502 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)O 240690a_100000102301_100000702456 [0,2,0,0,0,0|2,0,0]=4 12503 B15R1.3309 CCCCNC(=O)c1ccc(cc1Cl)O 527a_100000102301_100000702456 [0,2,0,0,0,0|2,0,0]=4 12504 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 11a_100000102301_100000214689 [0,2,0,0,0,0|1,1,0]=4 12505 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 1626a_100000102301_100000214689 [0,2,0,0,0,0|1,1,0]=4 12506 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 240690a_100000102301_100000214689 [0,2,0,0,0,0|1,1,0]=4 12507 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Br 527a_100000102301_100000214689 [0,2,0,0,0,0|1,1,0]=4 12508 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 11a_100000102301_100000766033 [0,2,0,0,0,0|2,0,0]=4 12509 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 1626a_100000102301_100000766033 [0,2,0,0,0,0|2,0,0]=4 12510 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 240690a_100000102301_100000766033 [0,2,0,0,0,0|2,0,0]=4 12511 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)C 527a_100000102301_100000766033 [0,2,0,0,0,0|2,0,0]=4 12512 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 11a_100000102301_100000212326 [0,2,0,0,0,0|1,0,0]=3 12513 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 1626a_100000102301_100000212326 [0,2,0,0,0,0|1,0,0]=3 12514 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 240690a_100000102301_100000212326 [0,2,0,0,0,0|1,0,0]=3 12515 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)Cl 527a_100000102301_100000212326 [0,2,0,0,0,0|1,0,0]=3 12516 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 11a_100000102301_100000211022 [0,2,0,0,0,0|1,1,0]=4 12517 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 1626a_100000102301_100000211022 [0,2,0,0,0,0|1,1,0]=4 12518 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 240690a_100000102301_100000211022 [0,2,0,0,0,0|1,1,0]=4 12519 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)F 527a_100000102301_100000211022 [0,2,0,0,0,0|1,1,0]=4 12520 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 11a_100000102301_100000037189 [0,2,0,0,0,0|1,1,0]=4 12521 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 1626a_100000102301_100000037189 [0,2,0,0,0,0|1,1,0]=4 12522 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 240690a_100000102301_100000037189 [0,2,0,0,0,0|1,1,0]=4 12523 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)I 527a_100000102301_100000037189 [0,2,0,0,0,0|1,1,0]=4 12524 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)O 240690a_100000102301_100000689029 [0,2,0,0,0,0|2,0,0]=4 12525 B15R1.3309 CCCCNC(=O)c1ccc(cc1F)O 527a_100000102301_100000689029 [0,2,0,0,0,0|2,0,0]=4 12526 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 11a_100000102301_100000751167 [0,2,0,0,0,0|1,1,0]=4 12527 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 1626a_100000102301_100000751167 [0,2,0,0,0,0|1,1,0]=4 12528 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 240690a_100000102301_100000751167 [0,2,0,0,0,0|1,1,0]=4 12529 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Br 527a_100000102301_100000751167 [0,2,0,0,0,0|1,1,0]=4 12530 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 11a_100000102301_100009999607 [0,2,0,0,0,0|2,0,0]=4 12531 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 1626a_100000102301_100009999607 [0,2,0,0,0,0|2,0,0]=4 12532 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 240690a_100000102301_100009999607 [0,2,0,0,0,0|2,0,0]=4 12533 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)C 527a_100000102301_100009999607 [0,2,0,0,0,0|2,0,0]=4 12534 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 11a_100000102301_100000739380 [0,2,0,0,0,0|1,0,0]=3 12535 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 1626a_100000102301_100000739380 [0,2,0,0,0,0|1,0,0]=3 12536 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 240690a_100000102301_100000739380 [0,2,0,0,0,0|1,0,0]=3 12537 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)Cl 527a_100000102301_100000739380 [0,2,0,0,0,0|1,0,0]=3 12538 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 11a_100000102301_100000739341 [0,2,0,0,0,0|1,1,0]=4 12539 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 1626a_100000102301_100000739341 [0,2,0,0,0,0|1,1,0]=4 12540 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 240690a_100000102301_100000739341 [0,2,0,0,0,0|1,1,0]=4 12541 B15R1.3309 CCCCNC(=O)c1ccc(cc1I)F 527a_100000102301_100000739341 [0,2,0,0,0,0|1,1,0]=4 12542 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Br 240690a_100000102301_100000744433 [0,2,0,0,0,0|1,1,0]=4 12543 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Br 527a_100000102301_100000744433 [0,2,0,0,0,0|1,1,0]=4 12544 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)C 1626a_100000102301_100000212137 [0,2,0,0,0,0|2,0,0]=4 12545 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)C 240690a_100000102301_100000212137 [0,2,0,0,0,0|2,0,0]=4 12546 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)C 527a_100000102301_100000212137 [0,2,0,0,0,0|2,0,0]=4 12547 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Cl 11a_100000102301_100000188622 [0,2,0,0,0,0|1,0,0]=3 12548 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Cl 240690a_100000102301_100000188622 [0,2,0,0,0,0|1,0,0]=3 12549 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)Cl 527a_100000102301_100000188622 [0,2,0,0,0,0|1,0,0]=3 12550 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)F 240690a_100000102301_100000746061 [0,2,0,0,0,0|1,1,0]=4 12551 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)F 527a_100000102301_100000746061 [0,2,0,0,0,0|1,1,0]=4 12552 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)I 240690a_100000102301_100000091984 [0,2,0,0,0,0|1,1,0]=4 12553 B15R1.3309 CCCCNC(=O)c1ccc(cc1O)I 527a_100000102301_100000091984 [0,2,0,0,0,0|1,1,0]=4 12554 B15R1.3309 CCCNN=C(C)c1ccc(cc1Br)Cl 4a_100000740057_100011934292 [0,2,0,0,0,0|2,0,0]=4 12555 B15R1.3309 CCCNN=C(C)c1ccc(cc1C)Cl 4a_100000740057_100011998434 [0,2,0,0,0,0|2,0,0]=4 12556 B15R1.3309 CCCNN=C(C)c1ccc(cc1Cl)Cl 4a_100000740057_100000210972 [0,2,0,0,0,0|2,0,0]=4 12557 B15R1.3309 CCCNN=C(C)c1ccc(cc1F)Cl 4a_100000740057_100011805184 [0,2,0,0,0,0|2,0,0]=4 12558 B15R1.3309 CCCNN=C(C)c1ccc(cc1O)Cl 4a_100000740057_100000061402 [0,2,0,0,0,0|2,0,0]=4 12559 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)Br 22a_100000740057_100000762965 [0,2,0,0,0,0|1,1,0]=4 12560 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)C 22a_100000740057_100000685072 [0,2,0,0,0,0|2,0,0]=4 12561 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)Cl 22a_100000740057_100000766353 [0,2,0,0,0,0|1,0,0]=3 12562 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)F 22a_100000740057_100000212304 [0,2,0,0,0,0|1,1,0]=4 12563 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)I 22a_100000740057_100012360512 [0,2,0,0,0,0|1,1,0]=4 12564 B15R1.3309 CCCNNC(=O)c1ccc(cc1Br)O 22a_100000740057_100012344906 [0,2,0,0,0,0|2,0,0]=4 12565 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)Br 22a_100000740057_100000741311 [0,2,0,0,0,0|1,1,0]=4 12566 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)C 22a_100000740057_100000211164 [0,2,0,0,0,0|2,0,0]=4 12567 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)Cl 22a_100000740057_100000688705 [0,2,0,0,0,0|1,0,0]=3 12568 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)F 22a_100000740057_100000686989 [0,2,0,0,0,0|1,1,0]=4 12569 B15R1.3309 CCCNNC(=O)c1ccc(cc1C)I 22a_100000740057_100010189873 [0,2,0,0,0,0|1,1,0]=4 12570 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)Br 22a_100000740057_100000741628 [0,2,0,0,0,0|1,1,0]=4 12571 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)C 22a_100000740057_100000766932 [0,2,0,0,0,0|2,0,0]=4 12572 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)Cl 22a_100000740057_100000185840 [0,2,0,0,0,0|1,0,0]=3 12573 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)F 22a_100000740057_100000211397 [0,2,0,0,0,0|1,1,0]=4 12574 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)I 22a_100000740057_100000751301 [0,2,0,0,0,0|1,1,0]=4 12575 B15R1.3309 CCCNNC(=O)c1ccc(cc1Cl)O 22a_100000740057_100000702456 [0,2,0,0,0,0|2,0,0]=4 12576 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)Br 22a_100000740057_100000214689 [0,2,0,0,0,0|1,1,0]=4 12577 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)C 22a_100000740057_100000766033 [0,2,0,0,0,0|2,0,0]=4 12578 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)Cl 22a_100000740057_100000212326 [0,2,0,0,0,0|1,0,0]=3 12579 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)F 22a_100000740057_100000211022 [0,2,0,0,0,0|1,1,0]=4 12580 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)I 22a_100000740057_100000037189 [0,2,0,0,0,0|1,1,0]=4 12581 B15R1.3309 CCCNNC(=O)c1ccc(cc1F)O 22a_100000740057_100000689029 [0,2,0,0,0,0|2,0,0]=4 12582 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)Br 22a_100000740057_100000751167 [0,2,0,0,0,0|1,1,0]=4 12583 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)C 22a_100000740057_100009999607 [0,2,0,0,0,0|2,0,0]=4 12584 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)Cl 22a_100000740057_100000739380 [0,2,0,0,0,0|1,0,0]=3 12585 B15R1.3309 CCCNNC(=O)c1ccc(cc1I)F 22a_100000740057_100000739341 [0,2,0,0,0,0|1,1,0]=4 12586 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)Br 22a_100000740057_100000744433 [0,2,0,0,0,0|1,1,0]=4 12587 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)C 22a_100000740057_100000212137 [0,2,0,0,0,0|2,0,0]=4 12588 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)Cl 22a_100000740057_100000188622 [0,2,0,0,0,0|1,0,0]=3 12589 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)F 22a_100000740057_100000746061 [0,2,0,0,0,0|1,1,0]=4 12590 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)I 22a_100000740057_100000091984 [0,2,0,0,0,0|1,1,0]=4 12591 B15R1.3309 CCCNNC(=O)c1ccc(cc1O)O 22a_100000740057_100000212172 [0,2,0,0,0,0|2,0,0]=4 12592 B15R1.3309 CCCOCC(=O)c1ccc(cc1F)Cl 34a_100000210258_100012351891 [0,2,0,0,0,0|2,0,0]=4 12593 B15R1.3309 CCCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000210303 [0,2,0,0,0,0|2,0,0]=4 12594 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)Cl 62a_100000210303_100012351891 [0,2,0,0,0,0|2,0,0]=4 12595 B15R1.3309 CCCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000210303 [0,2,0,0,0,0|2,0,0]=4 12596 B15R1.3309 CCNCOC(=O)c1ccc(cc1Cl)Cl 2230a_100015525214_100010978946 [0,2,0,0,0,0|2,0,0]=4 12597 B15R1.3309 CCOCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100011215890 [0,2,0,0,0,0|2,0,0]=4 12598 B15R1.3309 CCOCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100011215890 [0,2,0,0,0,0|2,0,0]=4 12599 B15R1.3309 CCOCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100011215890 [0,2,0,0,0,0|2,0,0]=4 12600 B15R1.3309 CCOCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100011215890 [0,2,0,0,0,0|2,0,0]=4 12601 B15R1.3309 CCOCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100011215890 [0,2,0,0,0,0|2,0,0]=4 12602 B15R1.3309 CCOCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100011215890 [0,2,0,0,0,0|2,0,0]=4 12603 B15R1.3309 CCSCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000757381 [0,2,0,0,0,0|2,0,0]=4 12604 B15R1.3309 CCSCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000757381 [0,2,0,0,0,0|2,0,0]=4 12605 B15R1.3309 CCSCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000757381 [0,2,0,0,0,0|2,0,0]=4 12606 B15R1.3309 CCSCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000757381 [0,2,0,0,0,0|2,0,0]=4 12607 B15R1.3309 CCSCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000757381 [0,2,0,0,0,0|2,0,0]=4 12608 B15R1.3309 CCSCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000757381 [0,2,0,0,0,0|2,0,0]=4 12609 B15R1.3309 CCSCOC(=O)c1ccc(cc1Cl)Cl 62a_100010978946_100000210202 [0,2,0,0,0,0|2,0,0]=4 12610 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000740836 [0,2,0,0,0,0|1,1,0]=4 12611 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000740836 [0,2,0,0,0,0|2,0,0]=4 12612 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000740836 [0,2,0,0,0,0|1,0,0]=3 12613 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000740836 [0,2,0,0,0,0|1,1,0]=4 12614 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000740836 [0,2,0,0,0,0|1,1,0]=4 12615 B15R1.3309 COCCCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000740836 [0,2,0,0,0,0|2,0,0]=4 12616 B15R1.3309 COCCCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000740836 [0,2,0,0,0,0|1,1,0]=4 12617 B15R1.3309 COCCCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000740836 [0,2,0,0,0,0|2,0,0]=4 12618 B15R1.3309 COCCCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000740836 [0,2,0,0,0,0|1,0,0]=3 12619 B15R1.3309 COCCCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000740836 [0,2,0,0,0,0|1,1,0]=4 12620 B15R1.3309 COCCCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000740836 [0,2,0,0,0,0|1,1,0]=4 12621 B15R1.3309 COCCCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000740836 [0,2,0,0,0,0|2,0,0]=4 12622 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000740836 [0,2,0,0,0,0|1,1,0]=4 12623 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000740836 [0,2,0,0,0,0|2,0,0]=4 12624 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000740836 [0,2,0,0,0,0|1,0,0]=3 12625 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000740836 [0,2,0,0,0,0|1,1,0]=4 12626 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000740836 [0,2,0,0,0,0|1,1,0]=4 12627 B15R1.3309 COCCCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000740836 [0,2,0,0,0,0|2,0,0]=4 12628 B15R1.3309 COCCCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000740836 [0,2,0,0,0,0|1,1,0]=4 12629 B15R1.3309 COCCCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000740836 [0,2,0,0,0,0|2,0,0]=4 12630 B15R1.3309 COCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000740836 [0,2,0,0,0,0|1,0,0]=3 12631 B15R1.3309 COCCCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000740836 [0,2,0,0,0,0|1,1,0]=4 12632 B15R1.3309 COCCCC(=O)c1ccc(cc1F)F 34a_100138415774_100012405562 [0,2,0,0,0,0|1,1,0]=4 12633 B15R1.3309 COCCCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000740836 [0,2,0,0,0,0|1,1,0]=4 12634 B15R1.3309 COCCCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000740836 [0,2,0,0,0,0|2,0,0]=4 12635 B15R1.3309 COCCCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000740836 [0,2,0,0,0,0|1,1,0]=4 12636 B15R1.3309 COCCCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000740836 [0,2,0,0,0,0|2,0,0]=4 12637 B15R1.3309 COCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000740836 [0,2,0,0,0,0|1,0,0]=3 12638 B15R1.3309 COCCCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000740836 [0,2,0,0,0,0|1,1,0]=4 12639 B15R1.3309 COCCCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000740836 [0,2,0,0,0,0|1,1,0]=4 12640 B15R1.3309 COCCCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000740836 [0,2,0,0,0,0|2,0,0]=4 12641 B15R1.3309 COCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000740836 [0,2,0,0,0,0|1,0,0]=3 12642 B15R1.3309 COCCCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000740836 [0,2,0,0,0,0|1,1,0]=4 12643 B15R1.3309 COCCCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000740836 [0,2,0,0,0,0|1,1,0]=4 12644 B15R1.3309 COCCCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000740836 [0,2,0,0,0,0|2,0,0]=4 12645 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Br 1626a_100000209980_100000762965 [0,2,0,0,0,0|0,1,0]=3 12646 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Br 240690a_100000209980_100000762965 [0,2,0,0,0,0|0,1,0]=3 12647 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Br 527a_100000209980_100000762965 [0,2,0,0,0,0|0,1,0]=3 12648 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)C 1626a_100000209980_100000685072 [0,2,0,0,0,0|1,0,0]=3 12649 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)C 240690a_100000209980_100000685072 [0,2,0,0,0,0|1,0,0]=3 12650 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)C 527a_100000209980_100000685072 [0,2,0,0,0,0|1,0,0]=3 12651 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000209980_100000766353 [0,2,0,0,0,0|0,0,0]=2 12652 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000209980_100000766353 [0,2,0,0,0,0|0,0,0]=2 12653 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)Cl 527a_100000209980_100000766353 [0,2,0,0,0,0|0,0,0]=2 12654 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)F 1626a_100000209980_100000212304 [0,2,0,0,0,0|0,1,0]=3 12655 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)F 240690a_100000209980_100000212304 [0,2,0,0,0,0|0,1,0]=3 12656 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)F 527a_100000209980_100000212304 [0,2,0,0,0,0|0,1,0]=3 12657 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)I 1626a_100000209980_100012360512 [0,2,0,0,0,0|0,1,0]=3 12658 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)I 240690a_100000209980_100012360512 [0,2,0,0,0,0|0,1,0]=3 12659 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)I 527a_100000209980_100012360512 [0,2,0,0,0,0|0,1,0]=3 12660 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)O 240690a_100000209980_100012344906 [0,2,0,0,0,0|1,0,0]=3 12661 B15R1.3309 COCCNC(=O)c1ccc(cc1Br)O 527a_100000209980_100012344906 [0,2,0,0,0,0|1,0,0]=3 12662 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Br 1626a_100000209980_100000741311 [0,2,0,0,0,0|0,1,0]=3 12663 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Br 240690a_100000209980_100000741311 [0,2,0,0,0,0|0,1,0]=3 12664 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Br 527a_100000209980_100000741311 [0,2,0,0,0,0|0,1,0]=3 12665 B15R1.3309 COCCNC(=O)c1ccc(cc1C)C 1626a_100000209980_100000211164 [0,2,0,0,0,0|1,0,0]=3 12666 B15R1.3309 COCCNC(=O)c1ccc(cc1C)C 240690a_100000209980_100000211164 [0,2,0,0,0,0|1,0,0]=3 12667 B15R1.3309 COCCNC(=O)c1ccc(cc1C)C 527a_100000209980_100000211164 [0,2,0,0,0,0|1,0,0]=3 12668 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Cl 1626a_100000209980_100000688705 [0,2,0,0,0,0|0,0,0]=2 12669 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Cl 240690a_100000209980_100000688705 [0,2,0,0,0,0|0,0,0]=2 12670 B15R1.3309 COCCNC(=O)c1ccc(cc1C)Cl 527a_100000209980_100000688705 [0,2,0,0,0,0|0,0,0]=2 12671 B15R1.3309 COCCNC(=O)c1ccc(cc1C)F 1626a_100000209980_100000686989 [0,2,0,0,0,0|0,1,0]=3 12672 B15R1.3309 COCCNC(=O)c1ccc(cc1C)F 240690a_100000209980_100000686989 [0,2,0,0,0,0|0,1,0]=3 12673 B15R1.3309 COCCNC(=O)c1ccc(cc1C)F 527a_100000209980_100000686989 [0,2,0,0,0,0|0,1,0]=3 12674 B15R1.3309 COCCNC(=O)c1ccc(cc1C)I 1626a_100000209980_100010189873 [0,2,0,0,0,0|0,1,0]=3 12675 B15R1.3309 COCCNC(=O)c1ccc(cc1C)I 240690a_100000209980_100010189873 [0,2,0,0,0,0|0,1,0]=3 12676 B15R1.3309 COCCNC(=O)c1ccc(cc1C)I 527a_100000209980_100010189873 [0,2,0,0,0,0|0,1,0]=3 12677 B15R1.3309 COCCNC(=O)c1ccc(cc1C)O 240690a_100000209980_100000692822 [0,2,0,0,0,0|1,0,0]=3 12678 B15R1.3309 COCCNC(=O)c1ccc(cc1C)O 527a_100000209980_100000692822 [0,2,0,0,0,0|1,0,0]=3 12679 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000209980_100000741628 [0,2,0,0,0,0|0,1,0]=3 12680 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000209980_100000741628 [0,2,0,0,0,0|0,1,0]=3 12681 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Br 527a_100000209980_100000741628 [0,2,0,0,0,0|0,1,0]=3 12682 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)C 1626a_100000209980_100000766932 [0,2,0,0,0,0|1,0,0]=3 12683 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)C 240690a_100000209980_100000766932 [0,2,0,0,0,0|1,0,0]=3 12684 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)C 527a_100000209980_100000766932 [0,2,0,0,0,0|1,0,0]=3 12685 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000209980_100000185840 [0,2,0,0,0,0|0,0,0]=2 12686 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000209980_100000185840 [0,2,0,0,0,0|0,0,0]=2 12687 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000209980_100000185840 [0,2,0,0,0,0|0,0,0]=2 12688 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)F 1626a_100000209980_100000211397 [0,2,0,0,0,0|0,1,0]=3 12689 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)F 240690a_100000209980_100000211397 [0,2,0,0,0,0|0,1,0]=3 12690 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)F 527a_100000209980_100000211397 [0,2,0,0,0,0|0,1,0]=3 12691 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)I 1626a_100000209980_100000751301 [0,2,0,0,0,0|0,1,0]=3 12692 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)I 240690a_100000209980_100000751301 [0,2,0,0,0,0|0,1,0]=3 12693 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)I 527a_100000209980_100000751301 [0,2,0,0,0,0|0,1,0]=3 12694 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)N 34a_100000725507_200000210301 [0,2,0,0,0,0|1,0,0]=3 12695 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)O 240690a_100000209980_100000702456 [0,2,0,0,0,0|1,0,0]=3 12696 B15R1.3309 COCCNC(=O)c1ccc(cc1Cl)O 527a_100000209980_100000702456 [0,2,0,0,0,0|1,0,0]=3 12697 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Br 1626a_100000209980_100000214689 [0,2,0,0,0,0|0,1,0]=3 12698 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Br 240690a_100000209980_100000214689 [0,2,0,0,0,0|0,1,0]=3 12699 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Br 527a_100000209980_100000214689 [0,2,0,0,0,0|0,1,0]=3 12700 B15R1.3309 COCCNC(=O)c1ccc(cc1F)C 1626a_100000209980_100000766033 [0,2,0,0,0,0|1,0,0]=3 12701 B15R1.3309 COCCNC(=O)c1ccc(cc1F)C 240690a_100000209980_100000766033 [0,2,0,0,0,0|1,0,0]=3 12702 B15R1.3309 COCCNC(=O)c1ccc(cc1F)C 527a_100000209980_100000766033 [0,2,0,0,0,0|1,0,0]=3 12703 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Cl 1626a_100000209980_100000212326 [0,2,0,0,0,0|0,0,0]=2 12704 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Cl 240690a_100000209980_100000212326 [0,2,0,0,0,0|0,0,0]=2 12705 B15R1.3309 COCCNC(=O)c1ccc(cc1F)Cl 527a_100000209980_100000212326 [0,2,0,0,0,0|0,0,0]=2 12706 B15R1.3309 COCCNC(=O)c1ccc(cc1F)F 1626a_100000209980_100000211022 [0,2,0,0,0,0|0,1,0]=3 12707 B15R1.3309 COCCNC(=O)c1ccc(cc1F)F 240690a_100000209980_100000211022 [0,2,0,0,0,0|0,1,0]=3 12708 B15R1.3309 COCCNC(=O)c1ccc(cc1F)F 527a_100000209980_100000211022 [0,2,0,0,0,0|0,1,0]=3 12709 B15R1.3309 COCCNC(=O)c1ccc(cc1F)I 1626a_100000209980_100000037189 [0,2,0,0,0,0|0,1,0]=3 12710 B15R1.3309 COCCNC(=O)c1ccc(cc1F)I 240690a_100000209980_100000037189 [0,2,0,0,0,0|0,1,0]=3 12711 B15R1.3309 COCCNC(=O)c1ccc(cc1F)I 527a_100000209980_100000037189 [0,2,0,0,0,0|0,1,0]=3 12712 B15R1.3309 COCCNC(=O)c1ccc(cc1F)O 240690a_100000209980_100000689029 [0,2,0,0,0,0|1,0,0]=3 12713 B15R1.3309 COCCNC(=O)c1ccc(cc1F)O 527a_100000209980_100000689029 [0,2,0,0,0,0|1,0,0]=3 12714 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Br 1626a_100000209980_100000751167 [0,2,0,0,0,0|0,1,0]=3 12715 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Br 240690a_100000209980_100000751167 [0,2,0,0,0,0|0,1,0]=3 12716 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Br 527a_100000209980_100000751167 [0,2,0,0,0,0|0,1,0]=3 12717 B15R1.3309 COCCNC(=O)c1ccc(cc1I)C 1626a_100000209980_100009999607 [0,2,0,0,0,0|1,0,0]=3 12718 B15R1.3309 COCCNC(=O)c1ccc(cc1I)C 240690a_100000209980_100009999607 [0,2,0,0,0,0|1,0,0]=3 12719 B15R1.3309 COCCNC(=O)c1ccc(cc1I)C 527a_100000209980_100009999607 [0,2,0,0,0,0|1,0,0]=3 12720 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Cl 1626a_100000209980_100000739380 [0,2,0,0,0,0|0,0,0]=2 12721 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Cl 240690a_100000209980_100000739380 [0,2,0,0,0,0|0,0,0]=2 12722 B15R1.3309 COCCNC(=O)c1ccc(cc1I)Cl 527a_100000209980_100000739380 [0,2,0,0,0,0|0,0,0]=2 12723 B15R1.3309 COCCNC(=O)c1ccc(cc1I)F 1626a_100000209980_100000739341 [0,2,0,0,0,0|0,1,0]=3 12724 B15R1.3309 COCCNC(=O)c1ccc(cc1I)F 240690a_100000209980_100000739341 [0,2,0,0,0,0|0,1,0]=3 12725 B15R1.3309 COCCNC(=O)c1ccc(cc1I)F 527a_100000209980_100000739341 [0,2,0,0,0,0|0,1,0]=3 12726 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Br 240690a_100000209980_100000744433 [0,2,0,0,0,0|0,1,0]=3 12727 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Br 527a_100000209980_100000744433 [0,2,0,0,0,0|0,1,0]=3 12728 B15R1.3309 COCCNC(=O)c1ccc(cc1O)C 1626a_100000209980_100000212137 [0,2,0,0,0,0|1,0,0]=3 12729 B15R1.3309 COCCNC(=O)c1ccc(cc1O)C 240690a_100000209980_100000212137 [0,2,0,0,0,0|1,0,0]=3 12730 B15R1.3309 COCCNC(=O)c1ccc(cc1O)C 527a_100000209980_100000212137 [0,2,0,0,0,0|1,0,0]=3 12731 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Cl 240690a_100000209980_100000188622 [0,2,0,0,0,0|0,0,0]=2 12732 B15R1.3309 COCCNC(=O)c1ccc(cc1O)Cl 527a_100000209980_100000188622 [0,2,0,0,0,0|0,0,0]=2 12733 B15R1.3309 COCCNC(=O)c1ccc(cc1O)F 240690a_100000209980_100000746061 [0,2,0,0,0,0|0,1,0]=3 12734 B15R1.3309 COCCNC(=O)c1ccc(cc1O)F 527a_100000209980_100000746061 [0,2,0,0,0,0|0,1,0]=3 12735 B15R1.3309 COCCNC(=O)c1ccc(cc1O)I 240690a_100000209980_100000091984 [0,2,0,0,0,0|0,1,0]=3 12736 B15R1.3309 COCCNC(=O)c1ccc(cc1O)I 527a_100000209980_100000091984 [0,2,0,0,0,0|0,1,0]=3 12737 B15R1.3309 COCCNC(C)c1ccc(cc1Br)Cl 269862a_100000209980_100011934292 [0,2,0,0,0,0|1,0,1]=4 12738 B15R1.3309 COCCNC(C)c1ccc(cc1C)Cl 269862a_100000209980_100011998434 [0,2,0,0,0,0|1,0,1]=4 12739 B15R1.3309 COCCNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_100011201679 [0,2,0,0,0,0|1,0,1]=4 12740 B15R1.3309 COCCNC(C)c1ccc(cc1Cl)Cl 269862a_100000209980_100000210972 [0,2,0,0,0,0|1,0,1]=4 12741 B15R1.3309 COCCNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_100011201679 [0,2,0,0,0,0|1,0,1]=4 12742 B15R1.3309 COCCNC(C)c1ccc(cc1F)Cl 269862a_100000209980_100011805184 [0,2,0,0,0,0|1,0,1]=4 12743 B15R1.3309 COCCNC(C)c1ccc(cc1O)Cl 269862a_100000209980_100000061402 [0,2,0,0,0,0|1,0,1]=4 12744 B15R1.3309 COCCN[C@@H](C)c1ccc(cc1C)Cl 2230a_100020633667_100011201679 [0,2,0,0,0,0|1,0,1]=4 12745 B15R1.3309 COCCN[C@@H](C)c1ccc(cc1C)Cl 34a_100020633667_100011201679 [0,2,0,0,0,0|1,0,1]=4 12746 B15R1.3309 COCSCC(=O)c1ccc(cc1Cl)Cl 62a_100011218845_100000766300 [0,2,0,0,0,0|2,0,0]=4 12747 B15R1.3309 COCSCC(=O)c1ccc(cc1F)Cl 62a_100000766300_100012351891 [0,2,0,0,0,0|2,0,0]=4 12748 B15R1.3309 COCSCC(=O)c1ccc(cc1F)Cl 62a_100012351891_100000766300 [0,2,0,0,0,0|2,0,0]=4 12749 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 11a_100020590264_100000762965 [0,2,0,0,0,0|0,2,0]=4 12750 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 1626a_100020590264_100000762965 [0,2,0,0,0,0|0,2,0]=4 12751 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 240690a_100020590264_100000762965 [0,2,0,0,0,0|0,2,0]=4 12752 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Br 527a_100020590264_100000762965 [0,2,0,0,0,0|0,2,0]=4 12753 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 11a_100020590264_100000685072 [0,2,0,0,0,0|1,1,0]=4 12754 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 1626a_100020590264_100000685072 [0,2,0,0,0,0|1,1,0]=4 12755 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 240690a_100020590264_100000685072 [0,2,0,0,0,0|1,1,0]=4 12756 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)C 527a_100020590264_100000685072 [0,2,0,0,0,0|1,1,0]=4 12757 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 11a_100020590264_100000766353 [0,2,0,0,0,0|0,1,0]=3 12758 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 1626a_100020590264_100000766353 [0,2,0,0,0,0|0,1,0]=3 12759 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 240690a_100020590264_100000766353 [0,2,0,0,0,0|0,1,0]=3 12760 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)Cl 527a_100020590264_100000766353 [0,2,0,0,0,0|0,1,0]=3 12761 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 11a_100020590264_100000212304 [0,2,0,0,0,0|0,2,0]=4 12762 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 1626a_100020590264_100000212304 [0,2,0,0,0,0|0,2,0]=4 12763 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 240690a_100020590264_100000212304 [0,2,0,0,0,0|0,2,0]=4 12764 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)F 527a_100020590264_100000212304 [0,2,0,0,0,0|0,2,0]=4 12765 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 11a_100020590264_100012360512 [0,2,0,0,0,0|0,2,0]=4 12766 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 1626a_100020590264_100012360512 [0,2,0,0,0,0|0,2,0]=4 12767 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 240690a_100020590264_100012360512 [0,2,0,0,0,0|0,2,0]=4 12768 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)I 527a_100020590264_100012360512 [0,2,0,0,0,0|0,2,0]=4 12769 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)O 240690a_100020590264_100012344906 [0,2,0,0,0,0|1,1,0]=4 12770 B15R1.3309 CSCCNC(=O)c1ccc(cc1Br)O 527a_100020590264_100012344906 [0,2,0,0,0,0|1,1,0]=4 12771 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 11a_100020590264_100000741311 [0,2,0,0,0,0|0,2,0]=4 12772 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 1626a_100020590264_100000741311 [0,2,0,0,0,0|0,2,0]=4 12773 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 240690a_100020590264_100000741311 [0,2,0,0,0,0|0,2,0]=4 12774 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Br 527a_100020590264_100000741311 [0,2,0,0,0,0|0,2,0]=4 12775 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 11a_100020590264_100000211164 [0,2,0,0,0,0|1,1,0]=4 12776 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 1626a_100020590264_100000211164 [0,2,0,0,0,0|1,1,0]=4 12777 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 240690a_100020590264_100000211164 [0,2,0,0,0,0|1,1,0]=4 12778 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)C 527a_100020590264_100000211164 [0,2,0,0,0,0|1,1,0]=4 12779 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 11a_100020590264_100000688705 [0,2,0,0,0,0|0,1,0]=3 12780 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 1626a_100020590264_100000688705 [0,2,0,0,0,0|0,1,0]=3 12781 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 240690a_100020590264_100000688705 [0,2,0,0,0,0|0,1,0]=3 12782 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)Cl 527a_100020590264_100000688705 [0,2,0,0,0,0|0,1,0]=3 12783 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 11a_100020590264_100000686989 [0,2,0,0,0,0|0,2,0]=4 12784 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 1626a_100020590264_100000686989 [0,2,0,0,0,0|0,2,0]=4 12785 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 240690a_100020590264_100000686989 [0,2,0,0,0,0|0,2,0]=4 12786 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)F 527a_100020590264_100000686989 [0,2,0,0,0,0|0,2,0]=4 12787 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 11a_100020590264_100010189873 [0,2,0,0,0,0|0,2,0]=4 12788 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 1626a_100020590264_100010189873 [0,2,0,0,0,0|0,2,0]=4 12789 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 240690a_100020590264_100010189873 [0,2,0,0,0,0|0,2,0]=4 12790 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)I 527a_100020590264_100010189873 [0,2,0,0,0,0|0,2,0]=4 12791 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)O 240690a_100020590264_100000692822 [0,2,0,0,0,0|1,1,0]=4 12792 B15R1.3309 CSCCNC(=O)c1ccc(cc1C)O 527a_100020590264_100000692822 [0,2,0,0,0,0|1,1,0]=4 12793 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 11a_100020590264_100000741628 [0,2,0,0,0,0|0,2,0]=4 12794 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 1626a_100020590264_100000741628 [0,2,0,0,0,0|0,2,0]=4 12795 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 240690a_100020590264_100000741628 [0,2,0,0,0,0|0,2,0]=4 12796 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Br 527a_100020590264_100000741628 [0,2,0,0,0,0|0,2,0]=4 12797 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 11a_100020590264_100000766932 [0,2,0,0,0,0|1,1,0]=4 12798 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 1626a_100020590264_100000766932 [0,2,0,0,0,0|1,1,0]=4 12799 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 240690a_100020590264_100000766932 [0,2,0,0,0,0|1,1,0]=4 12800 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)C 527a_100020590264_100000766932 [0,2,0,0,0,0|1,1,0]=4 12801 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 11a_100020590264_100000185840 [0,2,0,0,0,0|0,1,0]=3 12802 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100020590264_100000185840 [0,2,0,0,0,0|0,1,0]=3 12803 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100020590264_100000185840 [0,2,0,0,0,0|0,1,0]=3 12804 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)Cl 527a_100020590264_100000185840 [0,2,0,0,0,0|0,1,0]=3 12805 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 11a_100020590264_100000211397 [0,2,0,0,0,0|0,2,0]=4 12806 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 1626a_100020590264_100000211397 [0,2,0,0,0,0|0,2,0]=4 12807 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 240690a_100020590264_100000211397 [0,2,0,0,0,0|0,2,0]=4 12808 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)F 527a_100020590264_100000211397 [0,2,0,0,0,0|0,2,0]=4 12809 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 11a_100020590264_100000751301 [0,2,0,0,0,0|0,2,0]=4 12810 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 1626a_100020590264_100000751301 [0,2,0,0,0,0|0,2,0]=4 12811 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 240690a_100020590264_100000751301 [0,2,0,0,0,0|0,2,0]=4 12812 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)I 527a_100020590264_100000751301 [0,2,0,0,0,0|0,2,0]=4 12813 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)O 240690a_100020590264_100000702456 [0,2,0,0,0,0|1,1,0]=4 12814 B15R1.3309 CSCCNC(=O)c1ccc(cc1Cl)O 527a_100020590264_100000702456 [0,2,0,0,0,0|1,1,0]=4 12815 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 11a_100020590264_100000214689 [0,2,0,0,0,0|0,2,0]=4 12816 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 1626a_100020590264_100000214689 [0,2,0,0,0,0|0,2,0]=4 12817 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 240690a_100020590264_100000214689 [0,2,0,0,0,0|0,2,0]=4 12818 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Br 527a_100020590264_100000214689 [0,2,0,0,0,0|0,2,0]=4 12819 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 11a_100020590264_100000766033 [0,2,0,0,0,0|1,1,0]=4 12820 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 1626a_100020590264_100000766033 [0,2,0,0,0,0|1,1,0]=4 12821 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 240690a_100020590264_100000766033 [0,2,0,0,0,0|1,1,0]=4 12822 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)C 527a_100020590264_100000766033 [0,2,0,0,0,0|1,1,0]=4 12823 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 11a_100020590264_100000212326 [0,2,0,0,0,0|0,1,0]=3 12824 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 1626a_100020590264_100000212326 [0,2,0,0,0,0|0,1,0]=3 12825 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 240690a_100020590264_100000212326 [0,2,0,0,0,0|0,1,0]=3 12826 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)Cl 527a_100020590264_100000212326 [0,2,0,0,0,0|0,1,0]=3 12827 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 11a_100020590264_100000211022 [0,2,0,0,0,0|0,2,0]=4 12828 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 1626a_100020590264_100000211022 [0,2,0,0,0,0|0,2,0]=4 12829 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 240690a_100020590264_100000211022 [0,2,0,0,0,0|0,2,0]=4 12830 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)F 527a_100020590264_100000211022 [0,2,0,0,0,0|0,2,0]=4 12831 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 11a_100020590264_100000037189 [0,2,0,0,0,0|0,2,0]=4 12832 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 1626a_100020590264_100000037189 [0,2,0,0,0,0|0,2,0]=4 12833 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 240690a_100020590264_100000037189 [0,2,0,0,0,0|0,2,0]=4 12834 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)I 527a_100020590264_100000037189 [0,2,0,0,0,0|0,2,0]=4 12835 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)O 240690a_100020590264_100000689029 [0,2,0,0,0,0|1,1,0]=4 12836 B15R1.3309 CSCCNC(=O)c1ccc(cc1F)O 527a_100020590264_100000689029 [0,2,0,0,0,0|1,1,0]=4 12837 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 11a_100020590264_100000751167 [0,2,0,0,0,0|0,2,0]=4 12838 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 1626a_100020590264_100000751167 [0,2,0,0,0,0|0,2,0]=4 12839 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 240690a_100020590264_100000751167 [0,2,0,0,0,0|0,2,0]=4 12840 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Br 527a_100020590264_100000751167 [0,2,0,0,0,0|0,2,0]=4 12841 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 11a_100020590264_100009999607 [0,2,0,0,0,0|1,1,0]=4 12842 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 1626a_100020590264_100009999607 [0,2,0,0,0,0|1,1,0]=4 12843 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 240690a_100020590264_100009999607 [0,2,0,0,0,0|1,1,0]=4 12844 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)C 527a_100020590264_100009999607 [0,2,0,0,0,0|1,1,0]=4 12845 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 11a_100020590264_100000739380 [0,2,0,0,0,0|0,1,0]=3 12846 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 1626a_100020590264_100000739380 [0,2,0,0,0,0|0,1,0]=3 12847 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 240690a_100020590264_100000739380 [0,2,0,0,0,0|0,1,0]=3 12848 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)Cl 527a_100020590264_100000739380 [0,2,0,0,0,0|0,1,0]=3 12849 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 11a_100020590264_100000739341 [0,2,0,0,0,0|0,2,0]=4 12850 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 1626a_100020590264_100000739341 [0,2,0,0,0,0|0,2,0]=4 12851 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 240690a_100020590264_100000739341 [0,2,0,0,0,0|0,2,0]=4 12852 B15R1.3309 CSCCNC(=O)c1ccc(cc1I)F 527a_100020590264_100000739341 [0,2,0,0,0,0|0,2,0]=4 12853 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Br 240690a_100020590264_100000744433 [0,2,0,0,0,0|0,2,0]=4 12854 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Br 527a_100020590264_100000744433 [0,2,0,0,0,0|0,2,0]=4 12855 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)C 1626a_100020590264_100000212137 [0,2,0,0,0,0|1,1,0]=4 12856 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)C 240690a_100020590264_100000212137 [0,2,0,0,0,0|1,1,0]=4 12857 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)C 527a_100020590264_100000212137 [0,2,0,0,0,0|1,1,0]=4 12858 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Cl 11a_100020590264_100000188622 [0,2,0,0,0,0|0,1,0]=3 12859 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Cl 240690a_100020590264_100000188622 [0,2,0,0,0,0|0,1,0]=3 12860 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)Cl 527a_100020590264_100000188622 [0,2,0,0,0,0|0,1,0]=3 12861 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)F 240690a_100020590264_100000746061 [0,2,0,0,0,0|0,2,0]=4 12862 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)F 527a_100020590264_100000746061 [0,2,0,0,0,0|0,2,0]=4 12863 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)I 240690a_100020590264_100000091984 [0,2,0,0,0,0|0,2,0]=4 12864 B15R1.3309 CSCCNC(=O)c1ccc(cc1O)I 527a_100020590264_100000091984 [0,2,0,0,0,0|0,2,0]=4 12865 B15R1.3309 Cc1cc(ccc1C(=O)CC#CCO)Cl 1458a_100000688705_200000047223 [0,2,0,0,0,0|1,0,1]=4 12866 B15R1.3309 Cc1cc(ccc1C(=O)CCCC#N)Cl 1458a_100000688705_100000211468 [0,2,0,0,0,0|2,0,0]=4 12867 B15R1.3309 Cc1cc(ccc1C(=O)CCCCF)Cl 1458a_100000688705_100000729493 [0,2,0,0,0,0|2,0,0]=4 12868 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)Br 1458a_100000741311_100000210776 [0,2,0,0,0,0|1,1,0]=4 12869 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)Cl 1458a_100000688705_100000210776 [0,2,0,0,0,0|1,0,0]=3 12870 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)F 1458a_100000686989_100000210776 [0,2,0,0,0,0|1,1,0]=4 12871 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)I 1458a_100010189873_100000210776 [0,2,0,0,0,0|1,1,0]=4 12872 B15R1.3309 Cc1cc(ccc1C(=O)CCCCO)O 1458a_100000692822_100000210776 [0,2,0,0,0,0|2,0,0]=4 12873 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Br 11a_100000720768_100000741311 [0,2,0,0,0,0|1,1,0]=4 12874 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Br 1626a_100000720768_100000741311 [0,2,0,0,0,0|1,1,0]=4 12875 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Br 240690a_100000720768_100000741311 [0,2,0,0,0,0|1,1,0]=4 12876 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Br 527a_100000720768_100000741311 [0,2,0,0,0,0|1,1,0]=4 12877 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Cl 11a_100000720768_100000688705 [0,2,0,0,0,0|1,0,0]=3 12878 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Cl 1626a_100000720768_100000688705 [0,2,0,0,0,0|1,0,0]=3 12879 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Cl 240690a_100000720768_100000688705 [0,2,0,0,0,0|1,0,0]=3 12880 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)Cl 527a_100000720768_100000688705 [0,2,0,0,0,0|1,0,0]=3 12881 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)F 11a_100000720768_100000686989 [0,2,0,0,0,0|1,1,0]=4 12882 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)F 1626a_100000720768_100000686989 [0,2,0,0,0,0|1,1,0]=4 12883 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)F 240690a_100000720768_100000686989 [0,2,0,0,0,0|1,1,0]=4 12884 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)F 527a_100000720768_100000686989 [0,2,0,0,0,0|1,1,0]=4 12885 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)I 11a_100000720768_100010189873 [0,2,0,0,0,0|1,1,0]=4 12886 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)I 1626a_100000720768_100010189873 [0,2,0,0,0,0|1,1,0]=4 12887 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)I 240690a_100000720768_100010189873 [0,2,0,0,0,0|1,1,0]=4 12888 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)I 527a_100000720768_100010189873 [0,2,0,0,0,0|1,1,0]=4 12889 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)O 240690a_100000720768_100000692822 [0,2,0,0,0,0|2,0,0]=4 12890 B15R1.3309 Cc1cc(ccc1C(=O)NCCC#N)O 527a_100000720768_100000692822 [0,2,0,0,0,0|2,0,0]=4 12891 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 11a_100015189416_100000741311 [0,2,0,0,0,0|1,1,0]=4 12892 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 1626a_100015189416_100000741311 [0,2,0,0,0,0|1,1,0]=4 12893 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 240690a_100015189416_100000741311 [0,2,0,0,0,0|1,1,0]=4 12894 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Br 527a_100015189416_100000741311 [0,2,0,0,0,0|1,1,0]=4 12895 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 11a_100015189416_100000688705 [0,2,0,0,0,0|1,0,0]=3 12896 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 1626a_100015189416_100000688705 [0,2,0,0,0,0|1,0,0]=3 12897 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 240690a_100015189416_100000688705 [0,2,0,0,0,0|1,0,0]=3 12898 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)Cl 527a_100015189416_100000688705 [0,2,0,0,0,0|1,0,0]=3 12899 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 11a_100015189416_100000686989 [0,2,0,0,0,0|1,1,0]=4 12900 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 1626a_100015189416_100000686989 [0,2,0,0,0,0|1,1,0]=4 12901 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 240690a_100015189416_100000686989 [0,2,0,0,0,0|1,1,0]=4 12902 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)F 527a_100015189416_100000686989 [0,2,0,0,0,0|1,1,0]=4 12903 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 11a_100015189416_100010189873 [0,2,0,0,0,0|1,1,0]=4 12904 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 1626a_100015189416_100010189873 [0,2,0,0,0,0|1,1,0]=4 12905 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 240690a_100015189416_100010189873 [0,2,0,0,0,0|1,1,0]=4 12906 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)I 527a_100015189416_100010189873 [0,2,0,0,0,0|1,1,0]=4 12907 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)O 240690a_100015189416_100000692822 [0,2,0,0,0,0|2,0,0]=4 12908 B15R1.3309 Cc1cc(ccc1C(=O)NCCCF)O 527a_100015189416_100000692822 [0,2,0,0,0,0|2,0,0]=4 12909 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Br 240690a_100000182051_100000741311 [0,2,0,0,0,0|0,1,0]=3 12910 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Br 527a_100000182051_100000741311 [0,2,0,0,0,0|0,1,0]=3 12911 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Cl 240690a_100000182051_100000688705 [0,2,0,0,0,0|0,0,0]=2 12912 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)Cl 527a_100000182051_100000688705 [0,2,0,0,0,0|0,0,0]=2 12913 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)F 240690a_100000182051_100000686989 [0,2,0,0,0,0|0,1,0]=3 12914 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)F 527a_100000182051_100000686989 [0,2,0,0,0,0|0,1,0]=3 12915 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)I 240690a_100000182051_100010189873 [0,2,0,0,0,0|0,1,0]=3 12916 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)I 527a_100000182051_100010189873 [0,2,0,0,0,0|0,1,0]=3 12917 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)O 240690a_100000182051_100000692822 [0,2,0,0,0,0|1,0,0]=3 12918 B15R1.3309 Cc1cc(ccc1C(=O)NCCCO)O 527a_100000182051_100000692822 [0,2,0,0,0,0|1,0,0]=3 12919 B15R1.3309 Cc1cc(ccc1C(=O)NNCCO)Br 22a_100000210001_100000741311 [0,2,0,0,0,0|0,1,0]=3 12920 B15R1.3309 Cc1cc(ccc1C(=O)NNCCO)Cl 22a_100000210001_100000688705 [0,2,0,0,0,0|0,0,0]=2 12921 B15R1.3309 Cc1cc(ccc1C(=O)NNCCO)F 22a_100000210001_100000686989 [0,2,0,0,0,0|0,1,0]=3 12922 B15R1.3309 Cc1cc(ccc1C(=O)NNCCO)I 22a_100000210001_100010189873 [0,2,0,0,0,0|0,1,0]=3 12923 B15R1.3309 Cc1cc(ccc1C(C)NCCCO)Cl 269862a_100000182051_100011998434 [0,2,0,0,0,0|1,0,1]=4 12924 B15R1.3309 Cc1cc(ccc1[C@H](C)NCCCO)Cl 2230a_100020633667_100000230001 [0,2,0,0,0,0|1,0,1]=4 12925 B15R1.3309 Cc1cc(ccc1[C@H](C)NCCCO)Cl 34a_100020633667_100000230001 [0,2,0,0,0,0|1,0,1]=4 12926 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)CCCCO 1458a_100000685072_100000210776 [0,2,0,0,0,0|2,0,0]=4 12927 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCC#N 11a_100000720768_100000685072 [0,2,0,0,0,0|2,0,0]=4 12928 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCC#N 1626a_100000720768_100000685072 [0,2,0,0,0,0|2,0,0]=4 12929 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCC#N 240690a_100000720768_100000685072 [0,2,0,0,0,0|2,0,0]=4 12930 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCC#N 527a_100000720768_100000685072 [0,2,0,0,0,0|2,0,0]=4 12931 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 11a_100015189416_100000685072 [0,2,0,0,0,0|2,0,0]=4 12932 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 1626a_100015189416_100000685072 [0,2,0,0,0,0|2,0,0]=4 12933 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 240690a_100015189416_100000685072 [0,2,0,0,0,0|2,0,0]=4 12934 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCF 527a_100015189416_100000685072 [0,2,0,0,0,0|2,0,0]=4 12935 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCO 240690a_100000182051_100000685072 [0,2,0,0,0,0|1,0,0]=3 12936 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NCCCO 527a_100000182051_100000685072 [0,2,0,0,0,0|1,0,0]=3 12937 B15R1.3309 Cc1ccc(c(c1)Br)C(=O)NNCCO 22a_100000210001_100000685072 [0,2,0,0,0,0|1,0,0]=3 12938 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CCCCO 1458a_100000211164_100000210776 [0,2,0,0,0,0|2,0,0]=4 12939 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CNCCF 34a_100000724931_100000229959 [0,2,0,0,0,0|2,0,0]=4 12940 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CNCCO 2230a_100016997473_100000229959 [0,2,0,0,0,0|1,0,0]=3 12941 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CNCCO 34a_100016990907_100000229959 [0,2,0,0,0,0|1,0,0]=3 12942 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CSCCO 62a_100000211926_100000229959 [0,2,0,0,0,0|2,0,0]=4 12943 B15R1.3309 Cc1ccc(c(c1)C)C(=O)CSCCO 62a_100000229959_100000211926 [0,2,0,0,0,0|2,0,0]=4 12944 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCC#N 11a_100000720768_100000211164 [0,2,0,0,0,0|2,0,0]=4 12945 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCC#N 1626a_100000720768_100000211164 [0,2,0,0,0,0|2,0,0]=4 12946 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCC#N 240690a_100000720768_100000211164 [0,2,0,0,0,0|2,0,0]=4 12947 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCC#N 527a_100000720768_100000211164 [0,2,0,0,0,0|2,0,0]=4 12948 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 11a_100015189416_100000211164 [0,2,0,0,0,0|2,0,0]=4 12949 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 1626a_100015189416_100000211164 [0,2,0,0,0,0|2,0,0]=4 12950 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 240690a_100015189416_100000211164 [0,2,0,0,0,0|2,0,0]=4 12951 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCF 527a_100015189416_100000211164 [0,2,0,0,0,0|2,0,0]=4 12952 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCO 240690a_100000182051_100000211164 [0,2,0,0,0,0|1,0,0]=3 12953 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NCCCO 527a_100000182051_100000211164 [0,2,0,0,0,0|1,0,0]=3 12954 B15R1.3309 Cc1ccc(c(c1)C)C(=O)NNCCO 22a_100000210001_100000211164 [0,2,0,0,0,0|1,0,0]=3 12955 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)CCCCO 1458a_100000766932_100000210776 [0,2,0,0,0,0|2,0,0]=4 12956 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCC#N 11a_100000720768_100000766932 [0,2,0,0,0,0|2,0,0]=4 12957 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCC#N 1626a_100000720768_100000766932 [0,2,0,0,0,0|2,0,0]=4 12958 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCC#N 240690a_100000720768_100000766932 [0,2,0,0,0,0|2,0,0]=4 12959 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCC#N 527a_100000720768_100000766932 [0,2,0,0,0,0|2,0,0]=4 12960 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 11a_100015189416_100000766932 [0,2,0,0,0,0|2,0,0]=4 12961 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 1626a_100015189416_100000766932 [0,2,0,0,0,0|2,0,0]=4 12962 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 240690a_100015189416_100000766932 [0,2,0,0,0,0|2,0,0]=4 12963 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCF 527a_100015189416_100000766932 [0,2,0,0,0,0|2,0,0]=4 12964 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCO 240690a_100000182051_100000766932 [0,2,0,0,0,0|1,0,0]=3 12965 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NCCCO 527a_100000182051_100000766932 [0,2,0,0,0,0|1,0,0]=3 12966 B15R1.3309 Cc1ccc(c(c1)Cl)C(=O)NNCCO 22a_100000210001_100000766932 [0,2,0,0,0,0|1,0,0]=3 12967 B15R1.3309 Cc1ccc(c(c1)F)C(=O)CCCCO 1458a_100000766033_100000210776 [0,2,0,0,0,0|2,0,0]=4 12968 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCC#N 11a_100000720768_100000766033 [0,2,0,0,0,0|2,0,0]=4 12969 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCC#N 1626a_100000720768_100000766033 [0,2,0,0,0,0|2,0,0]=4 12970 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCC#N 240690a_100000720768_100000766033 [0,2,0,0,0,0|2,0,0]=4 12971 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCC#N 527a_100000720768_100000766033 [0,2,0,0,0,0|2,0,0]=4 12972 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 11a_100015189416_100000766033 [0,2,0,0,0,0|2,0,0]=4 12973 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 1626a_100015189416_100000766033 [0,2,0,0,0,0|2,0,0]=4 12974 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 240690a_100015189416_100000766033 [0,2,0,0,0,0|2,0,0]=4 12975 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCF 527a_100015189416_100000766033 [0,2,0,0,0,0|2,0,0]=4 12976 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCO 240690a_100000182051_100000766033 [0,2,0,0,0,0|1,0,0]=3 12977 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NCCCO 527a_100000182051_100000766033 [0,2,0,0,0,0|1,0,0]=3 12978 B15R1.3309 Cc1ccc(c(c1)F)C(=O)NNCCO 22a_100000210001_100000766033 [0,2,0,0,0,0|1,0,0]=3 12979 B15R1.3309 Cc1ccc(c(c1)I)C(=O)CCCCO 1458a_100009999607_100000210776 [0,2,0,0,0,0|2,0,0]=4 12980 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCC#N 11a_100000720768_100009999607 [0,2,0,0,0,0|2,0,0]=4 12981 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCC#N 1626a_100000720768_100009999607 [0,2,0,0,0,0|2,0,0]=4 12982 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCC#N 240690a_100000720768_100009999607 [0,2,0,0,0,0|2,0,0]=4 12983 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCC#N 527a_100000720768_100009999607 [0,2,0,0,0,0|2,0,0]=4 12984 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 11a_100015189416_100009999607 [0,2,0,0,0,0|2,0,0]=4 12985 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 1626a_100015189416_100009999607 [0,2,0,0,0,0|2,0,0]=4 12986 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 240690a_100015189416_100009999607 [0,2,0,0,0,0|2,0,0]=4 12987 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCF 527a_100015189416_100009999607 [0,2,0,0,0,0|2,0,0]=4 12988 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCO 240690a_100000182051_100009999607 [0,2,0,0,0,0|1,0,0]=3 12989 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NCCCO 527a_100000182051_100009999607 [0,2,0,0,0,0|1,0,0]=3 12990 B15R1.3309 Cc1ccc(c(c1)I)C(=O)NNCCO 22a_100000210001_100009999607 [0,2,0,0,0,0|1,0,0]=3 12991 B15R1.3309 Cc1ccc(c(c1)O)C(=O)CCCCO 1458a_100000212137_100000210776 [0,2,0,0,0,0|2,0,0]=4 12992 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCC#N 1626a_100000720768_100000212137 [0,2,0,0,0,0|2,0,0]=4 12993 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCC#N 240690a_100000720768_100000212137 [0,2,0,0,0,0|2,0,0]=4 12994 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCC#N 527a_100000720768_100000212137 [0,2,0,0,0,0|2,0,0]=4 12995 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCF 1626a_100015189416_100000212137 [0,2,0,0,0,0|2,0,0]=4 12996 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCF 240690a_100015189416_100000212137 [0,2,0,0,0,0|2,0,0]=4 12997 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCF 527a_100015189416_100000212137 [0,2,0,0,0,0|2,0,0]=4 12998 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCO 240690a_100000182051_100000212137 [0,2,0,0,0,0|1,0,0]=3 12999 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NCCCO 527a_100000182051_100000212137 [0,2,0,0,0,0|1,0,0]=3 13000 B15R1.3309 Cc1ccc(c(c1)O)C(=O)NNCCO 22a_100000210001_100000212137 [0,2,0,0,0,0|1,0,0]=3 13001 B15R1.3309 N#CCCCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000211468 [0,2,0,0,0,0|2,0,0]=4 13002 B15R1.3309 N#CCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000211468 [0,2,0,0,0,0|2,0,0]=4 13003 B15R1.3309 N#CCCCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000211468 [0,2,0,0,0,0|2,0,0]=4 13004 B15R1.3309 N#CCCCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000211468 [0,2,0,0,0,0|2,0,0]=4 13005 B15R1.3309 N#CCCCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000211468 [0,2,0,0,0,0|2,0,0]=4 13006 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Br 11a_100000720768_100000762965 [0,2,0,0,0,0|1,1,0]=4 13007 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Br 1626a_100000720768_100000762965 [0,2,0,0,0,0|1,1,0]=4 13008 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Br 240690a_100000720768_100000762965 [0,2,0,0,0,0|1,1,0]=4 13009 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Br 527a_100000720768_100000762965 [0,2,0,0,0,0|1,1,0]=4 13010 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Cl 11a_100000720768_100000766353 [0,2,0,0,0,0|1,0,0]=3 13011 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Cl 1626a_100000720768_100000766353 [0,2,0,0,0,0|1,0,0]=3 13012 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Cl 240690a_100000720768_100000766353 [0,2,0,0,0,0|1,0,0]=3 13013 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)Cl 527a_100000720768_100000766353 [0,2,0,0,0,0|1,0,0]=3 13014 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)F 11a_100000720768_100000212304 [0,2,0,0,0,0|1,1,0]=4 13015 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)F 1626a_100000720768_100000212304 [0,2,0,0,0,0|1,1,0]=4 13016 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)F 240690a_100000720768_100000212304 [0,2,0,0,0,0|1,1,0]=4 13017 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)F 527a_100000720768_100000212304 [0,2,0,0,0,0|1,1,0]=4 13018 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)I 11a_100000720768_100012360512 [0,2,0,0,0,0|1,1,0]=4 13019 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)I 1626a_100000720768_100012360512 [0,2,0,0,0,0|1,1,0]=4 13020 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)I 240690a_100000720768_100012360512 [0,2,0,0,0,0|1,1,0]=4 13021 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)I 527a_100000720768_100012360512 [0,2,0,0,0,0|1,1,0]=4 13022 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)O 240690a_100000720768_100012344906 [0,2,0,0,0,0|2,0,0]=4 13023 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Br)O 527a_100000720768_100012344906 [0,2,0,0,0,0|2,0,0]=4 13024 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Br 11a_100000720768_100000741628 [0,2,0,0,0,0|1,1,0]=4 13025 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Br 1626a_100000720768_100000741628 [0,2,0,0,0,0|1,1,0]=4 13026 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Br 240690a_100000720768_100000741628 [0,2,0,0,0,0|1,1,0]=4 13027 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Br 527a_100000720768_100000741628 [0,2,0,0,0,0|1,1,0]=4 13028 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Cl 11a_100000720768_100000185840 [0,2,0,0,0,0|1,0,0]=3 13029 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Cl 1626a_100000720768_100000185840 [0,2,0,0,0,0|1,0,0]=3 13030 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Cl 240690a_100000720768_100000185840 [0,2,0,0,0,0|1,0,0]=3 13031 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)Cl 527a_100000720768_100000185840 [0,2,0,0,0,0|1,0,0]=3 13032 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)F 11a_100000720768_100000211397 [0,2,0,0,0,0|1,1,0]=4 13033 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)F 1626a_100000720768_100000211397 [0,2,0,0,0,0|1,1,0]=4 13034 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)F 240690a_100000720768_100000211397 [0,2,0,0,0,0|1,1,0]=4 13035 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)F 527a_100000720768_100000211397 [0,2,0,0,0,0|1,1,0]=4 13036 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)I 11a_100000720768_100000751301 [0,2,0,0,0,0|1,1,0]=4 13037 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)I 1626a_100000720768_100000751301 [0,2,0,0,0,0|1,1,0]=4 13038 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)I 240690a_100000720768_100000751301 [0,2,0,0,0,0|1,1,0]=4 13039 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)I 527a_100000720768_100000751301 [0,2,0,0,0,0|1,1,0]=4 13040 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)O 240690a_100000720768_100000702456 [0,2,0,0,0,0|2,0,0]=4 13041 B15R1.3309 N#CCCNC(=O)c1ccc(cc1Cl)O 527a_100000720768_100000702456 [0,2,0,0,0,0|2,0,0]=4 13042 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Br 11a_100000720768_100000214689 [0,2,0,0,0,0|1,1,0]=4 13043 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Br 1626a_100000720768_100000214689 [0,2,0,0,0,0|1,1,0]=4 13044 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Br 240690a_100000720768_100000214689 [0,2,0,0,0,0|1,1,0]=4 13045 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Br 527a_100000720768_100000214689 [0,2,0,0,0,0|1,1,0]=4 13046 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Cl 11a_100000720768_100000212326 [0,2,0,0,0,0|1,0,0]=3 13047 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Cl 1626a_100000720768_100000212326 [0,2,0,0,0,0|1,0,0]=3 13048 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Cl 240690a_100000720768_100000212326 [0,2,0,0,0,0|1,0,0]=3 13049 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)Cl 527a_100000720768_100000212326 [0,2,0,0,0,0|1,0,0]=3 13050 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)F 11a_100000720768_100000211022 [0,2,0,0,0,0|1,1,0]=4 13051 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)F 1626a_100000720768_100000211022 [0,2,0,0,0,0|1,1,0]=4 13052 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)F 240690a_100000720768_100000211022 [0,2,0,0,0,0|1,1,0]=4 13053 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)F 527a_100000720768_100000211022 [0,2,0,0,0,0|1,1,0]=4 13054 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)I 11a_100000720768_100000037189 [0,2,0,0,0,0|1,1,0]=4 13055 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)I 1626a_100000720768_100000037189 [0,2,0,0,0,0|1,1,0]=4 13056 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)I 240690a_100000720768_100000037189 [0,2,0,0,0,0|1,1,0]=4 13057 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)I 527a_100000720768_100000037189 [0,2,0,0,0,0|1,1,0]=4 13058 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)O 240690a_100000720768_100000689029 [0,2,0,0,0,0|2,0,0]=4 13059 B15R1.3309 N#CCCNC(=O)c1ccc(cc1F)O 527a_100000720768_100000689029 [0,2,0,0,0,0|2,0,0]=4 13060 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Br 11a_100000720768_100000751167 [0,2,0,0,0,0|1,1,0]=4 13061 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Br 1626a_100000720768_100000751167 [0,2,0,0,0,0|1,1,0]=4 13062 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Br 240690a_100000720768_100000751167 [0,2,0,0,0,0|1,1,0]=4 13063 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Br 527a_100000720768_100000751167 [0,2,0,0,0,0|1,1,0]=4 13064 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Cl 11a_100000720768_100000739380 [0,2,0,0,0,0|1,0,0]=3 13065 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Cl 1626a_100000720768_100000739380 [0,2,0,0,0,0|1,0,0]=3 13066 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Cl 240690a_100000720768_100000739380 [0,2,0,0,0,0|1,0,0]=3 13067 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)Cl 527a_100000720768_100000739380 [0,2,0,0,0,0|1,0,0]=3 13068 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)F 11a_100000720768_100000739341 [0,2,0,0,0,0|1,1,0]=4 13069 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)F 1626a_100000720768_100000739341 [0,2,0,0,0,0|1,1,0]=4 13070 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)F 240690a_100000720768_100000739341 [0,2,0,0,0,0|1,1,0]=4 13071 B15R1.3309 N#CCCNC(=O)c1ccc(cc1I)F 527a_100000720768_100000739341 [0,2,0,0,0,0|1,1,0]=4 13072 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Br 240690a_100000720768_100000744433 [0,2,0,0,0,0|1,1,0]=4 13073 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Br 527a_100000720768_100000744433 [0,2,0,0,0,0|1,1,0]=4 13074 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Cl 11a_100000720768_100000188622 [0,2,0,0,0,0|1,0,0]=3 13075 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Cl 240690a_100000720768_100000188622 [0,2,0,0,0,0|1,0,0]=3 13076 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)Cl 527a_100000720768_100000188622 [0,2,0,0,0,0|1,0,0]=3 13077 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)F 240690a_100000720768_100000746061 [0,2,0,0,0,0|1,1,0]=4 13078 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)F 527a_100000720768_100000746061 [0,2,0,0,0,0|1,1,0]=4 13079 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)I 240690a_100000720768_100000091984 [0,2,0,0,0,0|1,1,0]=4 13080 B15R1.3309 N#CCCNC(=O)c1ccc(cc1O)I 527a_100000720768_100000091984 [0,2,0,0,0,0|1,1,0]=4 13081 B15R1.3309 NCCOCC(=O)c1ccc(cc1F)Cl 34a_100000210304_100012351891 [0,2,0,0,0,0|2,0,0]=4 13082 B15R1.3309 O=C(CC#CCO)c1ccc(cc1Br)Cl 1458a_100000766353_200000047223 [0,2,0,0,0,0|1,0,1]=4 13083 B15R1.3309 O=C(CC#CCO)c1ccc(cc1Cl)Cl 1458a_100000185840_200000047223 [0,2,0,0,0,0|1,0,1]=4 13084 B15R1.3309 O=C(CC#CCO)c1ccc(cc1F)Cl 1458a_100000212326_200000047223 [0,2,0,0,0,0|1,0,1]=4 13085 B15R1.3309 O=C(CC#CCO)c1ccc(cc1I)Cl 1458a_100000739380_200000047223 [0,2,0,0,0,0|1,0,1]=4 13086 B15R1.3309 O=C(CC#CCO)c1ccc(cc1O)Cl 1458a_100000188622_200000047223 [0,2,0,0,0,0|1,0,1]=4 13087 B15R1.3309 O=C(CCCCF)c1ccc(cc1Br)Cl 1458a_100000766353_100000729493 [0,2,0,0,0,0|2,0,0]=4 13088 B15R1.3309 O=C(CCCCF)c1ccc(cc1Cl)Cl 1458a_100000185840_100000729493 [0,2,0,0,0,0|2,0,0]=4 13089 B15R1.3309 O=C(CCCCF)c1ccc(cc1F)Cl 1458a_100000212326_100000729493 [0,2,0,0,0,0|2,0,0]=4 13090 B15R1.3309 O=C(CCCCF)c1ccc(cc1I)Cl 1458a_100000739380_100000729493 [0,2,0,0,0,0|2,0,0]=4 13091 B15R1.3309 O=C(CCCCF)c1ccc(cc1O)Cl 1458a_100000188622_100000729493 [0,2,0,0,0,0|2,0,0]=4 13092 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)Br 1458a_100000762965_100000210776 [0,2,0,0,0,0|1,1,0]=4 13093 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)Cl 1458a_100000766353_100000210776 [0,2,0,0,0,0|1,0,0]=3 13094 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)F 1458a_100000212304_100000210776 [0,2,0,0,0,0|1,1,0]=4 13095 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)I 1458a_100012360512_100000210776 [0,2,0,0,0,0|1,1,0]=4 13096 B15R1.3309 O=C(CCCCO)c1ccc(cc1Br)O 1458a_100012344906_100000210776 [0,2,0,0,0,0|2,0,0]=4 13097 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)Br 1458a_100000741628_100000210776 [0,2,0,0,0,0|1,1,0]=4 13098 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210776 [0,2,0,0,0,0|1,0,0]=3 13099 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)F 1458a_100000211397_100000210776 [0,2,0,0,0,0|1,1,0]=4 13100 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)I 1458a_100000751301_100000210776 [0,2,0,0,0,0|1,1,0]=4 13101 B15R1.3309 O=C(CCCCO)c1ccc(cc1Cl)O 1458a_100000702456_100000210776 [0,2,0,0,0,0|2,0,0]=4 13102 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)Br 1458a_100000214689_100000210776 [0,2,0,0,0,0|1,1,0]=4 13103 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)Cl 1458a_100000212326_100000210776 [0,2,0,0,0,0|1,0,0]=3 13104 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)F 1458a_100000211022_100000210776 [0,2,0,0,0,0|1,1,0]=4 13105 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)I 1458a_100000037189_100000210776 [0,2,0,0,0,0|1,1,0]=4 13106 B15R1.3309 O=C(CCCCO)c1ccc(cc1F)O 1458a_100000689029_100000210776 [0,2,0,0,0,0|2,0,0]=4 13107 B15R1.3309 O=C(CCCCO)c1ccc(cc1I)Br 1458a_100000751167_100000210776 [0,2,0,0,0,0|1,1,0]=4 13108 B15R1.3309 O=C(CCCCO)c1ccc(cc1I)Cl 1458a_100000739380_100000210776 [0,2,0,0,0,0|1,0,0]=3 13109 B15R1.3309 O=C(CCCCO)c1ccc(cc1I)F 1458a_100000739341_100000210776 [0,2,0,0,0,0|1,1,0]=4 13110 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)Br 1458a_100000744433_100000210776 [0,2,0,0,0,0|1,1,0]=4 13111 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)Cl 1458a_100000188622_100000210776 [0,2,0,0,0,0|1,0,0]=3 13112 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)F 1458a_100000746061_100000210776 [0,2,0,0,0,0|1,1,0]=4 13113 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)I 1458a_100000091984_100000210776 [0,2,0,0,0,0|1,1,0]=4 13114 B15R1.3309 O=C(CCCCO)c1ccc(cc1O)O 1458a_100000212172_100000210776 [0,2,0,0,0,0|2,0,0]=4 13115 B15R1.3309 O=C(CNCCF)c1ccc(cc1Br)F 34a_100000724931_100012361341 [0,2,0,0,0,0|1,1,0]=4 13116 B15R1.3309 O=C(CNCCF)c1ccc(cc1Cl)F 34a_100000724931_100012056422 [0,2,0,0,0,0|1,1,0]=4 13117 B15R1.3309 O=C(CNCCF)c1ccc(cc1F)Br 34a_100000724931_200012361339 [0,2,0,0,0,0|1,1,0]=4 13118 B15R1.3309 O=C(CNCCF)c1ccc(cc1F)Cl 34a_100000724931_100012351891 [0,2,0,0,0,0|1,0,0]=3 13119 B15R1.3309 O=C(CNCCF)c1ccc(cc1F)F 34a_100000724931_100000229962 [0,2,0,0,0,0|1,1,0]=4 13120 B15R1.3309 O=C(CNCCF)c1ccc(cc1O)F 34a_100000724931_100009817053 [0,2,0,0,0,0|1,1,0]=4 13121 B15R1.3309 O=C(CNCCF)c1ccc(cc1O)O 34a_100000724931_100009814262 [0,2,0,0,0,0|2,0,0]=4 13122 B15R1.3309 O=C(CNCCO)c1ccc(cc1Br)F 34a_100016990907_100012361341 [0,2,0,0,0,0|0,1,0]=3 13123 B15R1.3309 O=C(CNCCO)c1ccc(cc1Cl)Cl 2230a_100016997473_100011218845 [0,2,0,0,0,0|0,0,0]=2 13124 B15R1.3309 O=C(CNCCO)c1ccc(cc1Cl)F 2230a_100016997473_100012056422 [0,2,0,0,0,0|0,1,0]=3 13125 B15R1.3309 O=C(CNCCO)c1ccc(cc1Cl)F 34a_100016990907_100012056422 [0,2,0,0,0,0|0,1,0]=3 13126 B15R1.3309 O=C(CNCCO)c1ccc(cc1F)Br 34a_100016990907_200012361339 [0,2,0,0,0,0|0,1,0]=3 13127 B15R1.3309 O=C(CNCCO)c1ccc(cc1F)Cl 34a_100016990907_100012351891 [0,2,0,0,0,0|0,0,0]=2 13128 B15R1.3309 O=C(CNCCO)c1ccc(cc1F)F 34a_100016990907_100000229962 [0,2,0,0,0,0|0,1,0]=3 13129 B15R1.3309 O=C(CNCCO)c1ccc(cc1O)F 34a_100016990907_100009817053 [0,2,0,0,0,0|0,1,0]=3 13130 B15R1.3309 O=C(CNCCO)c1ccc(cc1O)O 34a_100016990907_100009814262 [0,2,0,0,0,0|1,0,0]=3 13131 B15R1.3309 O=C(COCCBr)c1ccc(cc1F)Cl 34a_100000211926_100012351891 [0,2,0,0,0,0|2,0,0]=4 13132 B15R1.3309 O=C(CSCCF)c1ccc(cc1Cl)Cl 62a_100011218845_100011217306 [0,2,0,0,0,0|2,0,0]=4 13133 B15R1.3309 O=C(CSCCF)c1ccc(cc1F)Cl 62a_100011217306_100012351891 [0,2,0,0,0,0|2,0,0]=4 13134 B15R1.3309 O=C(CSCCF)c1ccc(cc1F)Cl 62a_100012351891_100011217306 [0,2,0,0,0,0|2,0,0]=4 13135 B15R1.3309 O=C(CSCCO)c1ccc(cc1Br)F 62a_100012361341_100000211926 [0,2,0,0,0,0|1,1,0]=4 13136 B15R1.3309 O=C(CSCCO)c1ccc(cc1Cl)Cl 62a_100011218845_100000211926 [0,2,0,0,0,0|1,0,0]=3 13137 B15R1.3309 O=C(CSCCO)c1ccc(cc1Cl)F 62a_100000211926_100012056422 [0,2,0,0,0,0|1,1,0]=4 13138 B15R1.3309 O=C(CSCCO)c1ccc(cc1Cl)F 62a_100012056422_100000211926 [0,2,0,0,0,0|1,1,0]=4 13139 B15R1.3309 O=C(CSCCO)c1ccc(cc1F)Br 62a_200012361339_100000211926 [0,2,0,0,0,0|1,1,0]=4 13140 B15R1.3309 O=C(CSCCO)c1ccc(cc1F)Cl 62a_100000211926_100012351891 [0,2,0,0,0,0|1,0,0]=3 13141 B15R1.3309 O=C(CSCCO)c1ccc(cc1F)Cl 62a_100012351891_100000211926 [0,2,0,0,0,0|1,0,0]=3 13142 B15R1.3309 O=C(CSCCO)c1ccc(cc1F)F 62a_100000211926_100000229962 [0,2,0,0,0,0|1,1,0]=4 13143 B15R1.3309 O=C(CSCCO)c1ccc(cc1F)F 62a_100000229962_100000211926 [0,2,0,0,0,0|1,1,0]=4 13144 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)F 62a_100000211926_100009817053 [0,2,0,0,0,0|1,1,0]=4 13145 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)F 62a_100009817053_100000211926 [0,2,0,0,0,0|1,1,0]=4 13146 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)O 62a_100000211926_100009814262 [0,2,0,0,0,0|2,0,0]=4 13147 B15R1.3309 O=C(CSCCO)c1ccc(cc1O)O 62a_100009814262_100000211926 [0,2,0,0,0,0|2,0,0]=4 13148 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 11a_100015189416_100000762965 [0,2,0,0,0,0|1,1,0]=4 13149 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 1626a_100015189416_100000762965 [0,2,0,0,0,0|1,1,0]=4 13150 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 240690a_100015189416_100000762965 [0,2,0,0,0,0|1,1,0]=4 13151 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Br 527a_100015189416_100000762965 [0,2,0,0,0,0|1,1,0]=4 13152 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 11a_100015189416_100000766353 [0,2,0,0,0,0|1,0,0]=3 13153 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 1626a_100015189416_100000766353 [0,2,0,0,0,0|1,0,0]=3 13154 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 240690a_100015189416_100000766353 [0,2,0,0,0,0|1,0,0]=3 13155 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)Cl 527a_100015189416_100000766353 [0,2,0,0,0,0|1,0,0]=3 13156 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 11a_100015189416_100000212304 [0,2,0,0,0,0|1,1,0]=4 13157 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 1626a_100015189416_100000212304 [0,2,0,0,0,0|1,1,0]=4 13158 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 240690a_100015189416_100000212304 [0,2,0,0,0,0|1,1,0]=4 13159 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)F 527a_100015189416_100000212304 [0,2,0,0,0,0|1,1,0]=4 13160 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 11a_100015189416_100012360512 [0,2,0,0,0,0|1,1,0]=4 13161 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 1626a_100015189416_100012360512 [0,2,0,0,0,0|1,1,0]=4 13162 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 240690a_100015189416_100012360512 [0,2,0,0,0,0|1,1,0]=4 13163 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)I 527a_100015189416_100012360512 [0,2,0,0,0,0|1,1,0]=4 13164 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)O 240690a_100015189416_100012344906 [0,2,0,0,0,0|2,0,0]=4 13165 B15R1.3309 O=C(NCCCF)c1ccc(cc1Br)O 527a_100015189416_100012344906 [0,2,0,0,0,0|2,0,0]=4 13166 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 11a_100015189416_100000741628 [0,2,0,0,0,0|1,1,0]=4 13167 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 1626a_100015189416_100000741628 [0,2,0,0,0,0|1,1,0]=4 13168 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 240690a_100015189416_100000741628 [0,2,0,0,0,0|1,1,0]=4 13169 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Br 527a_100015189416_100000741628 [0,2,0,0,0,0|1,1,0]=4 13170 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 11a_100015189416_100000185840 [0,2,0,0,0,0|1,0,0]=3 13171 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 1626a_100015189416_100000185840 [0,2,0,0,0,0|1,0,0]=3 13172 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 240690a_100015189416_100000185840 [0,2,0,0,0,0|1,0,0]=3 13173 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)Cl 527a_100015189416_100000185840 [0,2,0,0,0,0|1,0,0]=3 13174 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 11a_100015189416_100000211397 [0,2,0,0,0,0|1,1,0]=4 13175 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 1626a_100015189416_100000211397 [0,2,0,0,0,0|1,1,0]=4 13176 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 240690a_100015189416_100000211397 [0,2,0,0,0,0|1,1,0]=4 13177 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)F 527a_100015189416_100000211397 [0,2,0,0,0,0|1,1,0]=4 13178 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 11a_100015189416_100000751301 [0,2,0,0,0,0|1,1,0]=4 13179 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 1626a_100015189416_100000751301 [0,2,0,0,0,0|1,1,0]=4 13180 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 240690a_100015189416_100000751301 [0,2,0,0,0,0|1,1,0]=4 13181 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)I 527a_100015189416_100000751301 [0,2,0,0,0,0|1,1,0]=4 13182 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)O 240690a_100015189416_100000702456 [0,2,0,0,0,0|2,0,0]=4 13183 B15R1.3309 O=C(NCCCF)c1ccc(cc1Cl)O 527a_100015189416_100000702456 [0,2,0,0,0,0|2,0,0]=4 13184 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 11a_100015189416_100000214689 [0,2,0,0,0,0|1,1,0]=4 13185 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 1626a_100015189416_100000214689 [0,2,0,0,0,0|1,1,0]=4 13186 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 240690a_100015189416_100000214689 [0,2,0,0,0,0|1,1,0]=4 13187 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Br 527a_100015189416_100000214689 [0,2,0,0,0,0|1,1,0]=4 13188 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 11a_100015189416_100000212326 [0,2,0,0,0,0|1,0,0]=3 13189 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 1626a_100015189416_100000212326 [0,2,0,0,0,0|1,0,0]=3 13190 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 240690a_100015189416_100000212326 [0,2,0,0,0,0|1,0,0]=3 13191 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)Cl 527a_100015189416_100000212326 [0,2,0,0,0,0|1,0,0]=3 13192 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 11a_100015189416_100000211022 [0,2,0,0,0,0|1,1,0]=4 13193 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 1626a_100015189416_100000211022 [0,2,0,0,0,0|1,1,0]=4 13194 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 240690a_100015189416_100000211022 [0,2,0,0,0,0|1,1,0]=4 13195 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)F 527a_100015189416_100000211022 [0,2,0,0,0,0|1,1,0]=4 13196 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 11a_100015189416_100000037189 [0,2,0,0,0,0|1,1,0]=4 13197 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 1626a_100015189416_100000037189 [0,2,0,0,0,0|1,1,0]=4 13198 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 240690a_100015189416_100000037189 [0,2,0,0,0,0|1,1,0]=4 13199 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)I 527a_100015189416_100000037189 [0,2,0,0,0,0|1,1,0]=4 13200 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)O 240690a_100015189416_100000689029 [0,2,0,0,0,0|2,0,0]=4 13201 B15R1.3309 O=C(NCCCF)c1ccc(cc1F)O 527a_100015189416_100000689029 [0,2,0,0,0,0|2,0,0]=4 13202 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 11a_100015189416_100000751167 [0,2,0,0,0,0|1,1,0]=4 13203 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 1626a_100015189416_100000751167 [0,2,0,0,0,0|1,1,0]=4 13204 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 240690a_100015189416_100000751167 [0,2,0,0,0,0|1,1,0]=4 13205 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Br 527a_100015189416_100000751167 [0,2,0,0,0,0|1,1,0]=4 13206 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 11a_100015189416_100000739380 [0,2,0,0,0,0|1,0,0]=3 13207 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 1626a_100015189416_100000739380 [0,2,0,0,0,0|1,0,0]=3 13208 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 240690a_100015189416_100000739380 [0,2,0,0,0,0|1,0,0]=3 13209 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)Cl 527a_100015189416_100000739380 [0,2,0,0,0,0|1,0,0]=3 13210 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 11a_100015189416_100000739341 [0,2,0,0,0,0|1,1,0]=4 13211 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 1626a_100015189416_100000739341 [0,2,0,0,0,0|1,1,0]=4 13212 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 240690a_100015189416_100000739341 [0,2,0,0,0,0|1,1,0]=4 13213 B15R1.3309 O=C(NCCCF)c1ccc(cc1I)F 527a_100015189416_100000739341 [0,2,0,0,0,0|1,1,0]=4 13214 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Br 240690a_100015189416_100000744433 [0,2,0,0,0,0|1,1,0]=4 13215 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Br 527a_100015189416_100000744433 [0,2,0,0,0,0|1,1,0]=4 13216 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Cl 11a_100015189416_100000188622 [0,2,0,0,0,0|1,0,0]=3 13217 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Cl 240690a_100015189416_100000188622 [0,2,0,0,0,0|1,0,0]=3 13218 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)Cl 527a_100015189416_100000188622 [0,2,0,0,0,0|1,0,0]=3 13219 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)F 240690a_100015189416_100000746061 [0,2,0,0,0,0|1,1,0]=4 13220 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)F 527a_100015189416_100000746061 [0,2,0,0,0,0|1,1,0]=4 13221 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)I 240690a_100015189416_100000091984 [0,2,0,0,0,0|1,1,0]=4 13222 B15R1.3309 O=C(NCCCF)c1ccc(cc1O)I 527a_100015189416_100000091984 [0,2,0,0,0,0|1,1,0]=4 13223 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Br 240690a_100000182051_100000762965 [0,2,0,0,0,0|0,1,0]=3 13224 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Br 527a_100000182051_100000762965 [0,2,0,0,0,0|0,1,0]=3 13225 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Cl 240690a_100000182051_100000766353 [0,2,0,0,0,0|0,0,0]=2 13226 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)Cl 527a_100000182051_100000766353 [0,2,0,0,0,0|0,0,0]=2 13227 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)F 240690a_100000182051_100000212304 [0,2,0,0,0,0|0,1,0]=3 13228 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)F 527a_100000182051_100000212304 [0,2,0,0,0,0|0,1,0]=3 13229 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)I 240690a_100000182051_100012360512 [0,2,0,0,0,0|0,1,0]=3 13230 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)I 527a_100000182051_100012360512 [0,2,0,0,0,0|0,1,0]=3 13231 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)O 240690a_100000182051_100012344906 [0,2,0,0,0,0|1,0,0]=3 13232 B15R1.3309 O=C(NCCCO)c1ccc(cc1Br)O 527a_100000182051_100012344906 [0,2,0,0,0,0|1,0,0]=3 13233 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Br 240690a_100000182051_100000741628 [0,2,0,0,0,0|0,1,0]=3 13234 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Br 527a_100000182051_100000741628 [0,2,0,0,0,0|0,1,0]=3 13235 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Cl 240690a_100000182051_100000185840 [0,2,0,0,0,0|0,0,0]=2 13236 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)Cl 527a_100000182051_100000185840 [0,2,0,0,0,0|0,0,0]=2 13237 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)F 240690a_100000182051_100000211397 [0,2,0,0,0,0|0,1,0]=3 13238 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)F 527a_100000182051_100000211397 [0,2,0,0,0,0|0,1,0]=3 13239 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)I 240690a_100000182051_100000751301 [0,2,0,0,0,0|0,1,0]=3 13240 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)I 527a_100000182051_100000751301 [0,2,0,0,0,0|0,1,0]=3 13241 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)O 240690a_100000182051_100000702456 [0,2,0,0,0,0|1,0,0]=3 13242 B15R1.3309 O=C(NCCCO)c1ccc(cc1Cl)O 527a_100000182051_100000702456 [0,2,0,0,0,0|1,0,0]=3 13243 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Br 240690a_100000182051_100000214689 [0,2,0,0,0,0|0,1,0]=3 13244 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Br 527a_100000182051_100000214689 [0,2,0,0,0,0|0,1,0]=3 13245 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Cl 240690a_100000182051_100000212326 [0,2,0,0,0,0|0,0,0]=2 13246 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)Cl 527a_100000182051_100000212326 [0,2,0,0,0,0|0,0,0]=2 13247 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)F 240690a_100000182051_100000211022 [0,2,0,0,0,0|0,1,0]=3 13248 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)F 527a_100000182051_100000211022 [0,2,0,0,0,0|0,1,0]=3 13249 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)I 240690a_100000182051_100000037189 [0,2,0,0,0,0|0,1,0]=3 13250 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)I 527a_100000182051_100000037189 [0,2,0,0,0,0|0,1,0]=3 13251 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)O 240690a_100000182051_100000689029 [0,2,0,0,0,0|1,0,0]=3 13252 B15R1.3309 O=C(NCCCO)c1ccc(cc1F)O 527a_100000182051_100000689029 [0,2,0,0,0,0|1,0,0]=3 13253 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Br 240690a_100000182051_100000751167 [0,2,0,0,0,0|0,1,0]=3 13254 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Br 527a_100000182051_100000751167 [0,2,0,0,0,0|0,1,0]=3 13255 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Cl 240690a_100000182051_100000739380 [0,2,0,0,0,0|0,0,0]=2 13256 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)Cl 527a_100000182051_100000739380 [0,2,0,0,0,0|0,0,0]=2 13257 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)F 240690a_100000182051_100000739341 [0,2,0,0,0,0|0,1,0]=3 13258 B15R1.3309 O=C(NCCCO)c1ccc(cc1I)F 527a_100000182051_100000739341 [0,2,0,0,0,0|0,1,0]=3 13259 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Br 240690a_100000182051_100000744433 [0,2,0,0,0,0|0,1,0]=3 13260 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Br 527a_100000182051_100000744433 [0,2,0,0,0,0|0,1,0]=3 13261 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Cl 240690a_100000182051_100000188622 [0,2,0,0,0,0|0,0,0]=2 13262 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)Cl 527a_100000182051_100000188622 [0,2,0,0,0,0|0,0,0]=2 13263 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)F 240690a_100000182051_100000746061 [0,2,0,0,0,0|0,1,0]=3 13264 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)F 527a_100000182051_100000746061 [0,2,0,0,0,0|0,1,0]=3 13265 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)I 240690a_100000182051_100000091984 [0,2,0,0,0,0|0,1,0]=3 13266 B15R1.3309 O=C(NCCCO)c1ccc(cc1O)I 527a_100000182051_100000091984 [0,2,0,0,0,0|0,1,0]=3 13267 B15R1.3309 O=C(NNCCO)c1ccc(cc1Br)Br 22a_100000210001_100000762965 [0,2,0,0,0,0|0,1,0]=3 13268 B15R1.3309 O=C(NNCCO)c1ccc(cc1Br)Cl 22a_100000210001_100000766353 [0,2,0,0,0,0|0,0,0]=2 13269 B15R1.3309 O=C(NNCCO)c1ccc(cc1Br)F 22a_100000210001_100000212304 [0,2,0,0,0,0|0,1,0]=3 13270 B15R1.3309 O=C(NNCCO)c1ccc(cc1Br)I 22a_100000210001_100012360512 [0,2,0,0,0,0|0,1,0]=3 13271 B15R1.3309 O=C(NNCCO)c1ccc(cc1Br)O 22a_100000210001_100012344906 [0,2,0,0,0,0|1,0,0]=3 13272 B15R1.3309 O=C(NNCCO)c1ccc(cc1Cl)Br 22a_100000210001_100000741628 [0,2,0,0,0,0|0,1,0]=3 13273 B15R1.3309 O=C(NNCCO)c1ccc(cc1Cl)Cl 22a_100000210001_100000185840 [0,2,0,0,0,0|0,0,0]=2 13274 B15R1.3309 O=C(NNCCO)c1ccc(cc1Cl)F 22a_100000210001_100000211397 [0,2,0,0,0,0|0,1,0]=3 13275 B15R1.3309 O=C(NNCCO)c1ccc(cc1Cl)I 22a_100000210001_100000751301 [0,2,0,0,0,0|0,1,0]=3 13276 B15R1.3309 O=C(NNCCO)c1ccc(cc1Cl)O 22a_100000210001_100000702456 [0,2,0,0,0,0|1,0,0]=3 13277 B15R1.3309 O=C(NNCCO)c1ccc(cc1F)Br 22a_100000210001_100000214689 [0,2,0,0,0,0|0,1,0]=3 13278 B15R1.3309 O=C(NNCCO)c1ccc(cc1F)Cl 22a_100000210001_100000212326 [0,2,0,0,0,0|0,0,0]=2 13279 B15R1.3309 O=C(NNCCO)c1ccc(cc1F)F 22a_100000210001_100000211022 [0,2,0,0,0,0|0,1,0]=3 13280 B15R1.3309 O=C(NNCCO)c1ccc(cc1F)I 22a_100000210001_100000037189 [0,2,0,0,0,0|0,1,0]=3 13281 B15R1.3309 O=C(NNCCO)c1ccc(cc1F)O 22a_100000210001_100000689029 [0,2,0,0,0,0|1,0,0]=3 13282 B15R1.3309 O=C(NNCCO)c1ccc(cc1I)Br 22a_100000210001_100000751167 [0,2,0,0,0,0|0,1,0]=3 13283 B15R1.3309 O=C(NNCCO)c1ccc(cc1I)Cl 22a_100000210001_100000739380 [0,2,0,0,0,0|0,0,0]=2 13284 B15R1.3309 O=C(NNCCO)c1ccc(cc1I)F 22a_100000210001_100000739341 [0,2,0,0,0,0|0,1,0]=3 13285 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)Br 22a_100000210001_100000744433 [0,2,0,0,0,0|0,1,0]=3 13286 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)Cl 22a_100000210001_100000188622 [0,2,0,0,0,0|0,0,0]=2 13287 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)F 22a_100000210001_100000746061 [0,2,0,0,0,0|0,1,0]=3 13288 B15R1.3309 O=C(NNCCO)c1ccc(cc1O)I 22a_100000210001_100000091984 [0,2,0,0,0,0|0,1,0]=3 13289 B15R1.3309 O=C(OCSCF)c1ccc(cc1Cl)Cl 62a_100010978946_100015361967 [0,2,0,0,0,0|2,0,0]=4 13290 B15R1.3309 OCCNC[C@H](O)c1ccc(cc1Cl)Cl 2230a_100016997473_100000761231 [0,2,0,0,0,0|0,0,2]=4 13291 B15R1.3309 OCCNC[C@H](O)c1ccc(cc1Cl)Cl 34a_100016990907_100000761231 [0,2,0,0,0,0|0,0,2]=4 13292 B15R1.3309 [13CH3]OCCNC(=O)c1ccc(cc1Cl)N 34a_100000725507_200025704644 [0,2,0,0,0,0|1,0,0]=3 13293 B15R1.140 CCCC(NCCO)c1ccc(cc1)Cl 269862a_100000210304_100000211515 [0,2,0,0,0,0|1,0,1]=4 13294 B15R1.140 OCCNC(CCO)c1ccc(cc1)Cl 2230a_100000730317_100000211926 [0,2,0,0,0,0|0,0,2]=4 13295 B15R1.140 OCCNC(CCO)c1ccc(cc1)Cl 34a_100000730317_100000211926 [0,2,0,0,0,0|0,0,2]=4 13296 B15R1.145 CC(C)C(NCCO)c1ccc(cc1)Cl 2230a_100015204473_100000211926 [0,2,0,0,0,0|1,0,1]=4 13297 B15R1.145 CC(C)C(NCCO)c1ccc(cc1)Cl 269862a_100000210304_100000742363 [0,2,0,0,0,0|1,0,1]=4 13298 B15R1.145 CC(C)C(NCCO)c1ccc(cc1)Cl 34a_100015204473_100000211926 [0,2,0,0,0,0|1,0,1]=4 13299 B15R1.145 CCCNC(C(=O)O)c1ccc(cc1)Cl 269956a_100000761553_100000210207 [0,2,0,0,0,0|1,0,1]=4 13300 B15R1.145 Cc1ccc(cc1)C(NCCO)C(=O)O 269956a_100138412518_100000211926 [0,2,0,0,0,0|1,0,1]=4 13301 B15R1.145 O=C(O)C(NCCF)c1ccc(cc1)Cl 269956a_100000761553_100011217306 [0,2,0,0,0,0|1,0,1]=4 13302 B15R1.145 O=C(O)C(NCCO)c1ccc(cc1)Br 269956a_100102946273_100000211926 [0,2,0,0,0,0|0,1,1]=4 13303 B15R1.145 O=C(O)C(NCCO)c1ccc(cc1)Cl 269956a_100000761553_100000211926 [0,2,0,0,0,0|0,0,1]=3 13304 B15R1.145 O=C(O)C(NCCO)c1ccc(cc1)F 269956a_100011215775_100000211926 [0,2,0,0,0,0|0,1,1]=4 13305 B15R1.659 CC(O)CNC(C#N)c1ccc(cc1)Cl 2230a_100000747793_100011218427 [0,2,0,0,0,0|1,0,1]=4 13306 B15R1.659 CC(O)CN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100011218427 [0,2,0,0,0,0|0,0,2]=4 13307 B15R1.659 CC(O)CN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100011218427 [0,2,0,0,0,0|0,0,2]=4 13308 B15R1.659 CCC(NCC(C)O)c1ccc(cc1)Cl 269862a_100000210904_100000210983 [0,2,0,0,0,0|1,0,1]=4 13309 B15R1.659 CC[C@H](NCC(C)O)c1ccc(cc1)Cl 2230a_100015186824_100011218427 [0,2,0,0,0,0|1,0,1]=4 13310 B15R1.659 CC[C@H](NCC(C)O)c1ccc(cc1)Cl 34a_100015186824_100011218427 [0,2,0,0,0,0|1,0,1]=4 13311 B15R1.659 CC[C@H](NC[C@@H](C)O)c1ccc(cc1)Cl 2230a_100015186824_100009817552 [0,2,0,0,0,0|1,0,1]=4 13312 B15R1.659 CC[C@H](NC[C@@H](C)O)c1ccc(cc1)Cl 34a_100015186824_100009817552 [0,2,0,0,0,0|1,0,1]=4 13313 B15R1.659 C[C@@H](O)CNC(C#N)c1ccc(cc1)Cl 2230a_100000747793_100009817552 [0,2,0,0,0,0|1,0,1]=4 13314 B15R1.659 C[C@@H](O)CN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100009817552 [0,2,0,0,0,0|0,0,2]=4 13315 B15R1.659 C[C@@H](O)CN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100009817552 [0,2,0,0,0,0|0,0,2]=4 13316 B15R1.3504 CCC(NCCO)c1ccc(c(c1)Cl)Cl 269862a_100000210304_100000182811 [0,2,0,0,0,0|1,0,1]=4 13317 B15R1.3504 CCC(NCCO)c1ccc(c(c1)F)Cl 269862a_100000210304_100012000384 [0,2,0,0,0,0|1,0,1]=4 13318 B15R1.3504 N#CC(NCCO)c1ccc(c(c1)Cl)Cl 2230a_100000750753_100000211926 [0,2,0,0,0,0|1,0,1]=4 13319 B15R1.3504 OCCNC(CO)c1ccc(c(c1)Cl)Cl 2230a_100011404344_100000211926 [0,2,0,0,0,0|0,0,2]=4 13320 B15R1.3504 OCCNC(CO)c1ccc(c(c1)Cl)Cl 269862a_100000210304_100000246375 [0,2,0,0,0,0|0,0,2]=4 13321 B15R1.3504 OCCNC(CO)c1ccc(c(c1)Cl)Cl 34a_100011404344_100000211926 [0,2,0,0,0,0|0,0,2]=4 13322 B15R1.15224 CCC(NCCO)c1ccc(cc1Cl)Cl 269862a_100000210304_100000211697 [0,2,0,0,0,0|1,0,1]=4 13323 B15R1.15224 CCC(NCCO)c1ccc(cc1F)Cl 269862a_100000210304_200011805165 [0,2,0,0,0,0|1,0,1]=4 13324 B15R1.581 C#CCN(CC)C(=O)c1ccc(cc1)Cl 11a_100000744766_100000210187 [0,2,0,0,0,0|1,0,1]=4 13325 B15R1.581 C#CCN(CC)C(=O)c1ccc(cc1)Cl 1626a_100000744766_100000210187 [0,2,0,0,0,0|1,0,1]=4 13326 B15R1.581 C#CCN(CC)C(=O)c1ccc(cc1)Cl 240690a_100000744766_100000210187 [0,2,0,0,0,0|1,0,1]=4 13327 B15R1.581 C#CCN(CC)C(=O)c1ccc(cc1)Cl 527a_100000744766_100000210187 [0,2,0,0,0,0|1,0,1]=4 13328 B15R1.581 CCCC(CC)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100011219200 [0,2,0,0,0,0|2,0,0]=4 13329 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Br 11a_100000226822_100000185839 [0,2,0,0,0,0|1,1,0]=4 13330 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Br 1626a_100000226822_100000185839 [0,2,0,0,0,0|1,1,0]=4 13331 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Br 240690a_100000226822_100000185839 [0,2,0,0,0,0|1,1,0]=4 13332 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Br 527a_100000226822_100000185839 [0,2,0,0,0,0|1,1,0]=4 13333 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)C 11a_100000226822_100000188618 [0,2,0,0,0,0|2,0,0]=4 13334 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)C 1626a_100000226822_100000188618 [0,2,0,0,0,0|2,0,0]=4 13335 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)C 240690a_100000226822_100000188618 [0,2,0,0,0,0|2,0,0]=4 13336 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)C 527a_100000226822_100000188618 [0,2,0,0,0,0|2,0,0]=4 13337 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Cl 11a_100000226822_100000210187 [0,2,0,0,0,0|1,0,0]=3 13338 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Cl 1626a_100000226822_100000210187 [0,2,0,0,0,0|1,0,0]=3 13339 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Cl 240690a_100000226822_100000210187 [0,2,0,0,0,0|1,0,0]=3 13340 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)Cl 527a_100000226822_100000210187 [0,2,0,0,0,0|1,0,0]=3 13341 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)F 11a_100000226822_100000187176 [0,2,0,0,0,0|1,1,0]=4 13342 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)F 1626a_100000226822_100000187176 [0,2,0,0,0,0|1,1,0]=4 13343 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)F 240690a_100000226822_100000187176 [0,2,0,0,0,0|1,1,0]=4 13344 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)F 527a_100000226822_100000187176 [0,2,0,0,0,0|1,1,0]=4 13345 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)I 11a_100000226822_100000187904 [0,2,0,0,0,0|1,1,0]=4 13346 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)I 1626a_100000226822_100000187904 [0,2,0,0,0,0|1,1,0]=4 13347 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)I 240690a_100000226822_100000187904 [0,2,0,0,0,0|1,1,0]=4 13348 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)I 527a_100000226822_100000187904 [0,2,0,0,0,0|1,1,0]=4 13349 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)O 240690a_100000226822_100000212099 [0,2,0,0,0,0|2,0,0]=4 13350 B15R1.581 CCCN(CC)C(=O)c1ccc(cc1)O 527a_100000226822_100000212099 [0,2,0,0,0,0|2,0,0]=4 13351 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)Br 240690a_100000210973_100000185839 [0,2,0,0,0,0|0,1,0]=3 13352 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)Br 527a_100000210973_100000185839 [0,2,0,0,0,0|0,1,0]=3 13353 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)C 240690a_100000210973_100000188618 [0,2,0,0,0,0|1,0,0]=3 13354 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)C 527a_100000210973_100000188618 [0,2,0,0,0,0|1,0,0]=3 13355 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)Cl 240690a_100000210973_100000210187 [0,2,0,0,0,0|0,0,0]=2 13356 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)Cl 527a_100000210973_100000210187 [0,2,0,0,0,0|0,0,0]=2 13357 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)F 240690a_100000210973_100000187176 [0,2,0,0,0,0|0,1,0]=3 13358 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)F 527a_100000210973_100000187176 [0,2,0,0,0,0|0,1,0]=3 13359 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)I 240690a_100000210973_100000187904 [0,2,0,0,0,0|0,1,0]=3 13360 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)I 527a_100000210973_100000187904 [0,2,0,0,0,0|0,1,0]=3 13361 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)O 240690a_100000210973_100000212099 [0,2,0,0,0,0|1,0,0]=3 13362 B15R1.581 CCN(CCO)C(=O)c1ccc(cc1)O 527a_100000210973_100000212099 [0,2,0,0,0,0|1,0,0]=3 13363 B15R1.581 CCN(CCO)C(C)c1ccc(cc1)Cl 2230a_100000210973_100000684792 [0,2,0,0,0,0|1,0,1]=4 13364 B15R1.581 CCN(CCO)C(C)c1ccc(cc1)Cl 269982a_100000210973_100000684792 [0,2,0,0,0,0|1,0,1]=4 13365 B15R1.619 CCCN(C)S(=O)(=O)c1ccc(cc1)Cl 270084a_100000747261_100000209962 [0,2,0,0,0,0|2,0,0]=4 13366 B15R1.619 CCCN(C)S(=O)(=O)c1ccc(cc1)Cl 274078a_100000747261_100000209962 [0,2,0,0,0,0|2,0,0]=4 13367 B15R1.619 CCCN(C)S(=O)(=O)c1ccc(cc1)Cl 40a_100000747261_100000077732 [0,2,0,0,0,0|2,0,0]=4 13368 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)Br 270084a_100000210263_100000182491 [0,2,0,0,0,0|1,1,0]=4 13369 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)Br 274078a_100000210263_100000182491 [0,2,0,0,0,0|1,1,0]=4 13370 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)Br 40a_100000210263_100010306709 [0,2,0,0,0,0|1,1,0]=4 13371 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)Cl 270084a_100000210263_100000209962 [0,2,0,0,0,0|1,0,0]=3 13372 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)Cl 274078a_100000210263_100000209962 [0,2,0,0,0,0|1,0,0]=3 13373 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)Cl 40a_100000210263_100000077732 [0,2,0,0,0,0|1,0,0]=3 13374 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)F 270084a_100000210263_100000184267 [0,2,0,0,0,0|1,1,0]=4 13375 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)F 274078a_100000210263_100000184267 [0,2,0,0,0,0|1,1,0]=4 13376 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)F 40a_100000210263_100000081159 [0,2,0,0,0,0|1,1,0]=4 13377 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)I 270084a_100000210263_100011205396 [0,2,0,0,0,0|1,1,0]=4 13378 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)I 274078a_100000210263_100011205396 [0,2,0,0,0,0|1,1,0]=4 13379 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)N 40a_100000210263_100000054796 [0,2,0,0,0,0|2,0,0]=4 13380 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)O 270084a_100000210263_100020667864 [0,2,0,0,0,0|2,0,0]=4 13381 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(cc1)O 274078a_100000210263_100020667864 [0,2,0,0,0,0|2,0,0]=4 13382 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(nc1)Cl 270084a_100000210263_100000184283 [0,2,0,0,0,0|2,0,0]=4 13383 B15R1.619 CN(CCO)S(=O)(=O)c1ccc(nc1)Cl 274078a_100000210263_100000184283 [0,2,0,0,0,0|2,0,0]=4 13384 B15R1.619 Cc1ccc(cc1)S(=O)(=O)N(C)CCO 270084a_100000210263_100000211267 [0,2,0,0,0,0|2,0,0]=4 13385 B15R1.619 Cc1ccc(cc1)S(=O)(=O)N(C)CCO 274078a_100000210263_100000211267 [0,2,0,0,0,0|2,0,0]=4 13386 B15R1.619 Cc1ccc(cc1)S(=O)(=O)N(C)CCO 40a_100000210263_100000039673 [0,2,0,0,0,0|2,0,0]=4 13387 B15R1.880 C=C(C)CN(C)C(=O)c1ccc(cc1)Cl 11a_100000225649_100000210187 [0,2,0,0,0,0|1,0,1]=4 13388 B15R1.880 C=C(C)CN(C)C(=O)c1ccc(cc1)Cl 1626a_100000225649_100000210187 [0,2,0,0,0,0|1,0,1]=4 13389 B15R1.880 C=C(C)CN(C)C(=O)c1ccc(cc1)Cl 527a_100000225649_100000210187 [0,2,0,0,0,0|1,0,1]=4 13390 B15R1.880 CC(C)CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000731052 [0,2,0,0,0,0|2,0,0]=4 13391 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 11a_100000747067_100000185839 [0,2,0,0,0,0|1,1,0]=4 13392 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 1626a_100000747067_100000185839 [0,2,0,0,0,0|1,1,0]=4 13393 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 240690a_100000747067_100000185839 [0,2,0,0,0,0|1,1,0]=4 13394 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Br 527a_100000747067_100000185839 [0,2,0,0,0,0|1,1,0]=4 13395 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 11a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 13396 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 1626a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 13397 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 240690a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 13398 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)Cl 527a_100000747067_100000210187 [0,2,0,0,0,0|1,0,0]=3 13399 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 11a_100000747067_100000187176 [0,2,0,0,0,0|1,1,0]=4 13400 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 1626a_100000747067_100000187176 [0,2,0,0,0,0|1,1,0]=4 13401 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 240690a_100000747067_100000187176 [0,2,0,0,0,0|1,1,0]=4 13402 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)F 527a_100000747067_100000187176 [0,2,0,0,0,0|1,1,0]=4 13403 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 11a_100000747067_100000187904 [0,2,0,0,0,0|1,1,0]=4 13404 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 1626a_100000747067_100000187904 [0,2,0,0,0,0|1,1,0]=4 13405 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 240690a_100000747067_100000187904 [0,2,0,0,0,0|1,1,0]=4 13406 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)I 527a_100000747067_100000187904 [0,2,0,0,0,0|1,1,0]=4 13407 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)O 240690a_100000747067_100000212099 [0,2,0,0,0,0|2,0,0]=4 13408 B15R1.880 CC(C)CN(C)C(=O)c1ccc(cc1)O 527a_100000747067_100000212099 [0,2,0,0,0,0|2,0,0]=4 13409 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Br 240690a_100000227577_100000185839 [0,2,0,0,0,0|0,1,0]=3 13410 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Br 527a_100000227577_100000185839 [0,2,0,0,0,0|0,1,0]=3 13411 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Cl 240690a_100000227577_100000210187 [0,2,0,0,0,0|0,0,0]=2 13412 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)Cl 527a_100000227577_100000210187 [0,2,0,0,0,0|0,0,0]=2 13413 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)F 240690a_100000227577_100000187176 [0,2,0,0,0,0|0,1,0]=3 13414 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)F 527a_100000227577_100000187176 [0,2,0,0,0,0|0,1,0]=3 13415 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)I 240690a_100000227577_100000187904 [0,2,0,0,0,0|0,1,0]=3 13416 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)I 527a_100000227577_100000187904 [0,2,0,0,0,0|0,1,0]=3 13417 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)O 240690a_100000227577_100000212099 [0,2,0,0,0,0|1,0,0]=3 13418 B15R1.880 CC(O)CN(C)C(=O)c1ccc(cc1)O 527a_100000227577_100000212099 [0,2,0,0,0,0|1,0,0]=3 13419 B15R1.880 CC(O)CN(C)C(C)c1ccc(cc1)Cl 2230a_100000227577_100000684792 [0,2,0,0,0,0|1,0,1]=4 13420 B15R1.880 CC(O)CN(C)C(C)c1ccc(cc1)Cl 2230a_100000231102_100011218427 [0,2,0,0,0,0|1,0,1]=4 13421 B15R1.880 CC(O)CN(C)C(C)c1ccc(cc1)Cl 269982a_100000227577_100000684792 [0,2,0,0,0,0|1,0,1]=4 13422 B15R1.880 CC(O)CN(C)C(C)c1ccc(cc1)Cl 269982a_100000231102_100011218427 [0,2,0,0,0,0|1,0,1]=4 13423 B15R1.880 CC(c1ccc(cc1)Cl)N(C)C[C@@H](C)O 2230a_100000231102_100009817552 [0,2,0,0,0,0|1,0,1]=4 13424 B15R1.880 CC(c1ccc(cc1)Cl)N(C)C[C@@H](C)O 269982a_100000231102_100009817552 [0,2,0,0,0,0|1,0,1]=4 13425 B15R1.880 CN(CC(=O)N)C(=O)c1ccc(cc1)Cl 11a_100000739694_100000210187 [0,2,0,0,0,0|0,0,2]=4 13426 B15R1.880 CN(CC(=O)N)C(=O)c1ccc(cc1)Cl 527a_100000739694_100000210187 [0,2,0,0,0,0|0,0,2]=4 13427 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 11a_100000747067_100000188618 [0,2,0,0,0,0|2,0,0]=4 13428 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 1626a_100000747067_100000188618 [0,2,0,0,0,0|2,0,0]=4 13429 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 240690a_100000747067_100000188618 [0,2,0,0,0,0|2,0,0]=4 13430 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)C 527a_100000747067_100000188618 [0,2,0,0,0,0|2,0,0]=4 13431 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)O 240690a_100000227577_100000188618 [0,2,0,0,0,0|1,0,0]=3 13432 B15R1.880 Cc1ccc(cc1)C(=O)N(C)CC(C)O 527a_100000227577_100000188618 [0,2,0,0,0,0|1,0,0]=3 13433 B15R1.3943 C#Cc1ccc(cc1)C(=O)C(C)CCO 1458a_100011217615_100009893172 [0,2,0,0,0,0|2,0,0]=4 13434 B15R1.3943 C#Cc1ccc(cc1)C(=O)N(C)CCC 11a_100000747261_100011217615 [0,2,0,0,0,0|2,0,0]=4 13435 B15R1.3943 C#Cc1ccc(cc1)C(=O)N(C)CCC 1626a_100000747261_100011217615 [0,2,0,0,0,0|2,0,0]=4 13436 B15R1.3943 C#Cc1ccc(cc1)C(=O)N(C)CCC 240690a_100000747261_100011217615 [0,2,0,0,0,0|2,0,0]=4 13437 B15R1.3943 C#Cc1ccc(cc1)C(=O)N(C)CCC 527a_100000747261_100011217615 [0,2,0,0,0,0|2,0,0]=4 13438 B15R1.3943 C#Cc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100011217615 [0,2,0,0,0,0|1,0,0]=3 13439 B15R1.3943 C#Cc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100011217615 [0,2,0,0,0,0|1,0,0]=3 13440 B15R1.3943 C=Cc1ccc(cc1)C(=O)C(C)CCO 1458a_100000687532_100009893172 [0,2,0,0,0,0|2,0,0]=4 13441 B15R1.3943 C=Cc1ccc(cc1)C(=O)N(C)CCC 11a_100000747261_100000687532 [0,2,0,0,0,0|2,0,0]=4 13442 B15R1.3943 C=Cc1ccc(cc1)C(=O)N(C)CCC 1626a_100000747261_100000687532 [0,2,0,0,0,0|2,0,0]=4 13443 B15R1.3943 C=Cc1ccc(cc1)C(=O)N(C)CCC 240690a_100000747261_100000687532 [0,2,0,0,0,0|2,0,0]=4 13444 B15R1.3943 C=Cc1ccc(cc1)C(=O)N(C)CCC 527a_100000747261_100000687532 [0,2,0,0,0,0|2,0,0]=4 13445 B15R1.3943 C=Cc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100000687532 [0,2,0,0,0,0|1,0,0]=3 13446 B15R1.3943 C=Cc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100000687532 [0,2,0,0,0,0|1,0,0]=3 13447 B15R1.3943 CC(CCO)C(=O)c1ccc(cc1)C#N 1458a_100000210717_100009893172 [0,2,0,0,0,0|2,0,0]=4 13448 B15R1.3943 CC(CCO)C(=O)c1ccc(cc1)CO 1458a_100000183892_100009893172 [0,2,0,0,0,0|2,0,0]=4 13449 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)C#N 11a_100000747261_100000210717 [0,2,0,0,0,0|2,0,0]=4 13450 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)C#N 1626a_100000747261_100000210717 [0,2,0,0,0,0|2,0,0]=4 13451 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)C#N 240690a_100000747261_100000210717 [0,2,0,0,0,0|2,0,0]=4 13452 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)C#N 527a_100000747261_100000210717 [0,2,0,0,0,0|2,0,0]=4 13453 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)CC 11a_100000747261_100000211226 [0,2,0,0,0,0|2,0,0]=4 13454 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)CC 1626a_100000747261_100000211226 [0,2,0,0,0,0|2,0,0]=4 13455 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)CC 240690a_100000747261_100000211226 [0,2,0,0,0,0|2,0,0]=4 13456 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)CC 527a_100000747261_100000211226 [0,2,0,0,0,0|2,0,0]=4 13457 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)CO 1626a_100000747261_100000183892 [0,2,0,0,0,0|2,0,0]=4 13458 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)CO 240690a_100000747261_100000183892 [0,2,0,0,0,0|2,0,0]=4 13459 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)OC 11a_100000747261_100000184203 [0,2,0,0,0,0|2,0,0]=4 13460 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)OC 1626a_100000747261_100000184203 [0,2,0,0,0,0|2,0,0]=4 13461 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)OC 240690a_100000747261_100000184203 [0,2,0,0,0,0|2,0,0]=4 13462 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)OC 527a_100000747261_100000184203 [0,2,0,0,0,0|2,0,0]=4 13463 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)SC 11a_100000747261_100000189692 [0,2,0,0,0,0|2,0,0]=4 13464 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)SC 1626a_100000747261_100000189692 [0,2,0,0,0,0|2,0,0]=4 13465 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)SC 240690a_100000747261_100000189692 [0,2,0,0,0,0|2,0,0]=4 13466 B15R1.3943 CCCN(C)C(=O)c1ccc(cc1)SC 527a_100000747261_100000189692 [0,2,0,0,0,0|2,0,0]=4 13467 B15R1.3943 CCc1ccc(cc1)C(=O)C(C)CCO 1458a_100000211226_100009893172 [0,2,0,0,0,0|2,0,0]=4 13468 B15R1.3943 CCc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100000211226 [0,2,0,0,0,0|1,0,0]=3 13469 B15R1.3943 CCc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100000211226 [0,2,0,0,0,0|1,0,0]=3 13470 B15R1.3943 CN(CCO)C(=O)c1ccc(cc1)C#N 240690a_100000210263_100000210717 [0,2,0,0,0,0|1,0,0]=3 13471 B15R1.3943 CN(CCO)C(=O)c1ccc(cc1)C#N 527a_100000210263_100000210717 [0,2,0,0,0,0|1,0,0]=3 13472 B15R1.3943 CN(CCO)C(=O)c1ccc(cc1)CO 240690a_100000210263_100000183892 [0,2,0,0,0,0|1,0,0]=3 13473 B15R1.3943 COc1ccc(cc1)C(=O)C(C)CCO 1458a_100000184203_100009893172 [0,2,0,0,0,0|2,0,0]=4 13474 B15R1.3943 COc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100000184203 [0,2,0,0,0,0|1,0,0]=3 13475 B15R1.3943 COc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100000184203 [0,2,0,0,0,0|1,0,0]=3 13476 B15R1.3943 CSc1ccc(cc1)C(=O)C(C)CCO 1458a_100000189692_100009893172 [0,2,0,0,0,0|2,0,0]=4 13477 B15R1.3943 CSc1ccc(cc1)C(=O)N(C)CCO 240690a_100000210263_100000189692 [0,2,0,0,0,0|1,0,0]=3 13478 B15R1.3943 CSc1ccc(cc1)C(=O)N(C)CCO 527a_100000210263_100000189692 [0,2,0,0,0,0|1,0,0]=3 13479 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)Br)Cl 11a_100000225692_100000691181 [0,2,0,0,0,0|1,0,1]=4 13480 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)Br)Cl 1626a_100000225692_100000691181 [0,2,0,0,0,0|1,0,1]=4 13481 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)Br)Cl 527a_100000225692_100000691181 [0,2,0,0,0,0|1,0,1]=4 13482 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)C)Cl 11a_100000225692_100000686306 [0,2,0,0,0,0|1,0,1]=4 13483 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)C)Cl 1626a_100000225692_100000686306 [0,2,0,0,0,0|1,0,1]=4 13484 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)C)Cl 527a_100000225692_100000686306 [0,2,0,0,0,0|1,0,1]=4 13485 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 11a_100000225692_100000210401 [0,2,0,0,0,0|1,0,1]=4 13486 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 1626a_100000225692_100000210401 [0,2,0,0,0,0|1,0,1]=4 13487 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 527a_100000225692_100000210401 [0,2,0,0,0,0|1,0,1]=4 13488 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)F)Cl 11a_100000225692_100000743183 [0,2,0,0,0,0|1,0,1]=4 13489 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)F)Cl 1626a_100000225692_100000743183 [0,2,0,0,0,0|1,0,1]=4 13490 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)F)Cl 527a_100000225692_100000743183 [0,2,0,0,0,0|1,0,1]=4 13491 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)I)Cl 11a_100000225692_100000739381 [0,2,0,0,0,0|1,0,1]=4 13492 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)I)Cl 1626a_100000225692_100000739381 [0,2,0,0,0,0|1,0,1]=4 13493 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)I)Cl 527a_100000225692_100000739381 [0,2,0,0,0,0|1,0,1]=4 13494 B15R1.3956 C#CCN(C)C(=O)c1ccc(c(c1)O)Cl 527a_100000225692_100011933997 [0,2,0,0,0,0|1,0,1]=4 13495 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Br)Cl 11a_100000225617_100000691181 [0,2,0,0,0,0|1,0,1]=4 13496 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Br)Cl 1626a_100000225617_100000691181 [0,2,0,0,0,0|1,0,1]=4 13497 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Br)Cl 240690a_100000225617_100000691181 [0,2,0,0,0,0|1,0,1]=4 13498 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Br)Cl 527a_100000225617_100000691181 [0,2,0,0,0,0|1,0,1]=4 13499 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)C)Cl 11a_100000225617_100000686306 [0,2,0,0,0,0|1,0,1]=4 13500 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)C)Cl 1626a_100000225617_100000686306 [0,2,0,0,0,0|1,0,1]=4 13501 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)C)Cl 240690a_100000225617_100000686306 [0,2,0,0,0,0|1,0,1]=4 13502 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)C)Cl 527a_100000225617_100000686306 [0,2,0,0,0,0|1,0,1]=4 13503 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 11a_100000225617_100000210401 [0,2,0,0,0,0|1,0,1]=4 13504 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 1626a_100000225617_100000210401 [0,2,0,0,0,0|1,0,1]=4 13505 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 240690a_100000225617_100000210401 [0,2,0,0,0,0|1,0,1]=4 13506 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)Cl)Cl 527a_100000225617_100000210401 [0,2,0,0,0,0|1,0,1]=4 13507 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)F)Cl 11a_100000225617_100000743183 [0,2,0,0,0,0|1,0,1]=4 13508 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)F)Cl 1626a_100000225617_100000743183 [0,2,0,0,0,0|1,0,1]=4 13509 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)F)Cl 240690a_100000225617_100000743183 [0,2,0,0,0,0|1,0,1]=4 13510 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)F)Cl 527a_100000225617_100000743183 [0,2,0,0,0,0|1,0,1]=4 13511 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)I)Cl 11a_100000225617_100000739381 [0,2,0,0,0,0|1,0,1]=4 13512 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)I)Cl 1626a_100000225617_100000739381 [0,2,0,0,0,0|1,0,1]=4 13513 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)I)Cl 240690a_100000225617_100000739381 [0,2,0,0,0,0|1,0,1]=4 13514 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)I)Cl 527a_100000225617_100000739381 [0,2,0,0,0,0|1,0,1]=4 13515 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)O)Cl 240690a_100000225617_100011933997 [0,2,0,0,0,0|1,0,1]=4 13516 B15R1.3956 C=CCN(C)C(=O)c1ccc(c(c1)O)Cl 527a_100000225617_100011933997 [0,2,0,0,0,0|1,0,1]=4 13517 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100009893172 [0,2,0,0,0,0|1,1,0]=4 13518 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100009893172 [0,2,0,0,0,0|1,0,0]=3 13519 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100009893172 [0,2,0,0,0,0|1,1,0]=4 13520 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100009893172 [0,2,0,0,0,0|1,1,0]=4 13521 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100009893172 [0,2,0,0,0,0|2,0,0]=4 13522 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100009893172 [0,2,0,0,0,0|1,1,0]=4 13523 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100009893172 [0,2,0,0,0,0|1,0,0]=3 13524 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100009893172 [0,2,0,0,0,0|1,1,0]=4 13525 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100009893172 [0,2,0,0,0,0|1,1,0]=4 13526 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100009893172 [0,2,0,0,0,0|2,0,0]=4 13527 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100009893172 [0,2,0,0,0,0|1,1,0]=4 13528 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100009893172 [0,2,0,0,0,0|1,0,0]=3 13529 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)F)F 1458a_100000209822_100009893172 [0,2,0,0,0,0|1,1,0]=4 13530 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)F)I 1458a_100000062624_100009893172 [0,2,0,0,0,0|1,1,0]=4 13531 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)F)O 1458a_100000185466_100009893172 [0,2,0,0,0,0|2,0,0]=4 13532 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100009893172 [0,2,0,0,0,0|1,1,0]=4 13533 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100009893172 [0,2,0,0,0,0|1,0,0]=3 13534 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)I)F 1458a_100000688015_100009893172 [0,2,0,0,0,0|1,1,0]=4 13535 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)I)I 1458a_100000725830_100009893172 [0,2,0,0,0,0|1,1,0]=4 13536 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)I)O 1458a_100000037485_100009893172 [0,2,0,0,0,0|2,0,0]=4 13537 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100009893172 [0,2,0,0,0,0|1,1,0]=4 13538 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100009893172 [0,2,0,0,0,0|1,0,0]=3 13539 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)O)F 1458a_100000035894_100009893172 [0,2,0,0,0,0|1,1,0]=4 13540 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)O)I 1458a_100000239334_100009893172 [0,2,0,0,0,0|1,1,0]=4 13541 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100009893172 [0,2,0,0,0,0|2,0,0]=4 13542 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000766640 [0,2,0,0,0,0|2,0,0]=4 13543 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000766640 [0,2,0,0,0,0|2,0,0]=4 13544 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000766640 [0,2,0,0,0,0|2,0,0]=4 13545 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000766640 [0,2,0,0,0,0|2,0,0]=4 13546 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000766640 [0,2,0,0,0,0|2,0,0]=4 13547 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000766640 [0,2,0,0,0,0|2,0,0]=4 13548 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Br 11a_100000747261_100012339404 [0,2,0,0,0,0|1,1,0]=4 13549 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Br 1626a_100000747261_100012339404 [0,2,0,0,0,0|1,1,0]=4 13550 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Br 240690a_100000747261_100012339404 [0,2,0,0,0,0|1,1,0]=4 13551 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Br 527a_100000747261_100012339404 [0,2,0,0,0,0|1,1,0]=4 13552 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)C 11a_100000747261_100000186397 [0,2,0,0,0,0|2,0,0]=4 13553 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)C 1626a_100000747261_100000186397 [0,2,0,0,0,0|2,0,0]=4 13554 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)C 240690a_100000747261_100000186397 [0,2,0,0,0,0|2,0,0]=4 13555 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)C 527a_100000747261_100000186397 [0,2,0,0,0,0|2,0,0]=4 13556 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Cl 11a_100000747261_100000691181 [0,2,0,0,0,0|1,0,0]=3 13557 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Cl 1626a_100000747261_100000691181 [0,2,0,0,0,0|1,0,0]=3 13558 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Cl 240690a_100000747261_100000691181 [0,2,0,0,0,0|1,0,0]=3 13559 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)Cl 527a_100000747261_100000691181 [0,2,0,0,0,0|1,0,0]=3 13560 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)F 11a_100000747261_100000760357 [0,2,0,0,0,0|1,1,0]=4 13561 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)F 1626a_100000747261_100000760357 [0,2,0,0,0,0|1,1,0]=4 13562 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)F 240690a_100000747261_100000760357 [0,2,0,0,0,0|1,1,0]=4 13563 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)F 527a_100000747261_100000760357 [0,2,0,0,0,0|1,1,0]=4 13564 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)I 11a_100000747261_100000739115 [0,2,0,0,0,0|1,1,0]=4 13565 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)I 1626a_100000747261_100000739115 [0,2,0,0,0,0|1,1,0]=4 13566 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)I 240690a_100000747261_100000739115 [0,2,0,0,0,0|1,1,0]=4 13567 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)I 527a_100000747261_100000739115 [0,2,0,0,0,0|1,1,0]=4 13568 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)O 240690a_100000747261_100000189672 [0,2,0,0,0,0|2,0,0]=4 13569 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Br 11a_100000747261_100000692631 [0,2,0,0,0,0|1,1,0]=4 13570 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Br 1626a_100000747261_100000692631 [0,2,0,0,0,0|1,1,0]=4 13571 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Br 240690a_100000747261_100000692631 [0,2,0,0,0,0|1,1,0]=4 13572 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Br 527a_100000747261_100000692631 [0,2,0,0,0,0|1,1,0]=4 13573 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)C 11a_100000747261_100000210898 [0,2,0,0,0,0|2,0,0]=4 13574 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)C 1626a_100000747261_100000210898 [0,2,0,0,0,0|2,0,0]=4 13575 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)C 240690a_100000747261_100000210898 [0,2,0,0,0,0|2,0,0]=4 13576 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)C 527a_100000747261_100000210898 [0,2,0,0,0,0|2,0,0]=4 13577 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Cl 11a_100000747261_100000686306 [0,2,0,0,0,0|1,0,0]=3 13578 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Cl 1626a_100000747261_100000686306 [0,2,0,0,0,0|1,0,0]=3 13579 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Cl 240690a_100000747261_100000686306 [0,2,0,0,0,0|1,0,0]=3 13580 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)Cl 527a_100000747261_100000686306 [0,2,0,0,0,0|1,0,0]=3 13581 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)F 11a_100000747261_100000751819 [0,2,0,0,0,0|1,1,0]=4 13582 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)F 1626a_100000747261_100000751819 [0,2,0,0,0,0|1,1,0]=4 13583 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)F 240690a_100000747261_100000751819 [0,2,0,0,0,0|1,1,0]=4 13584 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)F 527a_100000747261_100000751819 [0,2,0,0,0,0|1,1,0]=4 13585 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)I 11a_100000747261_100000751300 [0,2,0,0,0,0|1,1,0]=4 13586 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)I 1626a_100000747261_100000751300 [0,2,0,0,0,0|1,1,0]=4 13587 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)I 240690a_100000747261_100000751300 [0,2,0,0,0,0|1,1,0]=4 13588 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)I 527a_100000747261_100000751300 [0,2,0,0,0,0|1,1,0]=4 13589 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)O 240690a_100000747261_100000685612 [0,2,0,0,0,0|2,0,0]=4 13590 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Br 11a_100000747261_100000687082 [0,2,0,0,0,0|1,1,0]=4 13591 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Br 1626a_100000747261_100000687082 [0,2,0,0,0,0|1,1,0]=4 13592 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Br 240690a_100000747261_100000687082 [0,2,0,0,0,0|1,1,0]=4 13593 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Br 527a_100000747261_100000687082 [0,2,0,0,0,0|1,1,0]=4 13594 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)C 11a_100000747261_100000751740 [0,2,0,0,0,0|2,0,0]=4 13595 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)C 1626a_100000747261_100000751740 [0,2,0,0,0,0|2,0,0]=4 13596 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)C 240690a_100000747261_100000751740 [0,2,0,0,0,0|2,0,0]=4 13597 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)C 527a_100000747261_100000751740 [0,2,0,0,0,0|2,0,0]=4 13598 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Cl 11a_100000747261_100000210401 [0,2,0,0,0,0|1,0,0]=3 13599 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Cl 1626a_100000747261_100000210401 [0,2,0,0,0,0|1,0,0]=3 13600 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Cl 240690a_100000747261_100000210401 [0,2,0,0,0,0|1,0,0]=3 13601 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)Cl 527a_100000747261_100000210401 [0,2,0,0,0,0|1,0,0]=3 13602 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)F 11a_100000747261_100000686462 [0,2,0,0,0,0|1,1,0]=4 13603 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)F 1626a_100000747261_100000686462 [0,2,0,0,0,0|1,1,0]=4 13604 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)F 240690a_100000747261_100000686462 [0,2,0,0,0,0|1,1,0]=4 13605 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)F 527a_100000747261_100000686462 [0,2,0,0,0,0|1,1,0]=4 13606 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)I 11a_100000747261_100000684831 [0,2,0,0,0,0|1,1,0]=4 13607 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)I 1626a_100000747261_100000684831 [0,2,0,0,0,0|1,1,0]=4 13608 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)I 240690a_100000747261_100000684831 [0,2,0,0,0,0|1,1,0]=4 13609 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)I 527a_100000747261_100000684831 [0,2,0,0,0,0|1,1,0]=4 13610 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)O 240690a_100000747261_100000212196 [0,2,0,0,0,0|2,0,0]=4 13611 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)O 527a_100000747261_100000212196 [0,2,0,0,0,0|2,0,0]=4 13612 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Br 11a_100000747261_100000743946 [0,2,0,0,0,0|1,1,0]=4 13613 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Br 1626a_100000747261_100000743946 [0,2,0,0,0,0|1,1,0]=4 13614 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Br 240690a_100000747261_100000743946 [0,2,0,0,0,0|1,1,0]=4 13615 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Br 527a_100000747261_100000743946 [0,2,0,0,0,0|1,1,0]=4 13616 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)C 11a_100000747261_100000212313 [0,2,0,0,0,0|2,0,0]=4 13617 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)C 1626a_100000747261_100000212313 [0,2,0,0,0,0|2,0,0]=4 13618 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)C 240690a_100000747261_100000212313 [0,2,0,0,0,0|2,0,0]=4 13619 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)C 527a_100000747261_100000212313 [0,2,0,0,0,0|2,0,0]=4 13620 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Cl 11a_100000747261_100000743183 [0,2,0,0,0,0|1,0,0]=3 13621 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Cl 1626a_100000747261_100000743183 [0,2,0,0,0,0|1,0,0]=3 13622 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Cl 240690a_100000747261_100000743183 [0,2,0,0,0,0|1,0,0]=3 13623 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)Cl 527a_100000747261_100000743183 [0,2,0,0,0,0|1,0,0]=3 13624 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)F 11a_100000747261_100000209822 [0,2,0,0,0,0|1,1,0]=4 13625 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)F 1626a_100000747261_100000209822 [0,2,0,0,0,0|1,1,0]=4 13626 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)F 240690a_100000747261_100000209822 [0,2,0,0,0,0|1,1,0]=4 13627 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)F 527a_100000747261_100000209822 [0,2,0,0,0,0|1,1,0]=4 13628 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)I 11a_100000747261_100000062624 [0,2,0,0,0,0|1,1,0]=4 13629 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)I 1626a_100000747261_100000062624 [0,2,0,0,0,0|1,1,0]=4 13630 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)I 240690a_100000747261_100000062624 [0,2,0,0,0,0|1,1,0]=4 13631 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)I 527a_100000747261_100000062624 [0,2,0,0,0,0|1,1,0]=4 13632 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)O 240690a_100000747261_100000185466 [0,2,0,0,0,0|2,0,0]=4 13633 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)O 527a_100000747261_100000185466 [0,2,0,0,0,0|2,0,0]=4 13634 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Br 11a_100000747261_100012343876 [0,2,0,0,0,0|1,1,0]=4 13635 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Br 1626a_100000747261_100012343876 [0,2,0,0,0,0|1,1,0]=4 13636 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Br 240690a_100000747261_100012343876 [0,2,0,0,0,0|1,1,0]=4 13637 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Br 527a_100000747261_100012343876 [0,2,0,0,0,0|1,1,0]=4 13638 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)C 11a_100000747261_100000751299 [0,2,0,0,0,0|2,0,0]=4 13639 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)C 1626a_100000747261_100000751299 [0,2,0,0,0,0|2,0,0]=4 13640 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)C 240690a_100000747261_100000751299 [0,2,0,0,0,0|2,0,0]=4 13641 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)C 527a_100000747261_100000751299 [0,2,0,0,0,0|2,0,0]=4 13642 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Cl 11a_100000747261_100000739381 [0,2,0,0,0,0|1,0,0]=3 13643 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Cl 1626a_100000747261_100000739381 [0,2,0,0,0,0|1,0,0]=3 13644 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Cl 240690a_100000747261_100000739381 [0,2,0,0,0,0|1,0,0]=3 13645 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)Cl 527a_100000747261_100000739381 [0,2,0,0,0,0|1,0,0]=3 13646 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)F 11a_100000747261_100000688015 [0,2,0,0,0,0|1,1,0]=4 13647 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)F 1626a_100000747261_100000688015 [0,2,0,0,0,0|1,1,0]=4 13648 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)F 240690a_100000747261_100000688015 [0,2,0,0,0,0|1,1,0]=4 13649 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)F 527a_100000747261_100000688015 [0,2,0,0,0,0|1,1,0]=4 13650 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)I 11a_100000747261_100000725830 [0,2,0,0,0,0|1,1,0]=4 13651 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)I 1626a_100000747261_100000725830 [0,2,0,0,0,0|1,1,0]=4 13652 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)I 240690a_100000747261_100000725830 [0,2,0,0,0,0|1,1,0]=4 13653 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)I 527a_100000747261_100000725830 [0,2,0,0,0,0|1,1,0]=4 13654 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)O 1626a_100000747261_100000037485 [0,2,0,0,0,0|2,0,0]=4 13655 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)O 240690a_100000747261_100000037485 [0,2,0,0,0,0|2,0,0]=4 13656 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Br 240690a_100000747261_100000689001 [0,2,0,0,0,0|1,1,0]=4 13657 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Br 527a_100000747261_100000689001 [0,2,0,0,0,0|1,1,0]=4 13658 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)C 240690a_100000747261_100000233767 [0,2,0,0,0,0|2,0,0]=4 13659 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Cl 240690a_100000747261_100011933997 [0,2,0,0,0,0|1,0,0]=3 13660 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Cl 527a_100000747261_100011933997 [0,2,0,0,0,0|1,0,0]=3 13661 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)F 240690a_100000747261_100000035894 [0,2,0,0,0,0|1,1,0]=4 13662 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)F 527a_100000747261_100000035894 [0,2,0,0,0,0|1,1,0]=4 13663 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)I 1626a_100000747261_100000239334 [0,2,0,0,0,0|1,1,0]=4 13664 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)I 240690a_100000747261_100000239334 [0,2,0,0,0,0|1,1,0]=4 13665 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)I 527a_100000747261_100000239334 [0,2,0,0,0,0|1,1,0]=4 13666 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)Br)Cl 11a_100000748184_100000691181 [0,2,0,0,0,0|1,0,1]=4 13667 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)Br)Cl 1626a_100000748184_100000691181 [0,2,0,0,0,0|1,0,1]=4 13668 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)Cl)Cl 11a_100000748184_100000210401 [0,2,0,0,0,0|1,0,1]=4 13669 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)Cl)Cl 1626a_100000748184_100000210401 [0,2,0,0,0,0|1,0,1]=4 13670 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)F)Cl 11a_100000748184_100000743183 [0,2,0,0,0,0|1,0,1]=4 13671 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)F)Cl 1626a_100000748184_100000743183 [0,2,0,0,0,0|1,0,1]=4 13672 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)I)Cl 11a_100000748184_100000739381 [0,2,0,0,0,0|1,0,1]=4 13673 B15R1.3956 CN(CC#N)C(=O)c1ccc(c(c1)I)Cl 1626a_100000748184_100000739381 [0,2,0,0,0,0|1,0,1]=4 13674 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)Br 240690a_100000210263_100012339404 [0,2,0,0,0,0|0,1,0]=3 13675 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)Br 527a_100000210263_100012339404 [0,2,0,0,0,0|0,1,0]=3 13676 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)Cl 240690a_100000210263_100000691181 [0,2,0,0,0,0|0,0,0]=2 13677 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)Cl 527a_100000210263_100000691181 [0,2,0,0,0,0|0,0,0]=2 13678 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)F 240690a_100000210263_100000760357 [0,2,0,0,0,0|0,1,0]=3 13679 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)F 527a_100000210263_100000760357 [0,2,0,0,0,0|0,1,0]=3 13680 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)I 240690a_100000210263_100000739115 [0,2,0,0,0,0|0,1,0]=3 13681 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)I 527a_100000210263_100000739115 [0,2,0,0,0,0|0,1,0]=3 13682 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Br)O 240690a_100000210263_100000189672 [0,2,0,0,0,0|1,0,0]=3 13683 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)Br 240690a_100000210263_100000687082 [0,2,0,0,0,0|0,1,0]=3 13684 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)Br 527a_100000210263_100000687082 [0,2,0,0,0,0|0,1,0]=3 13685 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)Cl 240690a_100000210263_100000210401 [0,2,0,0,0,0|0,0,0]=2 13686 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)Cl 527a_100000210263_100000210401 [0,2,0,0,0,0|0,0,0]=2 13687 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)F 240690a_100000210263_100000686462 [0,2,0,0,0,0|0,1,0]=3 13688 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)F 527a_100000210263_100000686462 [0,2,0,0,0,0|0,1,0]=3 13689 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)I 240690a_100000210263_100000684831 [0,2,0,0,0,0|0,1,0]=3 13690 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)I 527a_100000210263_100000684831 [0,2,0,0,0,0|0,1,0]=3 13691 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)O 240690a_100000210263_100000212196 [0,2,0,0,0,0|1,0,0]=3 13692 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)Cl)O 527a_100000210263_100000212196 [0,2,0,0,0,0|1,0,0]=3 13693 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)Br 240690a_100000210263_100000743946 [0,2,0,0,0,0|0,1,0]=3 13694 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)Br 527a_100000210263_100000743946 [0,2,0,0,0,0|0,1,0]=3 13695 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)Cl 240690a_100000210263_100000743183 [0,2,0,0,0,0|0,0,0]=2 13696 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)Cl 527a_100000210263_100000743183 [0,2,0,0,0,0|0,0,0]=2 13697 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)F 240690a_100000210263_100000209822 [0,2,0,0,0,0|0,1,0]=3 13698 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)F 527a_100000210263_100000209822 [0,2,0,0,0,0|0,1,0]=3 13699 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)I 240690a_100000210263_100000062624 [0,2,0,0,0,0|0,1,0]=3 13700 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)I 527a_100000210263_100000062624 [0,2,0,0,0,0|0,1,0]=3 13701 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)O 240690a_100000210263_100000185466 [0,2,0,0,0,0|1,0,0]=3 13702 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)F)O 527a_100000210263_100000185466 [0,2,0,0,0,0|1,0,0]=3 13703 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)Br 240690a_100000210263_100012343876 [0,2,0,0,0,0|0,1,0]=3 13704 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)Br 527a_100000210263_100012343876 [0,2,0,0,0,0|0,1,0]=3 13705 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)Cl 240690a_100000210263_100000739381 [0,2,0,0,0,0|0,0,0]=2 13706 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)Cl 527a_100000210263_100000739381 [0,2,0,0,0,0|0,0,0]=2 13707 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)F 240690a_100000210263_100000688015 [0,2,0,0,0,0|0,1,0]=3 13708 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)F 527a_100000210263_100000688015 [0,2,0,0,0,0|0,1,0]=3 13709 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)I 240690a_100000210263_100000725830 [0,2,0,0,0,0|0,1,0]=3 13710 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)I 527a_100000210263_100000725830 [0,2,0,0,0,0|0,1,0]=3 13711 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)I)O 240690a_100000210263_100000037485 [0,2,0,0,0,0|1,0,0]=3 13712 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)Br 240690a_100000210263_100000689001 [0,2,0,0,0,0|0,1,0]=3 13713 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)Br 527a_100000210263_100000689001 [0,2,0,0,0,0|0,1,0]=3 13714 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)Cl 240690a_100000210263_100011933997 [0,2,0,0,0,0|0,0,0]=2 13715 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)Cl 527a_100000210263_100011933997 [0,2,0,0,0,0|0,0,0]=2 13716 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)F 240690a_100000210263_100000035894 [0,2,0,0,0,0|0,1,0]=3 13717 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)F 527a_100000210263_100000035894 [0,2,0,0,0,0|0,1,0]=3 13718 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)I 240690a_100000210263_100000239334 [0,2,0,0,0,0|0,1,0]=3 13719 B15R1.3956 CN(CCO)C(=O)c1ccc(c(c1)O)I 527a_100000210263_100000239334 [0,2,0,0,0,0|0,1,0]=3 13720 B15R1.3956 Cc1cc(ccc1Br)C(=O)C(C)CCO 1458a_100000692631_100009893172 [0,2,0,0,0,0|1,1,0]=4 13721 B15R1.3956 Cc1cc(ccc1Br)C(=O)N(C)CCO 240690a_100000210263_100000692631 [0,2,0,0,0,0|0,1,0]=3 13722 B15R1.3956 Cc1cc(ccc1Br)C(=O)N(C)CCO 527a_100000210263_100000692631 [0,2,0,0,0,0|0,1,0]=3 13723 B15R1.3956 Cc1cc(ccc1Cl)C(=O)C(C)CCO 1458a_100000686306_100009893172 [0,2,0,0,0,0|1,0,0]=3 13724 B15R1.3956 Cc1cc(ccc1Cl)C(=O)N(C)CC#N 11a_100000748184_100000686306 [0,2,0,0,0,0|1,0,1]=4 13725 B15R1.3956 Cc1cc(ccc1Cl)C(=O)N(C)CC#N 1626a_100000748184_100000686306 [0,2,0,0,0,0|1,0,1]=4 13726 B15R1.3956 Cc1cc(ccc1Cl)C(=O)N(C)CCO 240690a_100000210263_100000686306 [0,2,0,0,0,0|0,0,0]=2 13727 B15R1.3956 Cc1cc(ccc1Cl)C(=O)N(C)CCO 527a_100000210263_100000686306 [0,2,0,0,0,0|0,0,0]=2 13728 B15R1.3956 Cc1cc(ccc1F)C(=O)C(C)CCO 1458a_100000751819_100009893172 [0,2,0,0,0,0|1,1,0]=4 13729 B15R1.3956 Cc1cc(ccc1F)C(=O)N(C)CCO 240690a_100000210263_100000751819 [0,2,0,0,0,0|0,1,0]=3 13730 B15R1.3956 Cc1cc(ccc1F)C(=O)N(C)CCO 527a_100000210263_100000751819 [0,2,0,0,0,0|0,1,0]=3 13731 B15R1.3956 Cc1cc(ccc1I)C(=O)C(C)CCO 1458a_100000751300_100009893172 [0,2,0,0,0,0|1,1,0]=4 13732 B15R1.3956 Cc1cc(ccc1I)C(=O)N(C)CCO 240690a_100000210263_100000751300 [0,2,0,0,0,0|0,1,0]=3 13733 B15R1.3956 Cc1cc(ccc1I)C(=O)N(C)CCO 527a_100000210263_100000751300 [0,2,0,0,0,0|0,1,0]=3 13734 B15R1.3956 Cc1cc(ccc1O)C(=O)C(C)CCO 1458a_100000685612_100009893172 [0,2,0,0,0,0|2,0,0]=4 13735 B15R1.3956 Cc1cc(ccc1O)C(=O)N(C)CCO 240690a_100000210263_100000685612 [0,2,0,0,0,0|1,0,0]=3 13736 B15R1.3956 Cc1ccc(cc1Br)C(=O)C(C)CCO 1458a_100000186397_100009893172 [0,2,0,0,0,0|2,0,0]=4 13737 B15R1.3956 Cc1ccc(cc1Br)C(=O)N(C)CCO 240690a_100000210263_100000186397 [0,2,0,0,0,0|1,0,0]=3 13738 B15R1.3956 Cc1ccc(cc1Br)C(=O)N(C)CCO 527a_100000210263_100000186397 [0,2,0,0,0,0|1,0,0]=3 13739 B15R1.3956 Cc1ccc(cc1C)C(=O)C(C)CCO 1458a_100000210898_100009893172 [0,2,0,0,0,0|2,0,0]=4 13740 B15R1.3956 Cc1ccc(cc1C)C(=O)N(C)CCO 240690a_100000210263_100000210898 [0,2,0,0,0,0|1,0,0]=3 13741 B15R1.3956 Cc1ccc(cc1C)C(=O)N(C)CCO 527a_100000210263_100000210898 [0,2,0,0,0,0|1,0,0]=3 13742 B15R1.3956 Cc1ccc(cc1Cl)C(=O)C(C)CCO 1458a_100000751740_100009893172 [0,2,0,0,0,0|2,0,0]=4 13743 B15R1.3956 Cc1ccc(cc1Cl)C(=O)N(C)CCO 240690a_100000210263_100000751740 [0,2,0,0,0,0|1,0,0]=3 13744 B15R1.3956 Cc1ccc(cc1Cl)C(=O)N(C)CCO 527a_100000210263_100000751740 [0,2,0,0,0,0|1,0,0]=3 13745 B15R1.3956 Cc1ccc(cc1F)C(=O)C(C)CCO 1458a_100000212313_100009893172 [0,2,0,0,0,0|2,0,0]=4 13746 B15R1.3956 Cc1ccc(cc1F)C(=O)N(C)CCO 240690a_100000210263_100000212313 [0,2,0,0,0,0|1,0,0]=3 13747 B15R1.3956 Cc1ccc(cc1F)C(=O)N(C)CCO 527a_100000210263_100000212313 [0,2,0,0,0,0|1,0,0]=3 13748 B15R1.3956 Cc1ccc(cc1I)C(=O)C(C)CCO 1458a_100000751299_100009893172 [0,2,0,0,0,0|2,0,0]=4 13749 B15R1.3956 Cc1ccc(cc1I)C(=O)N(C)CCO 240690a_100000210263_100000751299 [0,2,0,0,0,0|1,0,0]=3 13750 B15R1.3956 Cc1ccc(cc1I)C(=O)N(C)CCO 527a_100000210263_100000751299 [0,2,0,0,0,0|1,0,0]=3 13751 B15R1.3956 Cc1ccc(cc1O)C(=O)C(C)CCO 1458a_100000233767_100009893172 [0,2,0,0,0,0|2,0,0]=4 13752 B15R1.3956 Cc1ccc(cc1O)C(=O)N(C)CCO 240690a_100000210263_100000233767 [0,2,0,0,0,0|1,0,0]=3 13753 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1Br)Cl 11a_100000225692_100000766353 [0,2,0,0,0,0|1,0,1]=4 13754 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100000225692_100000766353 [0,2,0,0,0,0|1,0,1]=4 13755 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1Br)Cl 527a_100000225692_100000766353 [0,2,0,0,0,0|1,0,1]=4 13756 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1C)Cl 11a_100000225692_100000688705 [0,2,0,0,0,0|1,0,1]=4 13757 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1C)Cl 1626a_100000225692_100000688705 [0,2,0,0,0,0|1,0,1]=4 13758 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1C)Cl 527a_100000225692_100000688705 [0,2,0,0,0,0|1,0,1]=4 13759 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100000225692_100000185840 [0,2,0,0,0,0|1,0,1]=4 13760 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100000225692_100000185840 [0,2,0,0,0,0|1,0,1]=4 13761 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100000225692_100000185840 [0,2,0,0,0,0|1,0,1]=4 13762 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1F)Cl 11a_100000225692_100000212326 [0,2,0,0,0,0|1,0,1]=4 13763 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1F)Cl 1626a_100000225692_100000212326 [0,2,0,0,0,0|1,0,1]=4 13764 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1F)Cl 527a_100000225692_100000212326 [0,2,0,0,0,0|1,0,1]=4 13765 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1I)Cl 11a_100000225692_100000739380 [0,2,0,0,0,0|1,0,1]=4 13766 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1I)Cl 1626a_100000225692_100000739380 [0,2,0,0,0,0|1,0,1]=4 13767 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1I)Cl 527a_100000225692_100000739380 [0,2,0,0,0,0|1,0,1]=4 13768 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000225692_100000188622 [0,2,0,0,0,0|1,0,1]=4 13769 B15R1.16836 C#CCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000225692_100000188622 [0,2,0,0,0,0|1,0,1]=4 13770 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Br)Cl 11a_100000225617_100000766353 [0,2,0,0,0,0|1,0,1]=4 13771 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100000225617_100000766353 [0,2,0,0,0,0|1,0,1]=4 13772 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Br)Cl 240690a_100000225617_100000766353 [0,2,0,0,0,0|1,0,1]=4 13773 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Br)Cl 527a_100000225617_100000766353 [0,2,0,0,0,0|1,0,1]=4 13774 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1C)Cl 11a_100000225617_100000688705 [0,2,0,0,0,0|1,0,1]=4 13775 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1C)Cl 1626a_100000225617_100000688705 [0,2,0,0,0,0|1,0,1]=4 13776 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1C)Cl 240690a_100000225617_100000688705 [0,2,0,0,0,0|1,0,1]=4 13777 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1C)Cl 527a_100000225617_100000688705 [0,2,0,0,0,0|1,0,1]=4 13778 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100000225617_100000185840 [0,2,0,0,0,0|1,0,1]=4 13779 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100000225617_100000185840 [0,2,0,0,0,0|1,0,1]=4 13780 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Cl)Cl 240690a_100000225617_100000185840 [0,2,0,0,0,0|1,0,1]=4 13781 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100000225617_100000185840 [0,2,0,0,0,0|1,0,1]=4 13782 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1F)Cl 11a_100000225617_100000212326 [0,2,0,0,0,0|1,0,1]=4 13783 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1F)Cl 1626a_100000225617_100000212326 [0,2,0,0,0,0|1,0,1]=4 13784 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1F)Cl 240690a_100000225617_100000212326 [0,2,0,0,0,0|1,0,1]=4 13785 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1F)Cl 527a_100000225617_100000212326 [0,2,0,0,0,0|1,0,1]=4 13786 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1I)Cl 11a_100000225617_100000739380 [0,2,0,0,0,0|1,0,1]=4 13787 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1I)Cl 1626a_100000225617_100000739380 [0,2,0,0,0,0|1,0,1]=4 13788 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1I)Cl 240690a_100000225617_100000739380 [0,2,0,0,0,0|1,0,1]=4 13789 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1I)Cl 527a_100000225617_100000739380 [0,2,0,0,0,0|1,0,1]=4 13790 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000225617_100000188622 [0,2,0,0,0,0|1,0,1]=4 13791 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1O)Cl 240690a_100000225617_100000188622 [0,2,0,0,0,0|1,0,1]=4 13792 B15R1.16836 C=CCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000225617_100000188622 [0,2,0,0,0,0|1,0,1]=4 13793 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Br)Br 1458a_100000762965_100009893172 [0,2,0,0,0,0|1,1,0]=4 13794 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100009893172 [0,2,0,0,0,0|1,0,0]=3 13795 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Br)F 1458a_100000212304_100009893172 [0,2,0,0,0,0|1,1,0]=4 13796 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Br)I 1458a_100012360512_100009893172 [0,2,0,0,0,0|1,1,0]=4 13797 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Br)O 1458a_100012344906_100009893172 [0,2,0,0,0,0|2,0,0]=4 13798 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100009893172 [0,2,0,0,0,0|1,1,0]=4 13799 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100009893172 [0,2,0,0,0,0|1,0,0]=3 13800 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Cl)F 1458a_100000211397_100009893172 [0,2,0,0,0,0|1,1,0]=4 13801 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Cl)I 1458a_100000751301_100009893172 [0,2,0,0,0,0|1,1,0]=4 13802 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1Cl)O 1458a_100000702456_100009893172 [0,2,0,0,0,0|2,0,0]=4 13803 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1F)Br 1458a_100000214689_100009893172 [0,2,0,0,0,0|1,1,0]=4 13804 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1F)Cl 1458a_100000212326_100009893172 [0,2,0,0,0,0|1,0,0]=3 13805 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1F)F 1458a_100000211022_100009893172 [0,2,0,0,0,0|1,1,0]=4 13806 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1F)I 1458a_100000037189_100009893172 [0,2,0,0,0,0|1,1,0]=4 13807 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1F)O 1458a_100000689029_100009893172 [0,2,0,0,0,0|2,0,0]=4 13808 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1I)Br 1458a_100000751167_100009893172 [0,2,0,0,0,0|1,1,0]=4 13809 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1I)Cl 1458a_100000739380_100009893172 [0,2,0,0,0,0|1,0,0]=3 13810 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1I)F 1458a_100000739341_100009893172 [0,2,0,0,0,0|1,1,0]=4 13811 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1O)Br 1458a_100000744433_100009893172 [0,2,0,0,0,0|1,1,0]=4 13812 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_100009893172 [0,2,0,0,0,0|1,0,0]=3 13813 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1O)F 1458a_100000746061_100009893172 [0,2,0,0,0,0|1,1,0]=4 13814 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1O)I 1458a_100000091984_100009893172 [0,2,0,0,0,0|1,1,0]=4 13815 B15R1.16836 CC(CCO)C(=O)c1ccc(cc1O)O 1458a_100000212172_100009893172 [0,2,0,0,0,0|2,0,0]=4 13816 B15R1.16836 CCCC(C)C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000766640 [0,2,0,0,0,0|2,0,0]=4 13817 B15R1.16836 CCCC(C)C(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000766640 [0,2,0,0,0,0|2,0,0]=4 13818 B15R1.16836 CCCC(C)C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000766640 [0,2,0,0,0,0|2,0,0]=4 13819 B15R1.16836 CCCC(C)C(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000766640 [0,2,0,0,0,0|2,0,0]=4 13820 B15R1.16836 CCCC(C)C(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000766640 [0,2,0,0,0,0|2,0,0]=4 13821 B15R1.16836 CCCC(C)C(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000766640 [0,2,0,0,0,0|2,0,0]=4 13822 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Br 11a_100000747261_100000762965 [0,2,0,0,0,0|1,1,0]=4 13823 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Br 1626a_100000747261_100000762965 [0,2,0,0,0,0|1,1,0]=4 13824 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Br 240690a_100000747261_100000762965 [0,2,0,0,0,0|1,1,0]=4 13825 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Br 527a_100000747261_100000762965 [0,2,0,0,0,0|1,1,0]=4 13826 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)C 11a_100000747261_100000685072 [0,2,0,0,0,0|2,0,0]=4 13827 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)C 1626a_100000747261_100000685072 [0,2,0,0,0,0|2,0,0]=4 13828 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)C 240690a_100000747261_100000685072 [0,2,0,0,0,0|2,0,0]=4 13829 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)C 527a_100000747261_100000685072 [0,2,0,0,0,0|2,0,0]=4 13830 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Cl 11a_100000747261_100000766353 [0,2,0,0,0,0|1,0,0]=3 13831 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Cl 1626a_100000747261_100000766353 [0,2,0,0,0,0|1,0,0]=3 13832 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Cl 240690a_100000747261_100000766353 [0,2,0,0,0,0|1,0,0]=3 13833 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)Cl 527a_100000747261_100000766353 [0,2,0,0,0,0|1,0,0]=3 13834 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)F 11a_100000747261_100000212304 [0,2,0,0,0,0|1,1,0]=4 13835 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)F 1626a_100000747261_100000212304 [0,2,0,0,0,0|1,1,0]=4 13836 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)F 240690a_100000747261_100000212304 [0,2,0,0,0,0|1,1,0]=4 13837 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)F 527a_100000747261_100000212304 [0,2,0,0,0,0|1,1,0]=4 13838 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)I 11a_100000747261_100012360512 [0,2,0,0,0,0|1,1,0]=4 13839 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)I 1626a_100000747261_100012360512 [0,2,0,0,0,0|1,1,0]=4 13840 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)I 240690a_100000747261_100012360512 [0,2,0,0,0,0|1,1,0]=4 13841 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)I 527a_100000747261_100012360512 [0,2,0,0,0,0|1,1,0]=4 13842 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)O 240690a_100000747261_100012344906 [0,2,0,0,0,0|2,0,0]=4 13843 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Br)O 527a_100000747261_100012344906 [0,2,0,0,0,0|2,0,0]=4 13844 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Br 11a_100000747261_100000741311 [0,2,0,0,0,0|1,1,0]=4 13845 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Br 1626a_100000747261_100000741311 [0,2,0,0,0,0|1,1,0]=4 13846 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Br 240690a_100000747261_100000741311 [0,2,0,0,0,0|1,1,0]=4 13847 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Br 527a_100000747261_100000741311 [0,2,0,0,0,0|1,1,0]=4 13848 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)C 11a_100000747261_100000211164 [0,2,0,0,0,0|2,0,0]=4 13849 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)C 1626a_100000747261_100000211164 [0,2,0,0,0,0|2,0,0]=4 13850 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)C 240690a_100000747261_100000211164 [0,2,0,0,0,0|2,0,0]=4 13851 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)C 527a_100000747261_100000211164 [0,2,0,0,0,0|2,0,0]=4 13852 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Cl 11a_100000747261_100000688705 [0,2,0,0,0,0|1,0,0]=3 13853 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Cl 1626a_100000747261_100000688705 [0,2,0,0,0,0|1,0,0]=3 13854 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Cl 240690a_100000747261_100000688705 [0,2,0,0,0,0|1,0,0]=3 13855 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)Cl 527a_100000747261_100000688705 [0,2,0,0,0,0|1,0,0]=3 13856 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)F 11a_100000747261_100000686989 [0,2,0,0,0,0|1,1,0]=4 13857 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)F 1626a_100000747261_100000686989 [0,2,0,0,0,0|1,1,0]=4 13858 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)F 240690a_100000747261_100000686989 [0,2,0,0,0,0|1,1,0]=4 13859 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)F 527a_100000747261_100000686989 [0,2,0,0,0,0|1,1,0]=4 13860 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)I 11a_100000747261_100010189873 [0,2,0,0,0,0|1,1,0]=4 13861 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)I 1626a_100000747261_100010189873 [0,2,0,0,0,0|1,1,0]=4 13862 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)I 240690a_100000747261_100010189873 [0,2,0,0,0,0|1,1,0]=4 13863 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)I 527a_100000747261_100010189873 [0,2,0,0,0,0|1,1,0]=4 13864 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)O 240690a_100000747261_100000692822 [0,2,0,0,0,0|2,0,0]=4 13865 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1C)O 527a_100000747261_100000692822 [0,2,0,0,0,0|2,0,0]=4 13866 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Br 11a_100000747261_100000741628 [0,2,0,0,0,0|1,1,0]=4 13867 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Br 1626a_100000747261_100000741628 [0,2,0,0,0,0|1,1,0]=4 13868 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Br 240690a_100000747261_100000741628 [0,2,0,0,0,0|1,1,0]=4 13869 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Br 527a_100000747261_100000741628 [0,2,0,0,0,0|1,1,0]=4 13870 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)C 11a_100000747261_100000766932 [0,2,0,0,0,0|2,0,0]=4 13871 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)C 1626a_100000747261_100000766932 [0,2,0,0,0,0|2,0,0]=4 13872 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)C 240690a_100000747261_100000766932 [0,2,0,0,0,0|2,0,0]=4 13873 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)C 527a_100000747261_100000766932 [0,2,0,0,0,0|2,0,0]=4 13874 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Cl 11a_100000747261_100000185840 [0,2,0,0,0,0|1,0,0]=3 13875 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Cl 1626a_100000747261_100000185840 [0,2,0,0,0,0|1,0,0]=3 13876 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Cl 240690a_100000747261_100000185840 [0,2,0,0,0,0|1,0,0]=3 13877 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)Cl 527a_100000747261_100000185840 [0,2,0,0,0,0|1,0,0]=3 13878 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)F 11a_100000747261_100000211397 [0,2,0,0,0,0|1,1,0]=4 13879 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)F 1626a_100000747261_100000211397 [0,2,0,0,0,0|1,1,0]=4 13880 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)F 240690a_100000747261_100000211397 [0,2,0,0,0,0|1,1,0]=4 13881 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)F 527a_100000747261_100000211397 [0,2,0,0,0,0|1,1,0]=4 13882 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)I 11a_100000747261_100000751301 [0,2,0,0,0,0|1,1,0]=4 13883 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)I 1626a_100000747261_100000751301 [0,2,0,0,0,0|1,1,0]=4 13884 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)I 240690a_100000747261_100000751301 [0,2,0,0,0,0|1,1,0]=4 13885 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)I 527a_100000747261_100000751301 [0,2,0,0,0,0|1,1,0]=4 13886 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)O 240690a_100000747261_100000702456 [0,2,0,0,0,0|2,0,0]=4 13887 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1Cl)O 527a_100000747261_100000702456 [0,2,0,0,0,0|2,0,0]=4 13888 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Br 11a_100000747261_100000214689 [0,2,0,0,0,0|1,1,0]=4 13889 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Br 1626a_100000747261_100000214689 [0,2,0,0,0,0|1,1,0]=4 13890 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Br 240690a_100000747261_100000214689 [0,2,0,0,0,0|1,1,0]=4 13891 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Br 527a_100000747261_100000214689 [0,2,0,0,0,0|1,1,0]=4 13892 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)C 11a_100000747261_100000766033 [0,2,0,0,0,0|2,0,0]=4 13893 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)C 1626a_100000747261_100000766033 [0,2,0,0,0,0|2,0,0]=4 13894 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)C 240690a_100000747261_100000766033 [0,2,0,0,0,0|2,0,0]=4 13895 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)C 527a_100000747261_100000766033 [0,2,0,0,0,0|2,0,0]=4 13896 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Cl 11a_100000747261_100000212326 [0,2,0,0,0,0|1,0,0]=3 13897 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Cl 1626a_100000747261_100000212326 [0,2,0,0,0,0|1,0,0]=3 13898 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Cl 240690a_100000747261_100000212326 [0,2,0,0,0,0|1,0,0]=3 13899 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)Cl 527a_100000747261_100000212326 [0,2,0,0,0,0|1,0,0]=3 13900 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)F 11a_100000747261_100000211022 [0,2,0,0,0,0|1,1,0]=4 13901 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)F 1626a_100000747261_100000211022 [0,2,0,0,0,0|1,1,0]=4 13902 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)F 240690a_100000747261_100000211022 [0,2,0,0,0,0|1,1,0]=4 13903 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)F 527a_100000747261_100000211022 [0,2,0,0,0,0|1,1,0]=4 13904 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)I 11a_100000747261_100000037189 [0,2,0,0,0,0|1,1,0]=4 13905 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)I 1626a_100000747261_100000037189 [0,2,0,0,0,0|1,1,0]=4 13906 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)I 240690a_100000747261_100000037189 [0,2,0,0,0,0|1,1,0]=4 13907 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)I 527a_100000747261_100000037189 [0,2,0,0,0,0|1,1,0]=4 13908 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)O 240690a_100000747261_100000689029 [0,2,0,0,0,0|2,0,0]=4 13909 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1F)O 527a_100000747261_100000689029 [0,2,0,0,0,0|2,0,0]=4 13910 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Br 11a_100000747261_100000751167 [0,2,0,0,0,0|1,1,0]=4 13911 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Br 1626a_100000747261_100000751167 [0,2,0,0,0,0|1,1,0]=4 13912 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Br 240690a_100000747261_100000751167 [0,2,0,0,0,0|1,1,0]=4 13913 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Br 527a_100000747261_100000751167 [0,2,0,0,0,0|1,1,0]=4 13914 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)C 11a_100000747261_100009999607 [0,2,0,0,0,0|2,0,0]=4 13915 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)C 1626a_100000747261_100009999607 [0,2,0,0,0,0|2,0,0]=4 13916 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)C 240690a_100000747261_100009999607 [0,2,0,0,0,0|2,0,0]=4 13917 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)C 527a_100000747261_100009999607 [0,2,0,0,0,0|2,0,0]=4 13918 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Cl 11a_100000747261_100000739380 [0,2,0,0,0,0|1,0,0]=3 13919 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Cl 1626a_100000747261_100000739380 [0,2,0,0,0,0|1,0,0]=3 13920 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Cl 240690a_100000747261_100000739380 [0,2,0,0,0,0|1,0,0]=3 13921 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)Cl 527a_100000747261_100000739380 [0,2,0,0,0,0|1,0,0]=3 13922 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)F 11a_100000747261_100000739341 [0,2,0,0,0,0|1,1,0]=4 13923 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)F 1626a_100000747261_100000739341 [0,2,0,0,0,0|1,1,0]=4 13924 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)F 240690a_100000747261_100000739341 [0,2,0,0,0,0|1,1,0]=4 13925 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1I)F 527a_100000747261_100000739341 [0,2,0,0,0,0|1,1,0]=4 13926 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)Br 240690a_100000747261_100000744433 [0,2,0,0,0,0|1,1,0]=4 13927 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)Br 527a_100000747261_100000744433 [0,2,0,0,0,0|1,1,0]=4 13928 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)C 1626a_100000747261_100000212137 [0,2,0,0,0,0|2,0,0]=4 13929 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)C 240690a_100000747261_100000212137 [0,2,0,0,0,0|2,0,0]=4 13930 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)C 527a_100000747261_100000212137 [0,2,0,0,0,0|2,0,0]=4 13931 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)Cl 11a_100000747261_100000188622 [0,2,0,0,0,0|1,0,0]=3 13932 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)Cl 240690a_100000747261_100000188622 [0,2,0,0,0,0|1,0,0]=3 13933 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)Cl 527a_100000747261_100000188622 [0,2,0,0,0,0|1,0,0]=3 13934 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)F 240690a_100000747261_100000746061 [0,2,0,0,0,0|1,1,0]=4 13935 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)F 527a_100000747261_100000746061 [0,2,0,0,0,0|1,1,0]=4 13936 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)I 240690a_100000747261_100000091984 [0,2,0,0,0,0|1,1,0]=4 13937 B15R1.16836 CCCN(C)C(=O)c1ccc(cc1O)I 527a_100000747261_100000091984 [0,2,0,0,0,0|1,1,0]=4 13938 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1Br)Cl 11a_100000748184_100000766353 [0,2,0,0,0,0|1,0,1]=4 13939 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1Br)Cl 1626a_100000748184_100000766353 [0,2,0,0,0,0|1,0,1]=4 13940 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1Cl)Cl 11a_100000748184_100000185840 [0,2,0,0,0,0|1,0,1]=4 13941 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1Cl)Cl 1626a_100000748184_100000185840 [0,2,0,0,0,0|1,0,1]=4 13942 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1F)Cl 11a_100000748184_100000212326 [0,2,0,0,0,0|1,0,1]=4 13943 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1F)Cl 1626a_100000748184_100000212326 [0,2,0,0,0,0|1,0,1]=4 13944 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1I)Cl 11a_100000748184_100000739380 [0,2,0,0,0,0|1,0,1]=4 13945 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1I)Cl 1626a_100000748184_100000739380 [0,2,0,0,0,0|1,0,1]=4 13946 B15R1.16836 CN(CC#N)C(=O)c1ccc(cc1O)Cl 11a_100000748184_100000188622 [0,2,0,0,0,0|1,0,1]=4 13947 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)Br 240690a_100000210263_100000762965 [0,2,0,0,0,0|0,1,0]=3 13948 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)Br 527a_100000210263_100000762965 [0,2,0,0,0,0|0,1,0]=3 13949 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)Cl 240690a_100000210263_100000766353 [0,2,0,0,0,0|0,0,0]=2 13950 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)Cl 527a_100000210263_100000766353 [0,2,0,0,0,0|0,0,0]=2 13951 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)F 240690a_100000210263_100000212304 [0,2,0,0,0,0|0,1,0]=3 13952 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)F 527a_100000210263_100000212304 [0,2,0,0,0,0|0,1,0]=3 13953 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)I 240690a_100000210263_100012360512 [0,2,0,0,0,0|0,1,0]=3 13954 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)I 527a_100000210263_100012360512 [0,2,0,0,0,0|0,1,0]=3 13955 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)O 240690a_100000210263_100012344906 [0,2,0,0,0,0|1,0,0]=3 13956 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Br)O 527a_100000210263_100012344906 [0,2,0,0,0,0|1,0,0]=3 13957 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)Br 240690a_100000210263_100000741628 [0,2,0,0,0,0|0,1,0]=3 13958 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)Br 527a_100000210263_100000741628 [0,2,0,0,0,0|0,1,0]=3 13959 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)Cl 240690a_100000210263_100000185840 [0,2,0,0,0,0|0,0,0]=2 13960 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)Cl 527a_100000210263_100000185840 [0,2,0,0,0,0|0,0,0]=2 13961 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)F 240690a_100000210263_100000211397 [0,2,0,0,0,0|0,1,0]=3 13962 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)F 527a_100000210263_100000211397 [0,2,0,0,0,0|0,1,0]=3 13963 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)I 240690a_100000210263_100000751301 [0,2,0,0,0,0|0,1,0]=3 13964 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)I 527a_100000210263_100000751301 [0,2,0,0,0,0|0,1,0]=3 13965 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)O 240690a_100000210263_100000702456 [0,2,0,0,0,0|1,0,0]=3 13966 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1Cl)O 527a_100000210263_100000702456 [0,2,0,0,0,0|1,0,0]=3 13967 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)Br 240690a_100000210263_100000214689 [0,2,0,0,0,0|0,1,0]=3 13968 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)Br 527a_100000210263_100000214689 [0,2,0,0,0,0|0,1,0]=3 13969 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)Cl 240690a_100000210263_100000212326 [0,2,0,0,0,0|0,0,0]=2 13970 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)Cl 527a_100000210263_100000212326 [0,2,0,0,0,0|0,0,0]=2 13971 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)F 240690a_100000210263_100000211022 [0,2,0,0,0,0|0,1,0]=3 13972 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)F 527a_100000210263_100000211022 [0,2,0,0,0,0|0,1,0]=3 13973 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)I 240690a_100000210263_100000037189 [0,2,0,0,0,0|0,1,0]=3 13974 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)I 527a_100000210263_100000037189 [0,2,0,0,0,0|0,1,0]=3 13975 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)O 240690a_100000210263_100000689029 [0,2,0,0,0,0|1,0,0]=3 13976 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1F)O 527a_100000210263_100000689029 [0,2,0,0,0,0|1,0,0]=3 13977 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1I)Br 240690a_100000210263_100000751167 [0,2,0,0,0,0|0,1,0]=3 13978 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1I)Br 527a_100000210263_100000751167 [0,2,0,0,0,0|0,1,0]=3 13979 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1I)Cl 240690a_100000210263_100000739380 [0,2,0,0,0,0|0,0,0]=2 13980 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1I)Cl 527a_100000210263_100000739380 [0,2,0,0,0,0|0,0,0]=2 13981 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1I)F 240690a_100000210263_100000739341 [0,2,0,0,0,0|0,1,0]=3 13982 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1I)F 527a_100000210263_100000739341 [0,2,0,0,0,0|0,1,0]=3 13983 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)Br 240690a_100000210263_100000744433 [0,2,0,0,0,0|0,1,0]=3 13984 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)Br 527a_100000210263_100000744433 [0,2,0,0,0,0|0,1,0]=3 13985 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)Cl 240690a_100000210263_100000188622 [0,2,0,0,0,0|0,0,0]=2 13986 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)Cl 527a_100000210263_100000188622 [0,2,0,0,0,0|0,0,0]=2 13987 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)F 240690a_100000210263_100000746061 [0,2,0,0,0,0|0,1,0]=3 13988 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)F 527a_100000210263_100000746061 [0,2,0,0,0,0|0,1,0]=3 13989 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)I 240690a_100000210263_100000091984 [0,2,0,0,0,0|0,1,0]=3 13990 B15R1.16836 CN(CCO)C(=O)c1ccc(cc1O)I 527a_100000210263_100000091984 [0,2,0,0,0,0|0,1,0]=3 13991 B15R1.16836 Cc1cc(ccc1C(=O)C(C)CCO)Br 1458a_100000741311_100009893172 [0,2,0,0,0,0|1,1,0]=4 13992 B15R1.16836 Cc1cc(ccc1C(=O)C(C)CCO)Cl 1458a_100000688705_100009893172 [0,2,0,0,0,0|1,0,0]=3 13993 B15R1.16836 Cc1cc(ccc1C(=O)C(C)CCO)F 1458a_100000686989_100009893172 [0,2,0,0,0,0|1,1,0]=4 13994 B15R1.16836 Cc1cc(ccc1C(=O)C(C)CCO)I 1458a_100010189873_100009893172 [0,2,0,0,0,0|1,1,0]=4 13995 B15R1.16836 Cc1cc(ccc1C(=O)C(C)CCO)O 1458a_100000692822_100009893172 [0,2,0,0,0,0|2,0,0]=4 13996 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CC#N)Cl 11a_100000748184_100000688705 [0,2,0,0,0,0|1,0,1]=4 13997 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CC#N)Cl 1626a_100000748184_100000688705 [0,2,0,0,0,0|1,0,1]=4 13998 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)Br 240690a_100000210263_100000741311 [0,2,0,0,0,0|0,1,0]=3 13999 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)Br 527a_100000210263_100000741311 [0,2,0,0,0,0|0,1,0]=3 14000 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)Cl 240690a_100000210263_100000688705 [0,2,0,0,0,0|0,0,0]=2 14001 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)Cl 527a_100000210263_100000688705 [0,2,0,0,0,0|0,0,0]=2 14002 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)F 240690a_100000210263_100000686989 [0,2,0,0,0,0|0,1,0]=3 14003 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)F 527a_100000210263_100000686989 [0,2,0,0,0,0|0,1,0]=3 14004 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)I 240690a_100000210263_100010189873 [0,2,0,0,0,0|0,1,0]=3 14005 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)I 527a_100000210263_100010189873 [0,2,0,0,0,0|0,1,0]=3 14006 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)O 240690a_100000210263_100000692822 [0,2,0,0,0,0|1,0,0]=3 14007 B15R1.16836 Cc1cc(ccc1C(=O)N(C)CCO)O 527a_100000210263_100000692822 [0,2,0,0,0,0|1,0,0]=3 14008 B15R1.16836 Cc1ccc(c(c1)Br)C(=O)C(C)CCO 1458a_100000685072_100009893172 [0,2,0,0,0,0|2,0,0]=4 14009 B15R1.16836 Cc1ccc(c(c1)Br)C(=O)N(C)CCO 240690a_100000210263_100000685072 [0,2,0,0,0,0|1,0,0]=3 14010 B15R1.16836 Cc1ccc(c(c1)Br)C(=O)N(C)CCO 527a_100000210263_100000685072 [0,2,0,0,0,0|1,0,0]=3 14011 B15R1.16836 Cc1ccc(c(c1)C)C(=O)C(C)CCO 1458a_100000211164_100009893172 [0,2,0,0,0,0|2,0,0]=4 14012 B15R1.16836 Cc1ccc(c(c1)C)C(=O)N(C)CCO 240690a_100000210263_100000211164 [0,2,0,0,0,0|1,0,0]=3 14013 B15R1.16836 Cc1ccc(c(c1)C)C(=O)N(C)CCO 527a_100000210263_100000211164 [0,2,0,0,0,0|1,0,0]=3 14014 B15R1.16836 Cc1ccc(c(c1)Cl)C(=O)C(C)CCO 1458a_100000766932_100009893172 [0,2,0,0,0,0|2,0,0]=4 14015 B15R1.16836 Cc1ccc(c(c1)Cl)C(=O)N(C)CCO 240690a_100000210263_100000766932 [0,2,0,0,0,0|1,0,0]=3 14016 B15R1.16836 Cc1ccc(c(c1)Cl)C(=O)N(C)CCO 527a_100000210263_100000766932 [0,2,0,0,0,0|1,0,0]=3 14017 B15R1.16836 Cc1ccc(c(c1)F)C(=O)C(C)CCO 1458a_100000766033_100009893172 [0,2,0,0,0,0|2,0,0]=4 14018 B15R1.16836 Cc1ccc(c(c1)F)C(=O)N(C)CCO 240690a_100000210263_100000766033 [0,2,0,0,0,0|1,0,0]=3 14019 B15R1.16836 Cc1ccc(c(c1)F)C(=O)N(C)CCO 527a_100000210263_100000766033 [0,2,0,0,0,0|1,0,0]=3 14020 B15R1.16836 Cc1ccc(c(c1)I)C(=O)C(C)CCO 1458a_100009999607_100009893172 [0,2,0,0,0,0|2,0,0]=4 14021 B15R1.16836 Cc1ccc(c(c1)I)C(=O)N(C)CCO 240690a_100000210263_100009999607 [0,2,0,0,0,0|1,0,0]=3 14022 B15R1.16836 Cc1ccc(c(c1)I)C(=O)N(C)CCO 527a_100000210263_100009999607 [0,2,0,0,0,0|1,0,0]=3 14023 B15R1.16836 Cc1ccc(c(c1)O)C(=O)C(C)CCO 1458a_100000212137_100009893172 [0,2,0,0,0,0|2,0,0]=4 14024 B15R1.16836 Cc1ccc(c(c1)O)C(=O)N(C)CCO 240690a_100000210263_100000212137 [0,2,0,0,0,0|1,0,0]=3 14025 B15R1.16836 Cc1ccc(c(c1)O)C(=O)N(C)CCO 527a_100000210263_100000212137 [0,2,0,0,0,0|1,0,0]=3 14026 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100000210953_100000209962 [0,2,0,0,0,0|2,0,0]=4 14027 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000210953_100000209962 [0,2,0,0,0,0|2,0,0]=4 14028 B15R1.903 CC(C)CNS(=O)(=O)c1ccc(cc1)Cl 40a_100000210953_100000077732 [0,2,0,0,0,0|2,0,0]=4 14029 B15R1.903 CC(O)CNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_100011218427 [0,2,0,0,0,0|1,0,1]=4 14030 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)Br 270084a_100000210904_100000182491 [0,2,0,0,0,0|1,1,0]=4 14031 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)Br 274078a_100000210904_100000182491 [0,2,0,0,0,0|1,1,0]=4 14032 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)Br 40a_100000210904_100010306709 [0,2,0,0,0,0|1,1,0]=4 14033 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100000210904_100000209962 [0,2,0,0,0,0|1,0,0]=3 14034 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100000210904_100000209962 [0,2,0,0,0,0|1,0,0]=3 14035 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)Cl 40a_100000210904_100000077732 [0,2,0,0,0,0|1,0,0]=3 14036 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)F 270084a_100000210904_100000184267 [0,2,0,0,0,0|1,1,0]=4 14037 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)F 274078a_100000210904_100000184267 [0,2,0,0,0,0|1,1,0]=4 14038 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)F 40a_100000210904_100000081159 [0,2,0,0,0,0|1,1,0]=4 14039 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)I 270084a_100000210904_100011205396 [0,2,0,0,0,0|1,1,0]=4 14040 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)I 274078a_100000210904_100011205396 [0,2,0,0,0,0|1,1,0]=4 14041 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)N 40a_100000210904_100000054796 [0,2,0,0,0,0|2,0,0]=4 14042 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)O 270084a_100000210904_100020667864 [0,2,0,0,0,0|2,0,0]=4 14043 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(cc1)O 274078a_100000210904_100020667864 [0,2,0,0,0,0|2,0,0]=4 14044 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(nc1)Cl 270084a_100000210904_100000184283 [0,2,0,0,0,0|2,0,0]=4 14045 B15R1.903 CC(O)CNS(=O)(=O)c1ccc(nc1)Cl 274078a_100000210904_100000184283 [0,2,0,0,0,0|2,0,0]=4 14046 B15R1.903 C[C@@H](O)CNC(C)(C)c1ccc(cc1)Cl 2230a_100000750703_100009817552 [0,2,0,0,0,0|1,0,1]=4 14047 B15R1.903 Cc1ccc(cc1)S(=O)(=O)NCC(C)O 270084a_100000210904_100000211267 [0,2,0,0,0,0|2,0,0]=4 14048 B15R1.903 Cc1ccc(cc1)S(=O)(=O)NCC(C)O 274078a_100000210904_100000211267 [0,2,0,0,0,0|2,0,0]=4 14049 B15R1.903 Cc1ccc(cc1)S(=O)(=O)NCC(C)O 40a_100000210904_100000039673 [0,2,0,0,0,0|2,0,0]=4 14050 B15R1.903 O=S(=O)(NCC(F)F)c1ccc(cc1)Cl 270084a_100000765723_100000209962 [0,2,0,0,0,0|2,0,0]=4 14051 B15R1.903 O=S(=O)(NCC(F)F)c1ccc(cc1)Cl 274078a_100000765723_100000209962 [0,2,0,0,0,0|2,0,0]=4 14052 B15R1.903 O=S(=O)(NCC(F)F)c1ccc(cc1)Cl 40a_100000765723_100000077732 [0,2,0,0,0,0|2,0,0]=4 14053 B15R1.5404 C=Cc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000034458 [0,2,0,0,0,0|2,0,0]=4 14054 B15R1.5404 C=Cc1ccc(cc1)S(=O)(=O)NCCO 271570a_100011290941_100000186246 [0,2,0,0,0,0|2,0,0]=4 14055 B15R1.5404 C=Cc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000034458 [0,2,0,0,0,0|2,0,0]=4 14056 B15R1.5404 CCc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000212210 [0,2,0,0,0,0|2,0,0]=4 14057 B15R1.5404 CCc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000212210 [0,2,0,0,0,0|2,0,0]=4 14058 B15R1.5404 CNc1ccc(cc1)S(=O)(=O)NCCO 34a_200000239647_200000210301 [0,2,0,0,0,0|2,0,0]=4 14059 B15R1.5404 COc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000182833 [0,2,0,0,0,0|2,0,0]=4 14060 B15R1.5404 COc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000182833 [0,2,0,0,0,0|2,0,0]=4 14061 B15R1.5404 CSc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000747762 [0,2,0,0,0,0|2,0,0]=4 14062 B15R1.5404 CSc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000747762 [0,2,0,0,0,0|2,0,0]=4 14063 B15R1.5404 CSc1ccc(cc1)S(=O)(=O)NCCO 62a_100000186246_200000210301 [0,2,0,0,0,0|2,0,0]=4 14064 B15R1.5404 CSc1ccc(cc1)S(=O)(=O)NCCO 62a_200000210301_100000186246 [0,2,0,0,0,0|2,0,0]=4 14065 B15R1.5404 N#Cc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000184514 [0,2,0,0,0,0|2,0,0]=4 14066 B15R1.5404 N#Cc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000184514 [0,2,0,0,0,0|2,0,0]=4 14067 B15R1.5404 N#Cc1ccc(cc1)S(=O)(=O)NCCO 40a_100000210304_100010740313 [0,2,0,0,0,0|2,0,0]=4 14068 B15R1.5404 O=Cc1ccc(cc1)S(=O)(=O)NCCO 270084a_100000210304_100000045293 [0,2,0,0,0,0|2,0,0]=4 14069 B15R1.5404 O=Cc1ccc(cc1)S(=O)(=O)NCCO 274078a_100000210304_100000045293 [0,2,0,0,0,0|2,0,0]=4 14070 B15R1.5404 O=S(=O)(NCCO)c1ccc(cc1)CBr 270084a_100000210304_100000763552 [0,2,0,0,0,0|1,1,0]=4 14071 B15R1.5404 O=S(=O)(NCCO)c1ccc(cc1)CBr 274078a_100000210304_100000763552 [0,2,0,0,0,0|1,1,0]=4 14072 B15R1.5404 O=S(=O)(NCCO)c1ccc(cc1)CBr 40a_100000210304_100011072442 [0,2,0,0,0,0|1,1,0]=4 14073 B15R1.5404 [13CH3]Nc1ccc(cc1)S(=O)(=O)NCCO 34a_200000239647_200025704644 [0,2,0,0,0,0|2,0,0]=4 14074 B15R1.5404 [13CH3]Sc1ccc(cc1)S(=O)(=O)NCCO 62a_100000186246_200025704644 [0,2,0,0,0,0|2,0,0]=4 14075 B15R1.5404 [13CH3]Sc1ccc(cc1)S(=O)(=O)NCCO 62a_200025704644_100000186246 [0,2,0,0,0,0|2,0,0]=4 14076 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)Br)Cl 270084a_100020643023_100000687180 [0,2,0,0,0,0|2,0,0]=4 14077 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)Br)Cl 274078a_100020643023_100000687180 [0,2,0,0,0,0|2,0,0]=4 14078 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)C)Cl 270084a_100020643023_100000051332 [0,2,0,0,0,0|2,0,0]=4 14079 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)C)Cl 274078a_100020643023_100000051332 [0,2,0,0,0,0|2,0,0]=4 14080 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)Cl)Cl 270084a_100020643023_100000183565 [0,2,0,0,0,0|2,0,0]=4 14081 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)Cl)Cl 274078a_100020643023_100000183565 [0,2,0,0,0,0|2,0,0]=4 14082 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)Cl)Cl 40a_100020643023_200010235540 [0,2,0,0,0,0|2,0,0]=4 14083 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)F)Cl 270084a_100020643023_100011317203 [0,2,0,0,0,0|2,0,0]=4 14084 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)F)Cl 274078a_100020643023_100011317203 [0,2,0,0,0,0|2,0,0]=4 14085 B15R1.5419 CCCNS(=O)(=O)c1ccc(c(c1)N)Cl 40a_100020643023_100000039682 [0,2,0,0,0,0|2,0,0]=4 14086 B15R1.5419 Cc1cc(ccc1Br)S(=O)(=O)NCCO 270084a_100000210304_100000184575 [0,2,0,0,0,0|1,1,0]=4 14087 B15R1.5419 Cc1cc(ccc1Br)S(=O)(=O)NCCO 274078a_100000210304_100000184575 [0,2,0,0,0,0|1,1,0]=4 14088 B15R1.5419 Cc1cc(ccc1Br)S(=O)(=O)NCCO 40a_100000210304_200015196462 [0,2,0,0,0,0|1,1,0]=4 14089 B15R1.5419 Cc1cc(ccc1Cl)S(=O)(=O)NCCF 270084a_100000724931_100000051332 [0,2,0,0,0,0|2,0,0]=4 14090 B15R1.5419 Cc1cc(ccc1Cl)S(=O)(=O)NCCF 274078a_100000724931_100000051332 [0,2,0,0,0,0|2,0,0]=4 14091 B15R1.5419 Cc1cc(ccc1Cl)S(=O)(=O)NCCO 270084a_100000210304_100000051332 [0,2,0,0,0,0|1,0,0]=3 14092 B15R1.5419 Cc1cc(ccc1Cl)S(=O)(=O)NCCO 274078a_100000210304_100000051332 [0,2,0,0,0,0|1,0,0]=3 14093 B15R1.5419 Cc1cc(ccc1F)S(=O)(=O)NCCO 270084a_100000210304_100000742315 [0,2,0,0,0,0|1,1,0]=4 14094 B15R1.5419 Cc1cc(ccc1F)S(=O)(=O)NCCO 274078a_100000210304_100000742315 [0,2,0,0,0,0|1,1,0]=4 14095 B15R1.5419 Cc1cc(cnc1Cl)S(=O)(=O)NCCO 270084a_100000210304_100000757265 [0,2,0,0,0,0|2,0,0]=4 14096 B15R1.5419 Cc1cc(cnc1Cl)S(=O)(=O)NCCO 274078a_100000210304_100000757265 [0,2,0,0,0,0|2,0,0]=4 14097 B15R1.5419 Cc1ccc(cc1Br)S(=O)(=O)NCCO 270084a_100000210304_100000764225 [0,2,0,0,0,0|2,0,0]=4 14098 B15R1.5419 Cc1ccc(cc1Br)S(=O)(=O)NCCO 274078a_100000210304_100000764225 [0,2,0,0,0,0|2,0,0]=4 14099 B15R1.5419 Cc1ccc(cc1C)S(=O)(=O)NCCO 270084a_100000210304_200000182954 [0,2,0,0,0,0|2,0,0]=4 14100 B15R1.5419 Cc1ccc(cc1C)S(=O)(=O)NCCO 274078a_100000210304_200000182954 [0,2,0,0,0,0|2,0,0]=4 14101 B15R1.5419 Cc1ccc(cc1Cl)S(=O)(=O)NCCO 270084a_100000210304_100000739382 [0,2,0,0,0,0|2,0,0]=4 14102 B15R1.5419 Cc1ccc(cc1Cl)S(=O)(=O)NCCO 274078a_100000210304_100000739382 [0,2,0,0,0,0|2,0,0]=4 14103 B15R1.5419 Cc1ccc(cc1Cl)S(=O)(=O)NCCO 40a_100000210304_200015694257 [0,2,0,0,0,0|2,0,0]=4 14104 B15R1.5419 Cc1ccc(cc1F)S(=O)(=O)NCCO 270084a_100000210304_100000739383 [0,2,0,0,0,0|2,0,0]=4 14105 B15R1.5419 Cc1ccc(cc1F)S(=O)(=O)NCCO 274078a_100000210304_100000739383 [0,2,0,0,0,0|2,0,0]=4 14106 B15R1.5419 Nc1cc(ccc1Cl)S(=O)(=O)NCCF 40a_100000724931_100000039682 [0,2,0,0,0,0|2,0,0]=4 14107 B15R1.5419 Nc1cc(ccc1Cl)S(=O)(=O)NCCO 40a_100000210304_100000039682 [0,2,0,0,0,0|1,0,0]=3 14108 B15R1.5419 Nc1ccc(cc1Cl)S(=O)(=O)NCCO 40a_100000210304_200000036663 [0,2,0,0,0,0|2,0,0]=4 14109 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)Br)Cl 270084a_100000724931_100000687180 [0,2,0,0,0,0|2,0,0]=4 14110 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)Br)Cl 274078a_100000724931_100000687180 [0,2,0,0,0,0|2,0,0]=4 14111 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)Cl)Cl 270084a_100000724931_100000183565 [0,2,0,0,0,0|2,0,0]=4 14112 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)Cl)Cl 274078a_100000724931_100000183565 [0,2,0,0,0,0|2,0,0]=4 14113 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)Cl)Cl 40a_100000724931_200010235540 [0,2,0,0,0,0|2,0,0]=4 14114 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)F)Cl 270084a_100000724931_100011317203 [0,2,0,0,0,0|2,0,0]=4 14115 B15R1.5419 O=S(=O)(NCCF)c1ccc(c(c1)F)Cl 274078a_100000724931_100011317203 [0,2,0,0,0,0|2,0,0]=4 14116 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)Br 270084a_100000210304_200011211985 [0,2,0,0,0,0|1,1,0]=4 14117 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)Br 274078a_100000210304_200011211985 [0,2,0,0,0,0|1,1,0]=4 14118 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)Cl 270084a_100000210304_100000687180 [0,2,0,0,0,0|1,0,0]=3 14119 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)Cl 274078a_100000210304_100000687180 [0,2,0,0,0,0|1,0,0]=3 14120 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)F 270084a_100000210304_100000765437 [0,2,0,0,0,0|1,1,0]=4 14121 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)F 274078a_100000210304_100000765437 [0,2,0,0,0,0|1,1,0]=4 14122 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Br)F 40a_100000210304_100015196426 [0,2,0,0,0,0|1,1,0]=4 14123 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)Br 270084a_100000210304_100000692077 [0,2,0,0,0,0|1,1,0]=4 14124 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)Br 274078a_100000210304_100000692077 [0,2,0,0,0,0|1,1,0]=4 14125 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)Br 40a_100000210304_100015196460 [0,2,0,0,0,0|1,1,0]=4 14126 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)Cl 270084a_100000210304_100000183565 [0,2,0,0,0,0|1,0,0]=3 14127 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)Cl 274078a_100000210304_100000183565 [0,2,0,0,0,0|1,0,0]=3 14128 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)Cl 40a_100000210304_200010235540 [0,2,0,0,0,0|1,0,0]=3 14129 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)F 270084a_100000210304_100000184080 [0,2,0,0,0,0|1,1,0]=4 14130 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)Cl)F 274078a_100000210304_100000184080 [0,2,0,0,0,0|1,1,0]=4 14131 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)F)Br 270084a_100000210304_100000763610 [0,2,0,0,0,0|1,1,0]=4 14132 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)F)Br 274078a_100000210304_100000763610 [0,2,0,0,0,0|1,1,0]=4 14133 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)F)Cl 270084a_100000210304_100011317203 [0,2,0,0,0,0|1,0,0]=3 14134 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)F)Cl 274078a_100000210304_100011317203 [0,2,0,0,0,0|1,0,0]=3 14135 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)F)F 270084a_100000210304_100000211408 [0,2,0,0,0,0|1,1,0]=4 14136 B15R1.5419 O=S(=O)(NCCO)c1ccc(c(c1)F)F 274078a_100000210304_100000211408 [0,2,0,0,0,0|1,1,0]=4 14137 B15R1.5419 O=S(=O)(NCCO)c1cnc(c(c1)Br)Cl 270084a_100000210304_100000762685 [0,2,0,0,0,0|2,0,0]=4 14138 B15R1.5419 O=S(=O)(NCCO)c1cnc(c(c1)Br)Cl 274078a_100000210304_100000762685 [0,2,0,0,0,0|2,0,0]=4 14139 B15R1.5419 O=S(=O)(NCCO)c1cnc(c(c1)Cl)Cl 270084a_100000210304_200000039281 [0,2,0,0,0,0|2,0,0]=4 14140 B15R1.5419 O=S(=O)(NCCO)c1cnc(c(c1)Cl)Cl 274078a_100000210304_200000039281 [0,2,0,0,0,0|2,0,0]=4 14141 B15R1.5419 O=S(=O)(NCCO)c1cnc(c(c1)F)Cl 270084a_100000210304_200000120683 [0,2,0,0,0,0|2,0,0]=4 14142 B15R1.5419 O=S(=O)(NCCO)c1cnc(c(c1)F)Cl 274078a_100000210304_200000120683 [0,2,0,0,0,0|2,0,0]=4 14143 B15R1.22397 CC(C)(NCCO)c1ccc(cc1Cl)Cl 2230a_100016993697_100000211926 [0,2,0,0,0,0|1,0,1]=4 14144 B15R1.22397 CC(C)(NCCO)c1ccc(cc1Cl)Cl 34a_100016993697_100000211926 [0,2,0,0,0,0|1,0,1]=4 14145 B15R1.22397 CC(C)(NCCO)c1ccc(cc1Cl)Cl 7a_100016993697_100000211926 [0,2,0,0,0,0|1,0,1]=4 14146 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1Br)Cl 270084a_100020643023_100000726161 [0,2,0,0,0,0|2,0,0]=4 14147 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1Br)Cl 274078a_100020643023_100000726161 [0,2,0,0,0,0|2,0,0]=4 14148 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1C)Cl 270084a_100020643023_200000739422 [0,2,0,0,0,0|2,0,0]=4 14149 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1C)Cl 274078a_100020643023_200000739422 [0,2,0,0,0,0|2,0,0]=4 14150 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1Cl)Cl 270084a_100020643023_100000720568 [0,2,0,0,0,0|2,0,0]=4 14151 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1Cl)Cl 274078a_100020643023_100000720568 [0,2,0,0,0,0|2,0,0]=4 14152 B15R1.22397 CCCNS(=O)(=O)c1ccc(cc1F)Cl 274078a_100020643023_100000179752 [0,2,0,0,0,0|2,0,0]=4 14153 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCF)Cl 270084a_100000724931_200000739422 [0,2,0,0,0,0|2,0,0]=4 14154 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCF)Cl 274078a_100000724931_200000739422 [0,2,0,0,0,0|2,0,0]=4 14155 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)Br 270084a_100000210304_100000744902 [0,2,0,0,0,0|1,1,0]=4 14156 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)Br 274078a_100000210304_100000744902 [0,2,0,0,0,0|1,1,0]=4 14157 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)Br 40a_100000210304_100015196448 [0,2,0,0,0,0|1,1,0]=4 14158 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)Cl 270084a_100000210304_200000739422 [0,2,0,0,0,0|1,0,0]=3 14159 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)Cl 274078a_100000210304_200000739422 [0,2,0,0,0,0|1,0,0]=3 14160 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)F 270084a_100000210304_100000736127 [0,2,0,0,0,0|1,1,0]=4 14161 B15R1.22397 Cc1cc(ccc1S(=O)(=O)NCCO)F 274078a_100000210304_100000736127 [0,2,0,0,0,0|1,1,0]=4 14162 B15R1.22397 Cc1cc(ncc1S(=O)(=O)NCCO)Cl 270084a_100000210304_100011361768 [0,2,0,0,0,0|2,0,0]=4 14163 B15R1.22397 Cc1cc(ncc1S(=O)(=O)NCCO)Cl 274078a_100000210304_100011361768 [0,2,0,0,0,0|2,0,0]=4 14164 B15R1.22397 Cc1ccc(c(c1)Br)S(=O)(=O)NCCO 270084a_100000210304_100000736722 [0,2,0,0,0,0|2,0,0]=4 14165 B15R1.22397 Cc1ccc(c(c1)Br)S(=O)(=O)NCCO 274078a_100000210304_100000736722 [0,2,0,0,0,0|2,0,0]=4 14166 B15R1.22397 Cc1ccc(c(c1)C)S(=O)(=O)NCCO 270084a_100000210304_100000182922 [0,2,0,0,0,0|2,0,0]=4 14167 B15R1.22397 Cc1ccc(c(c1)C)S(=O)(=O)NCCO 274078a_100000210304_100000182922 [0,2,0,0,0,0|2,0,0]=4 14168 B15R1.22397 Cc1ccc(c(c1)Cl)S(=O)(=O)NCCO 270084a_100000210304_100000735684 [0,2,0,0,0,0|2,0,0]=4 14169 B15R1.22397 Cc1ccc(c(c1)Cl)S(=O)(=O)NCCO 274078a_100000210304_100000735684 [0,2,0,0,0,0|2,0,0]=4 14170 B15R1.22397 Cc1ccc(c(c1)F)S(=O)(=O)NCCO 270084a_100000210304_100000751630 [0,2,0,0,0,0|2,0,0]=4 14171 B15R1.22397 Cc1ccc(c(c1)F)S(=O)(=O)NCCO 274078a_100000210304_100000751630 [0,2,0,0,0,0|2,0,0]=4 14172 B15R1.22397 Cc1nc(ccc1S(=O)(=O)NCCO)Cl 270084a_100000210304_100000731512 [0,2,0,0,0,0|2,0,0]=4 14173 B15R1.22397 Cc1nc(ccc1S(=O)(=O)NCCO)Cl 274078a_100000210304_100000731512 [0,2,0,0,0,0|2,0,0]=4 14174 B15R1.22397 Nc1ccc(c(c1)F)S(=O)(=O)NCCO 40a_100000210304_100021443812 [0,2,0,0,0,0|2,0,0]=4 14175 B15R1.22397 O=S(=O)(NCCF)c1ccc(cc1Br)Cl 270084a_100000724931_100000726161 [0,2,0,0,0,0|2,0,0]=4 14176 B15R1.22397 O=S(=O)(NCCF)c1ccc(cc1Br)Cl 274078a_100000724931_100000726161 [0,2,0,0,0,0|2,0,0]=4 14177 B15R1.22397 O=S(=O)(NCCF)c1ccc(cc1Cl)Cl 270084a_100000724931_100000720568 [0,2,0,0,0,0|2,0,0]=4 14178 B15R1.22397 O=S(=O)(NCCF)c1ccc(cc1Cl)Cl 274078a_100000724931_100000720568 [0,2,0,0,0,0|2,0,0]=4 14179 B15R1.22397 O=S(=O)(NCCF)c1ccc(cc1F)Cl 274078a_100000724931_100000179752 [0,2,0,0,0,0|2,0,0]=4 14180 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Br)Br 270084a_100000210304_100000741759 [0,2,0,0,0,0|1,1,0]=4 14181 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Br)Br 274078a_100000210304_100000741759 [0,2,0,0,0,0|1,1,0]=4 14182 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Br)Cl 270084a_100000210304_100000726161 [0,2,0,0,0,0|1,0,0]=3 14183 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Br)Cl 274078a_100000210304_100000726161 [0,2,0,0,0,0|1,0,0]=3 14184 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Br)F 270084a_100000210304_100000739518 [0,2,0,0,0,0|1,1,0]=4 14185 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Br)F 274078a_100000210304_100000739518 [0,2,0,0,0,0|1,1,0]=4 14186 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Cl)Br 270084a_100000210304_100000184074 [0,2,0,0,0,0|1,1,0]=4 14187 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Cl)Br 274078a_100000210304_100000184074 [0,2,0,0,0,0|1,1,0]=4 14188 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Cl)Cl 270084a_100000210304_100000720568 [0,2,0,0,0,0|1,0,0]=3 14189 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Cl)Cl 274078a_100000210304_100000720568 [0,2,0,0,0,0|1,0,0]=3 14190 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Cl)F 270084a_100000210304_100000736424 [0,2,0,0,0,0|1,1,0]=4 14191 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1Cl)F 274078a_100000210304_100000736424 [0,2,0,0,0,0|1,1,0]=4 14192 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1F)Br 270084a_100000210304_100000752951 [0,2,0,0,0,0|1,1,0]=4 14193 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1F)Br 274078a_100000210304_100000752951 [0,2,0,0,0,0|1,1,0]=4 14194 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1F)Cl 274078a_100000210304_100000179752 [0,2,0,0,0,0|1,0,0]=3 14195 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1F)F 270084a_100000210304_100000204641 [0,2,0,0,0,0|1,1,0]=4 14196 B15R1.22397 O=S(=O)(NCCO)c1ccc(cc1F)F 274078a_100000210304_100000204641 [0,2,0,0,0,0|1,1,0]=4 14197 B15R1.22397 O=S(=O)(NCCO)c1ccc(nc1Cl)Cl 270084a_100000210304_100000051258 [0,2,0,0,0,0|2,0,0]=4 14198 B15R1.22397 O=S(=O)(NCCO)c1ccc(nc1Cl)Cl 274078a_100000210304_100000051258 [0,2,0,0,0,0|2,0,0]=4 14199 B15R1.5 C#Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100011217615_100012276601 [0,2,0,0,0,0|2,0,0]=4 14200 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100011217615 [0,2,0,0,0,0|2,0,0]=4 14201 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100011217615 [0,2,0,0,0,0|2,0,0]=4 14202 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100011217615 [0,2,0,0,0,0|2,0,0]=4 14203 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100011217615 [0,2,0,0,0,0|2,0,0]=4 14204 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100011217615 [0,2,0,0,0,0|1,0,0]=3 14205 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100011217615 [0,2,0,0,0,0|1,0,0]=3 14206 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100011217615 [0,2,0,0,0,0|1,0,0]=3 14207 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100011217615 [0,2,0,0,0,0|2,0,0]=4 14208 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100011217615 [0,2,0,0,0,0|2,0,0]=4 14209 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100011217615 [0,2,0,0,0,0|2,0,0]=4 14210 B15R1.5 C#Cc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100011217615 [0,2,0,0,0,0|2,0,0]=4 14211 B15R1.5 C=Cc1ccc(cc1)C(=O)CCC(C)O 1458a_100000687532_100012276601 [0,2,0,0,0,0|2,0,0]=4 14212 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000687532 [0,2,0,0,0,0|2,0,0]=4 14213 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000687532 [0,2,0,0,0,0|2,0,0]=4 14214 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000687532 [0,2,0,0,0,0|2,0,0]=4 14215 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 271570a_100011290941_200000155730 [0,2,0,0,0,0|2,0,0]=4 14216 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000687532 [0,2,0,0,0,0|2,0,0]=4 14217 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000687532 [0,2,0,0,0,0|1,0,0]=3 14218 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000687532 [0,2,0,0,0,0|1,0,0]=3 14219 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000687532 [0,2,0,0,0,0|1,0,0]=3 14220 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000687532 [0,2,0,0,0,0|2,0,0]=4 14221 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000687532 [0,2,0,0,0,0|2,0,0]=4 14222 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000687532 [0,2,0,0,0,0|2,0,0]=4 14223 B15R1.5 C=Cc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000687532 [0,2,0,0,0,0|2,0,0]=4 14224 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 11a_100000210953_100000210717 [0,2,0,0,0,0|2,0,0]=4 14225 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 1626a_100000210953_100000210717 [0,2,0,0,0,0|2,0,0]=4 14226 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 240690a_100000210953_100000210717 [0,2,0,0,0,0|2,0,0]=4 14227 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)C#N 527a_100000210953_100000210717 [0,2,0,0,0,0|2,0,0]=4 14228 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)CO 1626a_100000210953_100000183892 [0,2,0,0,0,0|2,0,0]=4 14229 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)CO 240690a_100000210953_100000183892 [0,2,0,0,0,0|2,0,0]=4 14230 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)S[13CH3] 62a_200000155730_200025704644 [0,2,0,0,0,0|2,0,0]=4 14231 B15R1.5 CC(C)CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_200000155730 [0,2,0,0,0,0|2,0,0]=4 14232 B15R1.5 CC(O)CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100012276601 [0,2,0,0,0,0|2,0,0]=4 14233 B15R1.5 CC(O)CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100012276601 [0,2,0,0,0,0|2,0,0]=4 14234 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)C#N 11a_100000210904_100000210717 [0,2,0,0,0,0|1,0,0]=3 14235 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)C#N 240690a_100000210904_100000210717 [0,2,0,0,0,0|1,0,0]=3 14236 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)C#N 527a_100000210904_100000210717 [0,2,0,0,0,0|1,0,0]=3 14237 B15R1.5 CC(O)CNC(=O)c1ccc(cc1)CO 240690a_100000210904_100000183892 [0,2,0,0,0,0|1,0,0]=3 14238 B15R1.5 CCc1ccc(cc1)C(=O)CCC(C)O 1458a_100000211226_100012276601 [0,2,0,0,0,0|2,0,0]=4 14239 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000211226 [0,2,0,0,0,0|2,0,0]=4 14240 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000211226 [0,2,0,0,0,0|2,0,0]=4 14241 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000211226 [0,2,0,0,0,0|2,0,0]=4 14242 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000211226 [0,2,0,0,0,0|2,0,0]=4 14243 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000211226 [0,2,0,0,0,0|1,0,0]=3 14244 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000211226 [0,2,0,0,0,0|1,0,0]=3 14245 B15R1.5 CCc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000211226 [0,2,0,0,0,0|1,0,0]=3 14246 B15R1.5 CCc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000211226 [0,2,0,0,0,0|2,0,0]=4 14247 B15R1.5 CCc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000211226 [0,2,0,0,0,0|2,0,0]=4 14248 B15R1.5 CCc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000211226 [0,2,0,0,0,0|2,0,0]=4 14249 B15R1.5 CCc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000211226 [0,2,0,0,0,0|2,0,0]=4 14250 B15R1.5 CNc1ccc(cc1)C(=O)NCC(C)C 27a_100102657272_200000155730 [0,2,0,0,0,0|2,0,0]=4 14251 B15R1.5 COc1ccc(cc1)C(=O)CCC(C)O 1458a_100000184203_100012276601 [0,2,0,0,0,0|2,0,0]=4 14252 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000184203 [0,2,0,0,0,0|2,0,0]=4 14253 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000184203 [0,2,0,0,0,0|2,0,0]=4 14254 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000184203 [0,2,0,0,0,0|2,0,0]=4 14255 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000184203 [0,2,0,0,0,0|2,0,0]=4 14256 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000184203 [0,2,0,0,0,0|1,0,0]=3 14257 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000184203 [0,2,0,0,0,0|1,0,0]=3 14258 B15R1.5 COc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000184203 [0,2,0,0,0,0|1,0,0]=3 14259 B15R1.5 COc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000184203 [0,2,0,0,0,0|2,0,0]=4 14260 B15R1.5 COc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000184203 [0,2,0,0,0,0|2,0,0]=4 14261 B15R1.5 COc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000184203 [0,2,0,0,0,0|2,0,0]=4 14262 B15R1.5 COc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000184203 [0,2,0,0,0,0|2,0,0]=4 14263 B15R1.5 CSc1ccc(cc1)C(=O)CCC(C)O 1458a_100000189692_100012276601 [0,2,0,0,0,0|2,0,0]=4 14264 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 11a_100000210953_100000189692 [0,2,0,0,0,0|2,0,0]=4 14265 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 1626a_100000210953_100000189692 [0,2,0,0,0,0|2,0,0]=4 14266 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 240690a_100000210953_100000189692 [0,2,0,0,0,0|2,0,0]=4 14267 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 527a_100000210953_100000189692 [0,2,0,0,0,0|2,0,0]=4 14268 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 62a_200000155730_200000210301 [0,2,0,0,0,0|2,0,0]=4 14269 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)C 62a_200000210301_200000155730 [0,2,0,0,0,0|2,0,0]=4 14270 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)O 11a_100000210904_100000189692 [0,2,0,0,0,0|1,0,0]=3 14271 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)O 240690a_100000210904_100000189692 [0,2,0,0,0,0|1,0,0]=3 14272 B15R1.5 CSc1ccc(cc1)C(=O)NCC(C)O 527a_100000210904_100000189692 [0,2,0,0,0,0|1,0,0]=3 14273 B15R1.5 CSc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000189692 [0,2,0,0,0,0|2,0,0]=4 14274 B15R1.5 CSc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000189692 [0,2,0,0,0,0|2,0,0]=4 14275 B15R1.5 CSc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000189692 [0,2,0,0,0,0|2,0,0]=4 14276 B15R1.5 CSc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000189692 [0,2,0,0,0,0|2,0,0]=4 14277 B15R1.5 N#Cc1ccc(cc1)C(=O)NCC(F)F 11a_100000765723_100000210717 [0,2,0,0,0,0|2,0,0]=4 14278 B15R1.5 N#Cc1ccc(cc1)C(=O)NCC(F)F 1626a_100000765723_100000210717 [0,2,0,0,0,0|2,0,0]=4 14279 B15R1.5 N#Cc1ccc(cc1)C(=O)NCC(F)F 240690a_100000765723_100000210717 [0,2,0,0,0,0|2,0,0]=4 14280 B15R1.5 N#Cc1ccc(cc1)C(=O)NCC(F)F 527a_100000765723_100000210717 [0,2,0,0,0,0|2,0,0]=4 14281 B15R1.5 O=C(NCC(F)F)c1ccc(cc1)CO 1626a_100000765723_100000183892 [0,2,0,0,0,0|2,0,0]=4 14282 B15R1.5 O=C(NCC(F)F)c1ccc(cc1)CO 240690a_100000765723_100000183892 [0,2,0,0,0,0|2,0,0]=4 14283 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Br)Cl 11a_100000765925_100000691181 [0,2,0,0,0,0|1,0,1]=4 14284 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000765925_100000691181 [0,2,0,0,0,0|1,0,1]=4 14285 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000765925_100000691181 [0,2,0,0,0,0|1,0,1]=4 14286 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Br)Cl 527a_100000765925_100000691181 [0,2,0,0,0,0|1,0,1]=4 14287 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)C)Cl 11a_100000765925_100000686306 [0,2,0,0,0,0|1,0,1]=4 14288 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)C)Cl 1626a_100000765925_100000686306 [0,2,0,0,0,0|1,0,1]=4 14289 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)C)Cl 240690a_100000765925_100000686306 [0,2,0,0,0,0|1,0,1]=4 14290 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)C)Cl 527a_100000765925_100000686306 [0,2,0,0,0,0|1,0,1]=4 14291 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000765925_100000210401 [0,2,0,0,0,0|1,0,1]=4 14292 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000765925_100000210401 [0,2,0,0,0,0|1,0,1]=4 14293 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000765925_100000210401 [0,2,0,0,0,0|1,0,1]=4 14294 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000765925_100000210401 [0,2,0,0,0,0|1,0,1]=4 14295 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)F)Cl 11a_100000765925_100000743183 [0,2,0,0,0,0|1,0,1]=4 14296 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)F)Cl 1626a_100000765925_100000743183 [0,2,0,0,0,0|1,0,1]=4 14297 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)F)Cl 240690a_100000765925_100000743183 [0,2,0,0,0,0|1,0,1]=4 14298 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)F)Cl 527a_100000765925_100000743183 [0,2,0,0,0,0|1,0,1]=4 14299 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)I)Cl 11a_100000765925_100000739381 [0,2,0,0,0,0|1,0,1]=4 14300 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)I)Cl 1626a_100000765925_100000739381 [0,2,0,0,0,0|1,0,1]=4 14301 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)I)Cl 240690a_100000765925_100000739381 [0,2,0,0,0,0|1,0,1]=4 14302 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)I)Cl 527a_100000765925_100000739381 [0,2,0,0,0,0|1,0,1]=4 14303 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000765925_100011933997 [0,2,0,0,0,0|1,0,1]=4 14304 B15R1.889 C=C(C)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000765925_100011933997 [0,2,0,0,0,0|1,0,1]=4 14305 B15R1.889 CC(=O)CNC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000183949_200000210301 [0,2,0,0,0,0|0,0,2]=4 14306 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210312 [0,2,0,0,0,0|2,0,0]=4 14307 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210312 [0,2,0,0,0,0|2,0,0]=4 14308 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210312 [0,2,0,0,0,0|2,0,0]=4 14309 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210312 [0,2,0,0,0,0|2,0,0]=4 14310 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210312 [0,2,0,0,0,0|2,0,0]=4 14311 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 11a_100000210953_100012339404 [0,2,0,0,0,0|1,1,0]=4 14312 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 1626a_100000210953_100012339404 [0,2,0,0,0,0|1,1,0]=4 14313 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 240690a_100000210953_100012339404 [0,2,0,0,0,0|1,1,0]=4 14314 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Br 527a_100000210953_100012339404 [0,2,0,0,0,0|1,1,0]=4 14315 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 11a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 14316 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 14317 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 14318 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)Cl 527a_100000210953_100000691181 [0,2,0,0,0,0|1,0,0]=3 14319 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 11a_100000210953_100000760357 [0,2,0,0,0,0|1,1,0]=4 14320 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 1626a_100000210953_100000760357 [0,2,0,0,0,0|1,1,0]=4 14321 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 240690a_100000210953_100000760357 [0,2,0,0,0,0|1,1,0]=4 14322 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)F 527a_100000210953_100000760357 [0,2,0,0,0,0|1,1,0]=4 14323 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 11a_100000210953_100000739115 [0,2,0,0,0,0|1,1,0]=4 14324 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 1626a_100000210953_100000739115 [0,2,0,0,0,0|1,1,0]=4 14325 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 240690a_100000210953_100000739115 [0,2,0,0,0,0|1,1,0]=4 14326 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)I 527a_100000210953_100000739115 [0,2,0,0,0,0|1,1,0]=4 14327 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)O 240690a_100000210953_100000189672 [0,2,0,0,0,0|2,0,0]=4 14328 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 11a_100000210953_100000687082 [0,2,0,0,0,0|1,1,0]=4 14329 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 1626a_100000210953_100000687082 [0,2,0,0,0,0|1,1,0]=4 14330 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000210953_100000687082 [0,2,0,0,0,0|1,1,0]=4 14331 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Br 527a_100000210953_100000687082 [0,2,0,0,0,0|1,1,0]=4 14332 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 14333 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 14334 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 14335 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000210953_100000210401 [0,2,0,0,0,0|1,0,0]=3 14336 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 11a_100000210953_100000686462 [0,2,0,0,0,0|1,1,0]=4 14337 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 1626a_100000210953_100000686462 [0,2,0,0,0,0|1,1,0]=4 14338 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 240690a_100000210953_100000686462 [0,2,0,0,0,0|1,1,0]=4 14339 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)F 527a_100000210953_100000686462 [0,2,0,0,0,0|1,1,0]=4 14340 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 11a_100000210953_100000684831 [0,2,0,0,0,0|1,1,0]=4 14341 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 1626a_100000210953_100000684831 [0,2,0,0,0,0|1,1,0]=4 14342 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 240690a_100000210953_100000684831 [0,2,0,0,0,0|1,1,0]=4 14343 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)I 527a_100000210953_100000684831 [0,2,0,0,0,0|1,1,0]=4 14344 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)O 240690a_100000210953_100000212196 [0,2,0,0,0,0|2,0,0]=4 14345 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)O 527a_100000210953_100000212196 [0,2,0,0,0,0|2,0,0]=4 14346 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 11a_100000210953_100000743946 [0,2,0,0,0,0|1,1,0]=4 14347 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 1626a_100000210953_100000743946 [0,2,0,0,0,0|1,1,0]=4 14348 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 240690a_100000210953_100000743946 [0,2,0,0,0,0|1,1,0]=4 14349 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Br 527a_100000210953_100000743946 [0,2,0,0,0,0|1,1,0]=4 14350 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 11a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 14351 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 1626a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 14352 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 240690a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 14353 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)Cl 527a_100000210953_100000743183 [0,2,0,0,0,0|1,0,0]=3 14354 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 11a_100000210953_100000209822 [0,2,0,0,0,0|1,1,0]=4 14355 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 1626a_100000210953_100000209822 [0,2,0,0,0,0|1,1,0]=4 14356 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 240690a_100000210953_100000209822 [0,2,0,0,0,0|1,1,0]=4 14357 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)F 527a_100000210953_100000209822 [0,2,0,0,0,0|1,1,0]=4 14358 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 11a_100000210953_100000062624 [0,2,0,0,0,0|1,1,0]=4 14359 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 1626a_100000210953_100000062624 [0,2,0,0,0,0|1,1,0]=4 14360 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 240690a_100000210953_100000062624 [0,2,0,0,0,0|1,1,0]=4 14361 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)I 527a_100000210953_100000062624 [0,2,0,0,0,0|1,1,0]=4 14362 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)O 240690a_100000210953_100000185466 [0,2,0,0,0,0|2,0,0]=4 14363 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)O 527a_100000210953_100000185466 [0,2,0,0,0,0|2,0,0]=4 14364 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 11a_100000210953_100012343876 [0,2,0,0,0,0|1,1,0]=4 14365 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 1626a_100000210953_100012343876 [0,2,0,0,0,0|1,1,0]=4 14366 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 240690a_100000210953_100012343876 [0,2,0,0,0,0|1,1,0]=4 14367 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Br 527a_100000210953_100012343876 [0,2,0,0,0,0|1,1,0]=4 14368 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 11a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 14369 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 1626a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 14370 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 240690a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 14371 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)Cl 527a_100000210953_100000739381 [0,2,0,0,0,0|1,0,0]=3 14372 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 11a_100000210953_100000688015 [0,2,0,0,0,0|1,1,0]=4 14373 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 1626a_100000210953_100000688015 [0,2,0,0,0,0|1,1,0]=4 14374 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 240690a_100000210953_100000688015 [0,2,0,0,0,0|1,1,0]=4 14375 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)F 527a_100000210953_100000688015 [0,2,0,0,0,0|1,1,0]=4 14376 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 11a_100000210953_100000725830 [0,2,0,0,0,0|1,1,0]=4 14377 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 1626a_100000210953_100000725830 [0,2,0,0,0,0|1,1,0]=4 14378 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 240690a_100000210953_100000725830 [0,2,0,0,0,0|1,1,0]=4 14379 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)I 527a_100000210953_100000725830 [0,2,0,0,0,0|1,1,0]=4 14380 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)O 1626a_100000210953_100000037485 [0,2,0,0,0,0|2,0,0]=4 14381 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)O 240690a_100000210953_100000037485 [0,2,0,0,0,0|2,0,0]=4 14382 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Br 240690a_100000210953_100000689001 [0,2,0,0,0,0|1,1,0]=4 14383 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Br 527a_100000210953_100000689001 [0,2,0,0,0,0|1,1,0]=4 14384 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000210953_100011933997 [0,2,0,0,0,0|1,0,0]=3 14385 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000210953_100011933997 [0,2,0,0,0,0|1,0,0]=3 14386 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)F 240690a_100000210953_100000035894 [0,2,0,0,0,0|1,1,0]=4 14387 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)F 527a_100000210953_100000035894 [0,2,0,0,0,0|1,1,0]=4 14388 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 1626a_100000210953_100000239334 [0,2,0,0,0,0|1,1,0]=4 14389 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 240690a_100000210953_100000239334 [0,2,0,0,0,0|1,1,0]=4 14390 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 527a_100000210953_100000239334 [0,2,0,0,0,0|1,1,0]=4 14391 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Br)Cl 22a_100000741168_100000691181 [0,2,0,0,0,0|2,0,0]=4 14392 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)Cl)Cl 22a_100000741168_100000210401 [0,2,0,0,0,0|2,0,0]=4 14393 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)F)Cl 22a_100000741168_100000743183 [0,2,0,0,0,0|2,0,0]=4 14394 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)I)Cl 22a_100000741168_100000739381 [0,2,0,0,0,0|2,0,0]=4 14395 B15R1.889 CC(C)NNC(=O)c1ccc(c(c1)O)Cl 22a_100000741168_100011933997 [0,2,0,0,0,0|2,0,0]=4 14396 B15R1.889 CC(NC[C@@H](C)O)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100009817552 [0,2,0,0,0,0|1,0,1]=4 14397 B15R1.889 CC(NC[C@@H](C)O)c1ccc(c(c1)Cl)Cl 34a_100000743459_100009817552 [0,2,0,0,0,0|1,0,1]=4 14398 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100012276601 [0,2,0,0,0,0|1,1,0]=4 14399 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100012276601 [0,2,0,0,0,0|1,0,0]=3 14400 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100012276601 [0,2,0,0,0,0|1,1,0]=4 14401 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100012276601 [0,2,0,0,0,0|1,1,0]=4 14402 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100012276601 [0,2,0,0,0,0|2,0,0]=4 14403 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100012276601 [0,2,0,0,0,0|1,1,0]=4 14404 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100012276601 [0,2,0,0,0,0|1,0,0]=3 14405 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100012276601 [0,2,0,0,0,0|1,1,0]=4 14406 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100012276601 [0,2,0,0,0,0|1,1,0]=4 14407 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100012276601 [0,2,0,0,0,0|2,0,0]=4 14408 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100012276601 [0,2,0,0,0,0|1,1,0]=4 14409 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100012276601 [0,2,0,0,0,0|1,0,0]=3 14410 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100012276601 [0,2,0,0,0,0|1,1,0]=4 14411 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100012276601 [0,2,0,0,0,0|1,1,0]=4 14412 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100012276601 [0,2,0,0,0,0|2,0,0]=4 14413 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100012276601 [0,2,0,0,0,0|1,1,0]=4 14414 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100012276601 [0,2,0,0,0,0|1,0,0]=3 14415 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100012276601 [0,2,0,0,0,0|1,1,0]=4 14416 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100012276601 [0,2,0,0,0,0|1,1,0]=4 14417 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100012276601 [0,2,0,0,0,0|2,0,0]=4 14418 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100012276601 [0,2,0,0,0,0|1,1,0]=4 14419 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100012276601 [0,2,0,0,0,0|1,0,0]=3 14420 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100012276601 [0,2,0,0,0,0|1,1,0]=4 14421 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100012276601 [0,2,0,0,0,0|1,1,0]=4 14422 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100012276601 [0,2,0,0,0,0|2,0,0]=4 14423 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Br 11a_100000210904_100012339404 [0,2,0,0,0,0|0,1,0]=3 14424 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Br 240690a_100000210904_100012339404 [0,2,0,0,0,0|0,1,0]=3 14425 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Br 527a_100000210904_100012339404 [0,2,0,0,0,0|0,1,0]=3 14426 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Cl 11a_100000210904_100000691181 [0,2,0,0,0,0|0,0,0]=2 14427 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000210904_100000691181 [0,2,0,0,0,0|0,0,0]=2 14428 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)Cl 527a_100000210904_100000691181 [0,2,0,0,0,0|0,0,0]=2 14429 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)F 11a_100000210904_100000760357 [0,2,0,0,0,0|0,1,0]=3 14430 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)F 240690a_100000210904_100000760357 [0,2,0,0,0,0|0,1,0]=3 14431 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)F 527a_100000210904_100000760357 [0,2,0,0,0,0|0,1,0]=3 14432 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)I 11a_100000210904_100000739115 [0,2,0,0,0,0|0,1,0]=3 14433 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)I 240690a_100000210904_100000739115 [0,2,0,0,0,0|0,1,0]=3 14434 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)I 527a_100000210904_100000739115 [0,2,0,0,0,0|0,1,0]=3 14435 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)O 240690a_100000210904_100000189672 [0,2,0,0,0,0|1,0,0]=3 14436 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Br 11a_100000210904_100000687082 [0,2,0,0,0,0|0,1,0]=3 14437 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100000210904_100000687082 [0,2,0,0,0,0|0,1,0]=3 14438 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Br 527a_100000210904_100000687082 [0,2,0,0,0,0|0,1,0]=3 14439 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000210904_100000210401 [0,2,0,0,0,0|0,0,0]=2 14440 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000210904_100000210401 [0,2,0,0,0,0|0,0,0]=2 14441 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000210904_100000210401 [0,2,0,0,0,0|0,0,0]=2 14442 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)F 11a_100000210904_100000686462 [0,2,0,0,0,0|0,1,0]=3 14443 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)F 240690a_100000210904_100000686462 [0,2,0,0,0,0|0,1,0]=3 14444 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)F 527a_100000210904_100000686462 [0,2,0,0,0,0|0,1,0]=3 14445 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)I 11a_100000210904_100000684831 [0,2,0,0,0,0|0,1,0]=3 14446 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)I 240690a_100000210904_100000684831 [0,2,0,0,0,0|0,1,0]=3 14447 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)I 527a_100000210904_100000684831 [0,2,0,0,0,0|0,1,0]=3 14448 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)O 240690a_100000210904_100000212196 [0,2,0,0,0,0|1,0,0]=3 14449 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)O 527a_100000210904_100000212196 [0,2,0,0,0,0|1,0,0]=3 14450 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Br 11a_100000210904_100000743946 [0,2,0,0,0,0|0,1,0]=3 14451 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Br 240690a_100000210904_100000743946 [0,2,0,0,0,0|0,1,0]=3 14452 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Br 527a_100000210904_100000743946 [0,2,0,0,0,0|0,1,0]=3 14453 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Cl 11a_100000210904_100000743183 [0,2,0,0,0,0|0,0,0]=2 14454 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Cl 240690a_100000210904_100000743183 [0,2,0,0,0,0|0,0,0]=2 14455 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)Cl 527a_100000210904_100000743183 [0,2,0,0,0,0|0,0,0]=2 14456 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)F 11a_100000210904_100000209822 [0,2,0,0,0,0|0,1,0]=3 14457 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)F 240690a_100000210904_100000209822 [0,2,0,0,0,0|0,1,0]=3 14458 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)F 527a_100000210904_100000209822 [0,2,0,0,0,0|0,1,0]=3 14459 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)I 11a_100000210904_100000062624 [0,2,0,0,0,0|0,1,0]=3 14460 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)I 240690a_100000210904_100000062624 [0,2,0,0,0,0|0,1,0]=3 14461 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)I 527a_100000210904_100000062624 [0,2,0,0,0,0|0,1,0]=3 14462 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)O 240690a_100000210904_100000185466 [0,2,0,0,0,0|1,0,0]=3 14463 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)O 527a_100000210904_100000185466 [0,2,0,0,0,0|1,0,0]=3 14464 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Br 11a_100000210904_100012343876 [0,2,0,0,0,0|0,1,0]=3 14465 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Br 240690a_100000210904_100012343876 [0,2,0,0,0,0|0,1,0]=3 14466 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Br 527a_100000210904_100012343876 [0,2,0,0,0,0|0,1,0]=3 14467 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Cl 11a_100000210904_100000739381 [0,2,0,0,0,0|0,0,0]=2 14468 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Cl 240690a_100000210904_100000739381 [0,2,0,0,0,0|0,0,0]=2 14469 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)Cl 527a_100000210904_100000739381 [0,2,0,0,0,0|0,0,0]=2 14470 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)F 11a_100000210904_100000688015 [0,2,0,0,0,0|0,1,0]=3 14471 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)F 240690a_100000210904_100000688015 [0,2,0,0,0,0|0,1,0]=3 14472 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)F 527a_100000210904_100000688015 [0,2,0,0,0,0|0,1,0]=3 14473 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)I 11a_100000210904_100000725830 [0,2,0,0,0,0|0,1,0]=3 14474 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)I 240690a_100000210904_100000725830 [0,2,0,0,0,0|0,1,0]=3 14475 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)I 527a_100000210904_100000725830 [0,2,0,0,0,0|0,1,0]=3 14476 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)O 240690a_100000210904_100000037485 [0,2,0,0,0,0|1,0,0]=3 14477 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Br 240690a_100000210904_100000689001 [0,2,0,0,0,0|0,1,0]=3 14478 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Br 527a_100000210904_100000689001 [0,2,0,0,0,0|0,1,0]=3 14479 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000210904_100011933997 [0,2,0,0,0,0|0,0,0]=2 14480 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000210904_100011933997 [0,2,0,0,0,0|0,0,0]=2 14481 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)F 240690a_100000210904_100000035894 [0,2,0,0,0,0|0,1,0]=3 14482 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)F 527a_100000210904_100000035894 [0,2,0,0,0,0|0,1,0]=3 14483 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)I 240690a_100000210904_100000239334 [0,2,0,0,0,0|0,1,0]=3 14484 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)I 527a_100000210904_100000239334 [0,2,0,0,0,0|0,1,0]=3 14485 B15R1.889 CC(O)CNC(C)c1ccc(c(c1)Br)Cl 269862a_100000210904_100012356427 [0,2,0,0,0,0|1,0,1]=4 14486 B15R1.889 CC(O)CNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_100011218427 [0,2,0,0,0,0|1,0,1]=4 14487 B15R1.889 CC(O)CNC(C)c1ccc(c(c1)Cl)Cl 269862a_100000210904_100000210641 [0,2,0,0,0,0|1,0,1]=4 14488 B15R1.889 CC(O)CNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_100011218427 [0,2,0,0,0,0|1,0,1]=4 14489 B15R1.889 CC(O)CNC(C)c1ccc(c(c1)F)Cl 269862a_100000210904_100000693814 [0,2,0,0,0,0|1,0,1]=4 14490 B15R1.889 CC(O)CN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_100011218427 [0,2,0,0,0,0|1,0,1]=4 14491 B15R1.889 CC(O)CN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_100011218427 [0,2,0,0,0,0|1,0,1]=4 14492 B15R1.889 C[C@@H](O)CN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_100009817552 [0,2,0,0,0,0|1,0,1]=4 14493 B15R1.889 C[C@@H](O)CN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_100009817552 [0,2,0,0,0,0|1,0,1]=4 14494 B15R1.889 Cc1cc(ccc1Br)C(=O)CCC(C)O 1458a_100000692631_100012276601 [0,2,0,0,0,0|1,1,0]=4 14495 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 11a_100000210953_100000692631 [0,2,0,0,0,0|1,1,0]=4 14496 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 1626a_100000210953_100000692631 [0,2,0,0,0,0|1,1,0]=4 14497 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 240690a_100000210953_100000692631 [0,2,0,0,0,0|1,1,0]=4 14498 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)C 527a_100000210953_100000692631 [0,2,0,0,0,0|1,1,0]=4 14499 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)O 11a_100000210904_100000692631 [0,2,0,0,0,0|0,1,0]=3 14500 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)O 240690a_100000210904_100000692631 [0,2,0,0,0,0|0,1,0]=3 14501 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(C)O 527a_100000210904_100000692631 [0,2,0,0,0,0|0,1,0]=3 14502 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(F)F 11a_100000765723_100000692631 [0,2,0,0,0,0|1,1,0]=4 14503 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(F)F 1626a_100000765723_100000692631 [0,2,0,0,0,0|1,1,0]=4 14504 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(F)F 240690a_100000765723_100000692631 [0,2,0,0,0,0|1,1,0]=4 14505 B15R1.889 Cc1cc(ccc1Br)C(=O)NCC(F)F 527a_100000765723_100000692631 [0,2,0,0,0,0|1,1,0]=4 14506 B15R1.889 Cc1cc(ccc1Cl)C(=O)CCC(C)C 1458a_100000686306_100000210312 [0,2,0,0,0,0|2,0,0]=4 14507 B15R1.889 Cc1cc(ccc1Cl)C(=O)CCC(C)O 1458a_100000686306_100012276601 [0,2,0,0,0,0|1,0,0]=3 14508 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(=O)N 11a_100000711301_100000686306 [0,2,0,0,0,0|0,0,2]=4 14509 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(=O)N 240690a_100000711301_100000686306 [0,2,0,0,0,0|0,0,2]=4 14510 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(=O)N 527a_100000711301_100000686306 [0,2,0,0,0,0|0,0,2]=4 14511 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 11a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 14512 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 1626a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 14513 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 240690a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 14514 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)C 527a_100000210953_100000686306 [0,2,0,0,0,0|1,0,0]=3 14515 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)O 11a_100000210904_100000686306 [0,2,0,0,0,0|0,0,0]=2 14516 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)O 240690a_100000210904_100000686306 [0,2,0,0,0,0|0,0,0]=2 14517 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(C)O 527a_100000210904_100000686306 [0,2,0,0,0,0|0,0,0]=2 14518 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(F)F 11a_100000765723_100000686306 [0,2,0,0,0,0|1,0,0]=3 14519 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(F)F 1626a_100000765723_100000686306 [0,2,0,0,0,0|1,0,0]=3 14520 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(F)F 240690a_100000765723_100000686306 [0,2,0,0,0,0|1,0,0]=3 14521 B15R1.889 Cc1cc(ccc1Cl)C(=O)NCC(F)F 527a_100000765723_100000686306 [0,2,0,0,0,0|1,0,0]=3 14522 B15R1.889 Cc1cc(ccc1Cl)C(=O)NNC(C)C 22a_100000741168_100000686306 [0,2,0,0,0,0|2,0,0]=4 14523 B15R1.889 Cc1cc(ccc1Cl)C(C)NCC(C)O 269862a_100000210904_100011216000 [0,2,0,0,0,0|1,0,1]=4 14524 B15R1.889 Cc1cc(ccc1F)C(=O)CCC(C)O 1458a_100000751819_100012276601 [0,2,0,0,0,0|1,1,0]=4 14525 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 11a_100000210953_100000751819 [0,2,0,0,0,0|1,1,0]=4 14526 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 1626a_100000210953_100000751819 [0,2,0,0,0,0|1,1,0]=4 14527 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 240690a_100000210953_100000751819 [0,2,0,0,0,0|1,1,0]=4 14528 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)C 527a_100000210953_100000751819 [0,2,0,0,0,0|1,1,0]=4 14529 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)O 11a_100000210904_100000751819 [0,2,0,0,0,0|0,1,0]=3 14530 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)O 240690a_100000210904_100000751819 [0,2,0,0,0,0|0,1,0]=3 14531 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(C)O 527a_100000210904_100000751819 [0,2,0,0,0,0|0,1,0]=3 14532 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(F)F 11a_100000765723_100000751819 [0,2,0,0,0,0|1,1,0]=4 14533 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(F)F 1626a_100000765723_100000751819 [0,2,0,0,0,0|1,1,0]=4 14534 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(F)F 240690a_100000765723_100000751819 [0,2,0,0,0,0|1,1,0]=4 14535 B15R1.889 Cc1cc(ccc1F)C(=O)NCC(F)F 527a_100000765723_100000751819 [0,2,0,0,0,0|1,1,0]=4 14536 B15R1.889 Cc1cc(ccc1I)C(=O)CCC(C)O 1458a_100000751300_100012276601 [0,2,0,0,0,0|1,1,0]=4 14537 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 11a_100000210953_100000751300 [0,2,0,0,0,0|1,1,0]=4 14538 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 1626a_100000210953_100000751300 [0,2,0,0,0,0|1,1,0]=4 14539 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 240690a_100000210953_100000751300 [0,2,0,0,0,0|1,1,0]=4 14540 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)C 527a_100000210953_100000751300 [0,2,0,0,0,0|1,1,0]=4 14541 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)O 11a_100000210904_100000751300 [0,2,0,0,0,0|0,1,0]=3 14542 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)O 240690a_100000210904_100000751300 [0,2,0,0,0,0|0,1,0]=3 14543 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(C)O 527a_100000210904_100000751300 [0,2,0,0,0,0|0,1,0]=3 14544 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(F)F 11a_100000765723_100000751300 [0,2,0,0,0,0|1,1,0]=4 14545 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(F)F 1626a_100000765723_100000751300 [0,2,0,0,0,0|1,1,0]=4 14546 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(F)F 240690a_100000765723_100000751300 [0,2,0,0,0,0|1,1,0]=4 14547 B15R1.889 Cc1cc(ccc1I)C(=O)NCC(F)F 527a_100000765723_100000751300 [0,2,0,0,0,0|1,1,0]=4 14548 B15R1.889 Cc1cc(ccc1O)C(=O)CCC(C)O 1458a_100000685612_100012276601 [0,2,0,0,0,0|2,0,0]=4 14549 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(C)C 240690a_100000210953_100000685612 [0,2,0,0,0,0|2,0,0]=4 14550 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(C)O 240690a_100000210904_100000685612 [0,2,0,0,0,0|1,0,0]=3 14551 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(F)F 240690a_100000765723_100000685612 [0,2,0,0,0,0|2,0,0]=4 14552 B15R1.889 Cc1ccc(cc1Br)C(=O)CCC(C)O 1458a_100000186397_100012276601 [0,2,0,0,0,0|2,0,0]=4 14553 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 11a_100000210953_100000186397 [0,2,0,0,0,0|2,0,0]=4 14554 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 1626a_100000210953_100000186397 [0,2,0,0,0,0|2,0,0]=4 14555 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 240690a_100000210953_100000186397 [0,2,0,0,0,0|2,0,0]=4 14556 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)C 527a_100000210953_100000186397 [0,2,0,0,0,0|2,0,0]=4 14557 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)O 11a_100000210904_100000186397 [0,2,0,0,0,0|1,0,0]=3 14558 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)O 240690a_100000210904_100000186397 [0,2,0,0,0,0|1,0,0]=3 14559 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(C)O 527a_100000210904_100000186397 [0,2,0,0,0,0|1,0,0]=3 14560 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(F)F 11a_100000765723_100000186397 [0,2,0,0,0,0|2,0,0]=4 14561 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(F)F 1626a_100000765723_100000186397 [0,2,0,0,0,0|2,0,0]=4 14562 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(F)F 240690a_100000765723_100000186397 [0,2,0,0,0,0|2,0,0]=4 14563 B15R1.889 Cc1ccc(cc1Br)C(=O)NCC(F)F 527a_100000765723_100000186397 [0,2,0,0,0,0|2,0,0]=4 14564 B15R1.889 Cc1ccc(cc1C)C(=O)CCC(C)O 1458a_100000210898_100012276601 [0,2,0,0,0,0|2,0,0]=4 14565 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 11a_100000210953_100000210898 [0,2,0,0,0,0|2,0,0]=4 14566 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 1626a_100000210953_100000210898 [0,2,0,0,0,0|2,0,0]=4 14567 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 240690a_100000210953_100000210898 [0,2,0,0,0,0|2,0,0]=4 14568 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)C 527a_100000210953_100000210898 [0,2,0,0,0,0|2,0,0]=4 14569 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)O 11a_100000210904_100000210898 [0,2,0,0,0,0|1,0,0]=3 14570 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)O 240690a_100000210904_100000210898 [0,2,0,0,0,0|1,0,0]=3 14571 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(C)O 527a_100000210904_100000210898 [0,2,0,0,0,0|1,0,0]=3 14572 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(F)F 11a_100000765723_100000210898 [0,2,0,0,0,0|2,0,0]=4 14573 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(F)F 1626a_100000765723_100000210898 [0,2,0,0,0,0|2,0,0]=4 14574 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(F)F 240690a_100000765723_100000210898 [0,2,0,0,0,0|2,0,0]=4 14575 B15R1.889 Cc1ccc(cc1C)C(=O)NCC(F)F 527a_100000765723_100000210898 [0,2,0,0,0,0|2,0,0]=4 14576 B15R1.889 Cc1ccc(cc1Cl)C(=O)CCC(C)O 1458a_100000751740_100012276601 [0,2,0,0,0,0|2,0,0]=4 14577 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 11a_100000210953_100000751740 [0,2,0,0,0,0|2,0,0]=4 14578 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 1626a_100000210953_100000751740 [0,2,0,0,0,0|2,0,0]=4 14579 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 240690a_100000210953_100000751740 [0,2,0,0,0,0|2,0,0]=4 14580 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)C 527a_100000210953_100000751740 [0,2,0,0,0,0|2,0,0]=4 14581 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)O 11a_100000210904_100000751740 [0,2,0,0,0,0|1,0,0]=3 14582 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)O 240690a_100000210904_100000751740 [0,2,0,0,0,0|1,0,0]=3 14583 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(C)O 527a_100000210904_100000751740 [0,2,0,0,0,0|1,0,0]=3 14584 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(F)F 11a_100000765723_100000751740 [0,2,0,0,0,0|2,0,0]=4 14585 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(F)F 1626a_100000765723_100000751740 [0,2,0,0,0,0|2,0,0]=4 14586 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(F)F 240690a_100000765723_100000751740 [0,2,0,0,0,0|2,0,0]=4 14587 B15R1.889 Cc1ccc(cc1Cl)C(=O)NCC(F)F 527a_100000765723_100000751740 [0,2,0,0,0,0|2,0,0]=4 14588 B15R1.889 Cc1ccc(cc1F)C(=O)CCC(C)O 1458a_100000212313_100012276601 [0,2,0,0,0,0|2,0,0]=4 14589 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 11a_100000210953_100000212313 [0,2,0,0,0,0|2,0,0]=4 14590 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 1626a_100000210953_100000212313 [0,2,0,0,0,0|2,0,0]=4 14591 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 240690a_100000210953_100000212313 [0,2,0,0,0,0|2,0,0]=4 14592 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)C 527a_100000210953_100000212313 [0,2,0,0,0,0|2,0,0]=4 14593 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)O 11a_100000210904_100000212313 [0,2,0,0,0,0|1,0,0]=3 14594 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)O 240690a_100000210904_100000212313 [0,2,0,0,0,0|1,0,0]=3 14595 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(C)O 527a_100000210904_100000212313 [0,2,0,0,0,0|1,0,0]=3 14596 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(F)F 11a_100000765723_100000212313 [0,2,0,0,0,0|2,0,0]=4 14597 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(F)F 1626a_100000765723_100000212313 [0,2,0,0,0,0|2,0,0]=4 14598 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(F)F 240690a_100000765723_100000212313 [0,2,0,0,0,0|2,0,0]=4 14599 B15R1.889 Cc1ccc(cc1F)C(=O)NCC(F)F 527a_100000765723_100000212313 [0,2,0,0,0,0|2,0,0]=4 14600 B15R1.889 Cc1ccc(cc1I)C(=O)CCC(C)O 1458a_100000751299_100012276601 [0,2,0,0,0,0|2,0,0]=4 14601 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 11a_100000210953_100000751299 [0,2,0,0,0,0|2,0,0]=4 14602 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 1626a_100000210953_100000751299 [0,2,0,0,0,0|2,0,0]=4 14603 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 240690a_100000210953_100000751299 [0,2,0,0,0,0|2,0,0]=4 14604 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)C 527a_100000210953_100000751299 [0,2,0,0,0,0|2,0,0]=4 14605 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)O 11a_100000210904_100000751299 [0,2,0,0,0,0|1,0,0]=3 14606 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)O 240690a_100000210904_100000751299 [0,2,0,0,0,0|1,0,0]=3 14607 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(C)O 527a_100000210904_100000751299 [0,2,0,0,0,0|1,0,0]=3 14608 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(F)F 11a_100000765723_100000751299 [0,2,0,0,0,0|2,0,0]=4 14609 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(F)F 1626a_100000765723_100000751299 [0,2,0,0,0,0|2,0,0]=4 14610 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(F)F 240690a_100000765723_100000751299 [0,2,0,0,0,0|2,0,0]=4 14611 B15R1.889 Cc1ccc(cc1I)C(=O)NCC(F)F 527a_100000765723_100000751299 [0,2,0,0,0,0|2,0,0]=4 14612 B15R1.889 Cc1ccc(cc1O)C(=O)CCC(C)O 1458a_100000233767_100012276601 [0,2,0,0,0,0|2,0,0]=4 14613 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(C)C 240690a_100000210953_100000233767 [0,2,0,0,0,0|2,0,0]=4 14614 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(C)O 240690a_100000210904_100000233767 [0,2,0,0,0,0|1,0,0]=3 14615 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(F)F 240690a_100000765723_100000233767 [0,2,0,0,0,0|2,0,0]=4 14616 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)Br)Cl 11a_100000711301_100000691181 [0,2,0,0,0,0|0,0,2]=4 14617 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100000711301_100000691181 [0,2,0,0,0,0|0,0,2]=4 14618 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)Br)Cl 527a_100000711301_100000691181 [0,2,0,0,0,0|0,0,2]=4 14619 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)Cl)Cl 11a_100000711301_100000210401 [0,2,0,0,0,0|0,0,2]=4 14620 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100000711301_100000210401 [0,2,0,0,0,0|0,0,2]=4 14621 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100000711301_100000210401 [0,2,0,0,0,0|0,0,2]=4 14622 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)F)Cl 11a_100000711301_100000743183 [0,2,0,0,0,0|0,0,2]=4 14623 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)F)Cl 240690a_100000711301_100000743183 [0,2,0,0,0,0|0,0,2]=4 14624 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)F)Cl 527a_100000711301_100000743183 [0,2,0,0,0,0|0,0,2]=4 14625 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)I)Cl 11a_100000711301_100000739381 [0,2,0,0,0,0|0,0,2]=4 14626 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)I)Cl 240690a_100000711301_100000739381 [0,2,0,0,0,0|0,0,2]=4 14627 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)I)Cl 527a_100000711301_100000739381 [0,2,0,0,0,0|0,0,2]=4 14628 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000711301_100011933997 [0,2,0,0,0,0|0,0,2]=4 14629 B15R1.889 NC(=O)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000711301_100011933997 [0,2,0,0,0,0|0,0,2]=4 14630 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Br 11a_100000765723_100012339404 [0,2,0,0,0,0|1,1,0]=4 14631 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Br 1626a_100000765723_100012339404 [0,2,0,0,0,0|1,1,0]=4 14632 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Br 240690a_100000765723_100012339404 [0,2,0,0,0,0|1,1,0]=4 14633 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Br 527a_100000765723_100012339404 [0,2,0,0,0,0|1,1,0]=4 14634 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Cl 11a_100000765723_100000691181 [0,2,0,0,0,0|1,0,0]=3 14635 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Cl 1626a_100000765723_100000691181 [0,2,0,0,0,0|1,0,0]=3 14636 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Cl 240690a_100000765723_100000691181 [0,2,0,0,0,0|1,0,0]=3 14637 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)Cl 527a_100000765723_100000691181 [0,2,0,0,0,0|1,0,0]=3 14638 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)F 11a_100000765723_100000760357 [0,2,0,0,0,0|1,1,0]=4 14639 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)F 1626a_100000765723_100000760357 [0,2,0,0,0,0|1,1,0]=4 14640 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)F 240690a_100000765723_100000760357 [0,2,0,0,0,0|1,1,0]=4 14641 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)F 527a_100000765723_100000760357 [0,2,0,0,0,0|1,1,0]=4 14642 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)I 11a_100000765723_100000739115 [0,2,0,0,0,0|1,1,0]=4 14643 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)I 1626a_100000765723_100000739115 [0,2,0,0,0,0|1,1,0]=4 14644 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)I 240690a_100000765723_100000739115 [0,2,0,0,0,0|1,1,0]=4 14645 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)I 527a_100000765723_100000739115 [0,2,0,0,0,0|1,1,0]=4 14646 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Br)O 240690a_100000765723_100000189672 [0,2,0,0,0,0|2,0,0]=4 14647 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Br 11a_100000765723_100000687082 [0,2,0,0,0,0|1,1,0]=4 14648 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Br 1626a_100000765723_100000687082 [0,2,0,0,0,0|1,1,0]=4 14649 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Br 240690a_100000765723_100000687082 [0,2,0,0,0,0|1,1,0]=4 14650 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Br 527a_100000765723_100000687082 [0,2,0,0,0,0|1,1,0]=4 14651 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Cl 11a_100000765723_100000210401 [0,2,0,0,0,0|1,0,0]=3 14652 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Cl 1626a_100000765723_100000210401 [0,2,0,0,0,0|1,0,0]=3 14653 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Cl 240690a_100000765723_100000210401 [0,2,0,0,0,0|1,0,0]=3 14654 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)Cl 527a_100000765723_100000210401 [0,2,0,0,0,0|1,0,0]=3 14655 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)F 11a_100000765723_100000686462 [0,2,0,0,0,0|1,1,0]=4 14656 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)F 1626a_100000765723_100000686462 [0,2,0,0,0,0|1,1,0]=4 14657 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)F 240690a_100000765723_100000686462 [0,2,0,0,0,0|1,1,0]=4 14658 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)F 527a_100000765723_100000686462 [0,2,0,0,0,0|1,1,0]=4 14659 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)I 11a_100000765723_100000684831 [0,2,0,0,0,0|1,1,0]=4 14660 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)I 1626a_100000765723_100000684831 [0,2,0,0,0,0|1,1,0]=4 14661 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)I 240690a_100000765723_100000684831 [0,2,0,0,0,0|1,1,0]=4 14662 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)I 527a_100000765723_100000684831 [0,2,0,0,0,0|1,1,0]=4 14663 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)O 240690a_100000765723_100000212196 [0,2,0,0,0,0|2,0,0]=4 14664 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)Cl)O 527a_100000765723_100000212196 [0,2,0,0,0,0|2,0,0]=4 14665 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Br 11a_100000765723_100000743946 [0,2,0,0,0,0|1,1,0]=4 14666 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Br 1626a_100000765723_100000743946 [0,2,0,0,0,0|1,1,0]=4 14667 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Br 240690a_100000765723_100000743946 [0,2,0,0,0,0|1,1,0]=4 14668 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Br 527a_100000765723_100000743946 [0,2,0,0,0,0|1,1,0]=4 14669 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Cl 11a_100000765723_100000743183 [0,2,0,0,0,0|1,0,0]=3 14670 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Cl 1626a_100000765723_100000743183 [0,2,0,0,0,0|1,0,0]=3 14671 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Cl 240690a_100000765723_100000743183 [0,2,0,0,0,0|1,0,0]=3 14672 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)Cl 527a_100000765723_100000743183 [0,2,0,0,0,0|1,0,0]=3 14673 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)F 11a_100000765723_100000209822 [0,2,0,0,0,0|1,1,0]=4 14674 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)F 1626a_100000765723_100000209822 [0,2,0,0,0,0|1,1,0]=4 14675 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)F 240690a_100000765723_100000209822 [0,2,0,0,0,0|1,1,0]=4 14676 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)F 527a_100000765723_100000209822 [0,2,0,0,0,0|1,1,0]=4 14677 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)I 11a_100000765723_100000062624 [0,2,0,0,0,0|1,1,0]=4 14678 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)I 1626a_100000765723_100000062624 [0,2,0,0,0,0|1,1,0]=4 14679 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)I 240690a_100000765723_100000062624 [0,2,0,0,0,0|1,1,0]=4 14680 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)I 527a_100000765723_100000062624 [0,2,0,0,0,0|1,1,0]=4 14681 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)O 240690a_100000765723_100000185466 [0,2,0,0,0,0|2,0,0]=4 14682 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)F)O 527a_100000765723_100000185466 [0,2,0,0,0,0|2,0,0]=4 14683 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Br 11a_100000765723_100012343876 [0,2,0,0,0,0|1,1,0]=4 14684 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Br 1626a_100000765723_100012343876 [0,2,0,0,0,0|1,1,0]=4 14685 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Br 240690a_100000765723_100012343876 [0,2,0,0,0,0|1,1,0]=4 14686 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Br 527a_100000765723_100012343876 [0,2,0,0,0,0|1,1,0]=4 14687 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Cl 11a_100000765723_100000739381 [0,2,0,0,0,0|1,0,0]=3 14688 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Cl 1626a_100000765723_100000739381 [0,2,0,0,0,0|1,0,0]=3 14689 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Cl 240690a_100000765723_100000739381 [0,2,0,0,0,0|1,0,0]=3 14690 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)Cl 527a_100000765723_100000739381 [0,2,0,0,0,0|1,0,0]=3 14691 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)F 11a_100000765723_100000688015 [0,2,0,0,0,0|1,1,0]=4 14692 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)F 1626a_100000765723_100000688015 [0,2,0,0,0,0|1,1,0]=4 14693 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)F 240690a_100000765723_100000688015 [0,2,0,0,0,0|1,1,0]=4 14694 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)F 527a_100000765723_100000688015 [0,2,0,0,0,0|1,1,0]=4 14695 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)I 11a_100000765723_100000725830 [0,2,0,0,0,0|1,1,0]=4 14696 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)I 1626a_100000765723_100000725830 [0,2,0,0,0,0|1,1,0]=4 14697 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)I 240690a_100000765723_100000725830 [0,2,0,0,0,0|1,1,0]=4 14698 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)I 527a_100000765723_100000725830 [0,2,0,0,0,0|1,1,0]=4 14699 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)O 1626a_100000765723_100000037485 [0,2,0,0,0,0|2,0,0]=4 14700 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)I)O 240690a_100000765723_100000037485 [0,2,0,0,0,0|2,0,0]=4 14701 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)Br 240690a_100000765723_100000689001 [0,2,0,0,0,0|1,1,0]=4 14702 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)Br 527a_100000765723_100000689001 [0,2,0,0,0,0|1,1,0]=4 14703 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)Cl 240690a_100000765723_100011933997 [0,2,0,0,0,0|1,0,0]=3 14704 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)Cl 527a_100000765723_100011933997 [0,2,0,0,0,0|1,0,0]=3 14705 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)F 240690a_100000765723_100000035894 [0,2,0,0,0,0|1,1,0]=4 14706 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)F 527a_100000765723_100000035894 [0,2,0,0,0,0|1,1,0]=4 14707 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)I 1626a_100000765723_100000239334 [0,2,0,0,0,0|1,1,0]=4 14708 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)I 240690a_100000765723_100000239334 [0,2,0,0,0,0|1,1,0]=4 14709 B15R1.889 O=C(NCC(F)F)c1ccc(c(c1)O)I 527a_100000765723_100000239334 [0,2,0,0,0,0|1,1,0]=4 14710 B15R1.889 [13CH3]C(=O)CNC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000183949_200025704644 [0,2,0,0,0,0|0,0,2]=4 14711 B15R1.892 CC(C)(C)CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000755188 [0,2,0,0,0,0|2,0,0]=4 14712 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 11a_100000743828_100000185839 [0,2,0,0,0,0|1,1,0]=4 14713 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 1626a_100000743828_100000185839 [0,2,0,0,0,0|1,1,0]=4 14714 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 240690a_100000743828_100000185839 [0,2,0,0,0,0|1,1,0]=4 14715 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Br 527a_100000743828_100000185839 [0,2,0,0,0,0|1,1,0]=4 14716 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 11a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 14717 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 1626a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 14718 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 240690a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 14719 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)Cl 527a_100000743828_100000210187 [0,2,0,0,0,0|1,0,0]=3 14720 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 11a_100000743828_100000187176 [0,2,0,0,0,0|1,1,0]=4 14721 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 1626a_100000743828_100000187176 [0,2,0,0,0,0|1,1,0]=4 14722 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 240690a_100000743828_100000187176 [0,2,0,0,0,0|1,1,0]=4 14723 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)F 527a_100000743828_100000187176 [0,2,0,0,0,0|1,1,0]=4 14724 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 11a_100000743828_100000187904 [0,2,0,0,0,0|1,1,0]=4 14725 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 1626a_100000743828_100000187904 [0,2,0,0,0,0|1,1,0]=4 14726 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 240690a_100000743828_100000187904 [0,2,0,0,0,0|1,1,0]=4 14727 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)I 527a_100000743828_100000187904 [0,2,0,0,0,0|1,1,0]=4 14728 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)O 240690a_100000743828_100000212099 [0,2,0,0,0,0|2,0,0]=4 14729 B15R1.892 CC(C)(C)CNC(=O)c1ccc(cc1)O 527a_100000743828_100000212099 [0,2,0,0,0,0|2,0,0]=4 14730 B15R1.892 CC(C)(C)NNC(=O)c1ccc(cc1)Cl 22a_100000725372_100000210187 [0,2,0,0,0,0|2,0,0]=4 14731 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 11a_100020643315_100000185839 [0,2,0,0,0,0|1,1,0]=4 14732 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 1626a_100020643315_100000185839 [0,2,0,0,0,0|1,1,0]=4 14733 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 240690a_100020643315_100000185839 [0,2,0,0,0,0|1,1,0]=4 14734 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Br 527a_100020643315_100000185839 [0,2,0,0,0,0|1,1,0]=4 14735 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 11a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 14736 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 1626a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 14737 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 240690a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 14738 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)Cl 527a_100020643315_100000210187 [0,2,0,0,0,0|1,0,0]=3 14739 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 11a_100020643315_100000187176 [0,2,0,0,0,0|1,1,0]=4 14740 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 1626a_100020643315_100000187176 [0,2,0,0,0,0|1,1,0]=4 14741 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 240690a_100020643315_100000187176 [0,2,0,0,0,0|1,1,0]=4 14742 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)F 527a_100020643315_100000187176 [0,2,0,0,0,0|1,1,0]=4 14743 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 11a_100020643315_100000187904 [0,2,0,0,0,0|1,1,0]=4 14744 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 1626a_100020643315_100000187904 [0,2,0,0,0,0|1,1,0]=4 14745 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 240690a_100020643315_100000187904 [0,2,0,0,0,0|1,1,0]=4 14746 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)I 527a_100020643315_100000187904 [0,2,0,0,0,0|1,1,0]=4 14747 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)O 240690a_100020643315_100000212099 [0,2,0,0,0,0|2,0,0]=4 14748 B15R1.892 CC(C)(F)CNC(=O)c1ccc(cc1)O 527a_100020643315_100000212099 [0,2,0,0,0,0|2,0,0]=4 14749 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Br 1626a_100000751335_100000185839 [0,2,0,0,0,0|0,1,0]=3 14750 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Br 240690a_100000751335_100000185839 [0,2,0,0,0,0|0,1,0]=3 14751 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Br 527a_100000751335_100000185839 [0,2,0,0,0,0|0,1,0]=3 14752 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Cl 1626a_100000751335_100000210187 [0,2,0,0,0,0|0,0,0]=2 14753 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Cl 240690a_100000751335_100000210187 [0,2,0,0,0,0|0,0,0]=2 14754 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)Cl 527a_100000751335_100000210187 [0,2,0,0,0,0|0,0,0]=2 14755 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)F 1626a_100000751335_100000187176 [0,2,0,0,0,0|0,1,0]=3 14756 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)F 240690a_100000751335_100000187176 [0,2,0,0,0,0|0,1,0]=3 14757 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)F 527a_100000751335_100000187176 [0,2,0,0,0,0|0,1,0]=3 14758 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)I 1626a_100000751335_100000187904 [0,2,0,0,0,0|0,1,0]=3 14759 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)I 240690a_100000751335_100000187904 [0,2,0,0,0,0|0,1,0]=3 14760 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)I 527a_100000751335_100000187904 [0,2,0,0,0,0|0,1,0]=3 14761 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)O 240690a_100000751335_100000212099 [0,2,0,0,0,0|1,0,0]=3 14762 B15R1.892 CC(C)(O)CNC(=O)c1ccc(cc1)O 527a_100000751335_100000212099 [0,2,0,0,0,0|1,0,0]=3 14763 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 11a_100000731000_100000185839 [0,2,0,0,0,0|1,1,0]=4 14764 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 1626a_100000731000_100000185839 [0,2,0,0,0,0|1,1,0]=4 14765 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 240690a_100000731000_100000185839 [0,2,0,0,0,0|1,1,0]=4 14766 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Br 527a_100000731000_100000185839 [0,2,0,0,0,0|1,1,0]=4 14767 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 11a_100000731000_100000210187 [0,2,0,0,0,0|1,0,0]=3 14768 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 1626a_100000731000_100000210187 [0,2,0,0,0,0|1,0,0]=3 14769 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 240690a_100000731000_100000210187 [0,2,0,0,0,0|1,0,0]=3 14770 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)Cl 527a_100000731000_100000210187 [0,2,0,0,0,0|1,0,0]=3 14771 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 11a_100000731000_100000187176 [0,2,0,0,0,0|1,1,0]=4 14772 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 1626a_100000731000_100000187176 [0,2,0,0,0,0|1,1,0]=4 14773 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 240690a_100000731000_100000187176 [0,2,0,0,0,0|1,1,0]=4 14774 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)F 527a_100000731000_100000187176 [0,2,0,0,0,0|1,1,0]=4 14775 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 11a_100000731000_100000187904 [0,2,0,0,0,0|1,1,0]=4 14776 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 1626a_100000731000_100000187904 [0,2,0,0,0,0|1,1,0]=4 14777 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 240690a_100000731000_100000187904 [0,2,0,0,0,0|1,1,0]=4 14778 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)I 527a_100000731000_100000187904 [0,2,0,0,0,0|1,1,0]=4 14779 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)O 240690a_100000731000_100000212099 [0,2,0,0,0,0|2,0,0]=4 14780 B15R1.892 CC(F)(F)CNC(=O)c1ccc(cc1)O 527a_100000731000_100000212099 [0,2,0,0,0,0|2,0,0]=4 14781 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)Cl 2230a_100000751335_100000684792 [0,2,0,0,0,0|1,0,1]=4 14782 B15R1.892 CC(NCC(C)(C)O)c1ccc(cc1)Cl 269862a_100000751335_100000185797 [0,2,0,0,0,0|1,0,1]=4 14783 B15R1.892 C[C@@H](NCC(C)(C)O)c1ccc(cc1)Cl 34a_100015205461_100000764493 [0,2,0,0,0,0|1,0,1]=4 14784 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 11a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 14785 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 1626a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 14786 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 240690a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 14787 B15R1.892 C[Si](C)(C)CNC(=O)c1ccc(cc1)Cl 527a_102516607284_100000210187 [0,2,0,0,0,0|1,1,0]=4 14788 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 11a_100000743828_100000188618 [0,2,0,0,0,0|2,0,0]=4 14789 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 1626a_100000743828_100000188618 [0,2,0,0,0,0|2,0,0]=4 14790 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 240690a_100000743828_100000188618 [0,2,0,0,0,0|2,0,0]=4 14791 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)C 527a_100000743828_100000188618 [0,2,0,0,0,0|2,0,0]=4 14792 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 11a_100020643315_100000188618 [0,2,0,0,0,0|2,0,0]=4 14793 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 1626a_100020643315_100000188618 [0,2,0,0,0,0|2,0,0]=4 14794 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 240690a_100020643315_100000188618 [0,2,0,0,0,0|2,0,0]=4 14795 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)F 527a_100020643315_100000188618 [0,2,0,0,0,0|2,0,0]=4 14796 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)O 1626a_100000751335_100000188618 [0,2,0,0,0,0|1,0,0]=3 14797 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)O 240690a_100000751335_100000188618 [0,2,0,0,0,0|1,0,0]=3 14798 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(C)O 527a_100000751335_100000188618 [0,2,0,0,0,0|1,0,0]=3 14799 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 11a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 14800 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 1626a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 14801 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 240690a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 14802 B15R1.892 Cc1ccc(cc1)C(=O)NCC(C)(F)F 527a_100000731000_100000188618 [0,2,0,0,0,0|2,0,0]=4 14803 B15R1.892 Cc1ccc(cc1)C(=O)NCC(F)(F)F 11a_100000717047_100000188618 [0,2,0,0,0,0|2,0,0]=4 14804 B15R1.892 Cc1ccc(cc1)C(=O)NCC(F)(F)F 1626a_100000717047_100000188618 [0,2,0,0,0,0|2,0,0]=4 14805 B15R1.892 Cc1ccc(cc1)C(=O)NCC(F)(F)F 240690a_100000717047_100000188618 [0,2,0,0,0,0|2,0,0]=4 14806 B15R1.892 Cc1ccc(cc1)C(=O)NCC(F)(F)F 527a_100000717047_100000188618 [0,2,0,0,0,0|2,0,0]=4 14807 B15R1.892 O=C(CCC(F)(F)F)c1ccc(cc1)Cl 1458a_100000210187_100011219754 [0,2,0,0,0,0|2,0,0]=4 14808 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Br 11a_100000717047_100000185839 [0,2,0,0,0,0|1,1,0]=4 14809 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Br 1626a_100000717047_100000185839 [0,2,0,0,0,0|1,1,0]=4 14810 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Br 240690a_100000717047_100000185839 [0,2,0,0,0,0|1,1,0]=4 14811 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Br 527a_100000717047_100000185839 [0,2,0,0,0,0|1,1,0]=4 14812 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Cl 11a_100000717047_100000210187 [0,2,0,0,0,0|1,0,0]=3 14813 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Cl 1626a_100000717047_100000210187 [0,2,0,0,0,0|1,0,0]=3 14814 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Cl 240690a_100000717047_100000210187 [0,2,0,0,0,0|1,0,0]=3 14815 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)Cl 527a_100000717047_100000210187 [0,2,0,0,0,0|1,0,0]=3 14816 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)F 11a_100000717047_100000187176 [0,2,0,0,0,0|1,1,0]=4 14817 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)F 1626a_100000717047_100000187176 [0,2,0,0,0,0|1,1,0]=4 14818 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)F 240690a_100000717047_100000187176 [0,2,0,0,0,0|1,1,0]=4 14819 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)F 527a_100000717047_100000187176 [0,2,0,0,0,0|1,1,0]=4 14820 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)I 11a_100000717047_100000187904 [0,2,0,0,0,0|1,1,0]=4 14821 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)I 1626a_100000717047_100000187904 [0,2,0,0,0,0|1,1,0]=4 14822 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)I 240690a_100000717047_100000187904 [0,2,0,0,0,0|1,1,0]=4 14823 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)I 527a_100000717047_100000187904 [0,2,0,0,0,0|1,1,0]=4 14824 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)O 240690a_100000717047_100000212099 [0,2,0,0,0,0|2,0,0]=4 14825 B15R1.892 O=C(NCC(F)(F)F)c1ccc(cc1)O 527a_100000717047_100000212099 [0,2,0,0,0,0|2,0,0]=4 14826 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Br)Cl 11a_100000765925_100000766353 [0,2,0,0,0,0|1,0,1]=4 14827 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Br)Cl 1626a_100000765925_100000766353 [0,2,0,0,0,0|1,0,1]=4 14828 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000765925_100000766353 [0,2,0,0,0,0|1,0,1]=4 14829 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Br)Cl 527a_100000765925_100000766353 [0,2,0,0,0,0|1,0,1]=4 14830 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1C)Cl 11a_100000765925_100000688705 [0,2,0,0,0,0|1,0,1]=4 14831 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1C)Cl 1626a_100000765925_100000688705 [0,2,0,0,0,0|1,0,1]=4 14832 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1C)Cl 240690a_100000765925_100000688705 [0,2,0,0,0,0|1,0,1]=4 14833 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1C)Cl 527a_100000765925_100000688705 [0,2,0,0,0,0|1,0,1]=4 14834 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000765925_100000185840 [0,2,0,0,0,0|1,0,1]=4 14835 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Cl)Cl 1626a_100000765925_100000185840 [0,2,0,0,0,0|1,0,1]=4 14836 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000765925_100000185840 [0,2,0,0,0,0|1,0,1]=4 14837 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000765925_100000185840 [0,2,0,0,0,0|1,0,1]=4 14838 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1F)Cl 11a_100000765925_100000212326 [0,2,0,0,0,0|1,0,1]=4 14839 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1F)Cl 1626a_100000765925_100000212326 [0,2,0,0,0,0|1,0,1]=4 14840 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1F)Cl 240690a_100000765925_100000212326 [0,2,0,0,0,0|1,0,1]=4 14841 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1F)Cl 527a_100000765925_100000212326 [0,2,0,0,0,0|1,0,1]=4 14842 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1I)Cl 11a_100000765925_100000739380 [0,2,0,0,0,0|1,0,1]=4 14843 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1I)Cl 1626a_100000765925_100000739380 [0,2,0,0,0,0|1,0,1]=4 14844 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1I)Cl 240690a_100000765925_100000739380 [0,2,0,0,0,0|1,0,1]=4 14845 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1I)Cl 527a_100000765925_100000739380 [0,2,0,0,0,0|1,0,1]=4 14846 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Cl 11a_100000765925_100000188622 [0,2,0,0,0,0|1,0,1]=4 14847 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Cl 240690a_100000765925_100000188622 [0,2,0,0,0,0|1,0,1]=4 14848 B15R1.5822 C=C(C)CNC(=O)c1ccc(cc1O)Cl 527a_100000765925_100000188622 [0,2,0,0,0,0|1,0,1]=4 14849 B15R1.5822 CC(=O)CNC(=O)c1ccc(cc1Cl)Cl 1458a_100000182489_200000210301 [0,2,0,0,0,0|0,0,2]=4 14850 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210312 [0,2,0,0,0,0|2,0,0]=4 14851 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210312 [0,2,0,0,0,0|2,0,0]=4 14852 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210312 [0,2,0,0,0,0|2,0,0]=4 14853 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210312 [0,2,0,0,0,0|2,0,0]=4 14854 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210312 [0,2,0,0,0,0|2,0,0]=4 14855 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 11a_100000210953_100000762965 [0,2,0,0,0,0|1,1,0]=4 14856 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 1626a_100000210953_100000762965 [0,2,0,0,0,0|1,1,0]=4 14857 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 240690a_100000210953_100000762965 [0,2,0,0,0,0|1,1,0]=4 14858 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 527a_100000210953_100000762965 [0,2,0,0,0,0|1,1,0]=4 14859 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 11a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 14860 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 1626a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 14861 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 14862 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 527a_100000210953_100000766353 [0,2,0,0,0,0|1,0,0]=3 14863 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 11a_100000210953_100000212304 [0,2,0,0,0,0|1,1,0]=4 14864 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 1626a_100000210953_100000212304 [0,2,0,0,0,0|1,1,0]=4 14865 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 240690a_100000210953_100000212304 [0,2,0,0,0,0|1,1,0]=4 14866 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 527a_100000210953_100000212304 [0,2,0,0,0,0|1,1,0]=4 14867 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 11a_100000210953_100012360512 [0,2,0,0,0,0|1,1,0]=4 14868 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 1626a_100000210953_100012360512 [0,2,0,0,0,0|1,1,0]=4 14869 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 240690a_100000210953_100012360512 [0,2,0,0,0,0|1,1,0]=4 14870 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 527a_100000210953_100012360512 [0,2,0,0,0,0|1,1,0]=4 14871 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)O 240690a_100000210953_100012344906 [0,2,0,0,0,0|2,0,0]=4 14872 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)O 527a_100000210953_100012344906 [0,2,0,0,0,0|2,0,0]=4 14873 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 11a_100000210953_100000741628 [0,2,0,0,0,0|1,1,0]=4 14874 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 1626a_100000210953_100000741628 [0,2,0,0,0,0|1,1,0]=4 14875 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 240690a_100000210953_100000741628 [0,2,0,0,0,0|1,1,0]=4 14876 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 527a_100000210953_100000741628 [0,2,0,0,0,0|1,1,0]=4 14877 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 14878 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 1626a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 14879 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 14880 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000210953_100000185840 [0,2,0,0,0,0|1,0,0]=3 14881 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 11a_100000210953_100000211397 [0,2,0,0,0,0|1,1,0]=4 14882 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 1626a_100000210953_100000211397 [0,2,0,0,0,0|1,1,0]=4 14883 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 240690a_100000210953_100000211397 [0,2,0,0,0,0|1,1,0]=4 14884 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 527a_100000210953_100000211397 [0,2,0,0,0,0|1,1,0]=4 14885 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 11a_100000210953_100000751301 [0,2,0,0,0,0|1,1,0]=4 14886 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 1626a_100000210953_100000751301 [0,2,0,0,0,0|1,1,0]=4 14887 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 240690a_100000210953_100000751301 [0,2,0,0,0,0|1,1,0]=4 14888 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 527a_100000210953_100000751301 [0,2,0,0,0,0|1,1,0]=4 14889 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)O 240690a_100000210953_100000702456 [0,2,0,0,0,0|2,0,0]=4 14890 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)O 527a_100000210953_100000702456 [0,2,0,0,0,0|2,0,0]=4 14891 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 11a_100000210953_100000214689 [0,2,0,0,0,0|1,1,0]=4 14892 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 1626a_100000210953_100000214689 [0,2,0,0,0,0|1,1,0]=4 14893 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 240690a_100000210953_100000214689 [0,2,0,0,0,0|1,1,0]=4 14894 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 527a_100000210953_100000214689 [0,2,0,0,0,0|1,1,0]=4 14895 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 11a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 14896 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 1626a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 14897 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 240690a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 14898 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 527a_100000210953_100000212326 [0,2,0,0,0,0|1,0,0]=3 14899 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 11a_100000210953_100000211022 [0,2,0,0,0,0|1,1,0]=4 14900 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 1626a_100000210953_100000211022 [0,2,0,0,0,0|1,1,0]=4 14901 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 240690a_100000210953_100000211022 [0,2,0,0,0,0|1,1,0]=4 14902 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 527a_100000210953_100000211022 [0,2,0,0,0,0|1,1,0]=4 14903 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 11a_100000210953_100000037189 [0,2,0,0,0,0|1,1,0]=4 14904 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 1626a_100000210953_100000037189 [0,2,0,0,0,0|1,1,0]=4 14905 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 240690a_100000210953_100000037189 [0,2,0,0,0,0|1,1,0]=4 14906 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 527a_100000210953_100000037189 [0,2,0,0,0,0|1,1,0]=4 14907 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)O 240690a_100000210953_100000689029 [0,2,0,0,0,0|2,0,0]=4 14908 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)O 527a_100000210953_100000689029 [0,2,0,0,0,0|2,0,0]=4 14909 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 11a_100000210953_100000751167 [0,2,0,0,0,0|1,1,0]=4 14910 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 1626a_100000210953_100000751167 [0,2,0,0,0,0|1,1,0]=4 14911 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 240690a_100000210953_100000751167 [0,2,0,0,0,0|1,1,0]=4 14912 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 527a_100000210953_100000751167 [0,2,0,0,0,0|1,1,0]=4 14913 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 11a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 14914 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 1626a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 14915 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 240690a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 14916 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 527a_100000210953_100000739380 [0,2,0,0,0,0|1,0,0]=3 14917 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 11a_100000210953_100000739341 [0,2,0,0,0,0|1,1,0]=4 14918 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 1626a_100000210953_100000739341 [0,2,0,0,0,0|1,1,0]=4 14919 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 240690a_100000210953_100000739341 [0,2,0,0,0,0|1,1,0]=4 14920 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 527a_100000210953_100000739341 [0,2,0,0,0,0|1,1,0]=4 14921 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Br 240690a_100000210953_100000744433 [0,2,0,0,0,0|1,1,0]=4 14922 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Br 527a_100000210953_100000744433 [0,2,0,0,0,0|1,1,0]=4 14923 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 11a_100000210953_100000188622 [0,2,0,0,0,0|1,0,0]=3 14924 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 240690a_100000210953_100000188622 [0,2,0,0,0,0|1,0,0]=3 14925 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 527a_100000210953_100000188622 [0,2,0,0,0,0|1,0,0]=3 14926 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)F 240690a_100000210953_100000746061 [0,2,0,0,0,0|1,1,0]=4 14927 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)F 527a_100000210953_100000746061 [0,2,0,0,0,0|1,1,0]=4 14928 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)I 240690a_100000210953_100000091984 [0,2,0,0,0,0|1,1,0]=4 14929 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)I 527a_100000210953_100000091984 [0,2,0,0,0,0|1,1,0]=4 14930 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Br)Cl 22a_100000741168_100000766353 [0,2,0,0,0,0|2,0,0]=4 14931 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1Cl)Cl 22a_100000741168_100000185840 [0,2,0,0,0,0|2,0,0]=4 14932 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1F)Cl 22a_100000741168_100000212326 [0,2,0,0,0,0|2,0,0]=4 14933 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1I)Cl 22a_100000741168_100000739380 [0,2,0,0,0,0|2,0,0]=4 14934 B15R1.5822 CC(C)NNC(=O)c1ccc(cc1O)Cl 22a_100000741168_100000188622 [0,2,0,0,0,0|2,0,0]=4 14935 B15R1.5822 CC(NC[C@@H](C)O)c1ccc(cc1Cl)Cl 2230a_100000179772_100009817552 [0,2,0,0,0,0|1,0,1]=4 14936 B15R1.5822 CC(NC[C@@H](C)O)c1ccc(cc1Cl)Cl 34a_100000179772_100009817552 [0,2,0,0,0,0|1,0,1]=4 14937 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100012276601 [0,2,0,0,0,0|1,1,0]=4 14938 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100012276601 [0,2,0,0,0,0|1,0,0]=3 14939 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100012276601 [0,2,0,0,0,0|1,1,0]=4 14940 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100012276601 [0,2,0,0,0,0|1,1,0]=4 14941 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100012276601 [0,2,0,0,0,0|2,0,0]=4 14942 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100012276601 [0,2,0,0,0,0|1,1,0]=4 14943 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100012276601 [0,2,0,0,0,0|1,0,0]=3 14944 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100012276601 [0,2,0,0,0,0|1,1,0]=4 14945 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100012276601 [0,2,0,0,0,0|1,1,0]=4 14946 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100012276601 [0,2,0,0,0,0|2,0,0]=4 14947 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100012276601 [0,2,0,0,0,0|1,1,0]=4 14948 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100012276601 [0,2,0,0,0,0|1,0,0]=3 14949 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100012276601 [0,2,0,0,0,0|1,1,0]=4 14950 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100012276601 [0,2,0,0,0,0|1,1,0]=4 14951 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100012276601 [0,2,0,0,0,0|2,0,0]=4 14952 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100012276601 [0,2,0,0,0,0|1,1,0]=4 14953 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100012276601 [0,2,0,0,0,0|1,0,0]=3 14954 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100012276601 [0,2,0,0,0,0|1,1,0]=4 14955 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100012276601 [0,2,0,0,0,0|1,1,0]=4 14956 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100012276601 [0,2,0,0,0,0|1,0,0]=3 14957 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100012276601 [0,2,0,0,0,0|1,1,0]=4 14958 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100012276601 [0,2,0,0,0,0|1,1,0]=4 14959 B15R1.5822 CC(O)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100012276601 [0,2,0,0,0,0|2,0,0]=4 14960 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Br 11a_100000210904_100000762965 [0,2,0,0,0,0|0,1,0]=3 14961 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Br 240690a_100000210904_100000762965 [0,2,0,0,0,0|0,1,0]=3 14962 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Br 527a_100000210904_100000762965 [0,2,0,0,0,0|0,1,0]=3 14963 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Cl 11a_100000210904_100000766353 [0,2,0,0,0,0|0,0,0]=2 14964 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000210904_100000766353 [0,2,0,0,0,0|0,0,0]=2 14965 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)Cl 527a_100000210904_100000766353 [0,2,0,0,0,0|0,0,0]=2 14966 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)F 11a_100000210904_100000212304 [0,2,0,0,0,0|0,1,0]=3 14967 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)F 240690a_100000210904_100000212304 [0,2,0,0,0,0|0,1,0]=3 14968 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)F 527a_100000210904_100000212304 [0,2,0,0,0,0|0,1,0]=3 14969 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)I 11a_100000210904_100012360512 [0,2,0,0,0,0|0,1,0]=3 14970 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)I 240690a_100000210904_100012360512 [0,2,0,0,0,0|0,1,0]=3 14971 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)I 527a_100000210904_100012360512 [0,2,0,0,0,0|0,1,0]=3 14972 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)O 240690a_100000210904_100012344906 [0,2,0,0,0,0|1,0,0]=3 14973 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Br)O 527a_100000210904_100012344906 [0,2,0,0,0,0|1,0,0]=3 14974 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Br 11a_100000210904_100000741628 [0,2,0,0,0,0|0,1,0]=3 14975 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Br 240690a_100000210904_100000741628 [0,2,0,0,0,0|0,1,0]=3 14976 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Br 527a_100000210904_100000741628 [0,2,0,0,0,0|0,1,0]=3 14977 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000210904_100000185840 [0,2,0,0,0,0|0,0,0]=2 14978 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000210904_100000185840 [0,2,0,0,0,0|0,0,0]=2 14979 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000210904_100000185840 [0,2,0,0,0,0|0,0,0]=2 14980 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)F 11a_100000210904_100000211397 [0,2,0,0,0,0|0,1,0]=3 14981 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)F 240690a_100000210904_100000211397 [0,2,0,0,0,0|0,1,0]=3 14982 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)F 527a_100000210904_100000211397 [0,2,0,0,0,0|0,1,0]=3 14983 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)I 11a_100000210904_100000751301 [0,2,0,0,0,0|0,1,0]=3 14984 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)I 240690a_100000210904_100000751301 [0,2,0,0,0,0|0,1,0]=3 14985 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)I 527a_100000210904_100000751301 [0,2,0,0,0,0|0,1,0]=3 14986 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)O 240690a_100000210904_100000702456 [0,2,0,0,0,0|1,0,0]=3 14987 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1Cl)O 527a_100000210904_100000702456 [0,2,0,0,0,0|1,0,0]=3 14988 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Br 11a_100000210904_100000214689 [0,2,0,0,0,0|0,1,0]=3 14989 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Br 240690a_100000210904_100000214689 [0,2,0,0,0,0|0,1,0]=3 14990 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Br 527a_100000210904_100000214689 [0,2,0,0,0,0|0,1,0]=3 14991 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Cl 11a_100000210904_100000212326 [0,2,0,0,0,0|0,0,0]=2 14992 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Cl 240690a_100000210904_100000212326 [0,2,0,0,0,0|0,0,0]=2 14993 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)Cl 527a_100000210904_100000212326 [0,2,0,0,0,0|0,0,0]=2 14994 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)F 11a_100000210904_100000211022 [0,2,0,0,0,0|0,1,0]=3 14995 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)F 240690a_100000210904_100000211022 [0,2,0,0,0,0|0,1,0]=3 14996 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)F 527a_100000210904_100000211022 [0,2,0,0,0,0|0,1,0]=3 14997 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)I 11a_100000210904_100000037189 [0,2,0,0,0,0|0,1,0]=3 14998 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)I 240690a_100000210904_100000037189 [0,2,0,0,0,0|0,1,0]=3 14999 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)I 527a_100000210904_100000037189 [0,2,0,0,0,0|0,1,0]=3 15000 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)O 240690a_100000210904_100000689029 [0,2,0,0,0,0|1,0,0]=3 15001 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1F)O 527a_100000210904_100000689029 [0,2,0,0,0,0|1,0,0]=3 15002 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Br 11a_100000210904_100000751167 [0,2,0,0,0,0|0,1,0]=3 15003 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Br 240690a_100000210904_100000751167 [0,2,0,0,0,0|0,1,0]=3 15004 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Br 527a_100000210904_100000751167 [0,2,0,0,0,0|0,1,0]=3 15005 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Cl 11a_100000210904_100000739380 [0,2,0,0,0,0|0,0,0]=2 15006 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Cl 240690a_100000210904_100000739380 [0,2,0,0,0,0|0,0,0]=2 15007 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)Cl 527a_100000210904_100000739380 [0,2,0,0,0,0|0,0,0]=2 15008 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)F 11a_100000210904_100000739341 [0,2,0,0,0,0|0,1,0]=3 15009 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)F 240690a_100000210904_100000739341 [0,2,0,0,0,0|0,1,0]=3 15010 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1I)F 527a_100000210904_100000739341 [0,2,0,0,0,0|0,1,0]=3 15011 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Br 240690a_100000210904_100000744433 [0,2,0,0,0,0|0,1,0]=3 15012 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Br 527a_100000210904_100000744433 [0,2,0,0,0,0|0,1,0]=3 15013 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 11a_100000210904_100000188622 [0,2,0,0,0,0|0,0,0]=2 15014 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 240690a_100000210904_100000188622 [0,2,0,0,0,0|0,0,0]=2 15015 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)Cl 527a_100000210904_100000188622 [0,2,0,0,0,0|0,0,0]=2 15016 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)F 240690a_100000210904_100000746061 [0,2,0,0,0,0|0,1,0]=3 15017 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)F 527a_100000210904_100000746061 [0,2,0,0,0,0|0,1,0]=3 15018 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)I 240690a_100000210904_100000091984 [0,2,0,0,0,0|0,1,0]=3 15019 B15R1.5822 CC(O)CNC(=O)c1ccc(cc1O)I 527a_100000210904_100000091984 [0,2,0,0,0,0|0,1,0]=3 15020 B15R1.5822 CC(O)CNC(C)c1ccc(cc1Br)Cl 269862a_100000210904_100011934292 [0,2,0,0,0,0|1,0,1]=4 15021 B15R1.5822 CC(O)CNC(C)c1ccc(cc1Cl)Cl 2230a_100000179772_100011218427 [0,2,0,0,0,0|1,0,1]=4 15022 B15R1.5822 CC(O)CNC(C)c1ccc(cc1Cl)Cl 269862a_100000210904_100000210972 [0,2,0,0,0,0|1,0,1]=4 15023 B15R1.5822 CC(O)CNC(C)c1ccc(cc1Cl)Cl 34a_100000179772_100011218427 [0,2,0,0,0,0|1,0,1]=4 15024 B15R1.5822 CC(O)CNC(C)c1ccc(cc1F)Cl 269862a_100000210904_100011805184 [0,2,0,0,0,0|1,0,1]=4 15025 B15R1.5822 CC(O)CNC(C)c1ccc(cc1O)Cl 269862a_100000210904_100000061402 [0,2,0,0,0,0|1,0,1]=4 15026 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)Cl 1458a_100000688705_100000210312 [0,2,0,0,0,0|2,0,0]=4 15027 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Br 1458a_100000741311_100012276601 [0,2,0,0,0,0|1,1,0]=4 15028 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Cl 1458a_100000688705_100012276601 [0,2,0,0,0,0|1,0,0]=3 15029 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)F 1458a_100000686989_100012276601 [0,2,0,0,0,0|1,1,0]=4 15030 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)I 1458a_100010189873_100012276601 [0,2,0,0,0,0|1,1,0]=4 15031 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)O 1458a_100000692822_100012276601 [0,2,0,0,0,0|2,0,0]=4 15032 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Cl 11a_100000711301_100000688705 [0,2,0,0,0,0|0,0,2]=4 15033 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Cl 240690a_100000711301_100000688705 [0,2,0,0,0,0|0,0,2]=4 15034 B15R1.5822 Cc1cc(ccc1C(=O)NCC(=O)N)Cl 527a_100000711301_100000688705 [0,2,0,0,0,0|0,0,2]=4 15035 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 11a_100000210953_100000741311 [0,2,0,0,0,0|1,1,0]=4 15036 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000741311 [0,2,0,0,0,0|1,1,0]=4 15037 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000741311 [0,2,0,0,0,0|1,1,0]=4 15038 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 527a_100000210953_100000741311 [0,2,0,0,0,0|1,1,0]=4 15039 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 11a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 15040 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 15041 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 15042 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 527a_100000210953_100000688705 [0,2,0,0,0,0|1,0,0]=3 15043 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 11a_100000210953_100000686989 [0,2,0,0,0,0|1,1,0]=4 15044 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 1626a_100000210953_100000686989 [0,2,0,0,0,0|1,1,0]=4 15045 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 240690a_100000210953_100000686989 [0,2,0,0,0,0|1,1,0]=4 15046 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 527a_100000210953_100000686989 [0,2,0,0,0,0|1,1,0]=4 15047 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 11a_100000210953_100010189873 [0,2,0,0,0,0|1,1,0]=4 15048 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 1626a_100000210953_100010189873 [0,2,0,0,0,0|1,1,0]=4 15049 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 240690a_100000210953_100010189873 [0,2,0,0,0,0|1,1,0]=4 15050 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 527a_100000210953_100010189873 [0,2,0,0,0,0|1,1,0]=4 15051 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)O 240690a_100000210953_100000692822 [0,2,0,0,0,0|2,0,0]=4 15052 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)O 527a_100000210953_100000692822 [0,2,0,0,0,0|2,0,0]=4 15053 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 11a_100000210904_100000741311 [0,2,0,0,0,0|0,1,0]=3 15054 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000741311 [0,2,0,0,0,0|0,1,0]=3 15055 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 527a_100000210904_100000741311 [0,2,0,0,0,0|0,1,0]=3 15056 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 11a_100000210904_100000688705 [0,2,0,0,0,0|0,0,0]=2 15057 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000688705 [0,2,0,0,0,0|0,0,0]=2 15058 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 527a_100000210904_100000688705 [0,2,0,0,0,0|0,0,0]=2 15059 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 11a_100000210904_100000686989 [0,2,0,0,0,0|0,1,0]=3 15060 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 240690a_100000210904_100000686989 [0,2,0,0,0,0|0,1,0]=3 15061 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 527a_100000210904_100000686989 [0,2,0,0,0,0|0,1,0]=3 15062 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 11a_100000210904_100010189873 [0,2,0,0,0,0|0,1,0]=3 15063 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 240690a_100000210904_100010189873 [0,2,0,0,0,0|0,1,0]=3 15064 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 527a_100000210904_100010189873 [0,2,0,0,0,0|0,1,0]=3 15065 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)O 240690a_100000210904_100000692822 [0,2,0,0,0,0|1,0,0]=3 15066 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)O 527a_100000210904_100000692822 [0,2,0,0,0,0|1,0,0]=3 15067 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Br 11a_100000765723_100000741311 [0,2,0,0,0,0|1,1,0]=4 15068 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Br 1626a_100000765723_100000741311 [0,2,0,0,0,0|1,1,0]=4 15069 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Br 240690a_100000765723_100000741311 [0,2,0,0,0,0|1,1,0]=4 15070 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Br 527a_100000765723_100000741311 [0,2,0,0,0,0|1,1,0]=4 15071 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Cl 11a_100000765723_100000688705 [0,2,0,0,0,0|1,0,0]=3 15072 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Cl 1626a_100000765723_100000688705 [0,2,0,0,0,0|1,0,0]=3 15073 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Cl 240690a_100000765723_100000688705 [0,2,0,0,0,0|1,0,0]=3 15074 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)Cl 527a_100000765723_100000688705 [0,2,0,0,0,0|1,0,0]=3 15075 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)F 11a_100000765723_100000686989 [0,2,0,0,0,0|1,1,0]=4 15076 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)F 1626a_100000765723_100000686989 [0,2,0,0,0,0|1,1,0]=4 15077 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)F 240690a_100000765723_100000686989 [0,2,0,0,0,0|1,1,0]=4 15078 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)F 527a_100000765723_100000686989 [0,2,0,0,0,0|1,1,0]=4 15079 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)I 11a_100000765723_100010189873 [0,2,0,0,0,0|1,1,0]=4 15080 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)I 1626a_100000765723_100010189873 [0,2,0,0,0,0|1,1,0]=4 15081 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)I 240690a_100000765723_100010189873 [0,2,0,0,0,0|1,1,0]=4 15082 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)I 527a_100000765723_100010189873 [0,2,0,0,0,0|1,1,0]=4 15083 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)O 240690a_100000765723_100000692822 [0,2,0,0,0,0|2,0,0]=4 15084 B15R1.5822 Cc1cc(ccc1C(=O)NCC(F)F)O 527a_100000765723_100000692822 [0,2,0,0,0,0|2,0,0]=4 15085 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)Cl 22a_100000741168_100000688705 [0,2,0,0,0,0|2,0,0]=4 15086 B15R1.5822 Cc1cc(ccc1C(C)NCC(C)O)Cl 269862a_100000210904_100011998434 [0,2,0,0,0,0|1,0,1]=4 15087 B15R1.5822 Cc1cc(ccc1[C@H](C)NCC(C)O)Cl 2230a_100020633667_100011218427 [0,2,0,0,0,0|1,0,1]=4 15088 B15R1.5822 Cc1cc(ccc1[C@H](C)NCC(C)O)Cl 34a_100020633667_100011218427 [0,2,0,0,0,0|1,0,1]=4 15089 B15R1.5822 Cc1cc(ccc1[C@H](C)NC[C@@H](C)O)Cl 2230a_100020633667_100009817552 [0,2,0,0,0,0|1,0,1]=4 15090 B15R1.5822 Cc1cc(ccc1[C@H](C)NC[C@@H](C)O)Cl 34a_100020633667_100009817552 [0,2,0,0,0,0|1,0,1]=4 15091 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)CCC(C)O 1458a_100000685072_100012276601 [0,2,0,0,0,0|2,0,0]=4 15092 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 11a_100000210953_100000685072 [0,2,0,0,0,0|2,0,0]=4 15093 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 1626a_100000210953_100000685072 [0,2,0,0,0,0|2,0,0]=4 15094 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 240690a_100000210953_100000685072 [0,2,0,0,0,0|2,0,0]=4 15095 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 527a_100000210953_100000685072 [0,2,0,0,0,0|2,0,0]=4 15096 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)O 11a_100000210904_100000685072 [0,2,0,0,0,0|1,0,0]=3 15097 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)O 240690a_100000210904_100000685072 [0,2,0,0,0,0|1,0,0]=3 15098 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)O 527a_100000210904_100000685072 [0,2,0,0,0,0|1,0,0]=3 15099 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(F)F 11a_100000765723_100000685072 [0,2,0,0,0,0|2,0,0]=4 15100 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(F)F 1626a_100000765723_100000685072 [0,2,0,0,0,0|2,0,0]=4 15101 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(F)F 240690a_100000765723_100000685072 [0,2,0,0,0,0|2,0,0]=4 15102 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(F)F 527a_100000765723_100000685072 [0,2,0,0,0,0|2,0,0]=4 15103 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CCC(C)O 1458a_100000211164_100012276601 [0,2,0,0,0,0|2,0,0]=4 15104 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 11a_100000210953_100000211164 [0,2,0,0,0,0|2,0,0]=4 15105 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 1626a_100000210953_100000211164 [0,2,0,0,0,0|2,0,0]=4 15106 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 240690a_100000210953_100000211164 [0,2,0,0,0,0|2,0,0]=4 15107 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 527a_100000210953_100000211164 [0,2,0,0,0,0|2,0,0]=4 15108 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 11a_100000210904_100000211164 [0,2,0,0,0,0|1,0,0]=3 15109 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 240690a_100000210904_100000211164 [0,2,0,0,0,0|1,0,0]=3 15110 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 527a_100000210904_100000211164 [0,2,0,0,0,0|1,0,0]=3 15111 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(F)F 11a_100000765723_100000211164 [0,2,0,0,0,0|2,0,0]=4 15112 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(F)F 1626a_100000765723_100000211164 [0,2,0,0,0,0|2,0,0]=4 15113 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(F)F 240690a_100000765723_100000211164 [0,2,0,0,0,0|2,0,0]=4 15114 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(F)F 527a_100000765723_100000211164 [0,2,0,0,0,0|2,0,0]=4 15115 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)CCC(C)O 1458a_100000766932_100012276601 [0,2,0,0,0,0|2,0,0]=4 15116 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 11a_100000210953_100000766932 [0,2,0,0,0,0|2,0,0]=4 15117 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 1626a_100000210953_100000766932 [0,2,0,0,0,0|2,0,0]=4 15118 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 240690a_100000210953_100000766932 [0,2,0,0,0,0|2,0,0]=4 15119 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 527a_100000210953_100000766932 [0,2,0,0,0,0|2,0,0]=4 15120 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)O 11a_100000210904_100000766932 [0,2,0,0,0,0|1,0,0]=3 15121 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)O 240690a_100000210904_100000766932 [0,2,0,0,0,0|1,0,0]=3 15122 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)O 527a_100000210904_100000766932 [0,2,0,0,0,0|1,0,0]=3 15123 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(F)F 11a_100000765723_100000766932 [0,2,0,0,0,0|2,0,0]=4 15124 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(F)F 1626a_100000765723_100000766932 [0,2,0,0,0,0|2,0,0]=4 15125 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(F)F 240690a_100000765723_100000766932 [0,2,0,0,0,0|2,0,0]=4 15126 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(F)F 527a_100000765723_100000766932 [0,2,0,0,0,0|2,0,0]=4 15127 B15R1.5822 Cc1ccc(c(c1)F)C(=O)CCC(C)O 1458a_100000766033_100012276601 [0,2,0,0,0,0|2,0,0]=4 15128 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 11a_100000210953_100000766033 [0,2,0,0,0,0|2,0,0]=4 15129 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 1626a_100000210953_100000766033 [0,2,0,0,0,0|2,0,0]=4 15130 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 240690a_100000210953_100000766033 [0,2,0,0,0,0|2,0,0]=4 15131 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 527a_100000210953_100000766033 [0,2,0,0,0,0|2,0,0]=4 15132 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)O 11a_100000210904_100000766033 [0,2,0,0,0,0|1,0,0]=3 15133 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)O 240690a_100000210904_100000766033 [0,2,0,0,0,0|1,0,0]=3 15134 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)O 527a_100000210904_100000766033 [0,2,0,0,0,0|1,0,0]=3 15135 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(F)F 11a_100000765723_100000766033 [0,2,0,0,0,0|2,0,0]=4 15136 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(F)F 1626a_100000765723_100000766033 [0,2,0,0,0,0|2,0,0]=4 15137 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(F)F 240690a_100000765723_100000766033 [0,2,0,0,0,0|2,0,0]=4 15138 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(F)F 527a_100000765723_100000766033 [0,2,0,0,0,0|2,0,0]=4 15139 B15R1.5822 Cc1ccc(c(c1)I)C(=O)CCC(C)O 1458a_100009999607_100012276601 [0,2,0,0,0,0|2,0,0]=4 15140 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 11a_100000210953_100009999607 [0,2,0,0,0,0|2,0,0]=4 15141 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 1626a_100000210953_100009999607 [0,2,0,0,0,0|2,0,0]=4 15142 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 240690a_100000210953_100009999607 [0,2,0,0,0,0|2,0,0]=4 15143 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 527a_100000210953_100009999607 [0,2,0,0,0,0|2,0,0]=4 15144 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)O 11a_100000210904_100009999607 [0,2,0,0,0,0|1,0,0]=3 15145 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)O 240690a_100000210904_100009999607 [0,2,0,0,0,0|1,0,0]=3 15146 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)O 527a_100000210904_100009999607 [0,2,0,0,0,0|1,0,0]=3 15147 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(F)F 11a_100000765723_100009999607 [0,2,0,0,0,0|2,0,0]=4 15148 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(F)F 1626a_100000765723_100009999607 [0,2,0,0,0,0|2,0,0]=4 15149 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(F)F 240690a_100000765723_100009999607 [0,2,0,0,0,0|2,0,0]=4 15150 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(F)F 527a_100000765723_100009999607 [0,2,0,0,0,0|2,0,0]=4 15151 B15R1.5822 Cc1ccc(c(c1)O)C(=O)CCC(C)O 1458a_100000212137_100012276601 [0,2,0,0,0,0|2,0,0]=4 15152 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 1626a_100000210953_100000212137 [0,2,0,0,0,0|2,0,0]=4 15153 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 240690a_100000210953_100000212137 [0,2,0,0,0,0|2,0,0]=4 15154 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 527a_100000210953_100000212137 [0,2,0,0,0,0|2,0,0]=4 15155 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)O 240690a_100000210904_100000212137 [0,2,0,0,0,0|1,0,0]=3 15156 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)O 527a_100000210904_100000212137 [0,2,0,0,0,0|1,0,0]=3 15157 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(F)F 1626a_100000765723_100000212137 [0,2,0,0,0,0|2,0,0]=4 15158 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(F)F 240690a_100000765723_100000212137 [0,2,0,0,0,0|2,0,0]=4 15159 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(F)F 527a_100000765723_100000212137 [0,2,0,0,0,0|2,0,0]=4 15160 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Cl 11a_100000711301_100000766353 [0,2,0,0,0,0|0,0,2]=4 15161 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000711301_100000766353 [0,2,0,0,0,0|0,0,2]=4 15162 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Br)Cl 527a_100000711301_100000766353 [0,2,0,0,0,0|0,0,2]=4 15163 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000711301_100000185840 [0,2,0,0,0,0|0,0,2]=4 15164 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000711301_100000185840 [0,2,0,0,0,0|0,0,2]=4 15165 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000711301_100000185840 [0,2,0,0,0,0|0,0,2]=4 15166 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Cl 11a_100000711301_100000212326 [0,2,0,0,0,0|0,0,2]=4 15167 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Cl 240690a_100000711301_100000212326 [0,2,0,0,0,0|0,0,2]=4 15168 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1F)Cl 527a_100000711301_100000212326 [0,2,0,0,0,0|0,0,2]=4 15169 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Cl 11a_100000711301_100000739380 [0,2,0,0,0,0|0,0,2]=4 15170 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Cl 240690a_100000711301_100000739380 [0,2,0,0,0,0|0,0,2]=4 15171 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1I)Cl 527a_100000711301_100000739380 [0,2,0,0,0,0|0,0,2]=4 15172 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Cl 11a_100000711301_100000188622 [0,2,0,0,0,0|0,0,2]=4 15173 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Cl 240690a_100000711301_100000188622 [0,2,0,0,0,0|0,0,2]=4 15174 B15R1.5822 NC(=O)CNC(=O)c1ccc(cc1O)Cl 527a_100000711301_100000188622 [0,2,0,0,0,0|0,0,2]=4 15175 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Br 11a_100000765723_100000762965 [0,2,0,0,0,0|1,1,0]=4 15176 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Br 1626a_100000765723_100000762965 [0,2,0,0,0,0|1,1,0]=4 15177 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Br 240690a_100000765723_100000762965 [0,2,0,0,0,0|1,1,0]=4 15178 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Br 527a_100000765723_100000762965 [0,2,0,0,0,0|1,1,0]=4 15179 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Cl 11a_100000765723_100000766353 [0,2,0,0,0,0|1,0,0]=3 15180 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Cl 1626a_100000765723_100000766353 [0,2,0,0,0,0|1,0,0]=3 15181 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Cl 240690a_100000765723_100000766353 [0,2,0,0,0,0|1,0,0]=3 15182 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)Cl 527a_100000765723_100000766353 [0,2,0,0,0,0|1,0,0]=3 15183 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)F 11a_100000765723_100000212304 [0,2,0,0,0,0|1,1,0]=4 15184 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)F 1626a_100000765723_100000212304 [0,2,0,0,0,0|1,1,0]=4 15185 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)F 240690a_100000765723_100000212304 [0,2,0,0,0,0|1,1,0]=4 15186 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)F 527a_100000765723_100000212304 [0,2,0,0,0,0|1,1,0]=4 15187 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)I 11a_100000765723_100012360512 [0,2,0,0,0,0|1,1,0]=4 15188 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)I 1626a_100000765723_100012360512 [0,2,0,0,0,0|1,1,0]=4 15189 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)I 240690a_100000765723_100012360512 [0,2,0,0,0,0|1,1,0]=4 15190 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)I 527a_100000765723_100012360512 [0,2,0,0,0,0|1,1,0]=4 15191 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)O 240690a_100000765723_100012344906 [0,2,0,0,0,0|2,0,0]=4 15192 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Br)O 527a_100000765723_100012344906 [0,2,0,0,0,0|2,0,0]=4 15193 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Br 11a_100000765723_100000741628 [0,2,0,0,0,0|1,1,0]=4 15194 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Br 1626a_100000765723_100000741628 [0,2,0,0,0,0|1,1,0]=4 15195 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Br 240690a_100000765723_100000741628 [0,2,0,0,0,0|1,1,0]=4 15196 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Br 527a_100000765723_100000741628 [0,2,0,0,0,0|1,1,0]=4 15197 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Cl 11a_100000765723_100000185840 [0,2,0,0,0,0|1,0,0]=3 15198 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Cl 1626a_100000765723_100000185840 [0,2,0,0,0,0|1,0,0]=3 15199 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Cl 240690a_100000765723_100000185840 [0,2,0,0,0,0|1,0,0]=3 15200 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)Cl 527a_100000765723_100000185840 [0,2,0,0,0,0|1,0,0]=3 15201 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)F 11a_100000765723_100000211397 [0,2,0,0,0,0|1,1,0]=4 15202 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)F 1626a_100000765723_100000211397 [0,2,0,0,0,0|1,1,0]=4 15203 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)F 240690a_100000765723_100000211397 [0,2,0,0,0,0|1,1,0]=4 15204 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)F 527a_100000765723_100000211397 [0,2,0,0,0,0|1,1,0]=4 15205 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)I 11a_100000765723_100000751301 [0,2,0,0,0,0|1,1,0]=4 15206 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)I 1626a_100000765723_100000751301 [0,2,0,0,0,0|1,1,0]=4 15207 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)I 240690a_100000765723_100000751301 [0,2,0,0,0,0|1,1,0]=4 15208 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)I 527a_100000765723_100000751301 [0,2,0,0,0,0|1,1,0]=4 15209 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)O 240690a_100000765723_100000702456 [0,2,0,0,0,0|2,0,0]=4 15210 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1Cl)O 527a_100000765723_100000702456 [0,2,0,0,0,0|2,0,0]=4 15211 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Br 11a_100000765723_100000214689 [0,2,0,0,0,0|1,1,0]=4 15212 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Br 1626a_100000765723_100000214689 [0,2,0,0,0,0|1,1,0]=4 15213 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Br 240690a_100000765723_100000214689 [0,2,0,0,0,0|1,1,0]=4 15214 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Br 527a_100000765723_100000214689 [0,2,0,0,0,0|1,1,0]=4 15215 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Cl 11a_100000765723_100000212326 [0,2,0,0,0,0|1,0,0]=3 15216 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Cl 1626a_100000765723_100000212326 [0,2,0,0,0,0|1,0,0]=3 15217 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Cl 240690a_100000765723_100000212326 [0,2,0,0,0,0|1,0,0]=3 15218 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)Cl 527a_100000765723_100000212326 [0,2,0,0,0,0|1,0,0]=3 15219 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)F 11a_100000765723_100000211022 [0,2,0,0,0,0|1,1,0]=4 15220 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)F 1626a_100000765723_100000211022 [0,2,0,0,0,0|1,1,0]=4 15221 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)F 240690a_100000765723_100000211022 [0,2,0,0,0,0|1,1,0]=4 15222 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)F 527a_100000765723_100000211022 [0,2,0,0,0,0|1,1,0]=4 15223 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)I 11a_100000765723_100000037189 [0,2,0,0,0,0|1,1,0]=4 15224 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)I 1626a_100000765723_100000037189 [0,2,0,0,0,0|1,1,0]=4 15225 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)I 240690a_100000765723_100000037189 [0,2,0,0,0,0|1,1,0]=4 15226 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)I 527a_100000765723_100000037189 [0,2,0,0,0,0|1,1,0]=4 15227 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)O 240690a_100000765723_100000689029 [0,2,0,0,0,0|2,0,0]=4 15228 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1F)O 527a_100000765723_100000689029 [0,2,0,0,0,0|2,0,0]=4 15229 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Br 11a_100000765723_100000751167 [0,2,0,0,0,0|1,1,0]=4 15230 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Br 1626a_100000765723_100000751167 [0,2,0,0,0,0|1,1,0]=4 15231 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Br 240690a_100000765723_100000751167 [0,2,0,0,0,0|1,1,0]=4 15232 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Br 527a_100000765723_100000751167 [0,2,0,0,0,0|1,1,0]=4 15233 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Cl 11a_100000765723_100000739380 [0,2,0,0,0,0|1,0,0]=3 15234 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Cl 1626a_100000765723_100000739380 [0,2,0,0,0,0|1,0,0]=3 15235 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Cl 240690a_100000765723_100000739380 [0,2,0,0,0,0|1,0,0]=3 15236 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)Cl 527a_100000765723_100000739380 [0,2,0,0,0,0|1,0,0]=3 15237 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)F 11a_100000765723_100000739341 [0,2,0,0,0,0|1,1,0]=4 15238 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)F 1626a_100000765723_100000739341 [0,2,0,0,0,0|1,1,0]=4 15239 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)F 240690a_100000765723_100000739341 [0,2,0,0,0,0|1,1,0]=4 15240 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1I)F 527a_100000765723_100000739341 [0,2,0,0,0,0|1,1,0]=4 15241 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)Br 240690a_100000765723_100000744433 [0,2,0,0,0,0|1,1,0]=4 15242 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)Br 527a_100000765723_100000744433 [0,2,0,0,0,0|1,1,0]=4 15243 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)Cl 11a_100000765723_100000188622 [0,2,0,0,0,0|1,0,0]=3 15244 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)Cl 240690a_100000765723_100000188622 [0,2,0,0,0,0|1,0,0]=3 15245 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)Cl 527a_100000765723_100000188622 [0,2,0,0,0,0|1,0,0]=3 15246 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)F 240690a_100000765723_100000746061 [0,2,0,0,0,0|1,1,0]=4 15247 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)F 527a_100000765723_100000746061 [0,2,0,0,0,0|1,1,0]=4 15248 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)I 240690a_100000765723_100000091984 [0,2,0,0,0,0|1,1,0]=4 15249 B15R1.5822 O=C(NCC(F)F)c1ccc(cc1O)I 527a_100000765723_100000091984 [0,2,0,0,0,0|1,1,0]=4 15250 B15R1.5822 [13CH3]C(=O)CNC(=O)c1ccc(cc1Cl)Cl 1458a_100000182489_200025704644 [0,2,0,0,0,0|0,0,2]=4 15251 B15R1.1221 C=C=Cc1ccc(cc1)C(=O)NCCC 271570a_100015277604_200000152267 [0,2,0,0,0,0|2,0,0]=4 15252 B15R1.1221 C=C=Cc1ccc(cc1)C(=O)NCCO 271570a_100015277604_200000158904 [0,2,0,0,0,0|1,0,0]=3 15253 B15R1.1221 CC#Cc1ccc(cc1)C(=O)CCCO 1458a_100009923575_100011215043 [0,2,0,0,0,0|2,0,0]=4 15254 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCC 11a_100020643023_100009923575 [0,2,0,0,0,0|2,0,0]=4 15255 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCC 1626a_100020643023_100009923575 [0,2,0,0,0,0|2,0,0]=4 15256 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCC 240690a_100020643023_100009923575 [0,2,0,0,0,0|2,0,0]=4 15257 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCC 527a_100020643023_100009923575 [0,2,0,0,0,0|2,0,0]=4 15258 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCF 11a_100000724931_100009923575 [0,2,0,0,0,0|2,0,0]=4 15259 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100009923575 [0,2,0,0,0,0|2,0,0]=4 15260 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100009923575 [0,2,0,0,0,0|2,0,0]=4 15261 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCF 527a_100000724931_100009923575 [0,2,0,0,0,0|2,0,0]=4 15262 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100009923575 [0,2,0,0,0,0|1,0,0]=3 15263 B15R1.1221 CC#Cc1ccc(cc1)C(=O)NCCO 527a_100000210304_100009923575 [0,2,0,0,0,0|1,0,0]=3 15264 B15R1.1221 CC=Cc1ccc(cc1)C(=O)NCCC 271570a_100016259895_200000152267 [0,2,0,0,0,0|2,0,0]=4 15265 B15R1.1221 CC=Cc1ccc(cc1)C(=O)NCCO 271570a_100016259895_200000158904 [0,2,0,0,0,0|1,0,0]=3 15266 B15R1.1221 CCCNC(=O)c1ccc(cc1)CC#N 11a_100020643023_100000693995 [0,2,0,0,0,0|2,0,0]=4 15267 B15R1.1221 CCCNC(=O)c1ccc(cc1)CC#N 1626a_100020643023_100000693995 [0,2,0,0,0,0|2,0,0]=4 15268 B15R1.1221 CCCNC(=O)c1ccc(cc1)CC#N 240690a_100020643023_100000693995 [0,2,0,0,0,0|2,0,0]=4 15269 B15R1.1221 CCCNC(=O)c1ccc(cc1)CC#N 527a_100020643023_100000693995 [0,2,0,0,0,0|2,0,0]=4 15270 B15R1.1221 CCCNC(=O)c1ccc(cc1)CCC 11a_100020643023_100011207308 [0,2,0,0,0,0|2,0,0]=4 15271 B15R1.1221 CCCNC(=O)c1ccc(cc1)CCC 1626a_100020643023_100011207308 [0,2,0,0,0,0|2,0,0]=4 15272 B15R1.1221 CCCNC(=O)c1ccc(cc1)CCC 240690a_100020643023_100011207308 [0,2,0,0,0,0|2,0,0]=4 15273 B15R1.1221 CCCNC(=O)c1ccc(cc1)CCC 527a_100020643023_100011207308 [0,2,0,0,0,0|2,0,0]=4 15274 B15R1.1221 CCCNC(=O)c1ccc(cc1)CCO 1626a_100020643023_100000078963 [0,2,0,0,0,0|2,0,0]=4 15275 B15R1.1221 CCCNC(=O)c1ccc(cc1)CCO 240690a_100020643023_100000078963 [0,2,0,0,0,0|2,0,0]=4 15276 B15R1.1221 CCCNC(=O)c1ccc(cc1)COC 11a_100020643023_100000189608 [0,2,0,0,0,0|2,0,0]=4 15277 B15R1.1221 CCCNC(=O)c1ccc(cc1)COC 1626a_100020643023_100000189608 [0,2,0,0,0,0|2,0,0]=4 15278 B15R1.1221 CCCNC(=O)c1ccc(cc1)COC 240690a_100020643023_100000189608 [0,2,0,0,0,0|2,0,0]=4 15279 B15R1.1221 CCCNC(=O)c1ccc(cc1)COC 527a_100020643023_100000189608 [0,2,0,0,0,0|2,0,0]=4 15280 B15R1.1221 CCCNC(=O)c1ccc(cc1)CSC 11a_100020643023_100000175442 [0,2,0,0,0,0|2,0,0]=4 15281 B15R1.1221 CCCNC(=O)c1ccc(cc1)CSC 1626a_100020643023_100000175442 [0,2,0,0,0,0|2,0,0]=4 15282 B15R1.1221 CCCNC(=O)c1ccc(cc1)CSC 240690a_100020643023_100000175442 [0,2,0,0,0,0|2,0,0]=4 15283 B15R1.1221 CCCNC(=O)c1ccc(cc1)CSC 527a_100020643023_100000175442 [0,2,0,0,0,0|2,0,0]=4 15284 B15R1.1221 CCCNC(=O)c1ccc(cc1)N=[N+]=[N-] 11a_100020643023_100000039380 [0,2,0,0,0,0|2,0,0]=4 15285 B15R1.1221 CCCNC(=O)c1ccc(cc1)N=[N+]=[N-] 240690a_100020643023_100000039380 [0,2,0,0,0,0|2,0,0]=4 15286 B15R1.1221 CCCNC(=O)c1ccc(cc1)NCC 2230a_100000725496_100000210202 [0,2,0,0,0,0|2,0,0]=4 15287 B15R1.1221 CCCNC(=O)c1ccc(cc1)NCC 27a_100015525214_200000152267 [0,2,0,0,0,0|2,0,0]=4 15288 B15R1.1221 CCCNC(=O)c1ccc(cc1)NCC 34a_100000725496_100000210202 [0,2,0,0,0,0|2,0,0]=4 15289 B15R1.1221 CCCNC(=O)c1ccc(cc1)NCF 34a_100000725496_100015361967 [0,2,0,0,0,0|1,1,0]=4 15290 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCC 11a_100020643023_100000181891 [0,2,0,0,0,0|2,0,0]=4 15291 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCC 1626a_100020643023_100000181891 [0,2,0,0,0,0|2,0,0]=4 15292 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCC 240690a_100020643023_100000181891 [0,2,0,0,0,0|2,0,0]=4 15293 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCC 34a_100000187946_100000210202 [0,2,0,0,0,0|2,0,0]=4 15294 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCC 527a_100020643023_100000181891 [0,2,0,0,0,0|2,0,0]=4 15295 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCC 7a_100000187946_100000210202 [0,2,0,0,0,0|2,0,0]=4 15296 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCF 34a_100000187946_100015361967 [0,2,0,0,0,0|1,1,0]=4 15297 B15R1.1221 CCCNC(=O)c1ccc(cc1)OCF 7a_100000187946_100015361967 [0,2,0,0,0,0|1,1,0]=4 15298 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCC 11a_100020643023_100000244969 [0,2,0,0,0,0|2,0,0]=4 15299 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCC 1626a_100020643023_100000244969 [0,2,0,0,0,0|2,0,0]=4 15300 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCC 240690a_100020643023_100000244969 [0,2,0,0,0,0|2,0,0]=4 15301 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCC 527a_100020643023_100000244969 [0,2,0,0,0,0|2,0,0]=4 15302 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCC 62a_100000210202_200000152267 [0,2,0,0,0,0|2,0,0]=4 15303 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCC 62a_200000152267_100000210202 [0,2,0,0,0,0|2,0,0]=4 15304 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCF 62a_100015361967_200000152267 [0,2,0,0,0,0|1,1,0]=4 15305 B15R1.1221 CCCNC(=O)c1ccc(cc1)SCF 62a_200000152267_100015361967 [0,2,0,0,0,0|1,1,0]=4 15306 B15R1.1221 CCCc1ccc(cc1)C(=O)CCCO 1458a_100011207308_100011215043 [0,2,0,0,0,0|2,0,0]=4 15307 B15R1.1221 CCCc1ccc(cc1)C(=O)NCCF 11a_100000724931_100011207308 [0,2,0,0,0,0|2,0,0]=4 15308 B15R1.1221 CCCc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100011207308 [0,2,0,0,0,0|2,0,0]=4 15309 B15R1.1221 CCCc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100011207308 [0,2,0,0,0,0|2,0,0]=4 15310 B15R1.1221 CCCc1ccc(cc1)C(=O)NCCF 527a_100000724931_100011207308 [0,2,0,0,0,0|2,0,0]=4 15311 B15R1.1221 CCCc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100011207308 [0,2,0,0,0,0|1,0,0]=3 15312 B15R1.1221 CCCc1ccc(cc1)C(=O)NCCO 527a_100000210304_100011207308 [0,2,0,0,0,0|1,0,0]=3 15313 B15R1.1221 CCNc1ccc(cc1)C(=O)NCCO 27a_100015525214_200000158904 [0,2,0,0,0,0|1,0,0]=3 15314 B15R1.1221 CCNc1ccc(cc1)C(=O)NCCO 34a_100000740983_100000210202 [0,2,0,0,0,0|1,0,0]=3 15315 B15R1.1221 CCOc1ccc(cc1)C(=O)CCCO 1458a_100000181891_100011215043 [0,2,0,0,0,0|2,0,0]=4 15316 B15R1.1221 CCOc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000181891 [0,2,0,0,0,0|2,0,0]=4 15317 B15R1.1221 CCOc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000181891 [0,2,0,0,0,0|2,0,0]=4 15318 B15R1.1221 CCOc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000181891 [0,2,0,0,0,0|2,0,0]=4 15319 B15R1.1221 CCOc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000181891 [0,2,0,0,0,0|2,0,0]=4 15320 B15R1.1221 CCOc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000181891 [0,2,0,0,0,0|1,0,0]=3 15321 B15R1.1221 CCOc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000181891 [0,2,0,0,0,0|1,0,0]=3 15322 B15R1.1221 CCOc1ccc(cc1)C(=O)OCCO 34a_100000031026_100000210202 [0,2,0,0,0,0|2,0,0]=4 15323 B15R1.1221 CCOc1ccc(cc1)C(=O)OCCO 7a_100000031026_100000210202 [0,2,0,0,0,0|2,0,0]=4 15324 B15R1.1221 CCSc1ccc(cc1)C(=O)CCCO 1458a_100000244969_100011215043 [0,2,0,0,0,0|2,0,0]=4 15325 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000244969 [0,2,0,0,0,0|2,0,0]=4 15326 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000244969 [0,2,0,0,0,0|2,0,0]=4 15327 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000244969 [0,2,0,0,0,0|2,0,0]=4 15328 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000244969 [0,2,0,0,0,0|2,0,0]=4 15329 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000244969 [0,2,0,0,0,0|1,0,0]=3 15330 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000244969 [0,2,0,0,0,0|1,0,0]=3 15331 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCO 62a_100000210202_200000158904 [0,2,0,0,0,0|1,0,0]=3 15332 B15R1.1221 CCSc1ccc(cc1)C(=O)NCCO 62a_200000158904_100000210202 [0,2,0,0,0,0|1,0,0]=3 15333 B15R1.1221 COCc1ccc(cc1)C(=O)CCCO 1458a_100000189608_100011215043 [0,2,0,0,0,0|2,0,0]=4 15334 B15R1.1221 COCc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000189608 [0,2,0,0,0,0|2,0,0]=4 15335 B15R1.1221 COCc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000189608 [0,2,0,0,0,0|2,0,0]=4 15336 B15R1.1221 COCc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000189608 [0,2,0,0,0,0|2,0,0]=4 15337 B15R1.1221 COCc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000189608 [0,2,0,0,0,0|2,0,0]=4 15338 B15R1.1221 COCc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000189608 [0,2,0,0,0,0|1,0,0]=3 15339 B15R1.1221 COCc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000189608 [0,2,0,0,0,0|1,0,0]=3 15340 B15R1.1221 CSCc1ccc(cc1)C(=O)CCCO 1458a_100000175442_100011215043 [0,2,0,0,0,0|2,0,0]=4 15341 B15R1.1221 CSCc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000175442 [0,2,0,0,0,0|2,0,0]=4 15342 B15R1.1221 CSCc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000175442 [0,2,0,0,0,0|2,0,0]=4 15343 B15R1.1221 CSCc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000175442 [0,2,0,0,0,0|2,0,0]=4 15344 B15R1.1221 CSCc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000175442 [0,2,0,0,0,0|2,0,0]=4 15345 B15R1.1221 CSCc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000175442 [0,2,0,0,0,0|1,0,0]=3 15346 B15R1.1221 CSCc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000175442 [0,2,0,0,0,0|1,0,0]=3 15347 B15R1.1221 N#CCc1ccc(cc1)C(=O)CCCO 1458a_100000693995_100011215043 [0,2,0,0,0,0|2,0,0]=4 15348 B15R1.1221 N#CCc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000693995 [0,2,0,0,0,0|2,0,0]=4 15349 B15R1.1221 N#CCc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000693995 [0,2,0,0,0,0|2,0,0]=4 15350 B15R1.1221 N#CCc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000693995 [0,2,0,0,0,0|2,0,0]=4 15351 B15R1.1221 N#CCc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000693995 [0,2,0,0,0,0|2,0,0]=4 15352 B15R1.1221 N#CCc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000693995 [0,2,0,0,0,0|1,0,0]=3 15353 B15R1.1221 N#CCc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000693995 [0,2,0,0,0,0|1,0,0]=3 15354 B15R1.1221 O=C(CCCO)c1ccc(cc1)CCO 1458a_100000078963_100011215043 [0,2,0,0,0,0|2,0,0]=4 15355 B15R1.1221 O=C(NCCF)c1ccc(cc1)CCO 1626a_100000724931_100000078963 [0,2,0,0,0,0|2,0,0]=4 15356 B15R1.1221 O=C(NCCF)c1ccc(cc1)CCO 240690a_100000724931_100000078963 [0,2,0,0,0,0|2,0,0]=4 15357 B15R1.1221 O=C(NCCO)c1ccc(cc1)CCO 240690a_100000210304_100000078963 [0,2,0,0,0,0|1,0,0]=3 15358 B15R1.1221 O=C(NCCO)c1ccc(cc1)NCF 34a_100000740983_100015361967 [0,2,0,0,0,0|0,1,0]=3 15359 B15R1.1221 O=C(NCCO)c1ccc(cc1)SCF 62a_100015361967_200000158904 [0,2,0,0,0,0|0,1,0]=3 15360 B15R1.1221 O=C(NCCO)c1ccc(cc1)SCF 62a_200000158904_100015361967 [0,2,0,0,0,0|0,1,0]=3 15361 B15R1.1221 O=C(OCCO)c1ccc(cc1)OCF 34a_100000031026_100015361967 [0,2,0,0,0,0|1,1,0]=4 15362 B15R1.1221 O=C(OCCO)c1ccc(cc1)OCF 7a_100000031026_100015361967 [0,2,0,0,0,0|1,1,0]=4 15363 B15R1.1221 [N-]=[N+]=Nc1ccc(cc1)C(=O)CCCO 1458a_100000039380_100011215043 [0,2,0,0,0,0|2,0,0]=4 15364 B15R1.1221 [N-]=[N+]=Nc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000039380 [0,2,0,0,0,0|2,0,0]=4 15365 B15R1.1221 [N-]=[N+]=Nc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000039380 [0,2,0,0,0,0|2,0,0]=4 15366 B15R1.1221 [N-]=[N+]=Nc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000039380 [0,2,0,0,0,0|1,0,0]=3 15367 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)CCCO 1458a_200009908186_100011215043 [0,2,0,0,0,0|2,0,0]=4 15368 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCC 11a_100020643023_200009908186 [0,2,0,0,0,0|2,0,0]=4 15369 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCC 1626a_100020643023_200009908186 [0,2,0,0,0,0|2,0,0]=4 15370 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCC 240690a_100020643023_200009908186 [0,2,0,0,0,0|2,0,0]=4 15371 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCC 271570a_100000694244_200000152267 [0,2,0,0,0,0|2,0,0]=4 15372 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCC 527a_100020643023_200009908186 [0,2,0,0,0,0|2,0,0]=4 15373 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCF 11a_100000724931_200009908186 [0,2,0,0,0,0|2,0,0]=4 15374 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCF 1626a_100000724931_200009908186 [0,2,0,0,0,0|2,0,0]=4 15375 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCF 240690a_100000724931_200009908186 [0,2,0,0,0,0|2,0,0]=4 15376 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCF 527a_100000724931_200009908186 [0,2,0,0,0,0|2,0,0]=4 15377 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCO 240690a_100000210304_200009908186 [0,2,0,0,0,0|1,0,0]=3 15378 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCO 271570a_100000694244_200000158904 [0,2,0,0,0,0|1,0,0]=3 15379 B15R1.1222 C=C(C)c1ccc(cc1)C(=O)NCCO 527a_100000210304_200009908186 [0,2,0,0,0,0|1,0,0]=3 15380 B15R1.1222 CC(=O)c1ccc(cc1)C(=O)OCCO 1458a_100010260019_200000210301 [0,2,0,0,0,0|2,0,0]=4 15381 B15R1.1222 CC(C)c1ccc(cc1)C(=O)CCCO 1458a_100000210772_100011215043 [0,2,0,0,0,0|2,0,0]=4 15382 B15R1.1222 CC(C)c1ccc(cc1)C(=O)NCCF 11a_100000724931_100000210772 [0,2,0,0,0,0|2,0,0]=4 15383 B15R1.1222 CC(C)c1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000210772 [0,2,0,0,0,0|2,0,0]=4 15384 B15R1.1222 CC(C)c1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000210772 [0,2,0,0,0,0|2,0,0]=4 15385 B15R1.1222 CC(C)c1ccc(cc1)C(=O)NCCF 527a_100000724931_100000210772 [0,2,0,0,0,0|2,0,0]=4 15386 B15R1.1222 CC(C)c1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000210772 [0,2,0,0,0,0|1,0,0]=3 15387 B15R1.1222 CC(C)c1ccc(cc1)C(=O)NCCO 527a_100000210304_100000210772 [0,2,0,0,0,0|1,0,0]=3 15388 B15R1.1222 CC(O)c1ccc(cc1)C(=O)CCCO 1458a_100000076921_100011215043 [0,2,0,0,0,0|2,0,0]=4 15389 B15R1.1222 CC(O)c1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000076921 [0,2,0,0,0,0|2,0,0]=4 15390 B15R1.1222 CC(O)c1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000076921 [0,2,0,0,0,0|1,0,0]=3 15391 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(=O)N 11a_100020643023_100000230133 [0,2,0,0,0,0|2,0,0]=4 15392 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(=O)N 1626a_100020643023_100000230133 [0,2,0,0,0,0|2,0,0]=4 15393 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(=O)N 240690a_100020643023_100000230133 [0,2,0,0,0,0|2,0,0]=4 15394 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(C)C 11a_100020643023_100000210772 [0,2,0,0,0,0|2,0,0]=4 15395 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(C)C 1626a_100020643023_100000210772 [0,2,0,0,0,0|2,0,0]=4 15396 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(C)C 240690a_100020643023_100000210772 [0,2,0,0,0,0|2,0,0]=4 15397 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(C)C 527a_100020643023_100000210772 [0,2,0,0,0,0|2,0,0]=4 15398 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(C)O 240690a_100020643023_100000076921 [0,2,0,0,0,0|2,0,0]=4 15399 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(F)F 11a_100020643023_100011735500 [0,2,0,0,0,0|1,1,0]=4 15400 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(F)F 1626a_100020643023_100011735500 [0,2,0,0,0,0|1,1,0]=4 15401 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(F)F 240690a_100020643023_100011735500 [0,2,0,0,0,0|1,1,0]=4 15402 B15R1.1222 CCCNC(=O)c1ccc(cc1)C(F)F 527a_100020643023_100011735500 [0,2,0,0,0,0|1,1,0]=4 15403 B15R1.1222 CCCNC(=O)c1ccc(cc1)N(C)C 11a_100020643023_100000210873 [0,2,0,0,0,0|2,0,0]=4 15404 B15R1.1222 CCCNC(=O)c1ccc(cc1)N(C)C 1626a_100020643023_100000210873 [0,2,0,0,0,0|2,0,0]=4 15405 B15R1.1222 CCCNC(=O)c1ccc(cc1)N(C)C 240690a_100020643023_100000210873 [0,2,0,0,0,0|2,0,0]=4 15406 B15R1.1222 CCCNC(=O)c1ccc(cc1)N(C)C 27a_100102631434_200000152267 [0,2,0,0,0,0|2,0,0]=4 15407 B15R1.1222 CCCNC(=O)c1ccc(cc1)N(C)C 527a_100020643023_100000210873 [0,2,0,0,0,0|2,0,0]=4 15408 B15R1.1222 CCCNC(=O)c1ccc(cc1)S(=O)C 1626a_100020643023_200000217594 [0,2,0,0,0,0|2,0,0]=4 15409 B15R1.1222 CCCNC(=O)c1ccc(cc1)S(=O)C 240690a_100020643023_200000217594 [0,2,0,0,0,0|2,0,0]=4 15410 B15R1.1222 CCCNC(=O)c1ccc(cc1)S(=O)C 527a_100020643023_200000217594 [0,2,0,0,0,0|2,0,0]=4 15411 B15R1.1222 CCCNC(=O)c1ccc(cc1)[N+](=O)[O-] 11a_100020643023_100000185811 [0,2,0,0,0,0|2,0,0]=4 15412 B15R1.1222 CCCNC(=O)c1ccc(cc1)[N+](=O)[O-] 1626a_100020643023_100000185811 [0,2,0,0,0,0|2,0,0]=4 15413 B15R1.1222 CCCNC(=O)c1ccc(cc1)[N+](=O)[O-] 240690a_100020643023_100000185811 [0,2,0,0,0,0|2,0,0]=4 15414 B15R1.1222 CCCNC(=O)c1ccc(cc1)[N+](=O)[O-] 527a_100020643023_100000185811 [0,2,0,0,0,0|2,0,0]=4 15415 B15R1.1222 CN(C)c1ccc(cc1)C(=O)CCCO 1458a_100000210873_100011215043 [0,2,0,0,0,0|2,0,0]=4 15416 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCF 11a_100000724931_100000210873 [0,2,0,0,0,0|2,0,0]=4 15417 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000210873 [0,2,0,0,0,0|2,0,0]=4 15418 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000210873 [0,2,0,0,0,0|2,0,0]=4 15419 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCF 527a_100000724931_100000210873 [0,2,0,0,0,0|2,0,0]=4 15420 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000210873 [0,2,0,0,0,0|1,0,0]=3 15421 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCO 27a_100102631434_200000158904 [0,2,0,0,0,0|1,0,0]=3 15422 B15R1.1222 CN(C)c1ccc(cc1)C(=O)NCCO 527a_100000210304_100000210873 [0,2,0,0,0,0|1,0,0]=3 15423 B15R1.1222 CS(=O)c1ccc(cc1)C(=O)CCCO 1458a_200000217594_100011215043 [0,2,0,0,0,0|2,0,0]=4 15424 B15R1.1222 CS(=O)c1ccc(cc1)C(=O)NCCF 1626a_100000724931_200000217594 [0,2,0,0,0,0|2,0,0]=4 15425 B15R1.1222 CS(=O)c1ccc(cc1)C(=O)NCCF 240690a_100000724931_200000217594 [0,2,0,0,0,0|2,0,0]=4 15426 B15R1.1222 CS(=O)c1ccc(cc1)C(=O)NCCF 527a_100000724931_200000217594 [0,2,0,0,0,0|2,0,0]=4 15427 B15R1.1222 CS(=O)c1ccc(cc1)C(=O)NCCO 240690a_100000210304_200000217594 [0,2,0,0,0,0|1,0,0]=3 15428 B15R1.1222 CS(=O)c1ccc(cc1)C(=O)NCCO 527a_100000210304_200000217594 [0,2,0,0,0,0|1,0,0]=3 15429 B15R1.1222 NC(=O)c1ccc(cc1)C(=O)CCCO 1458a_100000230133_100011215043 [0,2,0,0,0,0|2,0,0]=4 15430 B15R1.1222 NC(=O)c1ccc(cc1)C(=O)NCCF 11a_100000724931_100000230133 [0,2,0,0,0,0|2,0,0]=4 15431 B15R1.1222 NC(=O)c1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000230133 [0,2,0,0,0,0|2,0,0]=4 15432 B15R1.1222 NC(=O)c1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000230133 [0,2,0,0,0,0|2,0,0]=4 15433 B15R1.1222 NC(=O)c1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000230133 [0,2,0,0,0,0|1,0,0]=3 15434 B15R1.1222 O=C(CCCO)c1ccc(cc1)C(F)F 1458a_100011735500_100011215043 [0,2,0,0,0,0|1,1,0]=4 15435 B15R1.1222 O=C(CCCO)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_100011215043 [0,2,0,0,0,0|2,0,0]=4 15436 B15R1.1222 O=C(NCCF)c1ccc(cc1)C(F)F 11a_100000724931_100011735500 [0,2,0,0,0,0|1,1,0]=4 15437 B15R1.1222 O=C(NCCF)c1ccc(cc1)C(F)F 1626a_100000724931_100011735500 [0,2,0,0,0,0|1,1,0]=4 15438 B15R1.1222 O=C(NCCF)c1ccc(cc1)C(F)F 240690a_100000724931_100011735500 [0,2,0,0,0,0|1,1,0]=4 15439 B15R1.1222 O=C(NCCF)c1ccc(cc1)C(F)F 527a_100000724931_100011735500 [0,2,0,0,0,0|1,1,0]=4 15440 B15R1.1222 O=C(NCCF)c1ccc(cc1)[N+](=O)[O-] 11a_100000724931_100000185811 [0,2,0,0,0,0|2,0,0]=4 15441 B15R1.1222 O=C(NCCF)c1ccc(cc1)[N+](=O)[O-] 1626a_100000724931_100000185811 [0,2,0,0,0,0|2,0,0]=4 15442 B15R1.1222 O=C(NCCF)c1ccc(cc1)[N+](=O)[O-] 240690a_100000724931_100000185811 [0,2,0,0,0,0|2,0,0]=4 15443 B15R1.1222 O=C(NCCF)c1ccc(cc1)[N+](=O)[O-] 527a_100000724931_100000185811 [0,2,0,0,0,0|2,0,0]=4 15444 B15R1.1222 O=C(NCCO)c1ccc(cc1)C(F)F 240690a_100000210304_100011735500 [0,2,0,0,0,0|0,1,0]=3 15445 B15R1.1222 O=C(NCCO)c1ccc(cc1)C(F)F 527a_100000210304_100011735500 [0,2,0,0,0,0|0,1,0]=3 15446 B15R1.1222 O=C(NCCO)c1ccc(cc1)[N+](=O)[O-] 240690a_100000210304_100000185811 [0,2,0,0,0,0|1,0,0]=3 15447 B15R1.1222 O=C(NCCO)c1ccc(cc1)[N+](=O)[O-] 527a_100000210304_100000185811 [0,2,0,0,0,0|1,0,0]=3 15448 B15R1.1222 O=C(NCCO)c1ccc(nc1)C(F)F 240690a_100000210304_100009846429 [0,2,0,0,0,0|1,1,0]=4 15449 B15R1.1222 O=C(NCCO)c1ccc(nc1)C(F)F 527a_100000210304_100009846429 [0,2,0,0,0,0|1,1,0]=4 15450 B15R1.1222 [13CH3]C(=O)c1ccc(cc1)C(=O)OCCO 1458a_100010260019_200025704644 [0,2,0,0,0,0|2,0,0]=4 15451 B15R1.1245 C#Cc1ccc(cc1C)C(=O)CCCO 1458a_100013243528_100011215043 [0,2,0,0,0,0|2,0,0]=4 15452 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCC 11a_100020643023_100013243528 [0,2,0,0,0,0|2,0,0]=4 15453 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCC 1626a_100020643023_100013243528 [0,2,0,0,0,0|2,0,0]=4 15454 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCC 527a_100020643023_100013243528 [0,2,0,0,0,0|2,0,0]=4 15455 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCF 11a_100000724931_100013243528 [0,2,0,0,0,0|2,0,0]=4 15456 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCF 1626a_100000724931_100013243528 [0,2,0,0,0,0|2,0,0]=4 15457 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCF 527a_100000724931_100013243528 [0,2,0,0,0,0|2,0,0]=4 15458 B15R1.1245 C#Cc1ccc(cc1C)C(=O)NCCO 527a_100000210304_100013243528 [0,2,0,0,0,0|1,0,0]=3 15459 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)CCCO 1458a_100014797261_100011215043 [0,2,0,0,0,0|2,0,0]=4 15460 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCC 11a_100020643023_100014797261 [0,2,0,0,0,0|2,0,0]=4 15461 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCC 1626a_100020643023_100014797261 [0,2,0,0,0,0|2,0,0]=4 15462 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCC 527a_100020643023_100014797261 [0,2,0,0,0,0|2,0,0]=4 15463 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCF 11a_100000724931_100014797261 [0,2,0,0,0,0|2,0,0]=4 15464 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCF 1626a_100000724931_100014797261 [0,2,0,0,0,0|2,0,0]=4 15465 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCF 527a_100000724931_100014797261 [0,2,0,0,0,0|2,0,0]=4 15466 B15R1.1245 C#Cc1ccc(cc1Cl)C(=O)NCCO 527a_100000210304_100014797261 [0,2,0,0,0,0|1,0,0]=3 15467 B15R1.1245 C=Cc1ccc(cc1C)C(=O)NCCC 271570a_100011290941_200012357430 [0,2,0,0,0,0|2,0,0]=4 15468 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)C#N 11a_100020643023_100012355661 [0,2,0,0,0,0|2,0,0]=4 15469 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)C#N 1626a_100020643023_100012355661 [0,2,0,0,0,0|2,0,0]=4 15470 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)C#N 240690a_100020643023_100012355661 [0,2,0,0,0,0|2,0,0]=4 15471 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)C#N 527a_100020643023_100012355661 [0,2,0,0,0,0|2,0,0]=4 15472 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)CC 11a_100020643023_100012340589 [0,2,0,0,0,0|2,0,0]=4 15473 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)CC 1626a_100020643023_100012340589 [0,2,0,0,0,0|2,0,0]=4 15474 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)CC 240690a_100020643023_100012340589 [0,2,0,0,0,0|2,0,0]=4 15475 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)CC 527a_100020643023_100012340589 [0,2,0,0,0,0|2,0,0]=4 15476 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 11a_100020643023_100000187947 [0,2,0,0,0,0|2,0,0]=4 15477 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 1626a_100020643023_100000187947 [0,2,0,0,0,0|2,0,0]=4 15478 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 240690a_100020643023_100000187947 [0,2,0,0,0,0|2,0,0]=4 15479 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 527a_100020643023_100000187947 [0,2,0,0,0,0|2,0,0]=4 15480 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)C#N 11a_100020643023_100012180287 [0,2,0,0,0,0|2,0,0]=4 15481 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)C#N 1626a_100020643023_100012180287 [0,2,0,0,0,0|2,0,0]=4 15482 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)C#N 240690a_100020643023_100012180287 [0,2,0,0,0,0|2,0,0]=4 15483 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)C#N 527a_100020643023_100012180287 [0,2,0,0,0,0|2,0,0]=4 15484 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)NC 2230a_100015183291_200000210301 [0,2,0,0,0,0|2,0,0]=4 15485 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)NC 27a_100102657272_200012357430 [0,2,0,0,0,0|2,0,0]=4 15486 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)NC 34a_100015183291_200000210301 [0,2,0,0,0,0|2,0,0]=4 15487 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)NC 7a_100015183291_200000210301 [0,2,0,0,0,0|2,0,0]=4 15488 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)N[13CH3] 2230a_100015183291_200025704644 [0,2,0,0,0,0|2,0,0]=4 15489 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)N[13CH3] 34a_100015183291_200025704644 [0,2,0,0,0,0|2,0,0]=4 15490 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)N[13CH3] 7a_100015183291_200025704644 [0,2,0,0,0,0|2,0,0]=4 15491 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 11a_100020643023_100011202886 [0,2,0,0,0,0|2,0,0]=4 15492 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 1626a_100020643023_100011202886 [0,2,0,0,0,0|2,0,0]=4 15493 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 240690a_100020643023_100011202886 [0,2,0,0,0,0|2,0,0]=4 15494 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 527a_100020643023_100011202886 [0,2,0,0,0,0|2,0,0]=4 15495 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200012357430 [0,2,0,0,0,0|2,0,0]=4 15496 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)SC 62a_200012357430_200000210301 [0,2,0,0,0,0|2,0,0]=4 15497 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200012357430_200025704644 [0,2,0,0,0,0|2,0,0]=4 15498 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200012357430 [0,2,0,0,0,0|2,0,0]=4 15499 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)C#N 11a_100020643023_100000694585 [0,2,0,0,0,0|2,0,0]=4 15500 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)C#N 1626a_100020643023_100000694585 [0,2,0,0,0,0|2,0,0]=4 15501 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)C#N 527a_100020643023_100000694585 [0,2,0,0,0,0|2,0,0]=4 15502 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 11a_100020643023_100000188346 [0,2,0,0,0,0|2,0,0]=4 15503 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 1626a_100020643023_100000188346 [0,2,0,0,0,0|2,0,0]=4 15504 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 240690a_100020643023_100000188346 [0,2,0,0,0,0|2,0,0]=4 15505 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 527a_100020643023_100000188346 [0,2,0,0,0,0|2,0,0]=4 15506 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)C#N 11a_100020643023_100011217213 [0,2,0,0,0,0|2,0,0]=4 15507 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)C#N 1626a_100020643023_100011217213 [0,2,0,0,0,0|2,0,0]=4 15508 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)C#N 527a_100020643023_100011217213 [0,2,0,0,0,0|2,0,0]=4 15509 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)CO 1626a_100020643023_100000687192 [0,2,0,0,0,0|2,0,0]=4 15510 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)CO 240690a_100020643023_100000687192 [0,2,0,0,0,0|2,0,0]=4 15511 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 11a_100020643023_100000186160 [0,2,0,0,0,0|2,0,0]=4 15512 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 1626a_100020643023_100000186160 [0,2,0,0,0,0|2,0,0]=4 15513 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 240690a_100020643023_100000186160 [0,2,0,0,0,0|2,0,0]=4 15514 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 527a_100020643023_100000186160 [0,2,0,0,0,0|2,0,0]=4 15515 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 11a_100020643023_100000188716 [0,2,0,0,0,0|2,0,0]=4 15516 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 1626a_100020643023_100000188716 [0,2,0,0,0,0|2,0,0]=4 15517 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 240690a_100020643023_100000188716 [0,2,0,0,0,0|2,0,0]=4 15518 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 527a_100020643023_100000188716 [0,2,0,0,0,0|2,0,0]=4 15519 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)CC 240690a_100020643023_100000089006 [0,2,0,0,0,0|2,0,0]=4 15520 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)CC 527a_100020643023_100000089006 [0,2,0,0,0,0|2,0,0]=4 15521 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)OC 240690a_100020643023_100000766810 [0,2,0,0,0,0|2,0,0]=4 15522 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)OC 527a_100020643023_100000766810 [0,2,0,0,0,0|2,0,0]=4 15523 B15R1.1245 CCc1ccc(cc1Br)C(=O)CCCO 1458a_100012340589_100011215043 [0,2,0,0,0,0|2,0,0]=4 15524 B15R1.1245 CCc1ccc(cc1Br)C(=O)NCCF 11a_100000724931_100012340589 [0,2,0,0,0,0|2,0,0]=4 15525 B15R1.1245 CCc1ccc(cc1Br)C(=O)NCCF 1626a_100000724931_100012340589 [0,2,0,0,0,0|2,0,0]=4 15526 B15R1.1245 CCc1ccc(cc1Br)C(=O)NCCF 240690a_100000724931_100012340589 [0,2,0,0,0,0|2,0,0]=4 15527 B15R1.1245 CCc1ccc(cc1Br)C(=O)NCCF 527a_100000724931_100012340589 [0,2,0,0,0,0|2,0,0]=4 15528 B15R1.1245 CCc1ccc(cc1Br)C(=O)NCCO 240690a_100000210304_100012340589 [0,2,0,0,0,0|1,0,0]=3 15529 B15R1.1245 CCc1ccc(cc1Br)C(=O)NCCO 527a_100000210304_100012340589 [0,2,0,0,0,0|1,0,0]=3 15530 B15R1.1245 CCc1ccc(cc1O)C(=O)CCCO 1458a_100000089006_100011215043 [0,2,0,0,0,0|2,0,0]=4 15531 B15R1.1245 CCc1ccc(cc1O)C(=O)NCCF 240690a_100000724931_100000089006 [0,2,0,0,0,0|2,0,0]=4 15532 B15R1.1245 CCc1ccc(cc1O)C(=O)NCCF 527a_100000724931_100000089006 [0,2,0,0,0,0|2,0,0]=4 15533 B15R1.1245 CCc1ccc(cc1O)C(=O)NCCO 240690a_100000210304_100000089006 [0,2,0,0,0,0|1,0,0]=3 15534 B15R1.1245 CCc1ccc(cc1O)C(=O)NCCO 527a_100000210304_100000089006 [0,2,0,0,0,0|1,0,0]=3 15535 B15R1.1245 COc1ccc(cc1Br)C(=O)CCCO 1458a_100000187947_100011215043 [0,2,0,0,0,0|2,0,0]=4 15536 B15R1.1245 COc1ccc(cc1Br)C(=O)NCCF 11a_100000724931_100000187947 [0,2,0,0,0,0|2,0,0]=4 15537 B15R1.1245 COc1ccc(cc1Br)C(=O)NCCF 1626a_100000724931_100000187947 [0,2,0,0,0,0|2,0,0]=4 15538 B15R1.1245 COc1ccc(cc1Br)C(=O)NCCF 240690a_100000724931_100000187947 [0,2,0,0,0,0|2,0,0]=4 15539 B15R1.1245 COc1ccc(cc1Br)C(=O)NCCF 527a_100000724931_100000187947 [0,2,0,0,0,0|2,0,0]=4 15540 B15R1.1245 COc1ccc(cc1Br)C(=O)NCCO 240690a_100000210304_100000187947 [0,2,0,0,0,0|1,0,0]=3 15541 B15R1.1245 COc1ccc(cc1Br)C(=O)NCCO 527a_100000210304_100000187947 [0,2,0,0,0,0|1,0,0]=3 15542 B15R1.1245 COc1ccc(cc1C)C(=O)CCCO 1458a_100011202886_100011215043 [0,2,0,0,0,0|2,0,0]=4 15543 B15R1.1245 COc1ccc(cc1C)C(=O)NCCF 11a_100000724931_100011202886 [0,2,0,0,0,0|2,0,0]=4 15544 B15R1.1245 COc1ccc(cc1C)C(=O)NCCF 1626a_100000724931_100011202886 [0,2,0,0,0,0|2,0,0]=4 15545 B15R1.1245 COc1ccc(cc1C)C(=O)NCCF 240690a_100000724931_100011202886 [0,2,0,0,0,0|2,0,0]=4 15546 B15R1.1245 COc1ccc(cc1C)C(=O)NCCF 527a_100000724931_100011202886 [0,2,0,0,0,0|2,0,0]=4 15547 B15R1.1245 COc1ccc(cc1C)C(=O)NCCO 240690a_100000210304_100011202886 [0,2,0,0,0,0|1,0,0]=3 15548 B15R1.1245 COc1ccc(cc1C)C(=O)NCCO 527a_100000210304_100011202886 [0,2,0,0,0,0|1,0,0]=3 15549 B15R1.1245 COc1ccc(cc1Cl)C(=O)CCCO 1458a_100000188346_100011215043 [0,2,0,0,0,0|2,0,0]=4 15550 B15R1.1245 COc1ccc(cc1Cl)C(=O)NCCF 11a_100000724931_100000188346 [0,2,0,0,0,0|2,0,0]=4 15551 B15R1.1245 COc1ccc(cc1Cl)C(=O)NCCF 1626a_100000724931_100000188346 [0,2,0,0,0,0|2,0,0]=4 15552 B15R1.1245 COc1ccc(cc1Cl)C(=O)NCCF 240690a_100000724931_100000188346 [0,2,0,0,0,0|2,0,0]=4 15553 B15R1.1245 COc1ccc(cc1Cl)C(=O)NCCF 527a_100000724931_100000188346 [0,2,0,0,0,0|2,0,0]=4 15554 B15R1.1245 COc1ccc(cc1Cl)C(=O)NCCO 240690a_100000210304_100000188346 [0,2,0,0,0,0|1,0,0]=3 15555 B15R1.1245 COc1ccc(cc1Cl)C(=O)NCCO 527a_100000210304_100000188346 [0,2,0,0,0,0|1,0,0]=3 15556 B15R1.1245 COc1ccc(cc1F)C(=O)CCCO 1458a_100000186160_100011215043 [0,2,0,0,0,0|2,0,0]=4 15557 B15R1.1245 COc1ccc(cc1F)C(=O)NCCF 11a_100000724931_100000186160 [0,2,0,0,0,0|2,0,0]=4 15558 B15R1.1245 COc1ccc(cc1F)C(=O)NCCF 1626a_100000724931_100000186160 [0,2,0,0,0,0|2,0,0]=4 15559 B15R1.1245 COc1ccc(cc1F)C(=O)NCCF 240690a_100000724931_100000186160 [0,2,0,0,0,0|2,0,0]=4 15560 B15R1.1245 COc1ccc(cc1F)C(=O)NCCF 527a_100000724931_100000186160 [0,2,0,0,0,0|2,0,0]=4 15561 B15R1.1245 COc1ccc(cc1F)C(=O)NCCO 240690a_100000210304_100000186160 [0,2,0,0,0,0|1,0,0]=3 15562 B15R1.1245 COc1ccc(cc1F)C(=O)NCCO 527a_100000210304_100000186160 [0,2,0,0,0,0|1,0,0]=3 15563 B15R1.1245 COc1ccc(cc1I)C(=O)CCCO 1458a_100000188716_100011215043 [0,2,0,0,0,0|2,0,0]=4 15564 B15R1.1245 COc1ccc(cc1I)C(=O)NCCF 11a_100000724931_100000188716 [0,2,0,0,0,0|2,0,0]=4 15565 B15R1.1245 COc1ccc(cc1I)C(=O)NCCF 1626a_100000724931_100000188716 [0,2,0,0,0,0|2,0,0]=4 15566 B15R1.1245 COc1ccc(cc1I)C(=O)NCCF 240690a_100000724931_100000188716 [0,2,0,0,0,0|2,0,0]=4 15567 B15R1.1245 COc1ccc(cc1I)C(=O)NCCF 527a_100000724931_100000188716 [0,2,0,0,0,0|2,0,0]=4 15568 B15R1.1245 COc1ccc(cc1I)C(=O)NCCO 240690a_100000210304_100000188716 [0,2,0,0,0,0|1,0,0]=3 15569 B15R1.1245 COc1ccc(cc1I)C(=O)NCCO 527a_100000210304_100000188716 [0,2,0,0,0,0|1,0,0]=3 15570 B15R1.1245 COc1ccc(cc1O)C(=O)CCCO 1458a_100000766810_100011215043 [0,2,0,0,0,0|2,0,0]=4 15571 B15R1.1245 COc1ccc(cc1O)C(=O)NCCF 240690a_100000724931_100000766810 [0,2,0,0,0,0|2,0,0]=4 15572 B15R1.1245 COc1ccc(cc1O)C(=O)NCCF 527a_100000724931_100000766810 [0,2,0,0,0,0|2,0,0]=4 15573 B15R1.1245 COc1ccc(cc1O)C(=O)NCCO 240690a_100000210304_100000766810 [0,2,0,0,0,0|1,0,0]=3 15574 B15R1.1245 COc1ccc(cc1O)C(=O)NCCO 527a_100000210304_100000766810 [0,2,0,0,0,0|1,0,0]=3 15575 B15R1.1245 Cc1cc(ccc1C#N)C(=O)CCCO 1458a_100012180287_100011215043 [0,2,0,0,0,0|2,0,0]=4 15576 B15R1.1245 Cc1cc(ccc1C#N)C(=O)NCCF 11a_100000724931_100012180287 [0,2,0,0,0,0|2,0,0]=4 15577 B15R1.1245 Cc1cc(ccc1C#N)C(=O)NCCF 1626a_100000724931_100012180287 [0,2,0,0,0,0|2,0,0]=4 15578 B15R1.1245 Cc1cc(ccc1C#N)C(=O)NCCF 240690a_100000724931_100012180287 [0,2,0,0,0,0|2,0,0]=4 15579 B15R1.1245 Cc1cc(ccc1C#N)C(=O)NCCF 527a_100000724931_100012180287 [0,2,0,0,0,0|2,0,0]=4 15580 B15R1.1245 Cc1cc(ccc1C#N)C(=O)NCCO 240690a_100000210304_100012180287 [0,2,0,0,0,0|1,0,0]=3 15581 B15R1.1245 Cc1cc(ccc1C#N)C(=O)NCCO 527a_100000210304_100012180287 [0,2,0,0,0,0|1,0,0]=3 15582 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)CCCO 1458a_100012355661_100011215043 [0,2,0,0,0,0|2,0,0]=4 15583 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)NCCF 11a_100000724931_100012355661 [0,2,0,0,0,0|2,0,0]=4 15584 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)NCCF 1626a_100000724931_100012355661 [0,2,0,0,0,0|2,0,0]=4 15585 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)NCCF 240690a_100000724931_100012355661 [0,2,0,0,0,0|2,0,0]=4 15586 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)NCCF 527a_100000724931_100012355661 [0,2,0,0,0,0|2,0,0]=4 15587 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)NCCO 240690a_100000210304_100012355661 [0,2,0,0,0,0|1,0,0]=3 15588 B15R1.1245 N#Cc1ccc(cc1Br)C(=O)NCCO 527a_100000210304_100012355661 [0,2,0,0,0,0|1,0,0]=3 15589 B15R1.1245 N#Cc1ccc(cc1Cl)C(=O)CCCO 1458a_100000694585_100011215043 [0,2,0,0,0,0|2,0,0]=4 15590 B15R1.1245 N#Cc1ccc(cc1Cl)C(=O)NCCF 11a_100000724931_100000694585 [0,2,0,0,0,0|2,0,0]=4 15591 B15R1.1245 N#Cc1ccc(cc1Cl)C(=O)NCCF 1626a_100000724931_100000694585 [0,2,0,0,0,0|2,0,0]=4 15592 B15R1.1245 N#Cc1ccc(cc1Cl)C(=O)NCCF 527a_100000724931_100000694585 [0,2,0,0,0,0|2,0,0]=4 15593 B15R1.1245 N#Cc1ccc(cc1Cl)C(=O)NCCO 527a_100000210304_100000694585 [0,2,0,0,0,0|1,0,0]=3 15594 B15R1.1245 N#Cc1ccc(cc1F)C(=O)CCCO 1458a_100011217213_100011215043 [0,2,0,0,0,0|2,0,0]=4 15595 B15R1.1245 N#Cc1ccc(cc1F)C(=O)NCCF 11a_100000724931_100011217213 [0,2,0,0,0,0|2,0,0]=4 15596 B15R1.1245 N#Cc1ccc(cc1F)C(=O)NCCF 1626a_100000724931_100011217213 [0,2,0,0,0,0|2,0,0]=4 15597 B15R1.1245 N#Cc1ccc(cc1F)C(=O)NCCF 527a_100000724931_100011217213 [0,2,0,0,0,0|2,0,0]=4 15598 B15R1.1245 N#Cc1ccc(cc1F)C(=O)NCCO 527a_100000210304_100011217213 [0,2,0,0,0,0|1,0,0]=3 15599 B15R1.1245 O=C(CCCO)c1ccc(c(c1)F)CO 1458a_100000687192_100011215043 [0,2,0,0,0,0|2,0,0]=4 15600 B15R1.1245 O=C(NCCF)c1ccc(c(c1)F)CO 1626a_100000724931_100000687192 [0,2,0,0,0,0|2,0,0]=4 15601 B15R1.1245 O=C(NCCF)c1ccc(c(c1)F)CO 240690a_100000724931_100000687192 [0,2,0,0,0,0|2,0,0]=4 15602 B15R1.1245 O=C(NCCO)c1ccc(c(c1)F)CO 240690a_100000210304_100000687192 [0,2,0,0,0,0|1,0,0]=3 15603 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100103168756_100011215043 [0,2,0,0,0,0|2,0,0]=4 15604 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCC 11a_100020643023_100103168756 [0,2,0,0,0,0|2,0,0]=4 15605 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCC 1626a_100020643023_100103168756 [0,2,0,0,0,0|2,0,0]=4 15606 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCC 240690a_100020643023_100103168756 [0,2,0,0,0,0|2,0,0]=4 15607 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCC 527a_100020643023_100103168756 [0,2,0,0,0,0|2,0,0]=4 15608 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCF 11a_100000724931_100103168756 [0,2,0,0,0,0|2,0,0]=4 15609 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCF 1626a_100000724931_100103168756 [0,2,0,0,0,0|2,0,0]=4 15610 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCF 240690a_100000724931_100103168756 [0,2,0,0,0,0|2,0,0]=4 15611 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCF 527a_100000724931_100103168756 [0,2,0,0,0,0|2,0,0]=4 15612 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCO 240690a_100000210304_100103168756 [0,2,0,0,0,0|1,0,0]=3 15613 B15R1.2314 C#Cc1ccc(c(c1)Cl)C(=O)NCCO 527a_100000210304_100103168756 [0,2,0,0,0,0|1,0,0]=3 15614 B15R1.2314 C=Cc1ccc(c(c1)F)C(=O)NCCC 271570a_100011290941_200000215516 [0,2,0,0,0,0|2,0,0]=4 15615 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)C#N 11a_100020643023_100010244945 [0,2,0,0,0,0|2,0,0]=4 15616 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)C#N 1626a_100020643023_100010244945 [0,2,0,0,0,0|2,0,0]=4 15617 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)C#N 240690a_100020643023_100010244945 [0,2,0,0,0,0|2,0,0]=4 15618 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)C#N 527a_100020643023_100010244945 [0,2,0,0,0,0|2,0,0]=4 15619 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)OC 11a_100020643023_100000748873 [0,2,0,0,0,0|2,0,0]=4 15620 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)OC 1626a_100020643023_100000748873 [0,2,0,0,0,0|2,0,0]=4 15621 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)OC 240690a_100020643023_100000748873 [0,2,0,0,0,0|2,0,0]=4 15622 B15R1.2314 CCCNC(=O)c1ccc(cc1Br)OC 527a_100020643023_100000748873 [0,2,0,0,0,0|2,0,0]=4 15623 B15R1.2314 CCCNC(=O)c1ccc(cc1C)C#N 11a_100020643023_100000691869 [0,2,0,0,0,0|2,0,0]=4 15624 B15R1.2314 CCCNC(=O)c1ccc(cc1C)C#N 1626a_100020643023_100000691869 [0,2,0,0,0,0|2,0,0]=4 15625 B15R1.2314 CCCNC(=O)c1ccc(cc1C)C#N 240690a_100020643023_100000691869 [0,2,0,0,0,0|2,0,0]=4 15626 B15R1.2314 CCCNC(=O)c1ccc(cc1C)C#N 527a_100020643023_100000691869 [0,2,0,0,0,0|2,0,0]=4 15627 B15R1.2314 CCCNC(=O)c1ccc(cc1C)OC 11a_100020643023_100000763155 [0,2,0,0,0,0|2,0,0]=4 15628 B15R1.2314 CCCNC(=O)c1ccc(cc1C)OC 1626a_100020643023_100000763155 [0,2,0,0,0,0|2,0,0]=4 15629 B15R1.2314 CCCNC(=O)c1ccc(cc1C)OC 240690a_100020643023_100000763155 [0,2,0,0,0,0|2,0,0]=4 15630 B15R1.2314 CCCNC(=O)c1ccc(cc1C)OC 527a_100020643023_100000763155 [0,2,0,0,0,0|2,0,0]=4 15631 B15R1.2314 CCCNC(=O)c1ccc(cc1C)SC 11a_100020643023_100012278374 [0,2,0,0,0,0|2,0,0]=4 15632 B15R1.2314 CCCNC(=O)c1ccc(cc1C)SC 1626a_100020643023_100012278374 [0,2,0,0,0,0|2,0,0]=4 15633 B15R1.2314 CCCNC(=O)c1ccc(cc1C)SC 240690a_100020643023_100012278374 [0,2,0,0,0,0|2,0,0]=4 15634 B15R1.2314 CCCNC(=O)c1ccc(cc1C)SC 527a_100020643023_100012278374 [0,2,0,0,0,0|2,0,0]=4 15635 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)C#N 11a_100020643023_100000100588 [0,2,0,0,0,0|2,0,0]=4 15636 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)C#N 1626a_100020643023_100000100588 [0,2,0,0,0,0|2,0,0]=4 15637 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)C#N 240690a_100020643023_100000100588 [0,2,0,0,0,0|2,0,0]=4 15638 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)C#N 527a_100020643023_100000100588 [0,2,0,0,0,0|2,0,0]=4 15639 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)CO 240690a_100020643023_100015659073 [0,2,0,0,0,0|2,0,0]=4 15640 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)NC 34a_100000744289_200000210301 [0,2,0,0,0,0|2,0,0]=4 15641 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)NC 7a_100000744289_200000210301 [0,2,0,0,0,0|2,0,0]=4 15642 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)N[13CH3] 34a_100000744289_200025704644 [0,2,0,0,0,0|2,0,0]=4 15643 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)N[13CH3] 7a_100000744289_200025704644 [0,2,0,0,0,0|2,0,0]=4 15644 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)OC 11a_100020643023_100000753557 [0,2,0,0,0,0|2,0,0]=4 15645 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)OC 1626a_100020643023_100000753557 [0,2,0,0,0,0|2,0,0]=4 15646 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)OC 240690a_100020643023_100000753557 [0,2,0,0,0,0|2,0,0]=4 15647 B15R1.2314 CCCNC(=O)c1ccc(cc1Cl)OC 527a_100020643023_100000753557 [0,2,0,0,0,0|2,0,0]=4 15648 B15R1.2314 CCCNC(=O)c1ccc(cc1F)C#N 11a_100020643023_100000238375 [0,2,0,0,0,0|2,0,0]=4 15649 B15R1.2314 CCCNC(=O)c1ccc(cc1F)C#N 1626a_100020643023_100000238375 [0,2,0,0,0,0|2,0,0]=4 15650 B15R1.2314 CCCNC(=O)c1ccc(cc1F)C#N 240690a_100020643023_100000238375 [0,2,0,0,0,0|2,0,0]=4 15651 B15R1.2314 CCCNC(=O)c1ccc(cc1F)C#N 527a_100020643023_100000238375 [0,2,0,0,0,0|2,0,0]=4 15652 B15R1.2314 CCCNC(=O)c1ccc(cc1F)CC 11a_100020643023_200009867912 [0,2,0,0,0,0|2,0,0]=4 15653 B15R1.2314 CCCNC(=O)c1ccc(cc1F)CC 1626a_100020643023_200009867912 [0,2,0,0,0,0|2,0,0]=4 15654 B15R1.2314 CCCNC(=O)c1ccc(cc1F)CC 240690a_100020643023_200009867912 [0,2,0,0,0,0|2,0,0]=4 15655 B15R1.2314 CCCNC(=O)c1ccc(cc1F)CC 527a_100020643023_200009867912 [0,2,0,0,0,0|2,0,0]=4 15656 B15R1.2314 CCCNC(=O)c1ccc(cc1F)CO 240690a_100020643023_100011934814 [0,2,0,0,0,0|2,0,0]=4 15657 B15R1.2314 CCCNC(=O)c1ccc(cc1F)NC 27a_100102657272_200000215516 [0,2,0,0,0,0|2,0,0]=4 15658 B15R1.2314 CCCNC(=O)c1ccc(cc1F)OC 11a_100020643023_100000198494 [0,2,0,0,0,0|2,0,0]=4 15659 B15R1.2314 CCCNC(=O)c1ccc(cc1F)OC 1626a_100020643023_100000198494 [0,2,0,0,0,0|2,0,0]=4 15660 B15R1.2314 CCCNC(=O)c1ccc(cc1F)OC 240690a_100020643023_100000198494 [0,2,0,0,0,0|2,0,0]=4 15661 B15R1.2314 CCCNC(=O)c1ccc(cc1F)OC 527a_100020643023_100000198494 [0,2,0,0,0,0|2,0,0]=4 15662 B15R1.2314 CCCNC(=O)c1ccc(cc1F)SC 62a_200000210301_200000215516 [0,2,0,0,0,0|2,0,0]=4 15663 B15R1.2314 CCCNC(=O)c1ccc(cc1F)SC 62a_200000215516_200000210301 [0,2,0,0,0,0|2,0,0]=4 15664 B15R1.2314 CCCNC(=O)c1ccc(cc1F)S[13CH3] 62a_200000215516_200025704644 [0,2,0,0,0,0|2,0,0]=4 15665 B15R1.2314 CCCNC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_200000215516 [0,2,0,0,0,0|2,0,0]=4 15666 B15R1.2314 CCCNC(=O)c1ccc(cc1I)OC 11a_100020643023_100000688016 [0,2,0,0,0,0|2,0,0]=4 15667 B15R1.2314 CCCNC(=O)c1ccc(cc1I)OC 1626a_100020643023_100000688016 [0,2,0,0,0,0|2,0,0]=4 15668 B15R1.2314 CCCNC(=O)c1ccc(cc1I)OC 240690a_100020643023_100000688016 [0,2,0,0,0,0|2,0,0]=4 15669 B15R1.2314 CCCNC(=O)c1ccc(cc1I)OC 527a_100020643023_100000688016 [0,2,0,0,0,0|2,0,0]=4 15670 B15R1.2314 CCCNC(=O)c1ccc(cc1O)OC 11a_100020643023_100000212123 [0,2,0,0,0,0|2,0,0]=4 15671 B15R1.2314 CCCNC(=O)c1ccc(cc1O)OC 240690a_100020643023_100000212123 [0,2,0,0,0,0|2,0,0]=4 15672 B15R1.2314 CCCNC(=O)c1ccc(cc1O)OC 527a_100020643023_100000212123 [0,2,0,0,0,0|2,0,0]=4 15673 B15R1.2314 CCc1ccc(c(c1)F)C(=O)CCCO 1458a_200009867912_100011215043 [0,2,0,0,0,0|2,0,0]=4 15674 B15R1.2314 CCc1ccc(c(c1)F)C(=O)NCCF 11a_100000724931_200009867912 [0,2,0,0,0,0|2,0,0]=4 15675 B15R1.2314 CCc1ccc(c(c1)F)C(=O)NCCF 1626a_100000724931_200009867912 [0,2,0,0,0,0|2,0,0]=4 15676 B15R1.2314 CCc1ccc(c(c1)F)C(=O)NCCF 240690a_100000724931_200009867912 [0,2,0,0,0,0|2,0,0]=4 15677 B15R1.2314 CCc1ccc(c(c1)F)C(=O)NCCF 527a_100000724931_200009867912 [0,2,0,0,0,0|2,0,0]=4 15678 B15R1.2314 CCc1ccc(c(c1)F)C(=O)NCCO 240690a_100000210304_200009867912 [0,2,0,0,0,0|1,0,0]=3 15679 B15R1.2314 CCc1ccc(c(c1)F)C(=O)NCCO 527a_100000210304_200009867912 [0,2,0,0,0,0|1,0,0]=3 15680 B15R1.2314 CNc1ccc(c(c1)Cl)C(=O)NCCO 34a_100000725507_200000210301 [0,2,0,0,0,0|1,0,0]=3 15681 B15R1.2314 CNc1ccc(c(c1)Cl)C(=O)NCCO 7a_100000725507_200000210301 [0,2,0,0,0,0|1,0,0]=3 15682 B15R1.2314 COc1ccc(c(c1)Br)C(=O)CCCO 1458a_100000748873_100011215043 [0,2,0,0,0,0|2,0,0]=4 15683 B15R1.2314 COc1ccc(c(c1)Br)C(=O)NCCF 11a_100000724931_100000748873 [0,2,0,0,0,0|2,0,0]=4 15684 B15R1.2314 COc1ccc(c(c1)Br)C(=O)NCCF 1626a_100000724931_100000748873 [0,2,0,0,0,0|2,0,0]=4 15685 B15R1.2314 COc1ccc(c(c1)Br)C(=O)NCCF 240690a_100000724931_100000748873 [0,2,0,0,0,0|2,0,0]=4 15686 B15R1.2314 COc1ccc(c(c1)Br)C(=O)NCCF 527a_100000724931_100000748873 [0,2,0,0,0,0|2,0,0]=4 15687 B15R1.2314 COc1ccc(c(c1)Br)C(=O)NCCO 240690a_100000210304_100000748873 [0,2,0,0,0,0|1,0,0]=3 15688 B15R1.2314 COc1ccc(c(c1)Br)C(=O)NCCO 527a_100000210304_100000748873 [0,2,0,0,0,0|1,0,0]=3 15689 B15R1.2314 COc1ccc(c(c1)C)C(=O)CCCO 1458a_100000763155_100011215043 [0,2,0,0,0,0|2,0,0]=4 15690 B15R1.2314 COc1ccc(c(c1)C)C(=O)NCCF 11a_100000724931_100000763155 [0,2,0,0,0,0|2,0,0]=4 15691 B15R1.2314 COc1ccc(c(c1)C)C(=O)NCCF 1626a_100000724931_100000763155 [0,2,0,0,0,0|2,0,0]=4 15692 B15R1.2314 COc1ccc(c(c1)C)C(=O)NCCF 240690a_100000724931_100000763155 [0,2,0,0,0,0|2,0,0]=4 15693 B15R1.2314 COc1ccc(c(c1)C)C(=O)NCCF 527a_100000724931_100000763155 [0,2,0,0,0,0|2,0,0]=4 15694 B15R1.2314 COc1ccc(c(c1)C)C(=O)NCCO 240690a_100000210304_100000763155 [0,2,0,0,0,0|1,0,0]=3 15695 B15R1.2314 COc1ccc(c(c1)C)C(=O)NCCO 527a_100000210304_100000763155 [0,2,0,0,0,0|1,0,0]=3 15696 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100000753557_100011215043 [0,2,0,0,0,0|2,0,0]=4 15697 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)NCCF 11a_100000724931_100000753557 [0,2,0,0,0,0|2,0,0]=4 15698 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)NCCF 1626a_100000724931_100000753557 [0,2,0,0,0,0|2,0,0]=4 15699 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)NCCF 240690a_100000724931_100000753557 [0,2,0,0,0,0|2,0,0]=4 15700 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)NCCF 527a_100000724931_100000753557 [0,2,0,0,0,0|2,0,0]=4 15701 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)NCCO 240690a_100000210304_100000753557 [0,2,0,0,0,0|1,0,0]=3 15702 B15R1.2314 COc1ccc(c(c1)Cl)C(=O)NCCO 527a_100000210304_100000753557 [0,2,0,0,0,0|1,0,0]=3 15703 B15R1.2314 COc1ccc(c(c1)F)C(=O)CCCO 1458a_100000198494_100011215043 [0,2,0,0,0,0|2,0,0]=4 15704 B15R1.2314 COc1ccc(c(c1)F)C(=O)NCCF 11a_100000724931_100000198494 [0,2,0,0,0,0|2,0,0]=4 15705 B15R1.2314 COc1ccc(c(c1)F)C(=O)NCCF 1626a_100000724931_100000198494 [0,2,0,0,0,0|2,0,0]=4 15706 B15R1.2314 COc1ccc(c(c1)F)C(=O)NCCF 240690a_100000724931_100000198494 [0,2,0,0,0,0|2,0,0]=4 15707 B15R1.2314 COc1ccc(c(c1)F)C(=O)NCCF 527a_100000724931_100000198494 [0,2,0,0,0,0|2,0,0]=4 15708 B15R1.2314 COc1ccc(c(c1)F)C(=O)NCCO 240690a_100000210304_100000198494 [0,2,0,0,0,0|1,0,0]=3 15709 B15R1.2314 COc1ccc(c(c1)F)C(=O)NCCO 527a_100000210304_100000198494 [0,2,0,0,0,0|1,0,0]=3 15710 B15R1.2314 COc1ccc(c(c1)I)C(=O)CCCO 1458a_100000688016_100011215043 [0,2,0,0,0,0|2,0,0]=4 15711 B15R1.2314 COc1ccc(c(c1)I)C(=O)NCCF 11a_100000724931_100000688016 [0,2,0,0,0,0|2,0,0]=4 15712 B15R1.2314 COc1ccc(c(c1)I)C(=O)NCCF 1626a_100000724931_100000688016 [0,2,0,0,0,0|2,0,0]=4 15713 B15R1.2314 COc1ccc(c(c1)I)C(=O)NCCF 240690a_100000724931_100000688016 [0,2,0,0,0,0|2,0,0]=4 15714 B15R1.2314 COc1ccc(c(c1)I)C(=O)NCCF 527a_100000724931_100000688016 [0,2,0,0,0,0|2,0,0]=4 15715 B15R1.2314 COc1ccc(c(c1)I)C(=O)NCCO 240690a_100000210304_100000688016 [0,2,0,0,0,0|1,0,0]=3 15716 B15R1.2314 COc1ccc(c(c1)I)C(=O)NCCO 527a_100000210304_100000688016 [0,2,0,0,0,0|1,0,0]=3 15717 B15R1.2314 COc1ccc(c(c1)O)C(=O)CCCO 1458a_100000212123_100011215043 [0,2,0,0,0,0|2,0,0]=4 15718 B15R1.2314 COc1ccc(c(c1)O)C(=O)NCCF 11a_100000724931_100000212123 [0,2,0,0,0,0|2,0,0]=4 15719 B15R1.2314 COc1ccc(c(c1)O)C(=O)NCCF 240690a_100000724931_100000212123 [0,2,0,0,0,0|2,0,0]=4 15720 B15R1.2314 COc1ccc(c(c1)O)C(=O)NCCF 527a_100000724931_100000212123 [0,2,0,0,0,0|2,0,0]=4 15721 B15R1.2314 COc1ccc(c(c1)O)C(=O)NCCO 240690a_100000210304_100000212123 [0,2,0,0,0,0|1,0,0]=3 15722 B15R1.2314 COc1ccc(c(c1)O)C(=O)NCCO 527a_100000210304_100000212123 [0,2,0,0,0,0|1,0,0]=3 15723 B15R1.2314 CSc1ccc(c(c1)C)C(=O)CCCO 1458a_100012278374_100011215043 [0,2,0,0,0,0|2,0,0]=4 15724 B15R1.2314 CSc1ccc(c(c1)C)C(=O)NCCF 11a_100000724931_100012278374 [0,2,0,0,0,0|2,0,0]=4 15725 B15R1.2314 CSc1ccc(c(c1)C)C(=O)NCCF 1626a_100000724931_100012278374 [0,2,0,0,0,0|2,0,0]=4 15726 B15R1.2314 CSc1ccc(c(c1)C)C(=O)NCCF 240690a_100000724931_100012278374 [0,2,0,0,0,0|2,0,0]=4 15727 B15R1.2314 CSc1ccc(c(c1)C)C(=O)NCCF 527a_100000724931_100012278374 [0,2,0,0,0,0|2,0,0]=4 15728 B15R1.2314 CSc1ccc(c(c1)C)C(=O)NCCO 240690a_100000210304_100012278374 [0,2,0,0,0,0|1,0,0]=3 15729 B15R1.2314 CSc1ccc(c(c1)C)C(=O)NCCO 527a_100000210304_100012278374 [0,2,0,0,0,0|1,0,0]=3 15730 B15R1.2314 Cc1cc(ccc1C(=O)CCCO)C#N 1458a_100000691869_100011215043 [0,2,0,0,0,0|2,0,0]=4 15731 B15R1.2314 Cc1cc(ccc1C(=O)NCCF)C#N 11a_100000724931_100000691869 [0,2,0,0,0,0|2,0,0]=4 15732 B15R1.2314 Cc1cc(ccc1C(=O)NCCF)C#N 1626a_100000724931_100000691869 [0,2,0,0,0,0|2,0,0]=4 15733 B15R1.2314 Cc1cc(ccc1C(=O)NCCF)C#N 240690a_100000724931_100000691869 [0,2,0,0,0,0|2,0,0]=4 15734 B15R1.2314 Cc1cc(ccc1C(=O)NCCF)C#N 527a_100000724931_100000691869 [0,2,0,0,0,0|2,0,0]=4 15735 B15R1.2314 Cc1cc(ccc1C(=O)NCCO)C#N 240690a_100000210304_100000691869 [0,2,0,0,0,0|1,0,0]=3 15736 B15R1.2314 Cc1cc(ccc1C(=O)NCCO)C#N 527a_100000210304_100000691869 [0,2,0,0,0,0|1,0,0]=3 15737 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)CCCO 1458a_100010244945_100011215043 [0,2,0,0,0,0|2,0,0]=4 15738 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)NCCF 11a_100000724931_100010244945 [0,2,0,0,0,0|2,0,0]=4 15739 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)NCCF 1626a_100000724931_100010244945 [0,2,0,0,0,0|2,0,0]=4 15740 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)NCCF 240690a_100000724931_100010244945 [0,2,0,0,0,0|2,0,0]=4 15741 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)NCCF 527a_100000724931_100010244945 [0,2,0,0,0,0|2,0,0]=4 15742 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)NCCO 240690a_100000210304_100010244945 [0,2,0,0,0,0|1,0,0]=3 15743 B15R1.2314 N#Cc1ccc(c(c1)Br)C(=O)NCCO 527a_100000210304_100010244945 [0,2,0,0,0,0|1,0,0]=3 15744 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)CCCO 1458a_100000100588_100011215043 [0,2,0,0,0,0|2,0,0]=4 15745 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)NCCF 11a_100000724931_100000100588 [0,2,0,0,0,0|2,0,0]=4 15746 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)NCCF 1626a_100000724931_100000100588 [0,2,0,0,0,0|2,0,0]=4 15747 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)NCCF 240690a_100000724931_100000100588 [0,2,0,0,0,0|2,0,0]=4 15748 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)NCCF 527a_100000724931_100000100588 [0,2,0,0,0,0|2,0,0]=4 15749 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)NCCO 240690a_100000210304_100000100588 [0,2,0,0,0,0|1,0,0]=3 15750 B15R1.2314 N#Cc1ccc(c(c1)Cl)C(=O)NCCO 527a_100000210304_100000100588 [0,2,0,0,0,0|1,0,0]=3 15751 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)CCCO 1458a_100000238375_100011215043 [0,2,0,0,0,0|2,0,0]=4 15752 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)NCCF 11a_100000724931_100000238375 [0,2,0,0,0,0|2,0,0]=4 15753 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)NCCF 1626a_100000724931_100000238375 [0,2,0,0,0,0|2,0,0]=4 15754 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)NCCF 240690a_100000724931_100000238375 [0,2,0,0,0,0|2,0,0]=4 15755 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)NCCF 527a_100000724931_100000238375 [0,2,0,0,0,0|2,0,0]=4 15756 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)NCCO 240690a_100000210304_100000238375 [0,2,0,0,0,0|1,0,0]=3 15757 B15R1.2314 N#Cc1ccc(c(c1)F)C(=O)NCCO 527a_100000210304_100000238375 [0,2,0,0,0,0|1,0,0]=3 15758 B15R1.2314 O=C(CCCO)c1ccc(cc1Cl)CO 1458a_100015659073_100011215043 [0,2,0,0,0,0|2,0,0]=4 15759 B15R1.2314 O=C(CCCO)c1ccc(cc1F)CO 1458a_100011934814_100011215043 [0,2,0,0,0,0|2,0,0]=4 15760 B15R1.2314 O=C(NCCF)c1ccc(cc1Cl)CO 240690a_100000724931_100015659073 [0,2,0,0,0,0|2,0,0]=4 15761 B15R1.2314 O=C(NCCF)c1ccc(cc1F)CO 240690a_100000724931_100011934814 [0,2,0,0,0,0|2,0,0]=4 15762 B15R1.2314 O=C(NCCO)c1ccc(cc1Cl)CO 240690a_100000210304_100015659073 [0,2,0,0,0,0|1,0,0]=3 15763 B15R1.2314 O=C(NCCO)c1ccc(cc1F)CO 240690a_100000210304_100011934814 [0,2,0,0,0,0|1,0,0]=3 15764 B15R1.2314 [13CH3]Nc1ccc(c(c1)Cl)C(=O)NCCO 34a_100000725507_200025704644 [0,2,0,0,0,0|1,0,0]=3 15765 B15R1.2314 [13CH3]Nc1ccc(c(c1)Cl)C(=O)NCCO 7a_100000725507_200025704644 [0,2,0,0,0,0|1,0,0]=3 15766 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)C#N)Cl 11a_100000212058_100000696165 [0,2,0,0,0,0|1,0,1]=4 15767 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)C#N)Cl 1626a_100000212058_100000696165 [0,2,0,0,0,0|1,0,1]=4 15768 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)C#N)Cl 240690a_100000212058_100000696165 [0,2,0,0,0,0|1,0,1]=4 15769 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)C#N)Cl 527a_100000212058_100000696165 [0,2,0,0,0,0|1,0,1]=4 15770 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)CC)Cl 11a_100000212058_100000102533 [0,2,0,0,0,0|1,0,1]=4 15771 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)CC)Cl 1626a_100000212058_100000102533 [0,2,0,0,0,0|1,0,1]=4 15772 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)CC)Cl 240690a_100000212058_100000102533 [0,2,0,0,0,0|1,0,1]=4 15773 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)CC)Cl 527a_100000212058_100000102533 [0,2,0,0,0,0|1,0,1]=4 15774 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)OC)Cl 11a_100000212058_100000181799 [0,2,0,0,0,0|1,0,1]=4 15775 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)OC)Cl 1626a_100000212058_100000181799 [0,2,0,0,0,0|1,0,1]=4 15776 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)OC)Cl 240690a_100000212058_100000181799 [0,2,0,0,0,0|1,0,1]=4 15777 B15R1.1243 C#CCNC(=O)c1ccc(c(c1)OC)Cl 527a_100000212058_100000181799 [0,2,0,0,0,0|1,0,1]=4 15778 B15R1.1243 C#Cc1cc(ccc1C)C(=O)CCCO 1458a_200012278110_100011215043 [0,2,0,0,0,0|2,0,0]=4 15779 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCC 11a_100020643023_200012278110 [0,2,0,0,0,0|2,0,0]=4 15780 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCC 1626a_100020643023_200012278110 [0,2,0,0,0,0|2,0,0]=4 15781 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCC 527a_100020643023_200012278110 [0,2,0,0,0,0|2,0,0]=4 15782 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCF 11a_100000724931_200012278110 [0,2,0,0,0,0|2,0,0]=4 15783 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCF 1626a_100000724931_200012278110 [0,2,0,0,0,0|2,0,0]=4 15784 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCF 527a_100000724931_200012278110 [0,2,0,0,0,0|2,0,0]=4 15785 B15R1.1243 C#Cc1cc(ccc1C)C(=O)NCCO 527a_100000210304_200012278110 [0,2,0,0,0,0|1,0,0]=3 15786 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)C#N)Cl 1626a_100020586998_100000696165 [0,2,0,0,0,0|1,0,1]=4 15787 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)C#N)Cl 240690a_100020586998_100000696165 [0,2,0,0,0,0|1,0,1]=4 15788 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)C#N)Cl 527a_100020586998_100000696165 [0,2,0,0,0,0|1,0,1]=4 15789 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)CC)Cl 1626a_100020586998_100000102533 [0,2,0,0,0,0|1,0,1]=4 15790 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)CC)Cl 240690a_100020586998_100000102533 [0,2,0,0,0,0|1,0,1]=4 15791 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)CC)Cl 527a_100020586998_100000102533 [0,2,0,0,0,0|1,0,1]=4 15792 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)OC)Cl 1626a_100020586998_100000181799 [0,2,0,0,0,0|1,0,1]=4 15793 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)OC)Cl 240690a_100020586998_100000181799 [0,2,0,0,0,0|1,0,1]=4 15794 B15R1.1243 C=CCNC(=O)c1ccc(c(c1)OC)Cl 527a_100020586998_100000181799 [0,2,0,0,0,0|1,0,1]=4 15795 B15R1.1243 C=Cc1cc(ccc1F)C(=O)NCCC 271570a_100011290941_200012359901 [0,2,0,0,0,0|1,1,0]=4 15796 B15R1.1243 CCCCC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_100000210211 [0,2,0,0,0,0|2,0,0]=4 15797 B15R1.1243 CCCCC(=O)c1ccc(c(c1)CC)Cl 1458a_100000102533_100000210211 [0,2,0,0,0,0|2,0,0]=4 15798 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210211 [0,2,0,0,0,0|2,0,0]=4 15799 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Br 11a_100020643023_100010253904 [0,2,0,0,0,0|1,1,0]=4 15800 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Br 1626a_100020643023_100010253904 [0,2,0,0,0,0|1,1,0]=4 15801 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Br 240690a_100020643023_100010253904 [0,2,0,0,0,0|1,1,0]=4 15802 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Br 527a_100020643023_100010253904 [0,2,0,0,0,0|1,1,0]=4 15803 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Cl 11a_100020643023_100000696165 [0,2,0,0,0,0|1,0,0]=3 15804 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Cl 1626a_100020643023_100000696165 [0,2,0,0,0,0|1,0,0]=3 15805 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Cl 240690a_100020643023_100000696165 [0,2,0,0,0,0|1,0,0]=3 15806 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)Cl 527a_100020643023_100000696165 [0,2,0,0,0,0|1,0,0]=3 15807 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)F 11a_100020643023_100000697239 [0,2,0,0,0,0|1,1,0]=4 15808 B15R1.1243 CCCNC(=O)c1ccc(c(c1)C#N)F 1626a_100020643023_100000697239 [0,2,0,0,0,0|1,1,0]=4 15809 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Br 11a_100020643023_100010152358 [0,2,0,0,0,0|1,1,0]=4 15810 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Br 1626a_100020643023_100010152358 [0,2,0,0,0,0|1,1,0]=4 15811 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Br 240690a_100020643023_100010152358 [0,2,0,0,0,0|1,1,0]=4 15812 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Br 527a_100020643023_100010152358 [0,2,0,0,0,0|1,1,0]=4 15813 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Cl 11a_100020643023_100000102533 [0,2,0,0,0,0|1,0,0]=3 15814 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Cl 1626a_100020643023_100000102533 [0,2,0,0,0,0|1,0,0]=3 15815 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Cl 240690a_100020643023_100000102533 [0,2,0,0,0,0|1,0,0]=3 15816 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)Cl 527a_100020643023_100000102533 [0,2,0,0,0,0|1,0,0]=3 15817 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)F 11a_100020643023_100009883079 [0,2,0,0,0,0|1,1,0]=4 15818 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)F 1626a_100020643023_100009883079 [0,2,0,0,0,0|1,1,0]=4 15819 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)F 240690a_100020643023_100009883079 [0,2,0,0,0,0|1,1,0]=4 15820 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CC)F 527a_100020643023_100009883079 [0,2,0,0,0,0|1,1,0]=4 15821 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)Br 1626a_100020643023_100010218026 [0,2,0,0,0,0|1,1,0]=4 15822 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)Br 240690a_100020643023_100010218026 [0,2,0,0,0,0|1,1,0]=4 15823 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)F 1626a_100020643023_100011803322 [0,2,0,0,0,0|1,1,0]=4 15824 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)F 240690a_100020643023_100011803322 [0,2,0,0,0,0|1,1,0]=4 15825 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)C 2230a_200015187719_200000210301 [0,2,0,0,0,0|2,0,0]=4 15826 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)C 34a_200015187719_200000210301 [0,2,0,0,0,0|2,0,0]=4 15827 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)C 7a_200015187719_200000210301 [0,2,0,0,0,0|2,0,0]=4 15828 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)Cl 34a_200011193700_200000210301 [0,2,0,0,0,0|1,0,0]=3 15829 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)F 27a_100102657272_200012359901 [0,2,0,0,0,0|1,1,0]=4 15830 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])C 2230a_200015187719_200025704644 [0,2,0,0,0,0|2,0,0]=4 15831 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])C 34a_200015187719_200025704644 [0,2,0,0,0,0|2,0,0]=4 15832 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])C 7a_200015187719_200025704644 [0,2,0,0,0,0|2,0,0]=4 15833 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])Cl 34a_200011193700_200025704644 [0,2,0,0,0,0|1,0,0]=3 15834 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 11a_100020643023_100011934951 [0,2,0,0,0,0|1,1,0]=4 15835 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 1626a_100020643023_100011934951 [0,2,0,0,0,0|1,1,0]=4 15836 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 240690a_100020643023_100011934951 [0,2,0,0,0,0|1,1,0]=4 15837 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 527a_100020643023_100011934951 [0,2,0,0,0,0|1,1,0]=4 15838 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 11a_100020643023_100000212341 [0,2,0,0,0,0|2,0,0]=4 15839 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 1626a_100020643023_100000212341 [0,2,0,0,0,0|2,0,0]=4 15840 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 240690a_100020643023_100000212341 [0,2,0,0,0,0|2,0,0]=4 15841 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 527a_100020643023_100000212341 [0,2,0,0,0,0|2,0,0]=4 15842 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 11a_100020643023_100000181799 [0,2,0,0,0,0|1,0,0]=3 15843 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 1626a_100020643023_100000181799 [0,2,0,0,0,0|1,0,0]=3 15844 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 240690a_100020643023_100000181799 [0,2,0,0,0,0|1,0,0]=3 15845 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 527a_100020643023_100000181799 [0,2,0,0,0,0|1,0,0]=3 15846 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 11a_100020643023_100000757635 [0,2,0,0,0,0|1,1,0]=4 15847 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 1626a_100020643023_100000757635 [0,2,0,0,0,0|1,1,0]=4 15848 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 240690a_100020643023_100000757635 [0,2,0,0,0,0|1,1,0]=4 15849 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 527a_100020643023_100000757635 [0,2,0,0,0,0|1,1,0]=4 15850 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 11a_100020643023_100012356290 [0,2,0,0,0,0|1,1,0]=4 15851 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 1626a_100020643023_100012356290 [0,2,0,0,0,0|1,1,0]=4 15852 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 240690a_100020643023_100012356290 [0,2,0,0,0,0|1,1,0]=4 15853 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 527a_100020643023_100012356290 [0,2,0,0,0,0|1,1,0]=4 15854 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)O 240690a_100020643023_100000687070 [0,2,0,0,0,0|2,0,0]=4 15855 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_200010239580 [0,2,0,0,0,0|2,0,0]=4 15856 B15R1.1243 CCCNC(=O)c1ccc(c(c1)SC)F 62a_200000210301_200012359901 [0,2,0,0,0,0|1,1,0]=4 15857 B15R1.1243 CCCNC(=O)c1ccc(c(c1)SC)F 62a_200012359901_200000210301 [0,2,0,0,0,0|1,1,0]=4 15858 B15R1.1243 CCCNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200012359901_200025704644 [0,2,0,0,0,0|1,1,0]=4 15859 B15R1.1243 CCCNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_200012359901 [0,2,0,0,0,0|1,1,0]=4 15860 B15R1.1243 CCNNC(=O)c1ccc(c(c1)C#N)Cl 22a_100000756455_100000696165 [0,2,0,0,0,0|2,0,0]=4 15861 B15R1.1243 CCNNC(=O)c1ccc(c(c1)CC)Cl 22a_100000756455_100000102533 [0,2,0,0,0,0|2,0,0]=4 15862 B15R1.1243 CCNNC(=O)c1ccc(c(c1)OC)Cl 22a_100000756455_100000181799 [0,2,0,0,0,0|2,0,0]=4 15863 B15R1.1243 CCc1cc(ccc1Br)C(=O)CCCO 1458a_100010152358_100011215043 [0,2,0,0,0,0|1,1,0]=4 15864 B15R1.1243 CCc1cc(ccc1Br)C(=O)NCCF 11a_100000724931_100010152358 [0,2,0,0,0,0|1,1,0]=4 15865 B15R1.1243 CCc1cc(ccc1Br)C(=O)NCCF 1626a_100000724931_100010152358 [0,2,0,0,0,0|1,1,0]=4 15866 B15R1.1243 CCc1cc(ccc1Br)C(=O)NCCF 240690a_100000724931_100010152358 [0,2,0,0,0,0|1,1,0]=4 15867 B15R1.1243 CCc1cc(ccc1Br)C(=O)NCCF 527a_100000724931_100010152358 [0,2,0,0,0,0|1,1,0]=4 15868 B15R1.1243 CCc1cc(ccc1Br)C(=O)NCCO 240690a_100000210304_100010152358 [0,2,0,0,0,0|0,1,0]=3 15869 B15R1.1243 CCc1cc(ccc1Br)C(=O)NCCO 527a_100000210304_100010152358 [0,2,0,0,0,0|0,1,0]=3 15870 B15R1.1243 CCc1cc(ccc1Cl)C(=O)CCCF 1458a_100000102533_100011934791 [0,2,0,0,0,0|2,0,0]=4 15871 B15R1.1243 CCc1cc(ccc1Cl)C(=O)CCCO 1458a_100000102533_100011215043 [0,2,0,0,0,0|1,0,0]=3 15872 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCC#N 1626a_100000734998_100000102533 [0,2,0,0,0,0|1,0,1]=4 15873 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCC#N 527a_100000734998_100000102533 [0,2,0,0,0,0|1,0,1]=4 15874 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCCF 11a_100000724931_100000102533 [0,2,0,0,0,0|1,0,0]=3 15875 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCCF 1626a_100000724931_100000102533 [0,2,0,0,0,0|1,0,0]=3 15876 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCCF 240690a_100000724931_100000102533 [0,2,0,0,0,0|1,0,0]=3 15877 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCCF 527a_100000724931_100000102533 [0,2,0,0,0,0|1,0,0]=3 15878 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCCO 240690a_100000210304_100000102533 [0,2,0,0,0,0|0,0,0]=2 15879 B15R1.1243 CCc1cc(ccc1Cl)C(=O)NCCO 527a_100000210304_100000102533 [0,2,0,0,0,0|0,0,0]=2 15880 B15R1.1243 CCc1cc(ccc1F)C(=O)CCCO 1458a_100009883079_100011215043 [0,2,0,0,0,0|1,1,0]=4 15881 B15R1.1243 CCc1cc(ccc1F)C(=O)NCCF 11a_100000724931_100009883079 [0,2,0,0,0,0|1,1,0]=4 15882 B15R1.1243 CCc1cc(ccc1F)C(=O)NCCF 1626a_100000724931_100009883079 [0,2,0,0,0,0|1,1,0]=4 15883 B15R1.1243 CCc1cc(ccc1F)C(=O)NCCF 240690a_100000724931_100009883079 [0,2,0,0,0,0|1,1,0]=4 15884 B15R1.1243 CCc1cc(ccc1F)C(=O)NCCF 527a_100000724931_100009883079 [0,2,0,0,0,0|1,1,0]=4 15885 B15R1.1243 CCc1cc(ccc1F)C(=O)NCCO 240690a_100000210304_100009883079 [0,2,0,0,0,0|0,1,0]=3 15886 B15R1.1243 CCc1cc(ccc1F)C(=O)NCCO 527a_100000210304_100009883079 [0,2,0,0,0,0|0,1,0]=3 15887 B15R1.1243 COc1cc(ccc1Br)C(=O)CCCO 1458a_100011934951_100011215043 [0,2,0,0,0,0|1,1,0]=4 15888 B15R1.1243 COc1cc(ccc1Br)C(=O)NCCF 11a_100000724931_100011934951 [0,2,0,0,0,0|1,1,0]=4 15889 B15R1.1243 COc1cc(ccc1Br)C(=O)NCCF 1626a_100000724931_100011934951 [0,2,0,0,0,0|1,1,0]=4 15890 B15R1.1243 COc1cc(ccc1Br)C(=O)NCCF 240690a_100000724931_100011934951 [0,2,0,0,0,0|1,1,0]=4 15891 B15R1.1243 COc1cc(ccc1Br)C(=O)NCCF 527a_100000724931_100011934951 [0,2,0,0,0,0|1,1,0]=4 15892 B15R1.1243 COc1cc(ccc1Br)C(=O)NCCO 240690a_100000210304_100011934951 [0,2,0,0,0,0|0,1,0]=3 15893 B15R1.1243 COc1cc(ccc1Br)C(=O)NCCO 527a_100000210304_100011934951 [0,2,0,0,0,0|0,1,0]=3 15894 B15R1.1243 COc1cc(ccc1C)C(=O)CCCO 1458a_100000212341_100011215043 [0,2,0,0,0,0|2,0,0]=4 15895 B15R1.1243 COc1cc(ccc1C)C(=O)NCCF 11a_100000724931_100000212341 [0,2,0,0,0,0|2,0,0]=4 15896 B15R1.1243 COc1cc(ccc1C)C(=O)NCCF 1626a_100000724931_100000212341 [0,2,0,0,0,0|2,0,0]=4 15897 B15R1.1243 COc1cc(ccc1C)C(=O)NCCF 240690a_100000724931_100000212341 [0,2,0,0,0,0|2,0,0]=4 15898 B15R1.1243 COc1cc(ccc1C)C(=O)NCCF 527a_100000724931_100000212341 [0,2,0,0,0,0|2,0,0]=4 15899 B15R1.1243 COc1cc(ccc1C)C(=O)NCCO 240690a_100000210304_100000212341 [0,2,0,0,0,0|1,0,0]=3 15900 B15R1.1243 COc1cc(ccc1C)C(=O)NCCO 527a_100000210304_100000212341 [0,2,0,0,0,0|1,0,0]=3 15901 B15R1.1243 COc1cc(ccc1Cl)C(=O)CCCF 1458a_100000181799_100011934791 [0,2,0,0,0,0|2,0,0]=4 15902 B15R1.1243 COc1cc(ccc1Cl)C(=O)CCCO 1458a_100000181799_100011215043 [0,2,0,0,0,0|1,0,0]=3 15903 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCC#N 1626a_100000734998_100000181799 [0,2,0,0,0,0|1,0,1]=4 15904 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCC#N 527a_100000734998_100000181799 [0,2,0,0,0,0|1,0,1]=4 15905 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCCF 11a_100000724931_100000181799 [0,2,0,0,0,0|1,0,0]=3 15906 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCCF 1626a_100000724931_100000181799 [0,2,0,0,0,0|1,0,0]=3 15907 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCCF 240690a_100000724931_100000181799 [0,2,0,0,0,0|1,0,0]=3 15908 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCCF 527a_100000724931_100000181799 [0,2,0,0,0,0|1,0,0]=3 15909 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCCO 240690a_100000210304_100000181799 [0,2,0,0,0,0|0,0,0]=2 15910 B15R1.1243 COc1cc(ccc1Cl)C(=O)NCCO 527a_100000210304_100000181799 [0,2,0,0,0,0|0,0,0]=2 15911 B15R1.1243 COc1cc(ccc1Cl)C(C)NCCO 269862a_100000210304_100012002813 [0,2,0,0,0,0|1,0,1]=4 15912 B15R1.1243 COc1cc(ccc1F)C(=O)CCCO 1458a_100000757635_100011215043 [0,2,0,0,0,0|1,1,0]=4 15913 B15R1.1243 COc1cc(ccc1F)C(=O)NCCF 11a_100000724931_100000757635 [0,2,0,0,0,0|1,1,0]=4 15914 B15R1.1243 COc1cc(ccc1F)C(=O)NCCF 1626a_100000724931_100000757635 [0,2,0,0,0,0|1,1,0]=4 15915 B15R1.1243 COc1cc(ccc1F)C(=O)NCCF 240690a_100000724931_100000757635 [0,2,0,0,0,0|1,1,0]=4 15916 B15R1.1243 COc1cc(ccc1F)C(=O)NCCF 527a_100000724931_100000757635 [0,2,0,0,0,0|1,1,0]=4 15917 B15R1.1243 COc1cc(ccc1F)C(=O)NCCO 240690a_100000210304_100000757635 [0,2,0,0,0,0|0,1,0]=3 15918 B15R1.1243 COc1cc(ccc1F)C(=O)NCCO 527a_100000210304_100000757635 [0,2,0,0,0,0|0,1,0]=3 15919 B15R1.1243 COc1cc(ccc1I)C(=O)CCCO 1458a_100012356290_100011215043 [0,2,0,0,0,0|1,1,0]=4 15920 B15R1.1243 COc1cc(ccc1I)C(=O)NCCF 11a_100000724931_100012356290 [0,2,0,0,0,0|1,1,0]=4 15921 B15R1.1243 COc1cc(ccc1I)C(=O)NCCF 1626a_100000724931_100012356290 [0,2,0,0,0,0|1,1,0]=4 15922 B15R1.1243 COc1cc(ccc1I)C(=O)NCCF 240690a_100000724931_100012356290 [0,2,0,0,0,0|1,1,0]=4 15923 B15R1.1243 COc1cc(ccc1I)C(=O)NCCF 527a_100000724931_100012356290 [0,2,0,0,0,0|1,1,0]=4 15924 B15R1.1243 COc1cc(ccc1I)C(=O)NCCO 240690a_100000210304_100012356290 [0,2,0,0,0,0|0,1,0]=3 15925 B15R1.1243 COc1cc(ccc1I)C(=O)NCCO 527a_100000210304_100012356290 [0,2,0,0,0,0|0,1,0]=3 15926 B15R1.1243 COc1cc(ccc1O)C(=O)CCCO 1458a_100000687070_100011215043 [0,2,0,0,0,0|2,0,0]=4 15927 B15R1.1243 COc1cc(ccc1O)C(=O)NCCF 240690a_100000724931_100000687070 [0,2,0,0,0,0|2,0,0]=4 15928 B15R1.1243 COc1cc(ccc1O)C(=O)NCCO 240690a_100000210304_100000687070 [0,2,0,0,0,0|1,0,0]=3 15929 B15R1.1243 N#CCNC(=O)c1ccc(c(c1)C#N)Cl 1626a_100000734998_100000696165 [0,2,0,0,0,0|1,0,1]=4 15930 B15R1.1243 N#CCNC(=O)c1ccc(c(c1)C#N)Cl 527a_100000734998_100000696165 [0,2,0,0,0,0|1,0,1]=4 15931 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)CCCO 1458a_100010253904_100011215043 [0,2,0,0,0,0|1,1,0]=4 15932 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)NCCF 11a_100000724931_100010253904 [0,2,0,0,0,0|1,1,0]=4 15933 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)NCCF 1626a_100000724931_100010253904 [0,2,0,0,0,0|1,1,0]=4 15934 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)NCCF 240690a_100000724931_100010253904 [0,2,0,0,0,0|1,1,0]=4 15935 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)NCCF 527a_100000724931_100010253904 [0,2,0,0,0,0|1,1,0]=4 15936 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)NCCO 240690a_100000210304_100010253904 [0,2,0,0,0,0|0,1,0]=3 15937 B15R1.1243 N#Cc1cc(ccc1Br)C(=O)NCCO 527a_100000210304_100010253904 [0,2,0,0,0,0|0,1,0]=3 15938 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)CCCF 1458a_100000696165_100011934791 [0,2,0,0,0,0|2,0,0]=4 15939 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)CCCO 1458a_100000696165_100011215043 [0,2,0,0,0,0|1,0,0]=3 15940 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)NCCF 11a_100000724931_100000696165 [0,2,0,0,0,0|1,0,0]=3 15941 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)NCCF 1626a_100000724931_100000696165 [0,2,0,0,0,0|1,0,0]=3 15942 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)NCCF 240690a_100000724931_100000696165 [0,2,0,0,0,0|1,0,0]=3 15943 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)NCCF 527a_100000724931_100000696165 [0,2,0,0,0,0|1,0,0]=3 15944 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)NCCO 240690a_100000210304_100000696165 [0,2,0,0,0,0|0,0,0]=2 15945 B15R1.1243 N#Cc1cc(ccc1Cl)C(=O)NCCO 527a_100000210304_100000696165 [0,2,0,0,0,0|0,0,0]=2 15946 B15R1.1243 N#Cc1cc(ccc1F)C(=O)CCCO 1458a_100000697239_100011215043 [0,2,0,0,0,0|1,1,0]=4 15947 B15R1.1243 N#Cc1cc(ccc1F)C(=O)NCCF 11a_100000724931_100000697239 [0,2,0,0,0,0|1,1,0]=4 15948 B15R1.1243 N#Cc1cc(ccc1F)C(=O)NCCF 1626a_100000724931_100000697239 [0,2,0,0,0,0|1,1,0]=4 15949 B15R1.1243 N#Cc1cc(ccc1O)C(=O)CCCO 1458a_100009875055_100011215043 [0,2,0,0,0,0|2,0,0]=4 15950 B15R1.1243 O=C(CCCO)c1ccc(c(c1)CO)Br 1458a_100010218026_100011215043 [0,2,0,0,0,0|1,1,0]=4 15951 B15R1.1243 O=C(CCCO)c1ccc(c(c1)CO)F 1458a_100011803322_100011215043 [0,2,0,0,0,0|1,1,0]=4 15952 B15R1.1243 O=C(NCCF)c1ccc(c(c1)CO)Br 1626a_100000724931_100010218026 [0,2,0,0,0,0|1,1,0]=4 15953 B15R1.1243 O=C(NCCF)c1ccc(c(c1)CO)Br 240690a_100000724931_100010218026 [0,2,0,0,0,0|1,1,0]=4 15954 B15R1.1243 O=C(NCCF)c1ccc(c(c1)CO)F 1626a_100000724931_100011803322 [0,2,0,0,0,0|1,1,0]=4 15955 B15R1.1243 O=C(NCCF)c1ccc(c(c1)CO)F 240690a_100000724931_100011803322 [0,2,0,0,0,0|1,1,0]=4 15956 B15R1.1243 O=C(NCCO)c1ccc(c(c1)CO)Br 240690a_100000210304_100010218026 [0,2,0,0,0,0|0,1,0]=3 15957 B15R1.1243 O=C(NCCO)c1ccc(c(c1)CO)F 240690a_100000210304_100011803322 [0,2,0,0,0,0|0,1,0]=3 15958 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)Cl 11a_100000212058_100010439669 [0,2,0,0,0,0|1,0,1]=4 15959 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100000212058_100010439669 [0,2,0,0,0,0|1,0,1]=4 15960 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100000212058_100010439669 [0,2,0,0,0,0|1,0,1]=4 15961 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100000212058_100010439669 [0,2,0,0,0,0|1,0,1]=4 15962 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)F 11a_100000212058_200010768543 [0,2,0,0,0,0|1,0,1]=4 15963 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)F 1626a_100000212058_200010768543 [0,2,0,0,0,0|1,0,1]=4 15964 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)F 240690a_100000212058_200010768543 [0,2,0,0,0,0|1,0,1]=4 15965 B15R1.2345 C#CCNC(=O)c1cc(c(cc1C)Cl)F 527a_100000212058_200010768543 [0,2,0,0,0,0|1,0,1]=4 15966 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_100000212058_100011934218 [0,2,0,0,0,0|1,0,1]=4 15967 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100000212058_100011934218 [0,2,0,0,0,0|1,0,1]=4 15968 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100000212058_100011934218 [0,2,0,0,0,0|1,0,1]=4 15969 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100000212058_100011934218 [0,2,0,0,0,0|1,0,1]=4 15970 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)F 11a_100000212058_100000212284 [0,2,0,0,0,0|1,0,1]=4 15971 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100000212058_100000212284 [0,2,0,0,0,0|1,0,1]=4 15972 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100000212058_100000212284 [0,2,0,0,0,0|1,0,1]=4 15973 B15R1.2345 C#CCNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100000212058_100000212284 [0,2,0,0,0,0|1,0,1]=4 15974 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Br 11a_100000212058_100011217226 [0,2,0,0,0,0|1,0,1]=4 15975 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100000212058_100011217226 [0,2,0,0,0,0|1,0,1]=4 15976 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100000212058_100011217226 [0,2,0,0,0,0|1,0,1]=4 15977 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Br 527a_100000212058_100011217226 [0,2,0,0,0,0|1,0,1]=4 15978 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Cl 11a_100000212058_100011217469 [0,2,0,0,0,0|1,0,1]=4 15979 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100000212058_100011217469 [0,2,0,0,0,0|1,0,1]=4 15980 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100000212058_100011217469 [0,2,0,0,0,0|1,0,1]=4 15981 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100000212058_100011217469 [0,2,0,0,0,0|1,0,1]=4 15982 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)F 11a_100000212058_100000690020 [0,2,0,0,0,0|1,0,1]=4 15983 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)F 1626a_100000212058_100000690020 [0,2,0,0,0,0|1,0,1]=4 15984 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)F 240690a_100000212058_100000690020 [0,2,0,0,0,0|1,0,1]=4 15985 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)F 527a_100000212058_100000690020 [0,2,0,0,0,0|1,0,1]=4 15986 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)I 11a_100000212058_100012920488 [0,2,0,0,0,0|1,0,1]=4 15987 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)I 1626a_100000212058_100012920488 [0,2,0,0,0,0|1,0,1]=4 15988 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)I 240690a_100000212058_100012920488 [0,2,0,0,0,0|1,0,1]=4 15989 B15R1.2345 C#CCNC(=O)c1cc(c(cc1F)Cl)I 527a_100000212058_100012920488 [0,2,0,0,0,0|1,0,1]=4 15990 B15R1.2345 C#CCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100000212058_200009814723 [0,2,0,0,0,0|1,0,1]=4 15991 B15R1.2345 C#CCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100000212058_200009814723 [0,2,0,0,0,0|1,0,1]=4 15992 B15R1.2345 C=CCNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100020586998_100010439669 [0,2,0,0,0,0|1,0,1]=4 15993 B15R1.2345 C=CCNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100020586998_100010439669 [0,2,0,0,0,0|1,0,1]=4 15994 B15R1.2345 C=CCNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100020586998_100010439669 [0,2,0,0,0,0|1,0,1]=4 15995 B15R1.2345 C=CCNC(=O)c1cc(c(cc1C)Cl)F 1626a_100020586998_200010768543 [0,2,0,0,0,0|1,0,1]=4 15996 B15R1.2345 C=CCNC(=O)c1cc(c(cc1C)Cl)F 240690a_100020586998_200010768543 [0,2,0,0,0,0|1,0,1]=4 15997 B15R1.2345 C=CCNC(=O)c1cc(c(cc1C)Cl)F 527a_100020586998_200010768543 [0,2,0,0,0,0|1,0,1]=4 15998 B15R1.2345 C=CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100020586998_100011934218 [0,2,0,0,0,0|1,0,1]=4 15999 B15R1.2345 C=CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100020586998_100011934218 [0,2,0,0,0,0|1,0,1]=4 16000 B15R1.2345 C=CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100020586998_100011934218 [0,2,0,0,0,0|1,0,1]=4 16001 B15R1.2345 C=CCNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100020586998_100000212284 [0,2,0,0,0,0|1,0,1]=4 16002 B15R1.2345 C=CCNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100020586998_100000212284 [0,2,0,0,0,0|1,0,1]=4 16003 B15R1.2345 C=CCNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100020586998_100000212284 [0,2,0,0,0,0|1,0,1]=4 16004 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100020586998_100011217226 [0,2,0,0,0,0|1,0,1]=4 16005 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100020586998_100011217226 [0,2,0,0,0,0|1,0,1]=4 16006 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)Br 527a_100020586998_100011217226 [0,2,0,0,0,0|1,0,1]=4 16007 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100020586998_100011217469 [0,2,0,0,0,0|1,0,1]=4 16008 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100020586998_100011217469 [0,2,0,0,0,0|1,0,1]=4 16009 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100020586998_100011217469 [0,2,0,0,0,0|1,0,1]=4 16010 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)F 1626a_100020586998_100000690020 [0,2,0,0,0,0|1,0,1]=4 16011 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)F 240690a_100020586998_100000690020 [0,2,0,0,0,0|1,0,1]=4 16012 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)F 527a_100020586998_100000690020 [0,2,0,0,0,0|1,0,1]=4 16013 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)I 1626a_100020586998_100012920488 [0,2,0,0,0,0|1,0,1]=4 16014 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)I 240690a_100020586998_100012920488 [0,2,0,0,0,0|1,0,1]=4 16015 B15R1.2345 C=CCNC(=O)c1cc(c(cc1F)Cl)I 527a_100020586998_100012920488 [0,2,0,0,0,0|1,0,1]=4 16016 B15R1.2345 C=CCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100020586998_200009814723 [0,2,0,0,0,0|1,0,1]=4 16017 B15R1.2345 C=CCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100020586998_200009814723 [0,2,0,0,0,0|1,0,1]=4 16018 B15R1.2345 CC(NCCO)c1cc(c(cc1Cl)Cl)Cl 269862a_100000210304_100010883557 [0,2,0,0,0,0|1,0,1]=4 16019 B15R1.2345 CC(NCCO)c1cc(c(cc1Cl)Cl)F 2230a_100000754468_100000211926 [0,2,0,0,0,0|1,0,1]=4 16020 B15R1.2345 CC(NCCO)c1cc(c(cc1Cl)Cl)F 269862a_100000210304_100000212065 [0,2,0,0,0,0|1,0,1]=4 16021 B15R1.2345 CC(NCCO)c1cc(c(cc1Cl)Cl)F 34a_100000754468_100000211926 [0,2,0,0,0,0|1,0,1]=4 16022 B15R1.2345 CC(NCCO)c1cc(c(cc1F)Cl)Cl 269862a_100000210304_100010004765 [0,2,0,0,0,0|1,0,1]=4 16023 B15R1.2345 CC(NCCO)c1cc(c(cc1F)Cl)F 269862a_100000210304_200011216423 [0,2,0,0,0,0|1,0,1]=4 16024 B15R1.2345 CC(NCCO)c1cc(c(cc1O)Cl)Cl 269862a_100000210304_100000720105 [0,2,0,0,0,0|1,0,1]=4 16025 B15R1.2345 CCCCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210211 [0,2,0,0,0,0|2,0,0]=4 16026 B15R1.2345 CCCCC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_100000210211 [0,2,0,0,0,0|2,0,0]=4 16027 B15R1.2345 CCCCC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100000210211 [0,2,0,0,0,0|2,0,0]=4 16028 B15R1.2345 CCCCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210211 [0,2,0,0,0,0|2,0,0]=4 16029 B15R1.2345 CCCCC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100000210211 [0,2,0,0,0,0|2,0,0]=4 16030 B15R1.2345 CCCCC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_100000210211 [0,2,0,0,0,0|2,0,0]=4 16031 B15R1.2345 CCCCC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_100000210211 [0,2,0,0,0,0|2,0,0]=4 16032 B15R1.2345 CCCCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210211 [0,2,0,0,0,0|2,0,0]=4 16033 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)C)F 11a_100020643023_200012355688 [0,2,0,0,0,0|2,0,0]=4 16034 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)C)F 1626a_100020643023_200012355688 [0,2,0,0,0,0|2,0,0]=4 16035 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)C)F 240690a_100020643023_200012355688 [0,2,0,0,0,0|2,0,0]=4 16036 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)C)F 527a_100020643023_200012355688 [0,2,0,0,0,0|2,0,0]=4 16037 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)C 11a_100020643023_100010204433 [0,2,0,0,0,0|1,1,0]=4 16038 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)C 1626a_100020643023_100010204433 [0,2,0,0,0,0|1,1,0]=4 16039 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)C 240690a_100020643023_100010204433 [0,2,0,0,0,0|1,1,0]=4 16040 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)C 527a_100020643023_100010204433 [0,2,0,0,0,0|1,1,0]=4 16041 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)Cl 11a_100020643023_100012921620 [0,2,0,0,0,0|1,1,0]=4 16042 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)Cl 1626a_100020643023_100012921620 [0,2,0,0,0,0|1,1,0]=4 16043 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)Cl 240690a_100020643023_100012921620 [0,2,0,0,0,0|1,1,0]=4 16044 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)Cl 527a_100020643023_100012921620 [0,2,0,0,0,0|1,1,0]=4 16045 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)F 11a_100020643023_100000685074 [0,2,0,0,0,0|1,1,0]=4 16046 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)F 1626a_100020643023_100000685074 [0,2,0,0,0,0|1,1,0]=4 16047 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)F 240690a_100020643023_100000685074 [0,2,0,0,0,0|1,1,0]=4 16048 B15R1.2345 CCCNC(=O)c1cc(c(cc1Br)F)F 527a_100020643023_100000685074 [0,2,0,0,0,0|1,1,0]=4 16049 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)C 11a_100020643023_100000695896 [0,2,0,0,0,0|1,1,0]=4 16050 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)C 1626a_100020643023_100000695896 [0,2,0,0,0,0|1,1,0]=4 16051 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)C 240690a_100020643023_100000695896 [0,2,0,0,0,0|1,1,0]=4 16052 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)C 527a_100020643023_100000695896 [0,2,0,0,0,0|1,1,0]=4 16053 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)F 11a_100020643023_100012344525 [0,2,0,0,0,0|1,1,0]=4 16054 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)F 1626a_100020643023_100012344525 [0,2,0,0,0,0|1,1,0]=4 16055 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)F 240690a_100020643023_100012344525 [0,2,0,0,0,0|1,1,0]=4 16056 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Br)F 527a_100020643023_100012344525 [0,2,0,0,0,0|1,1,0]=4 16057 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)Br 11a_100020643023_100012920494 [0,2,0,0,0,0|2,0,0]=4 16058 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)Br 1626a_100020643023_100012920494 [0,2,0,0,0,0|2,0,0]=4 16059 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)Br 240690a_100020643023_100012920494 [0,2,0,0,0,0|2,0,0]=4 16060 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)Br 527a_100020643023_100012920494 [0,2,0,0,0,0|2,0,0]=4 16061 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)C 11a_100020643023_100011216168 [0,2,0,0,0,0|2,0,0]=4 16062 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)C 1626a_100020643023_100011216168 [0,2,0,0,0,0|2,0,0]=4 16063 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)C 240690a_100020643023_100011216168 [0,2,0,0,0,0|2,0,0]=4 16064 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)C 527a_100020643023_100011216168 [0,2,0,0,0,0|2,0,0]=4 16065 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)I 11a_100020643023_100000723791 [0,2,0,0,0,0|2,0,0]=4 16066 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)I 1626a_100020643023_100000723791 [0,2,0,0,0,0|2,0,0]=4 16067 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)I 240690a_100020643023_100000723791 [0,2,0,0,0,0|2,0,0]=4 16068 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)C)I 527a_100020643023_100000723791 [0,2,0,0,0,0|2,0,0]=4 16069 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)Cl 11a_100020643023_100010439669 [0,2,0,0,0,0|1,0,0]=3 16070 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100020643023_100010439669 [0,2,0,0,0,0|1,0,0]=3 16071 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100020643023_100010439669 [0,2,0,0,0,0|1,0,0]=3 16072 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100020643023_100010439669 [0,2,0,0,0,0|1,0,0]=3 16073 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)F 11a_100020643023_200010768543 [0,2,0,0,0,0|1,0,0]=3 16074 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)F 1626a_100020643023_200010768543 [0,2,0,0,0,0|1,0,0]=3 16075 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)F 240690a_100020643023_200010768543 [0,2,0,0,0,0|1,0,0]=3 16076 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)Cl)F 527a_100020643023_200010768543 [0,2,0,0,0,0|1,0,0]=3 16077 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)Br 11a_100020643023_100000724332 [0,2,0,0,0,0|1,1,0]=4 16078 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)Br 1626a_100020643023_100000724332 [0,2,0,0,0,0|1,1,0]=4 16079 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)Br 240690a_100020643023_100000724332 [0,2,0,0,0,0|1,1,0]=4 16080 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)Br 527a_100020643023_100000724332 [0,2,0,0,0,0|1,1,0]=4 16081 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)F 11a_100020643023_100000062099 [0,2,0,0,0,0|1,1,0]=4 16082 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)F 1626a_100020643023_100000062099 [0,2,0,0,0,0|1,1,0]=4 16083 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)F 240690a_100020643023_100000062099 [0,2,0,0,0,0|1,1,0]=4 16084 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)F 527a_100020643023_100000062099 [0,2,0,0,0,0|1,1,0]=4 16085 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)I 11a_100020643023_100013328184 [0,2,0,0,0,0|1,1,0]=4 16086 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)I 1626a_100020643023_100013328184 [0,2,0,0,0,0|1,1,0]=4 16087 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)I 240690a_100020643023_100013328184 [0,2,0,0,0,0|1,1,0]=4 16088 B15R1.2345 CCCNC(=O)c1cc(c(cc1C)F)I 527a_100020643023_100013328184 [0,2,0,0,0,0|1,1,0]=4 16089 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)Cl 11a_100020643023_100000246132 [0,2,0,0,0,0|1,1,0]=4 16090 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)Cl 1626a_100020643023_100000246132 [0,2,0,0,0,0|1,1,0]=4 16091 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)Cl 240690a_100020643023_100000246132 [0,2,0,0,0,0|1,1,0]=4 16092 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)Cl 527a_100020643023_100000246132 [0,2,0,0,0,0|1,1,0]=4 16093 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)F 11a_100020643023_100000724438 [0,2,0,0,0,0|1,1,0]=4 16094 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)F 1626a_100020643023_100000724438 [0,2,0,0,0,0|1,1,0]=4 16095 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)F 240690a_100020643023_100000724438 [0,2,0,0,0,0|1,1,0]=4 16096 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Br)F 527a_100020643023_100000724438 [0,2,0,0,0,0|1,1,0]=4 16097 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)Cl 11a_100020643023_100013033594 [0,2,0,0,0,0|2,0,0]=4 16098 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)Cl 1626a_100020643023_100013033594 [0,2,0,0,0,0|2,0,0]=4 16099 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)Cl 240690a_100020643023_100013033594 [0,2,0,0,0,0|2,0,0]=4 16100 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)Cl 527a_100020643023_100013033594 [0,2,0,0,0,0|2,0,0]=4 16101 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)F 11a_100020643023_100009857485 [0,2,0,0,0,0|2,0,0]=4 16102 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)F 1626a_100020643023_100009857485 [0,2,0,0,0,0|2,0,0]=4 16103 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)F 240690a_100020643023_100009857485 [0,2,0,0,0,0|2,0,0]=4 16104 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)C)F 527a_100020643023_100009857485 [0,2,0,0,0,0|2,0,0]=4 16105 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_100020643023_100011934218 [0,2,0,0,0,0|1,0,0]=3 16106 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100020643023_100011934218 [0,2,0,0,0,0|1,0,0]=3 16107 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100020643023_100011934218 [0,2,0,0,0,0|1,0,0]=3 16108 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100020643023_100011934218 [0,2,0,0,0,0|1,0,0]=3 16109 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)F 11a_100020643023_100000212284 [0,2,0,0,0,0|1,0,0]=3 16110 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100020643023_100000212284 [0,2,0,0,0,0|1,0,0]=3 16111 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100020643023_100000212284 [0,2,0,0,0,0|1,0,0]=3 16112 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100020643023_100000212284 [0,2,0,0,0,0|1,0,0]=3 16113 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)C 11a_100020643023_100000687843 [0,2,0,0,0,0|1,1,0]=4 16114 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)C 1626a_100020643023_100000687843 [0,2,0,0,0,0|1,1,0]=4 16115 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)C 240690a_100020643023_100000687843 [0,2,0,0,0,0|1,1,0]=4 16116 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)C 527a_100020643023_100000687843 [0,2,0,0,0,0|1,1,0]=4 16117 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)F 11a_100020643023_100025704182 [0,2,0,0,0,0|1,1,0]=4 16118 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)F 1626a_100020643023_100025704182 [0,2,0,0,0,0|1,1,0]=4 16119 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)F 240690a_100020643023_100025704182 [0,2,0,0,0,0|1,1,0]=4 16120 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)F 527a_100020643023_100025704182 [0,2,0,0,0,0|1,1,0]=4 16121 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)I 11a_100020643023_100012920486 [0,2,0,0,0,0|1,1,0]=4 16122 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)I 1626a_100020643023_100012920486 [0,2,0,0,0,0|1,1,0]=4 16123 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)I 240690a_100020643023_100012920486 [0,2,0,0,0,0|1,1,0]=4 16124 B15R1.2345 CCCNC(=O)c1cc(c(cc1Cl)F)I 527a_100020643023_100012920486 [0,2,0,0,0,0|1,1,0]=4 16125 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Br 11a_100020643023_200011217225 [0,2,0,0,0,0|1,1,0]=4 16126 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Br 1626a_100020643023_200011217225 [0,2,0,0,0,0|1,1,0]=4 16127 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Br 240690a_100020643023_200011217225 [0,2,0,0,0,0|1,1,0]=4 16128 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Br 527a_100020643023_200011217225 [0,2,0,0,0,0|1,1,0]=4 16129 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)C 11a_100020643023_100012354683 [0,2,0,0,0,0|1,1,0]=4 16130 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)C 1626a_100020643023_100012354683 [0,2,0,0,0,0|1,1,0]=4 16131 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)C 240690a_100020643023_100012354683 [0,2,0,0,0,0|1,1,0]=4 16132 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)C 527a_100020643023_100012354683 [0,2,0,0,0,0|1,1,0]=4 16133 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Cl 11a_100020643023_100012347732 [0,2,0,0,0,0|1,1,0]=4 16134 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Cl 1626a_100020643023_100012347732 [0,2,0,0,0,0|1,1,0]=4 16135 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Cl 240690a_100020643023_100012347732 [0,2,0,0,0,0|1,1,0]=4 16136 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)Cl 527a_100020643023_100012347732 [0,2,0,0,0,0|1,1,0]=4 16137 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)F 11a_100020643023_100012024349 [0,2,0,0,0,0|1,1,0]=4 16138 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)F 1626a_100020643023_100012024349 [0,2,0,0,0,0|1,1,0]=4 16139 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)F 240690a_100020643023_100012024349 [0,2,0,0,0,0|1,1,0]=4 16140 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Br)F 527a_100020643023_100012024349 [0,2,0,0,0,0|1,1,0]=4 16141 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Br 11a_100020643023_100012920545 [0,2,0,0,0,0|2,0,0]=4 16142 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Br 1626a_100020643023_100012920545 [0,2,0,0,0,0|2,0,0]=4 16143 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Br 240690a_100020643023_100012920545 [0,2,0,0,0,0|2,0,0]=4 16144 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Br 527a_100020643023_100012920545 [0,2,0,0,0,0|2,0,0]=4 16145 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Cl 11a_100020643023_100012180961 [0,2,0,0,0,0|2,0,0]=4 16146 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Cl 1626a_100020643023_100012180961 [0,2,0,0,0,0|2,0,0]=4 16147 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Cl 240690a_100020643023_100012180961 [0,2,0,0,0,0|2,0,0]=4 16148 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)Cl 527a_100020643023_100012180961 [0,2,0,0,0,0|2,0,0]=4 16149 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)F 11a_100020643023_100000686409 [0,2,0,0,0,0|2,0,0]=4 16150 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)F 1626a_100020643023_100000686409 [0,2,0,0,0,0|2,0,0]=4 16151 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)F 240690a_100020643023_100000686409 [0,2,0,0,0,0|2,0,0]=4 16152 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)F 527a_100020643023_100000686409 [0,2,0,0,0,0|2,0,0]=4 16153 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)O 240690a_100020643023_100009839767 [0,2,0,0,0,0|2,0,0]=4 16154 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Br 11a_100020643023_100011217226 [0,2,0,0,0,0|1,0,0]=3 16155 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100020643023_100011217226 [0,2,0,0,0,0|1,0,0]=3 16156 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100020643023_100011217226 [0,2,0,0,0,0|1,0,0]=3 16157 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Br 527a_100020643023_100011217226 [0,2,0,0,0,0|1,0,0]=3 16158 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Cl 11a_100020643023_100011217469 [0,2,0,0,0,0|1,0,0]=3 16159 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100020643023_100011217469 [0,2,0,0,0,0|1,0,0]=3 16160 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100020643023_100011217469 [0,2,0,0,0,0|1,0,0]=3 16161 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100020643023_100011217469 [0,2,0,0,0,0|1,0,0]=3 16162 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)F 11a_100020643023_100000690020 [0,2,0,0,0,0|1,0,0]=3 16163 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)F 1626a_100020643023_100000690020 [0,2,0,0,0,0|1,0,0]=3 16164 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)F 240690a_100020643023_100000690020 [0,2,0,0,0,0|1,0,0]=3 16165 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)F 527a_100020643023_100000690020 [0,2,0,0,0,0|1,0,0]=3 16166 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)I 11a_100020643023_100012920488 [0,2,0,0,0,0|1,0,0]=3 16167 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)I 1626a_100020643023_100012920488 [0,2,0,0,0,0|1,0,0]=3 16168 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)I 240690a_100020643023_100012920488 [0,2,0,0,0,0|1,0,0]=3 16169 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)Cl)I 527a_100020643023_100012920488 [0,2,0,0,0,0|1,0,0]=3 16170 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Br 11a_100020643023_100000718434 [0,2,0,0,0,0|1,1,0]=4 16171 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Br 1626a_100020643023_100000718434 [0,2,0,0,0,0|1,1,0]=4 16172 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Br 240690a_100020643023_100000718434 [0,2,0,0,0,0|1,1,0]=4 16173 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Br 527a_100020643023_100000718434 [0,2,0,0,0,0|1,1,0]=4 16174 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)C 11a_100020643023_100000767126 [0,2,0,0,0,0|1,1,0]=4 16175 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)C 1626a_100020643023_100000767126 [0,2,0,0,0,0|1,1,0]=4 16176 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)C 240690a_100020643023_100000767126 [0,2,0,0,0,0|1,1,0]=4 16177 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)C 527a_100020643023_100000767126 [0,2,0,0,0,0|1,1,0]=4 16178 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Cl 11a_100020643023_100011997751 [0,2,0,0,0,0|1,1,0]=4 16179 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Cl 1626a_100020643023_100011997751 [0,2,0,0,0,0|1,1,0]=4 16180 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Cl 240690a_100020643023_100011997751 [0,2,0,0,0,0|1,1,0]=4 16181 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)Cl 527a_100020643023_100011997751 [0,2,0,0,0,0|1,1,0]=4 16182 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)F 11a_100020643023_100000687535 [0,2,0,0,0,0|1,1,0]=4 16183 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)F 1626a_100020643023_100000687535 [0,2,0,0,0,0|1,1,0]=4 16184 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)F 240690a_100020643023_100000687535 [0,2,0,0,0,0|1,1,0]=4 16185 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)F 527a_100020643023_100000687535 [0,2,0,0,0,0|1,1,0]=4 16186 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)I 11a_100020643023_100000691139 [0,2,0,0,0,0|1,1,0]=4 16187 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)I 1626a_100020643023_100000691139 [0,2,0,0,0,0|1,1,0]=4 16188 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)I 240690a_100020643023_100000691139 [0,2,0,0,0,0|1,1,0]=4 16189 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)F)I 527a_100020643023_100000691139 [0,2,0,0,0,0|1,1,0]=4 16190 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)O)Cl 240690a_100020643023_200009924051 [0,2,0,0,0,0|2,0,0]=4 16191 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)O)Cl 527a_100020643023_200009924051 [0,2,0,0,0,0|2,0,0]=4 16192 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)C)C 11a_100020643023_100010184404 [0,2,0,0,0,0|2,0,0]=4 16193 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)C)C 1626a_100020643023_100010184404 [0,2,0,0,0,0|2,0,0]=4 16194 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)C)C 240690a_100020643023_100010184404 [0,2,0,0,0,0|2,0,0]=4 16195 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)C)C 527a_100020643023_100010184404 [0,2,0,0,0,0|2,0,0]=4 16196 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)F)F 11a_100020643023_100000688017 [0,2,0,0,0,0|1,1,0]=4 16197 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)F)F 1626a_100020643023_100000688017 [0,2,0,0,0,0|1,1,0]=4 16198 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)F)F 240690a_100020643023_100000688017 [0,2,0,0,0,0|1,1,0]=4 16199 B15R1.2345 CCCNC(=O)c1cc(c(cc1I)F)F 527a_100020643023_100000688017 [0,2,0,0,0,0|1,1,0]=4 16200 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)Br)F 240690a_100020643023_100010827371 [0,2,0,0,0,0|1,1,0]=4 16201 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)Br)F 527a_100020643023_100010827371 [0,2,0,0,0,0|1,1,0]=4 16202 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)C)Br 240690a_100020643023_100010233826 [0,2,0,0,0,0|2,0,0]=4 16203 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)C)Br 527a_100020643023_100010233826 [0,2,0,0,0,0|2,0,0]=4 16204 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)C)C 240690a_100020643023_100009831561 [0,2,0,0,0,0|2,0,0]=4 16205 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)C)C 527a_100020643023_100009831561 [0,2,0,0,0,0|2,0,0]=4 16206 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100020643023_200009814723 [0,2,0,0,0,0|1,0,0]=3 16207 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100020643023_200009814723 [0,2,0,0,0,0|1,0,0]=3 16208 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)F)Br 240690a_100020643023_100010188153 [0,2,0,0,0,0|1,1,0]=4 16209 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)F)Br 527a_100020643023_100010188153 [0,2,0,0,0,0|1,1,0]=4 16210 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)F)Cl 240690a_100020643023_100009910333 [0,2,0,0,0,0|1,1,0]=4 16211 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)F)Cl 527a_100020643023_100009910333 [0,2,0,0,0,0|1,1,0]=4 16212 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)F)F 240690a_100020643023_100012182723 [0,2,0,0,0,0|1,1,0]=4 16213 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)F)F 527a_100020643023_100012182723 [0,2,0,0,0,0|1,1,0]=4 16214 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)O)Br 527a_100020643023_100009813906 [0,2,0,0,0,0|2,0,0]=4 16215 B15R1.2345 CCNNC(=O)c1cc(c(cc1C)Cl)Cl 22a_100000756455_100010439669 [0,2,0,0,0,0|2,0,0]=4 16216 B15R1.2345 CCNNC(=O)c1cc(c(cc1C)Cl)F 22a_100000756455_200010768543 [0,2,0,0,0,0|2,0,0]=4 16217 B15R1.2345 CCNNC(=O)c1cc(c(cc1Cl)Cl)Cl 22a_100000756455_100011934218 [0,2,0,0,0,0|2,0,0]=4 16218 B15R1.2345 CCNNC(=O)c1cc(c(cc1Cl)Cl)F 22a_100000756455_100000212284 [0,2,0,0,0,0|2,0,0]=4 16219 B15R1.2345 CCNNC(=O)c1cc(c(cc1F)Cl)Br 22a_100000756455_100011217226 [0,2,0,0,0,0|2,0,0]=4 16220 B15R1.2345 CCNNC(=O)c1cc(c(cc1F)Cl)Cl 22a_100000756455_100011217469 [0,2,0,0,0,0|2,0,0]=4 16221 B15R1.2345 CCNNC(=O)c1cc(c(cc1F)Cl)F 22a_100000756455_100000690020 [0,2,0,0,0,0|2,0,0]=4 16222 B15R1.2345 CCNNC(=O)c1cc(c(cc1F)Cl)I 22a_100000756455_100012920488 [0,2,0,0,0,0|2,0,0]=4 16223 B15R1.2345 CCNNC(=O)c1cc(c(cc1O)Cl)Br 22a_100000756455_200009814723 [0,2,0,0,0,0|2,0,0]=4 16224 B15R1.2345 Cc1cc(c(cc1Br)C(=O)CCCO)C 1458a_100012920494_100011215043 [0,2,0,0,0,0|2,0,0]=4 16225 B15R1.2345 Cc1cc(c(cc1Br)C(=O)CCCO)F 1458a_100012920545_100011215043 [0,2,0,0,0,0|2,0,0]=4 16226 B15R1.2345 Cc1cc(c(cc1Br)C(=O)CCCO)O 1458a_100010233826_100011215043 [0,2,0,0,0,0|2,0,0]=4 16227 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)C 11a_100000724931_100012920494 [0,2,0,0,0,0|2,0,0]=4 16228 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)C 1626a_100000724931_100012920494 [0,2,0,0,0,0|2,0,0]=4 16229 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)C 240690a_100000724931_100012920494 [0,2,0,0,0,0|2,0,0]=4 16230 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)C 527a_100000724931_100012920494 [0,2,0,0,0,0|2,0,0]=4 16231 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)F 11a_100000724931_100012920545 [0,2,0,0,0,0|2,0,0]=4 16232 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)F 1626a_100000724931_100012920545 [0,2,0,0,0,0|2,0,0]=4 16233 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)F 240690a_100000724931_100012920545 [0,2,0,0,0,0|2,0,0]=4 16234 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)F 527a_100000724931_100012920545 [0,2,0,0,0,0|2,0,0]=4 16235 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)O 240690a_100000724931_100010233826 [0,2,0,0,0,0|2,0,0]=4 16236 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCF)O 527a_100000724931_100010233826 [0,2,0,0,0,0|2,0,0]=4 16237 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCO)C 240690a_100000210304_100012920494 [0,2,0,0,0,0|1,0,0]=3 16238 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCO)C 527a_100000210304_100012920494 [0,2,0,0,0,0|1,0,0]=3 16239 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCO)F 240690a_100000210304_100012920545 [0,2,0,0,0,0|1,0,0]=3 16240 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCO)F 527a_100000210304_100012920545 [0,2,0,0,0,0|1,0,0]=3 16241 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCO)O 240690a_100000210304_100010233826 [0,2,0,0,0,0|1,0,0]=3 16242 B15R1.2345 Cc1cc(c(cc1Br)C(=O)NCCO)O 527a_100000210304_100010233826 [0,2,0,0,0,0|1,0,0]=3 16243 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)CCCO 1458a_100000695896_100011215043 [0,2,0,0,0,0|1,1,0]=4 16244 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)NCCF 11a_100000724931_100000695896 [0,2,0,0,0,0|1,1,0]=4 16245 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)NCCF 1626a_100000724931_100000695896 [0,2,0,0,0,0|1,1,0]=4 16246 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)NCCF 240690a_100000724931_100000695896 [0,2,0,0,0,0|1,1,0]=4 16247 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)NCCF 527a_100000724931_100000695896 [0,2,0,0,0,0|1,1,0]=4 16248 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)NCCO 240690a_100000210304_100000695896 [0,2,0,0,0,0|0,1,0]=3 16249 B15R1.2345 Cc1cc(c(cc1Br)C)C(=O)NCCO 527a_100000210304_100000695896 [0,2,0,0,0,0|0,1,0]=3 16250 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)CCCO 1458a_100012354683_100011215043 [0,2,0,0,0,0|1,1,0]=4 16251 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)NCCF 11a_100000724931_100012354683 [0,2,0,0,0,0|1,1,0]=4 16252 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)NCCF 1626a_100000724931_100012354683 [0,2,0,0,0,0|1,1,0]=4 16253 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)NCCF 240690a_100000724931_100012354683 [0,2,0,0,0,0|1,1,0]=4 16254 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)NCCF 527a_100000724931_100012354683 [0,2,0,0,0,0|1,1,0]=4 16255 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)NCCO 240690a_100000210304_100012354683 [0,2,0,0,0,0|0,1,0]=3 16256 B15R1.2345 Cc1cc(c(cc1Br)F)C(=O)NCCO 527a_100000210304_100012354683 [0,2,0,0,0,0|0,1,0]=3 16257 B15R1.2345 Cc1cc(c(cc1C(=O)CCCF)Cl)Cl 1458a_100010439669_100011934791 [0,2,0,0,0,0|2,0,0]=4 16258 B15R1.2345 Cc1cc(c(cc1C(=O)CCCF)F)Cl 1458a_200010768543_100011934791 [0,2,0,0,0,0|2,0,0]=4 16259 B15R1.2345 Cc1cc(c(cc1C(=O)CCCO)Br)F 1458a_100000724332_100011215043 [0,2,0,0,0,0|1,1,0]=4 16260 B15R1.2345 Cc1cc(c(cc1C(=O)CCCO)Cl)Cl 1458a_100010439669_100011215043 [0,2,0,0,0,0|1,0,0]=3 16261 B15R1.2345 Cc1cc(c(cc1C(=O)CCCO)F)Br 1458a_100012344525_100011215043 [0,2,0,0,0,0|1,1,0]=4 16262 B15R1.2345 Cc1cc(c(cc1C(=O)CCCO)F)Cl 1458a_200010768543_100011215043 [0,2,0,0,0,0|1,0,0]=3 16263 B15R1.2345 Cc1cc(c(cc1C(=O)CCCO)F)F 1458a_100000062099_100011215043 [0,2,0,0,0,0|1,1,0]=4 16264 B15R1.2345 Cc1cc(c(cc1C(=O)CCCO)I)F 1458a_100013328184_100011215043 [0,2,0,0,0,0|1,1,0]=4 16265 B15R1.2345 Cc1cc(c(cc1C(=O)NCC#N)Cl)Cl 1626a_100000734998_100010439669 [0,2,0,0,0,0|1,0,1]=4 16266 B15R1.2345 Cc1cc(c(cc1C(=O)NCC#N)Cl)Cl 527a_100000734998_100010439669 [0,2,0,0,0,0|1,0,1]=4 16267 B15R1.2345 Cc1cc(c(cc1C(=O)NCC#N)F)Cl 1626a_100000734998_200010768543 [0,2,0,0,0,0|1,0,1]=4 16268 B15R1.2345 Cc1cc(c(cc1C(=O)NCC#N)F)Cl 527a_100000734998_200010768543 [0,2,0,0,0,0|1,0,1]=4 16269 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Br)F 11a_100000724931_100000724332 [0,2,0,0,0,0|1,1,0]=4 16270 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Br)F 1626a_100000724931_100000724332 [0,2,0,0,0,0|1,1,0]=4 16271 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Br)F 240690a_100000724931_100000724332 [0,2,0,0,0,0|1,1,0]=4 16272 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Br)F 527a_100000724931_100000724332 [0,2,0,0,0,0|1,1,0]=4 16273 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Cl)Cl 11a_100000724931_100010439669 [0,2,0,0,0,0|1,0,0]=3 16274 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Cl)Cl 1626a_100000724931_100010439669 [0,2,0,0,0,0|1,0,0]=3 16275 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Cl)Cl 240690a_100000724931_100010439669 [0,2,0,0,0,0|1,0,0]=3 16276 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)Cl)Cl 527a_100000724931_100010439669 [0,2,0,0,0,0|1,0,0]=3 16277 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Br 11a_100000724931_100012344525 [0,2,0,0,0,0|1,1,0]=4 16278 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Br 1626a_100000724931_100012344525 [0,2,0,0,0,0|1,1,0]=4 16279 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Br 240690a_100000724931_100012344525 [0,2,0,0,0,0|1,1,0]=4 16280 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Br 527a_100000724931_100012344525 [0,2,0,0,0,0|1,1,0]=4 16281 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Cl 11a_100000724931_200010768543 [0,2,0,0,0,0|1,0,0]=3 16282 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Cl 1626a_100000724931_200010768543 [0,2,0,0,0,0|1,0,0]=3 16283 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Cl 240690a_100000724931_200010768543 [0,2,0,0,0,0|1,0,0]=3 16284 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)Cl 527a_100000724931_200010768543 [0,2,0,0,0,0|1,0,0]=3 16285 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)F 11a_100000724931_100000062099 [0,2,0,0,0,0|1,1,0]=4 16286 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)F 1626a_100000724931_100000062099 [0,2,0,0,0,0|1,1,0]=4 16287 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)F 240690a_100000724931_100000062099 [0,2,0,0,0,0|1,1,0]=4 16288 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)F)F 527a_100000724931_100000062099 [0,2,0,0,0,0|1,1,0]=4 16289 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)I)F 11a_100000724931_100013328184 [0,2,0,0,0,0|1,1,0]=4 16290 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)I)F 1626a_100000724931_100013328184 [0,2,0,0,0,0|1,1,0]=4 16291 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)I)F 240690a_100000724931_100013328184 [0,2,0,0,0,0|1,1,0]=4 16292 B15R1.2345 Cc1cc(c(cc1C(=O)NCCF)I)F 527a_100000724931_100013328184 [0,2,0,0,0,0|1,1,0]=4 16293 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)Br)F 240690a_100000210304_100000724332 [0,2,0,0,0,0|0,1,0]=3 16294 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)Br)F 527a_100000210304_100000724332 [0,2,0,0,0,0|0,1,0]=3 16295 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)Cl)Cl 240690a_100000210304_100010439669 [0,2,0,0,0,0|0,0,0]=2 16296 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)Cl)Cl 527a_100000210304_100010439669 [0,2,0,0,0,0|0,0,0]=2 16297 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)F)Br 240690a_100000210304_100012344525 [0,2,0,0,0,0|0,1,0]=3 16298 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)F)Br 527a_100000210304_100012344525 [0,2,0,0,0,0|0,1,0]=3 16299 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)F)Cl 240690a_100000210304_200010768543 [0,2,0,0,0,0|0,0,0]=2 16300 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)F)Cl 527a_100000210304_200010768543 [0,2,0,0,0,0|0,0,0]=2 16301 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)F)F 240690a_100000210304_100000062099 [0,2,0,0,0,0|0,1,0]=3 16302 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)F)F 527a_100000210304_100000062099 [0,2,0,0,0,0|0,1,0]=3 16303 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)I)F 240690a_100000210304_100013328184 [0,2,0,0,0,0|0,1,0]=3 16304 B15R1.2345 Cc1cc(c(cc1C(=O)NCCO)I)F 527a_100000210304_100013328184 [0,2,0,0,0,0|0,1,0]=3 16305 B15R1.2345 Cc1cc(c(cc1C)C(=O)CCCO)C 1458a_100011216168_100011215043 [0,2,0,0,0,0|2,0,0]=4 16306 B15R1.2345 Cc1cc(c(cc1C)C(=O)CCCO)I 1458a_100010184404_100011215043 [0,2,0,0,0,0|2,0,0]=4 16307 B15R1.2345 Cc1cc(c(cc1C)C(=O)CCCO)O 1458a_100009831561_100011215043 [0,2,0,0,0,0|2,0,0]=4 16308 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)C 11a_100000724931_100011216168 [0,2,0,0,0,0|2,0,0]=4 16309 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)C 1626a_100000724931_100011216168 [0,2,0,0,0,0|2,0,0]=4 16310 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)C 240690a_100000724931_100011216168 [0,2,0,0,0,0|2,0,0]=4 16311 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)C 527a_100000724931_100011216168 [0,2,0,0,0,0|2,0,0]=4 16312 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)I 11a_100000724931_100010184404 [0,2,0,0,0,0|2,0,0]=4 16313 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)I 1626a_100000724931_100010184404 [0,2,0,0,0,0|2,0,0]=4 16314 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)I 240690a_100000724931_100010184404 [0,2,0,0,0,0|2,0,0]=4 16315 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)I 527a_100000724931_100010184404 [0,2,0,0,0,0|2,0,0]=4 16316 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)O 240690a_100000724931_100009831561 [0,2,0,0,0,0|2,0,0]=4 16317 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCF)O 527a_100000724931_100009831561 [0,2,0,0,0,0|2,0,0]=4 16318 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCO)C 240690a_100000210304_100011216168 [0,2,0,0,0,0|1,0,0]=3 16319 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCO)C 527a_100000210304_100011216168 [0,2,0,0,0,0|1,0,0]=3 16320 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCO)I 240690a_100000210304_100010184404 [0,2,0,0,0,0|1,0,0]=3 16321 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCO)I 527a_100000210304_100010184404 [0,2,0,0,0,0|1,0,0]=3 16322 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCO)O 240690a_100000210304_100009831561 [0,2,0,0,0,0|1,0,0]=3 16323 B15R1.2345 Cc1cc(c(cc1C)C(=O)NCCO)O 527a_100000210304_100009831561 [0,2,0,0,0,0|1,0,0]=3 16324 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)CCCO)Cl 1458a_100013033594_100011215043 [0,2,0,0,0,0|2,0,0]=4 16325 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)CCCO)F 1458a_100012180961_100011215043 [0,2,0,0,0,0|2,0,0]=4 16326 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)Cl 11a_100000724931_100013033594 [0,2,0,0,0,0|2,0,0]=4 16327 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)Cl 1626a_100000724931_100013033594 [0,2,0,0,0,0|2,0,0]=4 16328 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)Cl 240690a_100000724931_100013033594 [0,2,0,0,0,0|2,0,0]=4 16329 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)Cl 527a_100000724931_100013033594 [0,2,0,0,0,0|2,0,0]=4 16330 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)F 11a_100000724931_100012180961 [0,2,0,0,0,0|2,0,0]=4 16331 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)F 1626a_100000724931_100012180961 [0,2,0,0,0,0|2,0,0]=4 16332 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)F 240690a_100000724931_100012180961 [0,2,0,0,0,0|2,0,0]=4 16333 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCF)F 527a_100000724931_100012180961 [0,2,0,0,0,0|2,0,0]=4 16334 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCO)Cl 240690a_100000210304_100013033594 [0,2,0,0,0,0|1,0,0]=3 16335 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCO)Cl 527a_100000210304_100013033594 [0,2,0,0,0,0|1,0,0]=3 16336 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCO)F 240690a_100000210304_100012180961 [0,2,0,0,0,0|1,0,0]=3 16337 B15R1.2345 Cc1cc(c(cc1Cl)C(=O)NCCO)F 527a_100000210304_100012180961 [0,2,0,0,0,0|1,0,0]=3 16338 B15R1.2345 Cc1cc(c(cc1Cl)F)C(C)NCCO 269862a_100000210304_100000031430 [0,2,0,0,0,0|1,0,1]=4 16339 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)CCCO 1458a_100010204433_100011215043 [0,2,0,0,0,0|1,1,0]=4 16340 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)NCCF 11a_100000724931_100010204433 [0,2,0,0,0,0|1,1,0]=4 16341 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)NCCF 1626a_100000724931_100010204433 [0,2,0,0,0,0|1,1,0]=4 16342 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)NCCF 240690a_100000724931_100010204433 [0,2,0,0,0,0|1,1,0]=4 16343 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)NCCF 527a_100000724931_100010204433 [0,2,0,0,0,0|1,1,0]=4 16344 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)NCCO 240690a_100000210304_100010204433 [0,2,0,0,0,0|0,1,0]=3 16345 B15R1.2345 Cc1cc(c(cc1F)Br)C(=O)NCCO 527a_100000210304_100010204433 [0,2,0,0,0,0|0,1,0]=3 16346 B15R1.2345 Cc1cc(c(cc1F)C(=O)CCCO)Br 1458a_200012355688_100011215043 [0,2,0,0,0,0|2,0,0]=4 16347 B15R1.2345 Cc1cc(c(cc1F)C(=O)CCCO)Cl 1458a_100009857485_100011215043 [0,2,0,0,0,0|2,0,0]=4 16348 B15R1.2345 Cc1cc(c(cc1F)C(=O)CCCO)F 1458a_100000686409_100011215043 [0,2,0,0,0,0|2,0,0]=4 16349 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Br 11a_100000724931_200012355688 [0,2,0,0,0,0|2,0,0]=4 16350 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Br 1626a_100000724931_200012355688 [0,2,0,0,0,0|2,0,0]=4 16351 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Br 240690a_100000724931_200012355688 [0,2,0,0,0,0|2,0,0]=4 16352 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Br 527a_100000724931_200012355688 [0,2,0,0,0,0|2,0,0]=4 16353 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Cl 11a_100000724931_100009857485 [0,2,0,0,0,0|2,0,0]=4 16354 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Cl 1626a_100000724931_100009857485 [0,2,0,0,0,0|2,0,0]=4 16355 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Cl 240690a_100000724931_100009857485 [0,2,0,0,0,0|2,0,0]=4 16356 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)Cl 527a_100000724931_100009857485 [0,2,0,0,0,0|2,0,0]=4 16357 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)F 11a_100000724931_100000686409 [0,2,0,0,0,0|2,0,0]=4 16358 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)F 1626a_100000724931_100000686409 [0,2,0,0,0,0|2,0,0]=4 16359 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)F 240690a_100000724931_100000686409 [0,2,0,0,0,0|2,0,0]=4 16360 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCF)F 527a_100000724931_100000686409 [0,2,0,0,0,0|2,0,0]=4 16361 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCO)Br 240690a_100000210304_200012355688 [0,2,0,0,0,0|1,0,0]=3 16362 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCO)Br 527a_100000210304_200012355688 [0,2,0,0,0,0|1,0,0]=3 16363 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCO)Cl 240690a_100000210304_100009857485 [0,2,0,0,0,0|1,0,0]=3 16364 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCO)Cl 527a_100000210304_100009857485 [0,2,0,0,0,0|1,0,0]=3 16365 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCO)F 240690a_100000210304_100000686409 [0,2,0,0,0,0|1,0,0]=3 16366 B15R1.2345 Cc1cc(c(cc1F)C(=O)NCCO)F 527a_100000210304_100000686409 [0,2,0,0,0,0|1,0,0]=3 16367 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)CCCO 1458a_100000687843_100011215043 [0,2,0,0,0,0|1,1,0]=4 16368 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)NCCF 11a_100000724931_100000687843 [0,2,0,0,0,0|1,1,0]=4 16369 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)NCCF 1626a_100000724931_100000687843 [0,2,0,0,0,0|1,1,0]=4 16370 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)NCCF 240690a_100000724931_100000687843 [0,2,0,0,0,0|1,1,0]=4 16371 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)NCCF 527a_100000724931_100000687843 [0,2,0,0,0,0|1,1,0]=4 16372 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)NCCO 240690a_100000210304_100000687843 [0,2,0,0,0,0|0,1,0]=3 16373 B15R1.2345 Cc1cc(c(cc1F)Cl)C(=O)NCCO 527a_100000210304_100000687843 [0,2,0,0,0,0|0,1,0]=3 16374 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)CCCO 1458a_100000767126_100011215043 [0,2,0,0,0,0|1,1,0]=4 16375 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)NCCF 11a_100000724931_100000767126 [0,2,0,0,0,0|1,1,0]=4 16376 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)NCCF 1626a_100000724931_100000767126 [0,2,0,0,0,0|1,1,0]=4 16377 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)NCCF 240690a_100000724931_100000767126 [0,2,0,0,0,0|1,1,0]=4 16378 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)NCCF 527a_100000724931_100000767126 [0,2,0,0,0,0|1,1,0]=4 16379 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)NCCO 240690a_100000210304_100000767126 [0,2,0,0,0,0|0,1,0]=3 16380 B15R1.2345 Cc1cc(c(cc1F)F)C(=O)NCCO 527a_100000210304_100000767126 [0,2,0,0,0,0|0,1,0]=3 16381 B15R1.2345 Cc1cc(c(cc1I)C(=O)CCCO)C 1458a_100000723791_100011215043 [0,2,0,0,0,0|2,0,0]=4 16382 B15R1.2345 Cc1cc(c(cc1I)C(=O)NCCF)C 11a_100000724931_100000723791 [0,2,0,0,0,0|2,0,0]=4 16383 B15R1.2345 Cc1cc(c(cc1I)C(=O)NCCF)C 1626a_100000724931_100000723791 [0,2,0,0,0,0|2,0,0]=4 16384 B15R1.2345 Cc1cc(c(cc1I)C(=O)NCCF)C 240690a_100000724931_100000723791 [0,2,0,0,0,0|2,0,0]=4 16385 B15R1.2345 Cc1cc(c(cc1I)C(=O)NCCF)C 527a_100000724931_100000723791 [0,2,0,0,0,0|2,0,0]=4 16386 B15R1.2345 Cc1cc(c(cc1I)C(=O)NCCO)C 240690a_100000210304_100000723791 [0,2,0,0,0,0|1,0,0]=3 16387 B15R1.2345 Cc1cc(c(cc1I)C(=O)NCCO)C 527a_100000210304_100000723791 [0,2,0,0,0,0|1,0,0]=3 16388 B15R1.2345 Cc1cc(c(cc1O)C(=O)CCCO)F 1458a_100009839767_100011215043 [0,2,0,0,0,0|2,0,0]=4 16389 B15R1.2345 Cc1cc(c(cc1O)C(=O)NCCF)F 240690a_100000724931_100009839767 [0,2,0,0,0,0|2,0,0]=4 16390 B15R1.2345 Cc1cc(c(cc1O)C(=O)NCCO)F 240690a_100000210304_100009839767 [0,2,0,0,0,0|1,0,0]=3 16391 B15R1.2345 N#CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100000734998_100011934218 [0,2,0,0,0,0|1,0,1]=4 16392 B15R1.2345 N#CCNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100000734998_100011934218 [0,2,0,0,0,0|1,0,1]=4 16393 B15R1.2345 N#CCNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100000734998_100000212284 [0,2,0,0,0,0|1,0,1]=4 16394 B15R1.2345 N#CCNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100000734998_100000212284 [0,2,0,0,0,0|1,0,1]=4 16395 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100000734998_100011217226 [0,2,0,0,0,0|1,0,1]=4 16396 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)Br 527a_100000734998_100011217226 [0,2,0,0,0,0|1,0,1]=4 16397 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100000734998_100011217469 [0,2,0,0,0,0|1,0,1]=4 16398 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100000734998_100011217469 [0,2,0,0,0,0|1,0,1]=4 16399 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)F 1626a_100000734998_100000690020 [0,2,0,0,0,0|1,0,1]=4 16400 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)F 527a_100000734998_100000690020 [0,2,0,0,0,0|1,0,1]=4 16401 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)I 1626a_100000734998_100012920488 [0,2,0,0,0,0|1,0,1]=4 16402 B15R1.2345 N#CCNC(=O)c1cc(c(cc1F)Cl)I 527a_100000734998_100012920488 [0,2,0,0,0,0|1,0,1]=4 16403 B15R1.2345 N#CCNC(=O)c1cc(c(cc1O)Cl)Br 527a_100000734998_200009814723 [0,2,0,0,0,0|1,0,1]=4 16404 B15R1.2345 O=C(CCCF)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100011934791 [0,2,0,0,0,0|2,0,0]=4 16405 B15R1.2345 O=C(CCCF)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100011934791 [0,2,0,0,0,0|2,0,0]=4 16406 B15R1.2345 O=C(CCCF)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100011934791 [0,2,0,0,0,0|2,0,0]=4 16407 B15R1.2345 O=C(CCCF)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100011934791 [0,2,0,0,0,0|2,0,0]=4 16408 B15R1.2345 O=C(CCCF)c1cc(c(cc1F)Cl)F 1458a_100000690020_100011934791 [0,2,0,0,0,0|2,0,0]=4 16409 B15R1.2345 O=C(CCCF)c1cc(c(cc1F)Cl)I 1458a_100012920488_100011934791 [0,2,0,0,0,0|2,0,0]=4 16410 B15R1.2345 O=C(CCCF)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100011934791 [0,2,0,0,0,0|2,0,0]=4 16411 B15R1.2345 O=C(CCCO)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100011215043 [0,2,0,0,0,0|1,1,0]=4 16412 B15R1.2345 O=C(CCCO)c1cc(c(cc1Br)F)F 1458a_100000685074_100011215043 [0,2,0,0,0,0|1,1,0]=4 16413 B15R1.2345 O=C(CCCO)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100011215043 [0,2,0,0,0,0|1,1,0]=4 16414 B15R1.2345 O=C(CCCO)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100011215043 [0,2,0,0,0,0|1,1,0]=4 16415 B15R1.2345 O=C(CCCO)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100011215043 [0,2,0,0,0,0|1,0,0]=3 16416 B15R1.2345 O=C(CCCO)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100011215043 [0,2,0,0,0,0|1,0,0]=3 16417 B15R1.2345 O=C(CCCO)c1cc(c(cc1Cl)F)F 1458a_100025704182_100011215043 [0,2,0,0,0,0|1,1,0]=4 16418 B15R1.2345 O=C(CCCO)c1cc(c(cc1Cl)F)I 1458a_100012920486_100011215043 [0,2,0,0,0,0|1,1,0]=4 16419 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Br)Br 1458a_200011217225_100011215043 [0,2,0,0,0,0|1,1,0]=4 16420 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100011215043 [0,2,0,0,0,0|1,1,0]=4 16421 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Br)F 1458a_100012024349_100011215043 [0,2,0,0,0,0|1,1,0]=4 16422 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100011215043 [0,2,0,0,0,0|1,0,0]=3 16423 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100011215043 [0,2,0,0,0,0|1,0,0]=3 16424 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Cl)F 1458a_100000690020_100011215043 [0,2,0,0,0,0|1,0,0]=3 16425 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)Cl)I 1458a_100012920488_100011215043 [0,2,0,0,0,0|1,0,0]=3 16426 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)F)Br 1458a_100000718434_100011215043 [0,2,0,0,0,0|1,1,0]=4 16427 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)F)Cl 1458a_100011997751_100011215043 [0,2,0,0,0,0|1,1,0]=4 16428 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)F)F 1458a_100000687535_100011215043 [0,2,0,0,0,0|1,1,0]=4 16429 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)F)I 1458a_100000691139_100011215043 [0,2,0,0,0,0|1,1,0]=4 16430 B15R1.2345 O=C(CCCO)c1cc(c(cc1F)O)Cl 1458a_200009924051_100011215043 [0,2,0,0,0,0|2,0,0]=4 16431 B15R1.2345 O=C(CCCO)c1cc(c(cc1I)F)F 1458a_100000688017_100011215043 [0,2,0,0,0,0|1,1,0]=4 16432 B15R1.2345 O=C(CCCO)c1cc(c(cc1O)Br)F 1458a_100010827371_100011215043 [0,2,0,0,0,0|1,1,0]=4 16433 B15R1.2345 O=C(CCCO)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100011215043 [0,2,0,0,0,0|1,0,0]=3 16434 B15R1.2345 O=C(CCCO)c1cc(c(cc1O)F)Br 1458a_100010188153_100011215043 [0,2,0,0,0,0|1,1,0]=4 16435 B15R1.2345 O=C(CCCO)c1cc(c(cc1O)F)Cl 1458a_100009910333_100011215043 [0,2,0,0,0,0|1,1,0]=4 16436 B15R1.2345 O=C(CCCO)c1cc(c(cc1O)F)F 1458a_100012182723_100011215043 [0,2,0,0,0,0|1,1,0]=4 16437 B15R1.2345 O=C(CCCO)c1cc(c(cc1O)O)Br 1458a_100009813906_100011215043 [0,2,0,0,0,0|2,0,0]=4 16438 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)Cl 11a_100000724931_100012921620 [0,2,0,0,0,0|1,1,0]=4 16439 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)Cl 1626a_100000724931_100012921620 [0,2,0,0,0,0|1,1,0]=4 16440 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)Cl 240690a_100000724931_100012921620 [0,2,0,0,0,0|1,1,0]=4 16441 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)Cl 527a_100000724931_100012921620 [0,2,0,0,0,0|1,1,0]=4 16442 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)F 11a_100000724931_100000685074 [0,2,0,0,0,0|1,1,0]=4 16443 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)F 1626a_100000724931_100000685074 [0,2,0,0,0,0|1,1,0]=4 16444 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)F 240690a_100000724931_100000685074 [0,2,0,0,0,0|1,1,0]=4 16445 B15R1.2345 O=C(NCCF)c1cc(c(cc1Br)F)F 527a_100000724931_100000685074 [0,2,0,0,0,0|1,1,0]=4 16446 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)Cl 11a_100000724931_100000246132 [0,2,0,0,0,0|1,1,0]=4 16447 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)Cl 1626a_100000724931_100000246132 [0,2,0,0,0,0|1,1,0]=4 16448 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)Cl 240690a_100000724931_100000246132 [0,2,0,0,0,0|1,1,0]=4 16449 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)Cl 527a_100000724931_100000246132 [0,2,0,0,0,0|1,1,0]=4 16450 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)F 11a_100000724931_100000724438 [0,2,0,0,0,0|1,1,0]=4 16451 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)F 1626a_100000724931_100000724438 [0,2,0,0,0,0|1,1,0]=4 16452 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)F 240690a_100000724931_100000724438 [0,2,0,0,0,0|1,1,0]=4 16453 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Br)F 527a_100000724931_100000724438 [0,2,0,0,0,0|1,1,0]=4 16454 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)Cl 11a_100000724931_100011934218 [0,2,0,0,0,0|1,0,0]=3 16455 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)Cl 1626a_100000724931_100011934218 [0,2,0,0,0,0|1,0,0]=3 16456 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)Cl 240690a_100000724931_100011934218 [0,2,0,0,0,0|1,0,0]=3 16457 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)Cl 527a_100000724931_100011934218 [0,2,0,0,0,0|1,0,0]=3 16458 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)F 11a_100000724931_100000212284 [0,2,0,0,0,0|1,0,0]=3 16459 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)F 1626a_100000724931_100000212284 [0,2,0,0,0,0|1,0,0]=3 16460 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)F 240690a_100000724931_100000212284 [0,2,0,0,0,0|1,0,0]=3 16461 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)Cl)F 527a_100000724931_100000212284 [0,2,0,0,0,0|1,0,0]=3 16462 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)F 11a_100000724931_100025704182 [0,2,0,0,0,0|1,1,0]=4 16463 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)F 1626a_100000724931_100025704182 [0,2,0,0,0,0|1,1,0]=4 16464 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)F 240690a_100000724931_100025704182 [0,2,0,0,0,0|1,1,0]=4 16465 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)F 527a_100000724931_100025704182 [0,2,0,0,0,0|1,1,0]=4 16466 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)I 11a_100000724931_100012920486 [0,2,0,0,0,0|1,1,0]=4 16467 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)I 1626a_100000724931_100012920486 [0,2,0,0,0,0|1,1,0]=4 16468 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)I 240690a_100000724931_100012920486 [0,2,0,0,0,0|1,1,0]=4 16469 B15R1.2345 O=C(NCCF)c1cc(c(cc1Cl)F)I 527a_100000724931_100012920486 [0,2,0,0,0,0|1,1,0]=4 16470 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Br 11a_100000724931_200011217225 [0,2,0,0,0,0|1,1,0]=4 16471 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Br 1626a_100000724931_200011217225 [0,2,0,0,0,0|1,1,0]=4 16472 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Br 240690a_100000724931_200011217225 [0,2,0,0,0,0|1,1,0]=4 16473 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Br 527a_100000724931_200011217225 [0,2,0,0,0,0|1,1,0]=4 16474 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Cl 11a_100000724931_100012347732 [0,2,0,0,0,0|1,1,0]=4 16475 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Cl 1626a_100000724931_100012347732 [0,2,0,0,0,0|1,1,0]=4 16476 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Cl 240690a_100000724931_100012347732 [0,2,0,0,0,0|1,1,0]=4 16477 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)Cl 527a_100000724931_100012347732 [0,2,0,0,0,0|1,1,0]=4 16478 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)F 11a_100000724931_100012024349 [0,2,0,0,0,0|1,1,0]=4 16479 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)F 1626a_100000724931_100012024349 [0,2,0,0,0,0|1,1,0]=4 16480 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)F 240690a_100000724931_100012024349 [0,2,0,0,0,0|1,1,0]=4 16481 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Br)F 527a_100000724931_100012024349 [0,2,0,0,0,0|1,1,0]=4 16482 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Br 11a_100000724931_100011217226 [0,2,0,0,0,0|1,0,0]=3 16483 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Br 1626a_100000724931_100011217226 [0,2,0,0,0,0|1,0,0]=3 16484 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Br 240690a_100000724931_100011217226 [0,2,0,0,0,0|1,0,0]=3 16485 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Br 527a_100000724931_100011217226 [0,2,0,0,0,0|1,0,0]=3 16486 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Cl 11a_100000724931_100011217469 [0,2,0,0,0,0|1,0,0]=3 16487 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Cl 1626a_100000724931_100011217469 [0,2,0,0,0,0|1,0,0]=3 16488 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Cl 240690a_100000724931_100011217469 [0,2,0,0,0,0|1,0,0]=3 16489 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)Cl 527a_100000724931_100011217469 [0,2,0,0,0,0|1,0,0]=3 16490 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)F 11a_100000724931_100000690020 [0,2,0,0,0,0|1,0,0]=3 16491 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)F 1626a_100000724931_100000690020 [0,2,0,0,0,0|1,0,0]=3 16492 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)F 240690a_100000724931_100000690020 [0,2,0,0,0,0|1,0,0]=3 16493 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)F 527a_100000724931_100000690020 [0,2,0,0,0,0|1,0,0]=3 16494 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)I 11a_100000724931_100012920488 [0,2,0,0,0,0|1,0,0]=3 16495 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)I 1626a_100000724931_100012920488 [0,2,0,0,0,0|1,0,0]=3 16496 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)I 240690a_100000724931_100012920488 [0,2,0,0,0,0|1,0,0]=3 16497 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)Cl)I 527a_100000724931_100012920488 [0,2,0,0,0,0|1,0,0]=3 16498 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Br 11a_100000724931_100000718434 [0,2,0,0,0,0|1,1,0]=4 16499 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Br 1626a_100000724931_100000718434 [0,2,0,0,0,0|1,1,0]=4 16500 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Br 240690a_100000724931_100000718434 [0,2,0,0,0,0|1,1,0]=4 16501 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Br 527a_100000724931_100000718434 [0,2,0,0,0,0|1,1,0]=4 16502 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Cl 11a_100000724931_100011997751 [0,2,0,0,0,0|1,1,0]=4 16503 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Cl 1626a_100000724931_100011997751 [0,2,0,0,0,0|1,1,0]=4 16504 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Cl 240690a_100000724931_100011997751 [0,2,0,0,0,0|1,1,0]=4 16505 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)Cl 527a_100000724931_100011997751 [0,2,0,0,0,0|1,1,0]=4 16506 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)F 11a_100000724931_100000687535 [0,2,0,0,0,0|1,1,0]=4 16507 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)F 1626a_100000724931_100000687535 [0,2,0,0,0,0|1,1,0]=4 16508 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)F 240690a_100000724931_100000687535 [0,2,0,0,0,0|1,1,0]=4 16509 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)F 527a_100000724931_100000687535 [0,2,0,0,0,0|1,1,0]=4 16510 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)I 11a_100000724931_100000691139 [0,2,0,0,0,0|1,1,0]=4 16511 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)I 1626a_100000724931_100000691139 [0,2,0,0,0,0|1,1,0]=4 16512 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)I 240690a_100000724931_100000691139 [0,2,0,0,0,0|1,1,0]=4 16513 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)F)I 527a_100000724931_100000691139 [0,2,0,0,0,0|1,1,0]=4 16514 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)O)Cl 240690a_100000724931_200009924051 [0,2,0,0,0,0|2,0,0]=4 16515 B15R1.2345 O=C(NCCF)c1cc(c(cc1F)O)Cl 527a_100000724931_200009924051 [0,2,0,0,0,0|2,0,0]=4 16516 B15R1.2345 O=C(NCCF)c1cc(c(cc1I)F)F 11a_100000724931_100000688017 [0,2,0,0,0,0|1,1,0]=4 16517 B15R1.2345 O=C(NCCF)c1cc(c(cc1I)F)F 1626a_100000724931_100000688017 [0,2,0,0,0,0|1,1,0]=4 16518 B15R1.2345 O=C(NCCF)c1cc(c(cc1I)F)F 240690a_100000724931_100000688017 [0,2,0,0,0,0|1,1,0]=4 16519 B15R1.2345 O=C(NCCF)c1cc(c(cc1I)F)F 527a_100000724931_100000688017 [0,2,0,0,0,0|1,1,0]=4 16520 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)Br)F 240690a_100000724931_100010827371 [0,2,0,0,0,0|1,1,0]=4 16521 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)Br)F 527a_100000724931_100010827371 [0,2,0,0,0,0|1,1,0]=4 16522 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)Cl)Br 240690a_100000724931_200009814723 [0,2,0,0,0,0|1,0,0]=3 16523 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)Cl)Br 527a_100000724931_200009814723 [0,2,0,0,0,0|1,0,0]=3 16524 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)F)Br 240690a_100000724931_100010188153 [0,2,0,0,0,0|1,1,0]=4 16525 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)F)Br 527a_100000724931_100010188153 [0,2,0,0,0,0|1,1,0]=4 16526 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)F)Cl 240690a_100000724931_100009910333 [0,2,0,0,0,0|1,1,0]=4 16527 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)F)Cl 527a_100000724931_100009910333 [0,2,0,0,0,0|1,1,0]=4 16528 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)F)F 240690a_100000724931_100012182723 [0,2,0,0,0,0|1,1,0]=4 16529 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)F)F 527a_100000724931_100012182723 [0,2,0,0,0,0|1,1,0]=4 16530 B15R1.2345 O=C(NCCF)c1cc(c(cc1O)O)Br 527a_100000724931_100009813906 [0,2,0,0,0,0|2,0,0]=4 16531 B15R1.2345 O=C(NCCO)c1cc(c(cc1Br)F)Cl 240690a_100000210304_100012921620 [0,2,0,0,0,0|0,1,0]=3 16532 B15R1.2345 O=C(NCCO)c1cc(c(cc1Br)F)Cl 527a_100000210304_100012921620 [0,2,0,0,0,0|0,1,0]=3 16533 B15R1.2345 O=C(NCCO)c1cc(c(cc1Br)F)F 240690a_100000210304_100000685074 [0,2,0,0,0,0|0,1,0]=3 16534 B15R1.2345 O=C(NCCO)c1cc(c(cc1Br)F)F 527a_100000210304_100000685074 [0,2,0,0,0,0|0,1,0]=3 16535 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Br)Cl 240690a_100000210304_100000246132 [0,2,0,0,0,0|0,1,0]=3 16536 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Br)Cl 527a_100000210304_100000246132 [0,2,0,0,0,0|0,1,0]=3 16537 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Br)F 240690a_100000210304_100000724438 [0,2,0,0,0,0|0,1,0]=3 16538 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Br)F 527a_100000210304_100000724438 [0,2,0,0,0,0|0,1,0]=3 16539 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Cl)Cl 240690a_100000210304_100011934218 [0,2,0,0,0,0|0,0,0]=2 16540 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Cl)Cl 527a_100000210304_100011934218 [0,2,0,0,0,0|0,0,0]=2 16541 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Cl)F 240690a_100000210304_100000212284 [0,2,0,0,0,0|0,0,0]=2 16542 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)Cl)F 527a_100000210304_100000212284 [0,2,0,0,0,0|0,0,0]=2 16543 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)F)F 240690a_100000210304_100025704182 [0,2,0,0,0,0|0,1,0]=3 16544 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)F)F 527a_100000210304_100025704182 [0,2,0,0,0,0|0,1,0]=3 16545 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)F)I 240690a_100000210304_100012920486 [0,2,0,0,0,0|0,1,0]=3 16546 B15R1.2345 O=C(NCCO)c1cc(c(cc1Cl)F)I 527a_100000210304_100012920486 [0,2,0,0,0,0|0,1,0]=3 16547 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Br)Br 240690a_100000210304_200011217225 [0,2,0,0,0,0|0,1,0]=3 16548 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Br)Br 527a_100000210304_200011217225 [0,2,0,0,0,0|0,1,0]=3 16549 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Br)Cl 240690a_100000210304_100012347732 [0,2,0,0,0,0|0,1,0]=3 16550 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Br)Cl 527a_100000210304_100012347732 [0,2,0,0,0,0|0,1,0]=3 16551 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Br)F 240690a_100000210304_100012024349 [0,2,0,0,0,0|0,1,0]=3 16552 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Br)F 527a_100000210304_100012024349 [0,2,0,0,0,0|0,1,0]=3 16553 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)Br 240690a_100000210304_100011217226 [0,2,0,0,0,0|0,0,0]=2 16554 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)Br 527a_100000210304_100011217226 [0,2,0,0,0,0|0,0,0]=2 16555 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)Cl 240690a_100000210304_100011217469 [0,2,0,0,0,0|0,0,0]=2 16556 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)Cl 527a_100000210304_100011217469 [0,2,0,0,0,0|0,0,0]=2 16557 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)F 240690a_100000210304_100000690020 [0,2,0,0,0,0|0,0,0]=2 16558 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)F 527a_100000210304_100000690020 [0,2,0,0,0,0|0,0,0]=2 16559 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)I 240690a_100000210304_100012920488 [0,2,0,0,0,0|0,0,0]=2 16560 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)Cl)I 527a_100000210304_100012920488 [0,2,0,0,0,0|0,0,0]=2 16561 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)Br 240690a_100000210304_100000718434 [0,2,0,0,0,0|0,1,0]=3 16562 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)Br 527a_100000210304_100000718434 [0,2,0,0,0,0|0,1,0]=3 16563 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)Cl 240690a_100000210304_100011997751 [0,2,0,0,0,0|0,1,0]=3 16564 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)Cl 527a_100000210304_100011997751 [0,2,0,0,0,0|0,1,0]=3 16565 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)F 240690a_100000210304_100000687535 [0,2,0,0,0,0|0,1,0]=3 16566 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)F 527a_100000210304_100000687535 [0,2,0,0,0,0|0,1,0]=3 16567 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)I 240690a_100000210304_100000691139 [0,2,0,0,0,0|0,1,0]=3 16568 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)F)I 527a_100000210304_100000691139 [0,2,0,0,0,0|0,1,0]=3 16569 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)O)Cl 240690a_100000210304_200009924051 [0,2,0,0,0,0|1,0,0]=3 16570 B15R1.2345 O=C(NCCO)c1cc(c(cc1F)O)Cl 527a_100000210304_200009924051 [0,2,0,0,0,0|1,0,0]=3 16571 B15R1.2345 O=C(NCCO)c1cc(c(cc1I)F)F 240690a_100000210304_100000688017 [0,2,0,0,0,0|0,1,0]=3 16572 B15R1.2345 O=C(NCCO)c1cc(c(cc1I)F)F 527a_100000210304_100000688017 [0,2,0,0,0,0|0,1,0]=3 16573 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)Br)F 240690a_100000210304_100010827371 [0,2,0,0,0,0|0,1,0]=3 16574 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)Br)F 527a_100000210304_100010827371 [0,2,0,0,0,0|0,1,0]=3 16575 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)Cl)Br 240690a_100000210304_200009814723 [0,2,0,0,0,0|0,0,0]=2 16576 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)Cl)Br 527a_100000210304_200009814723 [0,2,0,0,0,0|0,0,0]=2 16577 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)F)Br 240690a_100000210304_100010188153 [0,2,0,0,0,0|0,1,0]=3 16578 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)F)Br 527a_100000210304_100010188153 [0,2,0,0,0,0|0,1,0]=3 16579 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)F)Cl 240690a_100000210304_100009910333 [0,2,0,0,0,0|0,1,0]=3 16580 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)F)Cl 527a_100000210304_100009910333 [0,2,0,0,0,0|0,1,0]=3 16581 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)F)F 240690a_100000210304_100012182723 [0,2,0,0,0,0|0,1,0]=3 16582 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)F)F 527a_100000210304_100012182723 [0,2,0,0,0,0|0,1,0]=3 16583 B15R1.2345 O=C(NCCO)c1cc(c(cc1O)O)Br 527a_100000210304_100009813906 [0,2,0,0,0,0|1,0,0]=3 16584 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_100000212058_100010208263 [0,2,0,0,0,0|1,0,1]=4 16585 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100000212058_100010208263 [0,2,0,0,0,0|1,0,1]=4 16586 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100000212058_100010208263 [0,2,0,0,0,0|1,0,1]=4 16587 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100000212058_100010208263 [0,2,0,0,0,0|1,0,1]=4 16588 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)C)Cl 11a_100000212058_100010074829 [0,2,0,0,0,0|1,0,1]=4 16589 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100000212058_100010074829 [0,2,0,0,0,0|1,0,1]=4 16590 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100000212058_100010074829 [0,2,0,0,0,0|1,0,1]=4 16591 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100000212058_100010074829 [0,2,0,0,0,0|1,0,1]=4 16592 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)F)Cl 11a_100000212058_200010192171 [0,2,0,0,0,0|1,0,1]=4 16593 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100000212058_200010192171 [0,2,0,0,0,0|1,0,1]=4 16594 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100000212058_200010192171 [0,2,0,0,0,0|1,0,1]=4 16595 B15R1.2346 C#CCNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100000212058_200010192171 [0,2,0,0,0,0|1,0,1]=4 16596 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)C)Cl 11a_100000212058_100012183103 [0,2,0,0,0,0|1,0,1]=4 16597 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)C)Cl 1626a_100000212058_100012183103 [0,2,0,0,0,0|1,0,1]=4 16598 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)C)Cl 240690a_100000212058_100012183103 [0,2,0,0,0,0|1,0,1]=4 16599 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)C)Cl 527a_100000212058_100012183103 [0,2,0,0,0,0|1,0,1]=4 16600 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)F)Cl 11a_100000212058_100000085317 [0,2,0,0,0,0|1,0,1]=4 16601 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)F)Cl 1626a_100000212058_100000085317 [0,2,0,0,0,0|1,0,1]=4 16602 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)F)Cl 240690a_100000212058_100000085317 [0,2,0,0,0,0|1,0,1]=4 16603 B15R1.2346 C#CCNC(=O)c1ccc(c(c1F)F)Cl 527a_100000212058_100000085317 [0,2,0,0,0,0|1,0,1]=4 16604 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100020586998_100010208263 [0,2,0,0,0,0|1,0,1]=4 16605 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100020586998_100010208263 [0,2,0,0,0,0|1,0,1]=4 16606 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100020586998_100010208263 [0,2,0,0,0,0|1,0,1]=4 16607 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100020586998_100010074829 [0,2,0,0,0,0|1,0,1]=4 16608 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100020586998_100010074829 [0,2,0,0,0,0|1,0,1]=4 16609 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100020586998_100010074829 [0,2,0,0,0,0|1,0,1]=4 16610 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100020586998_200010192171 [0,2,0,0,0,0|1,0,1]=4 16611 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100020586998_200010192171 [0,2,0,0,0,0|1,0,1]=4 16612 B15R1.2346 C=CCNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100020586998_200010192171 [0,2,0,0,0,0|1,0,1]=4 16613 B15R1.2346 C=CCNC(=O)c1ccc(c(c1F)C)Cl 1626a_100020586998_100012183103 [0,2,0,0,0,0|1,0,1]=4 16614 B15R1.2346 C=CCNC(=O)c1ccc(c(c1F)C)Cl 240690a_100020586998_100012183103 [0,2,0,0,0,0|1,0,1]=4 16615 B15R1.2346 C=CCNC(=O)c1ccc(c(c1F)C)Cl 527a_100020586998_100012183103 [0,2,0,0,0,0|1,0,1]=4 16616 B15R1.2346 C=CCNC(=O)c1ccc(c(c1F)F)Cl 1626a_100020586998_100000085317 [0,2,0,0,0,0|1,0,1]=4 16617 B15R1.2346 C=CCNC(=O)c1ccc(c(c1F)F)Cl 240690a_100020586998_100000085317 [0,2,0,0,0,0|1,0,1]=4 16618 B15R1.2346 C=CCNC(=O)c1ccc(c(c1F)F)Cl 527a_100020586998_100000085317 [0,2,0,0,0,0|1,0,1]=4 16619 B15R1.2346 CC(NCCO)c1ccc(c(c1Cl)Cl)Cl 269862a_100000210304_100000211386 [0,2,0,0,0,0|1,0,1]=4 16620 B15R1.2346 CCCCC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_100000210211 [0,2,0,0,0,0|2,0,0]=4 16621 B15R1.2346 CCCCC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100000210211 [0,2,0,0,0,0|2,0,0]=4 16622 B15R1.2346 CCCCC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_100000210211 [0,2,0,0,0,0|2,0,0]=4 16623 B15R1.2346 CCCCC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_100000210211 [0,2,0,0,0,0|2,0,0]=4 16624 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)F)F 11a_100020643023_100012356454 [0,2,0,0,0,0|1,1,0]=4 16625 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)F)F 1626a_100020643023_100012356454 [0,2,0,0,0,0|1,1,0]=4 16626 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)F)F 240690a_100020643023_100012356454 [0,2,0,0,0,0|1,1,0]=4 16627 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)F)F 527a_100020643023_100012356454 [0,2,0,0,0,0|1,1,0]=4 16628 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)O)Br 240690a_100020643023_100016068111 [0,2,0,0,0,0|1,1,0]=4 16629 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)O)Br 527a_100020643023_100016068111 [0,2,0,0,0,0|1,1,0]=4 16630 B15R1.2346 CCCNC(=O)c1ccc(c(c1C)F)F 11a_100020643023_100000061971 [0,2,0,0,0,0|1,1,0]=4 16631 B15R1.2346 CCCNC(=O)c1ccc(c(c1C)F)F 1626a_100020643023_100000061971 [0,2,0,0,0,0|1,1,0]=4 16632 B15R1.2346 CCCNC(=O)c1ccc(c(c1C)F)F 240690a_100020643023_100000061971 [0,2,0,0,0,0|1,1,0]=4 16633 B15R1.2346 CCCNC(=O)c1ccc(c(c1C)F)F 527a_100020643023_100000061971 [0,2,0,0,0,0|1,1,0]=4 16634 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Br)Cl 11a_100020643023_100010208263 [0,2,0,0,0,0|1,0,0]=3 16635 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100020643023_100010208263 [0,2,0,0,0,0|1,0,0]=3 16636 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Br)Cl 240690a_100020643023_100010208263 [0,2,0,0,0,0|1,0,0]=3 16637 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100020643023_100010208263 [0,2,0,0,0,0|1,0,0]=3 16638 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)Cl 11a_100020643023_100010074829 [0,2,0,0,0,0|1,0,0]=3 16639 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)Cl 1626a_100020643023_100010074829 [0,2,0,0,0,0|1,0,0]=3 16640 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)Cl 240690a_100020643023_100010074829 [0,2,0,0,0,0|1,0,0]=3 16641 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)Cl 527a_100020643023_100010074829 [0,2,0,0,0,0|1,0,0]=3 16642 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)F 11a_100020643023_100000061447 [0,2,0,0,0,0|1,1,0]=4 16643 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)F 1626a_100020643023_100000061447 [0,2,0,0,0,0|1,1,0]=4 16644 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)F 240690a_100020643023_100000061447 [0,2,0,0,0,0|1,1,0]=4 16645 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)C)F 527a_100020643023_100000061447 [0,2,0,0,0,0|1,1,0]=4 16646 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)Br 11a_100020643023_200012347731 [0,2,0,0,0,0|1,1,0]=4 16647 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)Br 1626a_100020643023_200012347731 [0,2,0,0,0,0|1,1,0]=4 16648 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)Br 240690a_100020643023_200012347731 [0,2,0,0,0,0|1,1,0]=4 16649 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)Br 527a_100020643023_200012347731 [0,2,0,0,0,0|1,1,0]=4 16650 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)F 11a_100020643023_100010209669 [0,2,0,0,0,0|1,1,0]=4 16651 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)F 1626a_100020643023_100010209669 [0,2,0,0,0,0|1,1,0]=4 16652 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)F 240690a_100020643023_100010209669 [0,2,0,0,0,0|1,1,0]=4 16653 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)Cl)F 527a_100020643023_100010209669 [0,2,0,0,0,0|1,1,0]=4 16654 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)Cl 11a_100020643023_200010192171 [0,2,0,0,0,0|1,0,0]=3 16655 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100020643023_200010192171 [0,2,0,0,0,0|1,0,0]=3 16656 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)Cl 240690a_100020643023_200010192171 [0,2,0,0,0,0|1,0,0]=3 16657 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100020643023_200010192171 [0,2,0,0,0,0|1,0,0]=3 16658 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)F 11a_100020643023_100009888510 [0,2,0,0,0,0|1,1,0]=4 16659 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)F 1626a_100020643023_100009888510 [0,2,0,0,0,0|1,1,0]=4 16660 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)F 240690a_100020643023_100009888510 [0,2,0,0,0,0|1,1,0]=4 16661 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)F)F 527a_100020643023_100009888510 [0,2,0,0,0,0|1,1,0]=4 16662 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)O)O 240690a_100020643023_100009910189 [0,2,0,0,0,0|2,0,0]=4 16663 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)Br 11a_100020643023_200016032200 [0,2,0,0,0,0|1,1,0]=4 16664 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)Br 1626a_100020643023_200016032200 [0,2,0,0,0,0|1,1,0]=4 16665 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)Br 240690a_100020643023_200016032200 [0,2,0,0,0,0|1,1,0]=4 16666 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)Br 527a_100020643023_200016032200 [0,2,0,0,0,0|1,1,0]=4 16667 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)F 11a_100020643023_100010204296 [0,2,0,0,0,0|1,1,0]=4 16668 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)F 1626a_100020643023_100010204296 [0,2,0,0,0,0|1,1,0]=4 16669 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)F 240690a_100020643023_100010204296 [0,2,0,0,0,0|1,1,0]=4 16670 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Br)F 527a_100020643023_100010204296 [0,2,0,0,0,0|1,1,0]=4 16671 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Br 11a_100020643023_100000722919 [0,2,0,0,0,0|1,1,0]=4 16672 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Br 1626a_100020643023_100000722919 [0,2,0,0,0,0|1,1,0]=4 16673 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Br 240690a_100020643023_100000722919 [0,2,0,0,0,0|1,1,0]=4 16674 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Br 527a_100020643023_100000722919 [0,2,0,0,0,0|1,1,0]=4 16675 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)C 11a_100020643023_100010768504 [0,2,0,0,0,0|2,0,0]=4 16676 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)C 1626a_100020643023_100010768504 [0,2,0,0,0,0|2,0,0]=4 16677 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)C 240690a_100020643023_100010768504 [0,2,0,0,0,0|2,0,0]=4 16678 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)C 527a_100020643023_100010768504 [0,2,0,0,0,0|2,0,0]=4 16679 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Cl 11a_100020643023_100012183103 [0,2,0,0,0,0|1,0,0]=3 16680 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Cl 1626a_100020643023_100012183103 [0,2,0,0,0,0|1,0,0]=3 16681 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Cl 240690a_100020643023_100012183103 [0,2,0,0,0,0|1,0,0]=3 16682 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)Cl 527a_100020643023_100012183103 [0,2,0,0,0,0|1,0,0]=3 16683 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)F 11a_100020643023_100000067293 [0,2,0,0,0,0|1,1,0]=4 16684 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)F 1626a_100020643023_100000067293 [0,2,0,0,0,0|1,1,0]=4 16685 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)F 240690a_100020643023_100000067293 [0,2,0,0,0,0|1,1,0]=4 16686 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)C)F 527a_100020643023_100000067293 [0,2,0,0,0,0|1,1,0]=4 16687 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)Br 11a_100020643023_100000719840 [0,2,0,0,0,0|1,1,0]=4 16688 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)Br 1626a_100020643023_100000719840 [0,2,0,0,0,0|1,1,0]=4 16689 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)Br 240690a_100020643023_100000719840 [0,2,0,0,0,0|1,1,0]=4 16690 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)Br 527a_100020643023_100000719840 [0,2,0,0,0,0|1,1,0]=4 16691 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)C 11a_100020643023_100000722910 [0,2,0,0,0,0|2,0,0]=4 16692 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)C 1626a_100020643023_100000722910 [0,2,0,0,0,0|2,0,0]=4 16693 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)C 240690a_100020643023_100000722910 [0,2,0,0,0,0|2,0,0]=4 16694 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)C 527a_100020643023_100000722910 [0,2,0,0,0,0|2,0,0]=4 16695 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)F 11a_100020643023_100000034381 [0,2,0,0,0,0|1,1,0]=4 16696 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)F 1626a_100020643023_100000034381 [0,2,0,0,0,0|1,1,0]=4 16697 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)F 240690a_100020643023_100000034381 [0,2,0,0,0,0|1,1,0]=4 16698 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)Cl)F 527a_100020643023_100000034381 [0,2,0,0,0,0|1,1,0]=4 16699 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Br 11a_100020643023_100009816880 [0,2,0,0,0,0|1,1,0]=4 16700 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Br 1626a_100020643023_100009816880 [0,2,0,0,0,0|1,1,0]=4 16701 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Br 240690a_100020643023_100009816880 [0,2,0,0,0,0|1,1,0]=4 16702 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Br 527a_100020643023_100009816880 [0,2,0,0,0,0|1,1,0]=4 16703 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)C 11a_100020643023_100011219789 [0,2,0,0,0,0|2,0,0]=4 16704 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)C 1626a_100020643023_100011219789 [0,2,0,0,0,0|2,0,0]=4 16705 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)C 240690a_100020643023_100011219789 [0,2,0,0,0,0|2,0,0]=4 16706 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)C 527a_100020643023_100011219789 [0,2,0,0,0,0|2,0,0]=4 16707 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Cl 11a_100020643023_100000085317 [0,2,0,0,0,0|1,0,0]=3 16708 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Cl 1626a_100020643023_100000085317 [0,2,0,0,0,0|1,0,0]=3 16709 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Cl 240690a_100020643023_100000085317 [0,2,0,0,0,0|1,0,0]=3 16710 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)Cl 527a_100020643023_100000085317 [0,2,0,0,0,0|1,0,0]=3 16711 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)F 11a_100020643023_100000766628 [0,2,0,0,0,0|1,1,0]=4 16712 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)F 1626a_100020643023_100000766628 [0,2,0,0,0,0|1,1,0]=4 16713 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)F 240690a_100020643023_100000766628 [0,2,0,0,0,0|1,1,0]=4 16714 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)F 527a_100020643023_100000766628 [0,2,0,0,0,0|1,1,0]=4 16715 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)I 11a_100020643023_100010177778 [0,2,0,0,0,0|1,1,0]=4 16716 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)I 1626a_100020643023_100010177778 [0,2,0,0,0,0|1,1,0]=4 16717 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)I 240690a_100020643023_100010177778 [0,2,0,0,0,0|1,1,0]=4 16718 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)I 527a_100020643023_100010177778 [0,2,0,0,0,0|1,1,0]=4 16719 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)O 240690a_100020643023_100000036740 [0,2,0,0,0,0|2,0,0]=4 16720 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)O)F 240690a_100020643023_100000084588 [0,2,0,0,0,0|1,1,0]=4 16721 B15R1.2346 CCCNC(=O)c1ccc(c(c1I)C)C 11a_100020643023_100010188221 [0,2,0,0,0,0|2,0,0]=4 16722 B15R1.2346 CCCNC(=O)c1ccc(c(c1I)C)C 1626a_100020643023_100010188221 [0,2,0,0,0,0|2,0,0]=4 16723 B15R1.2346 CCCNC(=O)c1ccc(c(c1I)C)C 240690a_100020643023_100010188221 [0,2,0,0,0,0|2,0,0]=4 16724 B15R1.2346 CCCNC(=O)c1ccc(c(c1I)C)C 527a_100020643023_100010188221 [0,2,0,0,0,0|2,0,0]=4 16725 B15R1.2346 CCCNC(=O)c1ccc(c(c1O)C)C 240690a_100020643023_100000742916 [0,2,0,0,0,0|2,0,0]=4 16726 B15R1.2346 CCCNC(=O)c1ccc(c(c1O)C)C 527a_100020643023_100000742916 [0,2,0,0,0,0|2,0,0]=4 16727 B15R1.2346 CCCNC(=O)c1ccc(c(c1O)F)Br 240690a_100020643023_100010761495 [0,2,0,0,0,0|1,1,0]=4 16728 B15R1.2346 CCCNC(=O)c1ccc(c(c1O)F)Br 527a_100020643023_100010761495 [0,2,0,0,0,0|1,1,0]=4 16729 B15R1.2346 CCCNC(=O)c1ccc(c(c1O)F)F 240690a_100020643023_100011799213 [0,2,0,0,0,0|1,1,0]=4 16730 B15R1.2346 CCNNC(=O)c1ccc(c(c1Cl)Br)Cl 22a_100000756455_100010208263 [0,2,0,0,0,0|2,0,0]=4 16731 B15R1.2346 CCNNC(=O)c1ccc(c(c1Cl)C)Cl 22a_100000756455_100010074829 [0,2,0,0,0,0|2,0,0]=4 16732 B15R1.2346 CCNNC(=O)c1ccc(c(c1Cl)F)Cl 22a_100000756455_200010192171 [0,2,0,0,0,0|2,0,0]=4 16733 B15R1.2346 CCNNC(=O)c1ccc(c(c1F)C)Cl 22a_100000756455_100012183103 [0,2,0,0,0,0|2,0,0]=4 16734 B15R1.2346 CCNNC(=O)c1ccc(c(c1F)F)Cl 22a_100000756455_100000085317 [0,2,0,0,0,0|2,0,0]=4 16735 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)CCCF)Cl 1458a_100010074829_100011934791 [0,2,0,0,0,0|2,0,0]=4 16736 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)CCCO)Cl 1458a_100010074829_100011215043 [0,2,0,0,0,0|1,0,0]=3 16737 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)CCCO)F 1458a_100000061447_100011215043 [0,2,0,0,0,0|1,1,0]=4 16738 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCC#N)Cl 1626a_100000734998_100010074829 [0,2,0,0,0,0|1,0,1]=4 16739 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCC#N)Cl 527a_100000734998_100010074829 [0,2,0,0,0,0|1,0,1]=4 16740 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)Cl 11a_100000724931_100010074829 [0,2,0,0,0,0|1,0,0]=3 16741 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)Cl 1626a_100000724931_100010074829 [0,2,0,0,0,0|1,0,0]=3 16742 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)Cl 240690a_100000724931_100010074829 [0,2,0,0,0,0|1,0,0]=3 16743 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)Cl 527a_100000724931_100010074829 [0,2,0,0,0,0|1,0,0]=3 16744 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)F 11a_100000724931_100000061447 [0,2,0,0,0,0|1,1,0]=4 16745 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)F 1626a_100000724931_100000061447 [0,2,0,0,0,0|1,1,0]=4 16746 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)F 240690a_100000724931_100000061447 [0,2,0,0,0,0|1,1,0]=4 16747 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCF)F 527a_100000724931_100000061447 [0,2,0,0,0,0|1,1,0]=4 16748 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCO)Cl 240690a_100000210304_100010074829 [0,2,0,0,0,0|0,0,0]=2 16749 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCO)Cl 527a_100000210304_100010074829 [0,2,0,0,0,0|0,0,0]=2 16750 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCO)F 240690a_100000210304_100000061447 [0,2,0,0,0,0|0,1,0]=3 16751 B15R1.2346 Cc1c(ccc(c1Cl)C(=O)NCCO)F 527a_100000210304_100000061447 [0,2,0,0,0,0|0,1,0]=3 16752 B15R1.2346 Cc1c(ccc(c1Cl)C(C)NCCO)Cl 269862a_100000210304_100011094272 [0,2,0,0,0,0|1,0,1]=4 16753 B15R1.2346 Cc1c(ccc(c1F)C(=O)CCCF)Cl 1458a_100012183103_100011934791 [0,2,0,0,0,0|2,0,0]=4 16754 B15R1.2346 Cc1c(ccc(c1F)C(=O)CCCO)Br 1458a_100000722919_100011215043 [0,2,0,0,0,0|1,1,0]=4 16755 B15R1.2346 Cc1c(ccc(c1F)C(=O)CCCO)Cl 1458a_100012183103_100011215043 [0,2,0,0,0,0|1,0,0]=3 16756 B15R1.2346 Cc1c(ccc(c1F)C(=O)CCCO)F 1458a_100000067293_100011215043 [0,2,0,0,0,0|1,1,0]=4 16757 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCC#N)Cl 1626a_100000734998_100012183103 [0,2,0,0,0,0|1,0,1]=4 16758 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCC#N)Cl 527a_100000734998_100012183103 [0,2,0,0,0,0|1,0,1]=4 16759 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Br 11a_100000724931_100000722919 [0,2,0,0,0,0|1,1,0]=4 16760 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Br 1626a_100000724931_100000722919 [0,2,0,0,0,0|1,1,0]=4 16761 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Br 240690a_100000724931_100000722919 [0,2,0,0,0,0|1,1,0]=4 16762 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Br 527a_100000724931_100000722919 [0,2,0,0,0,0|1,1,0]=4 16763 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Cl 11a_100000724931_100012183103 [0,2,0,0,0,0|1,0,0]=3 16764 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Cl 1626a_100000724931_100012183103 [0,2,0,0,0,0|1,0,0]=3 16765 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Cl 240690a_100000724931_100012183103 [0,2,0,0,0,0|1,0,0]=3 16766 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)Cl 527a_100000724931_100012183103 [0,2,0,0,0,0|1,0,0]=3 16767 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)F 11a_100000724931_100000067293 [0,2,0,0,0,0|1,1,0]=4 16768 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)F 1626a_100000724931_100000067293 [0,2,0,0,0,0|1,1,0]=4 16769 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)F 240690a_100000724931_100000067293 [0,2,0,0,0,0|1,1,0]=4 16770 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCF)F 527a_100000724931_100000067293 [0,2,0,0,0,0|1,1,0]=4 16771 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCO)Br 240690a_100000210304_100000722919 [0,2,0,0,0,0|0,1,0]=3 16772 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCO)Br 527a_100000210304_100000722919 [0,2,0,0,0,0|0,1,0]=3 16773 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCO)Cl 240690a_100000210304_100012183103 [0,2,0,0,0,0|0,0,0]=2 16774 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCO)Cl 527a_100000210304_100012183103 [0,2,0,0,0,0|0,0,0]=2 16775 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCO)F 240690a_100000210304_100000067293 [0,2,0,0,0,0|0,1,0]=3 16776 B15R1.2346 Cc1c(ccc(c1F)C(=O)NCCO)F 527a_100000210304_100000067293 [0,2,0,0,0,0|0,1,0]=3 16777 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)CCCO 1458a_100000061971_100011215043 [0,2,0,0,0,0|1,1,0]=4 16778 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)NCCF 11a_100000724931_100000061971 [0,2,0,0,0,0|1,1,0]=4 16779 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)NCCF 1626a_100000724931_100000061971 [0,2,0,0,0,0|1,1,0]=4 16780 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)NCCF 240690a_100000724931_100000061971 [0,2,0,0,0,0|1,1,0]=4 16781 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)NCCF 527a_100000724931_100000061971 [0,2,0,0,0,0|1,1,0]=4 16782 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)NCCO 240690a_100000210304_100000061971 [0,2,0,0,0,0|0,1,0]=3 16783 B15R1.2346 Cc1c(ccc(c1F)F)C(=O)NCCO 527a_100000210304_100000061971 [0,2,0,0,0,0|0,1,0]=3 16784 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)CCCO 1458a_100010768504_100011215043 [0,2,0,0,0,0|2,0,0]=4 16785 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)NCCF 11a_100000724931_100010768504 [0,2,0,0,0,0|2,0,0]=4 16786 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)NCCF 1626a_100000724931_100010768504 [0,2,0,0,0,0|2,0,0]=4 16787 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)NCCF 240690a_100000724931_100010768504 [0,2,0,0,0,0|2,0,0]=4 16788 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)NCCF 527a_100000724931_100010768504 [0,2,0,0,0,0|2,0,0]=4 16789 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)NCCO 240690a_100000210304_100010768504 [0,2,0,0,0,0|1,0,0]=3 16790 B15R1.2346 Cc1ccc(c(c1C)F)C(=O)NCCO 527a_100000210304_100010768504 [0,2,0,0,0,0|1,0,0]=3 16791 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)CCCO 1458a_100010188221_100011215043 [0,2,0,0,0,0|2,0,0]=4 16792 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)NCCF 11a_100000724931_100010188221 [0,2,0,0,0,0|2,0,0]=4 16793 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)NCCF 1626a_100000724931_100010188221 [0,2,0,0,0,0|2,0,0]=4 16794 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)NCCF 240690a_100000724931_100010188221 [0,2,0,0,0,0|2,0,0]=4 16795 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)NCCF 527a_100000724931_100010188221 [0,2,0,0,0,0|2,0,0]=4 16796 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)NCCO 240690a_100000210304_100010188221 [0,2,0,0,0,0|1,0,0]=3 16797 B15R1.2346 Cc1ccc(c(c1C)I)C(=O)NCCO 527a_100000210304_100010188221 [0,2,0,0,0,0|1,0,0]=3 16798 B15R1.2346 Cc1ccc(c(c1C)O)C(=O)CCCO 1458a_100000742916_100011215043 [0,2,0,0,0,0|2,0,0]=4 16799 B15R1.2346 Cc1ccc(c(c1C)O)C(=O)NCCF 240690a_100000724931_100000742916 [0,2,0,0,0,0|2,0,0]=4 16800 B15R1.2346 Cc1ccc(c(c1C)O)C(=O)NCCF 527a_100000724931_100000742916 [0,2,0,0,0,0|2,0,0]=4 16801 B15R1.2346 Cc1ccc(c(c1C)O)C(=O)NCCO 240690a_100000210304_100000742916 [0,2,0,0,0,0|1,0,0]=3 16802 B15R1.2346 Cc1ccc(c(c1C)O)C(=O)NCCO 527a_100000210304_100000742916 [0,2,0,0,0,0|1,0,0]=3 16803 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)CCCO 1458a_100000722910_100011215043 [0,2,0,0,0,0|2,0,0]=4 16804 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)NCCF 11a_100000724931_100000722910 [0,2,0,0,0,0|2,0,0]=4 16805 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)NCCF 1626a_100000724931_100000722910 [0,2,0,0,0,0|2,0,0]=4 16806 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)NCCF 240690a_100000724931_100000722910 [0,2,0,0,0,0|2,0,0]=4 16807 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)NCCF 527a_100000724931_100000722910 [0,2,0,0,0,0|2,0,0]=4 16808 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)NCCO 240690a_100000210304_100000722910 [0,2,0,0,0,0|1,0,0]=3 16809 B15R1.2346 Cc1ccc(c(c1Cl)F)C(=O)NCCO 527a_100000210304_100000722910 [0,2,0,0,0,0|1,0,0]=3 16810 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)CCCO 1458a_100011219789_100011215043 [0,2,0,0,0,0|2,0,0]=4 16811 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)NCCF 11a_100000724931_100011219789 [0,2,0,0,0,0|2,0,0]=4 16812 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)NCCF 1626a_100000724931_100011219789 [0,2,0,0,0,0|2,0,0]=4 16813 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)NCCF 240690a_100000724931_100011219789 [0,2,0,0,0,0|2,0,0]=4 16814 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)NCCF 527a_100000724931_100011219789 [0,2,0,0,0,0|2,0,0]=4 16815 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)NCCO 240690a_100000210304_100011219789 [0,2,0,0,0,0|1,0,0]=3 16816 B15R1.2346 Cc1ccc(c(c1F)F)C(=O)NCCO 527a_100000210304_100011219789 [0,2,0,0,0,0|1,0,0]=3 16817 B15R1.2346 N#CCNC(=O)c1ccc(c(c1Cl)Br)Cl 1626a_100000734998_100010208263 [0,2,0,0,0,0|1,0,1]=4 16818 B15R1.2346 N#CCNC(=O)c1ccc(c(c1Cl)Br)Cl 527a_100000734998_100010208263 [0,2,0,0,0,0|1,0,1]=4 16819 B15R1.2346 N#CCNC(=O)c1ccc(c(c1Cl)F)Cl 1626a_100000734998_200010192171 [0,2,0,0,0,0|1,0,1]=4 16820 B15R1.2346 N#CCNC(=O)c1ccc(c(c1Cl)F)Cl 527a_100000734998_200010192171 [0,2,0,0,0,0|1,0,1]=4 16821 B15R1.2346 N#CCNC(=O)c1ccc(c(c1F)F)Cl 1626a_100000734998_100000085317 [0,2,0,0,0,0|1,0,1]=4 16822 B15R1.2346 N#CCNC(=O)c1ccc(c(c1F)F)Cl 527a_100000734998_100000085317 [0,2,0,0,0,0|1,0,1]=4 16823 B15R1.2346 O=C(CCCF)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100011934791 [0,2,0,0,0,0|2,0,0]=4 16824 B15R1.2346 O=C(CCCF)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100011934791 [0,2,0,0,0,0|2,0,0]=4 16825 B15R1.2346 O=C(CCCF)c1ccc(c(c1F)F)Cl 1458a_100000085317_100011934791 [0,2,0,0,0,0|2,0,0]=4 16826 B15R1.2346 O=C(CCCO)c1ccc(c(c1Br)F)F 1458a_100012356454_100011215043 [0,2,0,0,0,0|1,1,0]=4 16827 B15R1.2346 O=C(CCCO)c1ccc(c(c1Br)O)Br 1458a_100016068111_100011215043 [0,2,0,0,0,0|1,1,0]=4 16828 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_100011215043 [0,2,0,0,0,0|1,0,0]=3 16829 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_100011215043 [0,2,0,0,0,0|1,1,0]=4 16830 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_100011215043 [0,2,0,0,0,0|1,1,0]=4 16831 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_100011215043 [0,2,0,0,0,0|1,0,0]=3 16832 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)F)F 1458a_100009888510_100011215043 [0,2,0,0,0,0|1,1,0]=4 16833 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)O)O 1458a_100009910189_100011215043 [0,2,0,0,0,0|2,0,0]=4 16834 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)Br)Br 1458a_200016032200_100011215043 [0,2,0,0,0,0|1,1,0]=4 16835 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)Br)F 1458a_100010204296_100011215043 [0,2,0,0,0,0|1,1,0]=4 16836 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)Cl)Br 1458a_100000719840_100011215043 [0,2,0,0,0,0|1,1,0]=4 16837 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)Cl)F 1458a_100000034381_100011215043 [0,2,0,0,0,0|1,1,0]=4 16838 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)F)Br 1458a_100009816880_100011215043 [0,2,0,0,0,0|1,1,0]=4 16839 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)F)Cl 1458a_100000085317_100011215043 [0,2,0,0,0,0|1,0,0]=3 16840 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)F)F 1458a_100000766628_100011215043 [0,2,0,0,0,0|1,1,0]=4 16841 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)F)I 1458a_100010177778_100011215043 [0,2,0,0,0,0|1,1,0]=4 16842 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)F)O 1458a_100000036740_100011215043 [0,2,0,0,0,0|2,0,0]=4 16843 B15R1.2346 O=C(CCCO)c1ccc(c(c1F)O)F 1458a_100000084588_100011215043 [0,2,0,0,0,0|1,1,0]=4 16844 B15R1.2346 O=C(CCCO)c1ccc(c(c1O)F)Br 1458a_100010761495_100011215043 [0,2,0,0,0,0|1,1,0]=4 16845 B15R1.2346 O=C(CCCO)c1ccc(c(c1O)F)F 1458a_100011799213_100011215043 [0,2,0,0,0,0|1,1,0]=4 16846 B15R1.2346 O=C(CCCO)c1ccc(c(c1O)O)O 1458a_100000037941_100011215043 [0,2,0,0,0,0|2,0,0]=4 16847 B15R1.2346 O=C(NCCF)c1ccc(c(c1Br)F)F 11a_100000724931_100012356454 [0,2,0,0,0,0|1,1,0]=4 16848 B15R1.2346 O=C(NCCF)c1ccc(c(c1Br)F)F 1626a_100000724931_100012356454 [0,2,0,0,0,0|1,1,0]=4 16849 B15R1.2346 O=C(NCCF)c1ccc(c(c1Br)F)F 240690a_100000724931_100012356454 [0,2,0,0,0,0|1,1,0]=4 16850 B15R1.2346 O=C(NCCF)c1ccc(c(c1Br)F)F 527a_100000724931_100012356454 [0,2,0,0,0,0|1,1,0]=4 16851 B15R1.2346 O=C(NCCF)c1ccc(c(c1Br)O)Br 240690a_100000724931_100016068111 [0,2,0,0,0,0|1,1,0]=4 16852 B15R1.2346 O=C(NCCF)c1ccc(c(c1Br)O)Br 527a_100000724931_100016068111 [0,2,0,0,0,0|1,1,0]=4 16853 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Br)Cl 11a_100000724931_100010208263 [0,2,0,0,0,0|1,0,0]=3 16854 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Br)Cl 1626a_100000724931_100010208263 [0,2,0,0,0,0|1,0,0]=3 16855 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Br)Cl 240690a_100000724931_100010208263 [0,2,0,0,0,0|1,0,0]=3 16856 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Br)Cl 527a_100000724931_100010208263 [0,2,0,0,0,0|1,0,0]=3 16857 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)Br 11a_100000724931_200012347731 [0,2,0,0,0,0|1,1,0]=4 16858 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)Br 1626a_100000724931_200012347731 [0,2,0,0,0,0|1,1,0]=4 16859 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)Br 240690a_100000724931_200012347731 [0,2,0,0,0,0|1,1,0]=4 16860 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)Br 527a_100000724931_200012347731 [0,2,0,0,0,0|1,1,0]=4 16861 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)F 11a_100000724931_100010209669 [0,2,0,0,0,0|1,1,0]=4 16862 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)F 1626a_100000724931_100010209669 [0,2,0,0,0,0|1,1,0]=4 16863 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)F 240690a_100000724931_100010209669 [0,2,0,0,0,0|1,1,0]=4 16864 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)Cl)F 527a_100000724931_100010209669 [0,2,0,0,0,0|1,1,0]=4 16865 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)Cl 11a_100000724931_200010192171 [0,2,0,0,0,0|1,0,0]=3 16866 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)Cl 1626a_100000724931_200010192171 [0,2,0,0,0,0|1,0,0]=3 16867 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)Cl 240690a_100000724931_200010192171 [0,2,0,0,0,0|1,0,0]=3 16868 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)Cl 527a_100000724931_200010192171 [0,2,0,0,0,0|1,0,0]=3 16869 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)F 11a_100000724931_100009888510 [0,2,0,0,0,0|1,1,0]=4 16870 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)F 1626a_100000724931_100009888510 [0,2,0,0,0,0|1,1,0]=4 16871 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)F 240690a_100000724931_100009888510 [0,2,0,0,0,0|1,1,0]=4 16872 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)F)F 527a_100000724931_100009888510 [0,2,0,0,0,0|1,1,0]=4 16873 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)O)O 240690a_100000724931_100009910189 [0,2,0,0,0,0|2,0,0]=4 16874 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)Br 11a_100000724931_200016032200 [0,2,0,0,0,0|1,1,0]=4 16875 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)Br 1626a_100000724931_200016032200 [0,2,0,0,0,0|1,1,0]=4 16876 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)Br 240690a_100000724931_200016032200 [0,2,0,0,0,0|1,1,0]=4 16877 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)Br 527a_100000724931_200016032200 [0,2,0,0,0,0|1,1,0]=4 16878 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)F 11a_100000724931_100010204296 [0,2,0,0,0,0|1,1,0]=4 16879 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)F 1626a_100000724931_100010204296 [0,2,0,0,0,0|1,1,0]=4 16880 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)F 240690a_100000724931_100010204296 [0,2,0,0,0,0|1,1,0]=4 16881 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Br)F 527a_100000724931_100010204296 [0,2,0,0,0,0|1,1,0]=4 16882 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)Br 11a_100000724931_100000719840 [0,2,0,0,0,0|1,1,0]=4 16883 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)Br 1626a_100000724931_100000719840 [0,2,0,0,0,0|1,1,0]=4 16884 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)Br 240690a_100000724931_100000719840 [0,2,0,0,0,0|1,1,0]=4 16885 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)Br 527a_100000724931_100000719840 [0,2,0,0,0,0|1,1,0]=4 16886 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)F 11a_100000724931_100000034381 [0,2,0,0,0,0|1,1,0]=4 16887 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)F 1626a_100000724931_100000034381 [0,2,0,0,0,0|1,1,0]=4 16888 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)F 240690a_100000724931_100000034381 [0,2,0,0,0,0|1,1,0]=4 16889 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)Cl)F 527a_100000724931_100000034381 [0,2,0,0,0,0|1,1,0]=4 16890 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Br 11a_100000724931_100009816880 [0,2,0,0,0,0|1,1,0]=4 16891 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Br 1626a_100000724931_100009816880 [0,2,0,0,0,0|1,1,0]=4 16892 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Br 240690a_100000724931_100009816880 [0,2,0,0,0,0|1,1,0]=4 16893 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Br 527a_100000724931_100009816880 [0,2,0,0,0,0|1,1,0]=4 16894 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Cl 11a_100000724931_100000085317 [0,2,0,0,0,0|1,0,0]=3 16895 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Cl 1626a_100000724931_100000085317 [0,2,0,0,0,0|1,0,0]=3 16896 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Cl 240690a_100000724931_100000085317 [0,2,0,0,0,0|1,0,0]=3 16897 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)Cl 527a_100000724931_100000085317 [0,2,0,0,0,0|1,0,0]=3 16898 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)F 11a_100000724931_100000766628 [0,2,0,0,0,0|1,1,0]=4 16899 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)F 1626a_100000724931_100000766628 [0,2,0,0,0,0|1,1,0]=4 16900 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)F 240690a_100000724931_100000766628 [0,2,0,0,0,0|1,1,0]=4 16901 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)F 527a_100000724931_100000766628 [0,2,0,0,0,0|1,1,0]=4 16902 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)I 11a_100000724931_100010177778 [0,2,0,0,0,0|1,1,0]=4 16903 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)I 1626a_100000724931_100010177778 [0,2,0,0,0,0|1,1,0]=4 16904 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)I 240690a_100000724931_100010177778 [0,2,0,0,0,0|1,1,0]=4 16905 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)I 527a_100000724931_100010177778 [0,2,0,0,0,0|1,1,0]=4 16906 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)F)O 240690a_100000724931_100000036740 [0,2,0,0,0,0|2,0,0]=4 16907 B15R1.2346 O=C(NCCF)c1ccc(c(c1F)O)F 240690a_100000724931_100000084588 [0,2,0,0,0,0|1,1,0]=4 16908 B15R1.2346 O=C(NCCF)c1ccc(c(c1O)F)Br 240690a_100000724931_100010761495 [0,2,0,0,0,0|1,1,0]=4 16909 B15R1.2346 O=C(NCCF)c1ccc(c(c1O)F)Br 527a_100000724931_100010761495 [0,2,0,0,0,0|1,1,0]=4 16910 B15R1.2346 O=C(NCCF)c1ccc(c(c1O)F)F 240690a_100000724931_100011799213 [0,2,0,0,0,0|1,1,0]=4 16911 B15R1.2346 O=C(NCCO)c1ccc(c(c1Br)F)F 240690a_100000210304_100012356454 [0,2,0,0,0,0|0,1,0]=3 16912 B15R1.2346 O=C(NCCO)c1ccc(c(c1Br)F)F 527a_100000210304_100012356454 [0,2,0,0,0,0|0,1,0]=3 16913 B15R1.2346 O=C(NCCO)c1ccc(c(c1Br)O)Br 240690a_100000210304_100016068111 [0,2,0,0,0,0|0,1,0]=3 16914 B15R1.2346 O=C(NCCO)c1ccc(c(c1Br)O)Br 527a_100000210304_100016068111 [0,2,0,0,0,0|0,1,0]=3 16915 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)Br)Cl 240690a_100000210304_100010208263 [0,2,0,0,0,0|0,0,0]=2 16916 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)Br)Cl 527a_100000210304_100010208263 [0,2,0,0,0,0|0,0,0]=2 16917 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)Cl)Br 240690a_100000210304_200012347731 [0,2,0,0,0,0|0,1,0]=3 16918 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)Cl)Br 527a_100000210304_200012347731 [0,2,0,0,0,0|0,1,0]=3 16919 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)Cl)F 240690a_100000210304_100010209669 [0,2,0,0,0,0|0,1,0]=3 16920 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)Cl)F 527a_100000210304_100010209669 [0,2,0,0,0,0|0,1,0]=3 16921 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)F)Cl 240690a_100000210304_200010192171 [0,2,0,0,0,0|0,0,0]=2 16922 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)F)Cl 527a_100000210304_200010192171 [0,2,0,0,0,0|0,0,0]=2 16923 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)F)F 240690a_100000210304_100009888510 [0,2,0,0,0,0|0,1,0]=3 16924 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)F)F 527a_100000210304_100009888510 [0,2,0,0,0,0|0,1,0]=3 16925 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)O)O 240690a_100000210304_100009910189 [0,2,0,0,0,0|1,0,0]=3 16926 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Br)Br 240690a_100000210304_200016032200 [0,2,0,0,0,0|0,1,0]=3 16927 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Br)Br 527a_100000210304_200016032200 [0,2,0,0,0,0|0,1,0]=3 16928 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Br)F 240690a_100000210304_100010204296 [0,2,0,0,0,0|0,1,0]=3 16929 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Br)F 527a_100000210304_100010204296 [0,2,0,0,0,0|0,1,0]=3 16930 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Cl)Br 240690a_100000210304_100000719840 [0,2,0,0,0,0|0,1,0]=3 16931 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Cl)Br 527a_100000210304_100000719840 [0,2,0,0,0,0|0,1,0]=3 16932 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Cl)F 240690a_100000210304_100000034381 [0,2,0,0,0,0|0,1,0]=3 16933 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)Cl)F 527a_100000210304_100000034381 [0,2,0,0,0,0|0,1,0]=3 16934 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)Br 240690a_100000210304_100009816880 [0,2,0,0,0,0|0,1,0]=3 16935 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)Br 527a_100000210304_100009816880 [0,2,0,0,0,0|0,1,0]=3 16936 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)Cl 240690a_100000210304_100000085317 [0,2,0,0,0,0|0,0,0]=2 16937 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)Cl 527a_100000210304_100000085317 [0,2,0,0,0,0|0,0,0]=2 16938 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)F 240690a_100000210304_100000766628 [0,2,0,0,0,0|0,1,0]=3 16939 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)F 527a_100000210304_100000766628 [0,2,0,0,0,0|0,1,0]=3 16940 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)I 240690a_100000210304_100010177778 [0,2,0,0,0,0|0,1,0]=3 16941 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)I 527a_100000210304_100010177778 [0,2,0,0,0,0|0,1,0]=3 16942 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)F)O 240690a_100000210304_100000036740 [0,2,0,0,0,0|1,0,0]=3 16943 B15R1.2346 O=C(NCCO)c1ccc(c(c1F)O)F 240690a_100000210304_100000084588 [0,2,0,0,0,0|0,1,0]=3 16944 B15R1.2346 O=C(NCCO)c1ccc(c(c1O)F)Br 240690a_100000210304_100010761495 [0,2,0,0,0,0|0,1,0]=3 16945 B15R1.2346 O=C(NCCO)c1ccc(c(c1O)F)Br 527a_100000210304_100010761495 [0,2,0,0,0,0|0,1,0]=3 16946 B15R1.2346 O=C(NCCO)c1ccc(c(c1O)F)F 240690a_100000210304_100011799213 [0,2,0,0,0,0|0,1,0]=3 16947 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 11a_100000212058_200012920480 [0,2,0,0,0,0|1,0,1]=4 16948 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100000212058_200012920480 [0,2,0,0,0,0|1,0,1]=4 16949 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 240690a_100000212058_200012920480 [0,2,0,0,0,0|1,0,1]=4 16950 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100000212058_200012920480 [0,2,0,0,0,0|1,0,1]=4 16951 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)F 11a_100000212058_100010291025 [0,2,0,0,0,0|1,0,1]=4 16952 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100000212058_100010291025 [0,2,0,0,0,0|1,0,1]=4 16953 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)F 240690a_100000212058_100010291025 [0,2,0,0,0,0|1,0,1]=4 16954 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100000212058_100010291025 [0,2,0,0,0,0|1,0,1]=4 16955 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)C)Cl)C 11a_100000212058_100000102532 [0,2,0,0,0,0|1,0,1]=4 16956 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)C)Cl)C 1626a_100000212058_100000102532 [0,2,0,0,0,0|1,0,1]=4 16957 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)C)Cl)C 240690a_100000212058_100000102532 [0,2,0,0,0,0|1,0,1]=4 16958 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)C)Cl)C 527a_100000212058_100000102532 [0,2,0,0,0,0|1,0,1]=4 16959 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 11a_100000212058_100012339221 [0,2,0,0,0,0|1,0,1]=4 16960 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100000212058_100012339221 [0,2,0,0,0,0|1,0,1]=4 16961 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100000212058_100012339221 [0,2,0,0,0,0|1,0,1]=4 16962 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100000212058_100012339221 [0,2,0,0,0,0|1,0,1]=4 16963 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 11a_100000212058_200010244527 [0,2,0,0,0,0|1,0,1]=4 16964 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100000212058_200010244527 [0,2,0,0,0,0|1,0,1]=4 16965 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 240690a_100000212058_200010244527 [0,2,0,0,0,0|1,0,1]=4 16966 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100000212058_200010244527 [0,2,0,0,0,0|1,0,1]=4 16967 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)F)Cl)F 11a_100000212058_100000104779 [0,2,0,0,0,0|1,0,1]=4 16968 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100000212058_100000104779 [0,2,0,0,0,0|1,0,1]=4 16969 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)F)Cl)F 240690a_100000212058_100000104779 [0,2,0,0,0,0|1,0,1]=4 16970 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100000212058_100000104779 [0,2,0,0,0,0|1,0,1]=4 16971 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000212058_100000074654 [0,2,0,0,0,0|1,0,1]=4 16972 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100020586998_200012920480 [0,2,0,0,0,0|1,0,1]=4 16973 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 240690a_100020586998_200012920480 [0,2,0,0,0,0|1,0,1]=4 16974 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100020586998_200012920480 [0,2,0,0,0,0|1,0,1]=4 16975 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100020586998_100010291025 [0,2,0,0,0,0|1,0,1]=4 16976 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)Cl)F 240690a_100020586998_100010291025 [0,2,0,0,0,0|1,0,1]=4 16977 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100020586998_100010291025 [0,2,0,0,0,0|1,0,1]=4 16978 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)C)Cl)C 1626a_100020586998_100000102532 [0,2,0,0,0,0|1,0,1]=4 16979 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)C)Cl)C 240690a_100020586998_100000102532 [0,2,0,0,0,0|1,0,1]=4 16980 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)C)Cl)C 527a_100020586998_100000102532 [0,2,0,0,0,0|1,0,1]=4 16981 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100020586998_100012339221 [0,2,0,0,0,0|1,0,1]=4 16982 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100020586998_100012339221 [0,2,0,0,0,0|1,0,1]=4 16983 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100020586998_100012339221 [0,2,0,0,0,0|1,0,1]=4 16984 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100020586998_200010244527 [0,2,0,0,0,0|1,0,1]=4 16985 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 240690a_100020586998_200010244527 [0,2,0,0,0,0|1,0,1]=4 16986 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100020586998_200010244527 [0,2,0,0,0,0|1,0,1]=4 16987 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100020586998_100000104779 [0,2,0,0,0,0|1,0,1]=4 16988 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)F)Cl)F 240690a_100020586998_100000104779 [0,2,0,0,0,0|1,0,1]=4 16989 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100020586998_100000104779 [0,2,0,0,0,0|1,0,1]=4 16990 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020586998_100000074654 [0,2,0,0,0,0|1,0,1]=4 16991 B15R1.5924 CC(NCCO)c1cc(c(c(c1)Cl)Cl)Cl 269862a_100000210304_100016154646 [0,2,0,0,0,0|1,0,1]=4 16992 B15R1.5924 CC(NCCO)c1cc(c(c(c1)F)Cl)F 269862a_100000210304_100000104442 [0,2,0,0,0,0|1,0,1]=4 16993 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100000210211 [0,2,0,0,0,0|2,0,0]=4 16994 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_100000210211 [0,2,0,0,0,0|2,0,0]=4 16995 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100000210211 [0,2,0,0,0,0|2,0,0]=4 16996 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100000210211 [0,2,0,0,0,0|2,0,0]=4 16997 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210211 [0,2,0,0,0,0|2,0,0]=4 16998 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 11a_100020643023_100000187602 [0,2,0,0,0,0|2,0,0]=4 16999 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 1626a_100020643023_100000187602 [0,2,0,0,0,0|2,0,0]=4 17000 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 240690a_100020643023_100000187602 [0,2,0,0,0,0|2,0,0]=4 17001 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 527a_100020643023_100000187602 [0,2,0,0,0,0|2,0,0]=4 17002 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 11a_100020643023_200012347618 [0,2,0,0,0,0|2,0,0]=4 17003 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 1626a_100020643023_200012347618 [0,2,0,0,0,0|2,0,0]=4 17004 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 240690a_100020643023_200012347618 [0,2,0,0,0,0|2,0,0]=4 17005 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 527a_100020643023_200012347618 [0,2,0,0,0,0|2,0,0]=4 17006 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 11a_100020643023_200012920480 [0,2,0,0,0,0|1,0,0]=3 17007 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100020643023_200012920480 [0,2,0,0,0,0|1,0,0]=3 17008 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 240690a_100020643023_200012920480 [0,2,0,0,0,0|1,0,0]=3 17009 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100020643023_200012920480 [0,2,0,0,0,0|1,0,0]=3 17010 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 11a_100020643023_100010291025 [0,2,0,0,0,0|1,0,0]=3 17011 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100020643023_100010291025 [0,2,0,0,0,0|1,0,0]=3 17012 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 240690a_100020643023_100010291025 [0,2,0,0,0,0|1,0,0]=3 17013 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100020643023_100010291025 [0,2,0,0,0,0|1,0,0]=3 17014 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 11a_100020643023_100010259547 [0,2,0,0,0,0|1,1,0]=4 17015 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 1626a_100020643023_100010259547 [0,2,0,0,0,0|1,1,0]=4 17016 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 240690a_100020643023_100010259547 [0,2,0,0,0,0|1,1,0]=4 17017 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 527a_100020643023_100010259547 [0,2,0,0,0,0|1,1,0]=4 17018 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100020643023_100000692688 [0,2,0,0,0,0|2,0,0]=4 17019 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100020643023_100000692688 [0,2,0,0,0,0|2,0,0]=4 17020 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020643023_200009992764 [0,2,0,0,0,0|2,0,0]=4 17021 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 11a_100020643023_100000700660 [0,2,0,0,0,0|1,1,0]=4 17022 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 1626a_100020643023_100000700660 [0,2,0,0,0,0|1,1,0]=4 17023 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 240690a_100020643023_100000700660 [0,2,0,0,0,0|1,1,0]=4 17024 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 527a_100020643023_100000700660 [0,2,0,0,0,0|1,1,0]=4 17025 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 11a_100020643023_100000075298 [0,2,0,0,0,0|2,0,0]=4 17026 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 1626a_100020643023_100000075298 [0,2,0,0,0,0|2,0,0]=4 17027 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 240690a_100020643023_100000075298 [0,2,0,0,0,0|2,0,0]=4 17028 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 527a_100020643023_100000075298 [0,2,0,0,0,0|2,0,0]=4 17029 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 11a_100020643023_100000102532 [0,2,0,0,0,0|1,0,0]=3 17030 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 1626a_100020643023_100000102532 [0,2,0,0,0,0|1,0,0]=3 17031 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 240690a_100020643023_100000102532 [0,2,0,0,0,0|1,0,0]=3 17032 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 527a_100020643023_100000102532 [0,2,0,0,0,0|1,0,0]=3 17033 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 11a_100020643023_100000741972 [0,2,0,0,0,0|1,1,0]=4 17034 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 1626a_100020643023_100000741972 [0,2,0,0,0,0|1,1,0]=4 17035 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 240690a_100020643023_100000741972 [0,2,0,0,0,0|1,1,0]=4 17036 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 527a_100020643023_100000741972 [0,2,0,0,0,0|1,1,0]=4 17037 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 11a_100020643023_100010769667 [0,2,0,0,0,0|1,1,0]=4 17038 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 1626a_100020643023_100010769667 [0,2,0,0,0,0|1,1,0]=4 17039 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 240690a_100020643023_100010769667 [0,2,0,0,0,0|1,1,0]=4 17040 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 527a_100020643023_100010769667 [0,2,0,0,0,0|1,1,0]=4 17041 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)O)C 240690a_100020643023_100011219978 [0,2,0,0,0,0|2,0,0]=4 17042 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)O)C 527a_100020643023_100011219978 [0,2,0,0,0,0|2,0,0]=4 17043 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Br)Cl 11a_100020643023_100012354307 [0,2,0,0,0,0|1,1,0]=4 17044 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Br)Cl 1626a_100020643023_100012354307 [0,2,0,0,0,0|1,1,0]=4 17045 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Br)Cl 240690a_100020643023_100012354307 [0,2,0,0,0,0|1,1,0]=4 17046 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 11a_100020643023_100012356007 [0,2,0,0,0,0|2,0,0]=4 17047 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 1626a_100020643023_100012356007 [0,2,0,0,0,0|2,0,0]=4 17048 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 240690a_100020643023_100012356007 [0,2,0,0,0,0|2,0,0]=4 17049 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 527a_100020643023_100012356007 [0,2,0,0,0,0|2,0,0]=4 17050 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 11a_100020643023_100012339221 [0,2,0,0,0,0|1,0,0]=3 17051 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100020643023_100012339221 [0,2,0,0,0,0|1,0,0]=3 17052 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100020643023_100012339221 [0,2,0,0,0,0|1,0,0]=3 17053 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100020643023_100012339221 [0,2,0,0,0,0|1,0,0]=3 17054 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 11a_100020643023_200010244527 [0,2,0,0,0,0|1,0,0]=3 17055 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100020643023_200010244527 [0,2,0,0,0,0|1,0,0]=3 17056 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 240690a_100020643023_200010244527 [0,2,0,0,0,0|1,0,0]=3 17057 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100020643023_200010244527 [0,2,0,0,0,0|1,0,0]=3 17058 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)Cl 11a_100020643023_100011934374 [0,2,0,0,0,0|1,1,0]=4 17059 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)Cl 1626a_100020643023_100011934374 [0,2,0,0,0,0|1,1,0]=4 17060 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)Cl 240690a_100020643023_100011934374 [0,2,0,0,0,0|1,1,0]=4 17061 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 11a_100020643023_100000068011 [0,2,0,0,0,0|1,1,0]=4 17062 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 1626a_100020643023_100000068011 [0,2,0,0,0,0|1,1,0]=4 17063 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 240690a_100020643023_100000068011 [0,2,0,0,0,0|1,1,0]=4 17064 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 527a_100020643023_100000068011 [0,2,0,0,0,0|1,1,0]=4 17065 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100020643023_100000184433 [0,2,0,0,0,0|2,0,0]=4 17066 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100020643023_100000184433 [0,2,0,0,0,0|2,0,0]=4 17067 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020643023_200000078382 [0,2,0,0,0,0|2,0,0]=4 17068 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 11a_100020643023_100010078405 [0,2,0,0,0,0|1,1,0]=4 17069 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 1626a_100020643023_100010078405 [0,2,0,0,0,0|1,1,0]=4 17070 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 240690a_100020643023_100010078405 [0,2,0,0,0,0|1,1,0]=4 17071 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 527a_100020643023_100010078405 [0,2,0,0,0,0|1,1,0]=4 17072 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 11a_100020643023_100000055762 [0,2,0,0,0,0|2,0,0]=4 17073 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 1626a_100020643023_100000055762 [0,2,0,0,0,0|2,0,0]=4 17074 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 240690a_100020643023_100000055762 [0,2,0,0,0,0|2,0,0]=4 17075 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 527a_100020643023_100000055762 [0,2,0,0,0,0|2,0,0]=4 17076 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 11a_100020643023_100000104779 [0,2,0,0,0,0|1,0,0]=3 17077 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100020643023_100000104779 [0,2,0,0,0,0|1,0,0]=3 17078 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 240690a_100020643023_100000104779 [0,2,0,0,0,0|1,0,0]=3 17079 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100020643023_100000104779 [0,2,0,0,0,0|1,0,0]=3 17080 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 11a_100020643023_100000061453 [0,2,0,0,0,0|1,1,0]=4 17081 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 1626a_100020643023_100000061453 [0,2,0,0,0,0|1,1,0]=4 17082 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 240690a_100020643023_100000061453 [0,2,0,0,0,0|1,1,0]=4 17083 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 527a_100020643023_100000061453 [0,2,0,0,0,0|1,1,0]=4 17084 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 11a_100020643023_100000751656 [0,2,0,0,0,0|1,1,0]=4 17085 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 1626a_100020643023_100000751656 [0,2,0,0,0,0|1,1,0]=4 17086 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 240690a_100020643023_100000751656 [0,2,0,0,0,0|1,1,0]=4 17087 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 527a_100020643023_100000751656 [0,2,0,0,0,0|1,1,0]=4 17088 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)O 240690a_100020643023_200000081825 [0,2,0,0,0,0|1,1,0]=4 17089 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)O)F 240690a_100020643023_100000766045 [0,2,0,0,0,0|2,0,0]=4 17090 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)O)F 527a_100020643023_100000766045 [0,2,0,0,0,0|2,0,0]=4 17091 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 11a_100020643023_100012344050 [0,2,0,0,0,0|2,0,0]=4 17092 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 1626a_100020643023_100012344050 [0,2,0,0,0,0|2,0,0]=4 17093 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 240690a_100020643023_100012344050 [0,2,0,0,0,0|2,0,0]=4 17094 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 527a_100020643023_100012344050 [0,2,0,0,0,0|2,0,0]=4 17095 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)O)I 1626a_100020643023_100000034356 [0,2,0,0,0,0|2,0,0]=4 17096 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)O)I 240690a_100020643023_100000034356 [0,2,0,0,0,0|2,0,0]=4 17097 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)O)I 527a_100020643023_100000034356 [0,2,0,0,0,0|2,0,0]=4 17098 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020643023_100009812877 [0,2,0,0,0,0|1,1,0]=4 17099 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100020643023_100000031928 [0,2,0,0,0,0|2,0,0]=4 17100 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100020643023_100000031928 [0,2,0,0,0,0|2,0,0]=4 17101 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020643023_100000074654 [0,2,0,0,0,0|1,0,0]=3 17102 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Br)Cl)Cl 22a_100000756455_200012920480 [0,2,0,0,0,0|2,0,0]=4 17103 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Br)Cl)F 22a_100000756455_100010291025 [0,2,0,0,0,0|2,0,0]=4 17104 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)C)Cl)C 22a_100000756455_100000102532 [0,2,0,0,0,0|2,0,0]=4 17105 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 22a_100000756455_100012339221 [0,2,0,0,0,0|2,0,0]=4 17106 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Cl)Cl)F 22a_100000756455_200010244527 [0,2,0,0,0,0|2,0,0]=4 17107 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)F)Cl)F 22a_100000756455_100000104779 [0,2,0,0,0,0|2,0,0]=4 17108 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000756455_100000074654 [0,2,0,0,0,0|2,0,0]=4 17109 B15R1.5924 Cc1c(cc(cc1Br)C(=O)CCCO)Br 1458a_100000187602_100011215043 [0,2,0,0,0,0|2,0,0]=4 17110 B15R1.5924 Cc1c(cc(cc1Br)C(=O)CCCO)F 1458a_200012347618_100011215043 [0,2,0,0,0,0|2,0,0]=4 17111 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)Br 11a_100000724931_100000187602 [0,2,0,0,0,0|2,0,0]=4 17112 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)Br 1626a_100000724931_100000187602 [0,2,0,0,0,0|2,0,0]=4 17113 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)Br 240690a_100000724931_100000187602 [0,2,0,0,0,0|2,0,0]=4 17114 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)Br 527a_100000724931_100000187602 [0,2,0,0,0,0|2,0,0]=4 17115 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)F 11a_100000724931_200012347618 [0,2,0,0,0,0|2,0,0]=4 17116 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)F 1626a_100000724931_200012347618 [0,2,0,0,0,0|2,0,0]=4 17117 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)F 240690a_100000724931_200012347618 [0,2,0,0,0,0|2,0,0]=4 17118 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCF)F 527a_100000724931_200012347618 [0,2,0,0,0,0|2,0,0]=4 17119 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCO)Br 240690a_100000210304_100000187602 [0,2,0,0,0,0|1,0,0]=3 17120 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCO)Br 527a_100000210304_100000187602 [0,2,0,0,0,0|1,0,0]=3 17121 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCO)F 240690a_100000210304_200012347618 [0,2,0,0,0,0|1,0,0]=3 17122 B15R1.5924 Cc1c(cc(cc1Br)C(=O)NCCO)F 527a_100000210304_200012347618 [0,2,0,0,0,0|1,0,0]=3 17123 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)CCCO)Cl 1458a_100012356007_100011215043 [0,2,0,0,0,0|2,0,0]=4 17124 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)NCCF)Cl 11a_100000724931_100012356007 [0,2,0,0,0,0|2,0,0]=4 17125 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)NCCF)Cl 1626a_100000724931_100012356007 [0,2,0,0,0,0|2,0,0]=4 17126 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)NCCF)Cl 240690a_100000724931_100012356007 [0,2,0,0,0,0|2,0,0]=4 17127 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)NCCF)Cl 527a_100000724931_100012356007 [0,2,0,0,0,0|2,0,0]=4 17128 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)NCCO)Cl 240690a_100000210304_100012356007 [0,2,0,0,0,0|1,0,0]=3 17129 B15R1.5924 Cc1c(cc(cc1Cl)C(=O)NCCO)Cl 527a_100000210304_100012356007 [0,2,0,0,0,0|1,0,0]=3 17130 B15R1.5924 Cc1c(cc(cc1F)C(=O)CCCO)F 1458a_100000055762_100011215043 [0,2,0,0,0,0|2,0,0]=4 17131 B15R1.5924 Cc1c(cc(cc1F)C(=O)NCCF)F 11a_100000724931_100000055762 [0,2,0,0,0,0|2,0,0]=4 17132 B15R1.5924 Cc1c(cc(cc1F)C(=O)NCCF)F 1626a_100000724931_100000055762 [0,2,0,0,0,0|2,0,0]=4 17133 B15R1.5924 Cc1c(cc(cc1F)C(=O)NCCF)F 240690a_100000724931_100000055762 [0,2,0,0,0,0|2,0,0]=4 17134 B15R1.5924 Cc1c(cc(cc1F)C(=O)NCCF)F 527a_100000724931_100000055762 [0,2,0,0,0,0|2,0,0]=4 17135 B15R1.5924 Cc1c(cc(cc1F)C(=O)NCCO)F 240690a_100000210304_100000055762 [0,2,0,0,0,0|1,0,0]=3 17136 B15R1.5924 Cc1c(cc(cc1F)C(=O)NCCO)F 527a_100000210304_100000055762 [0,2,0,0,0,0|1,0,0]=3 17137 B15R1.5924 Cc1c(cc(cc1I)C(=O)CCCO)F 1458a_100012344050_100011215043 [0,2,0,0,0,0|2,0,0]=4 17138 B15R1.5924 Cc1c(cc(cc1I)C(=O)NCCF)F 11a_100000724931_100012344050 [0,2,0,0,0,0|2,0,0]=4 17139 B15R1.5924 Cc1c(cc(cc1I)C(=O)NCCF)F 1626a_100000724931_100012344050 [0,2,0,0,0,0|2,0,0]=4 17140 B15R1.5924 Cc1c(cc(cc1I)C(=O)NCCF)F 240690a_100000724931_100012344050 [0,2,0,0,0,0|2,0,0]=4 17141 B15R1.5924 Cc1c(cc(cc1I)C(=O)NCCF)F 527a_100000724931_100012344050 [0,2,0,0,0,0|2,0,0]=4 17142 B15R1.5924 Cc1c(cc(cc1I)C(=O)NCCO)F 240690a_100000210304_100012344050 [0,2,0,0,0,0|1,0,0]=3 17143 B15R1.5924 Cc1c(cc(cc1I)C(=O)NCCO)F 527a_100000210304_100012344050 [0,2,0,0,0,0|1,0,0]=3 17144 B15R1.5924 Cc1c(cc(cc1O)C(=O)CCCO)O 1458a_100000031928_100011215043 [0,2,0,0,0,0|2,0,0]=4 17145 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCF)O 240690a_100000724931_100000031928 [0,2,0,0,0,0|2,0,0]=4 17146 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCF)O 527a_100000724931_100000031928 [0,2,0,0,0,0|2,0,0]=4 17147 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCO)O 240690a_100000210304_100000031928 [0,2,0,0,0,0|1,0,0]=3 17148 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCO)O 527a_100000210304_100000031928 [0,2,0,0,0,0|1,0,0]=3 17149 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)CCCO 1458a_100000700660_100011215043 [0,2,0,0,0,0|1,1,0]=4 17150 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)NCCF 11a_100000724931_100000700660 [0,2,0,0,0,0|1,1,0]=4 17151 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)NCCF 1626a_100000724931_100000700660 [0,2,0,0,0,0|1,1,0]=4 17152 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)NCCF 240690a_100000724931_100000700660 [0,2,0,0,0,0|1,1,0]=4 17153 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)NCCF 527a_100000724931_100000700660 [0,2,0,0,0,0|1,1,0]=4 17154 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)NCCO 240690a_100000210304_100000700660 [0,2,0,0,0,0|0,1,0]=3 17155 B15R1.5924 Cc1cc(cc(c1Br)C)C(=O)NCCO 527a_100000210304_100000700660 [0,2,0,0,0,0|0,1,0]=3 17156 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)CCCO 1458a_100000075298_100011215043 [0,2,0,0,0,0|2,0,0]=4 17157 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)NCCF 11a_100000724931_100000075298 [0,2,0,0,0,0|2,0,0]=4 17158 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)NCCF 1626a_100000724931_100000075298 [0,2,0,0,0,0|2,0,0]=4 17159 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)NCCF 240690a_100000724931_100000075298 [0,2,0,0,0,0|2,0,0]=4 17160 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)NCCF 527a_100000724931_100000075298 [0,2,0,0,0,0|2,0,0]=4 17161 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)NCCO 240690a_100000210304_100000075298 [0,2,0,0,0,0|1,0,0]=3 17162 B15R1.5924 Cc1cc(cc(c1C)C)C(=O)NCCO 527a_100000210304_100000075298 [0,2,0,0,0,0|1,0,0]=3 17163 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)CCCF 1458a_100000102532_100011934791 [0,2,0,0,0,0|2,0,0]=4 17164 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)CCCO 1458a_100000102532_100011215043 [0,2,0,0,0,0|1,0,0]=3 17165 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCC#N 1626a_100000734998_100000102532 [0,2,0,0,0,0|1,0,1]=4 17166 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCC#N 527a_100000734998_100000102532 [0,2,0,0,0,0|1,0,1]=4 17167 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCCF 11a_100000724931_100000102532 [0,2,0,0,0,0|1,0,0]=3 17168 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCCF 1626a_100000724931_100000102532 [0,2,0,0,0,0|1,0,0]=3 17169 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCCF 240690a_100000724931_100000102532 [0,2,0,0,0,0|1,0,0]=3 17170 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCCF 527a_100000724931_100000102532 [0,2,0,0,0,0|1,0,0]=3 17171 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCCO 240690a_100000210304_100000102532 [0,2,0,0,0,0|0,0,0]=2 17172 B15R1.5924 Cc1cc(cc(c1Cl)C)C(=O)NCCO 527a_100000210304_100000102532 [0,2,0,0,0,0|0,0,0]=2 17173 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)CCCO 1458a_100000741972_100011215043 [0,2,0,0,0,0|1,1,0]=4 17174 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)NCCF 11a_100000724931_100000741972 [0,2,0,0,0,0|1,1,0]=4 17175 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)NCCF 1626a_100000724931_100000741972 [0,2,0,0,0,0|1,1,0]=4 17176 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)NCCF 240690a_100000724931_100000741972 [0,2,0,0,0,0|1,1,0]=4 17177 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)NCCF 527a_100000724931_100000741972 [0,2,0,0,0,0|1,1,0]=4 17178 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)NCCO 240690a_100000210304_100000741972 [0,2,0,0,0,0|0,1,0]=3 17179 B15R1.5924 Cc1cc(cc(c1F)C)C(=O)NCCO 527a_100000210304_100000741972 [0,2,0,0,0,0|0,1,0]=3 17180 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)CCCO 1458a_100000061453_100011215043 [0,2,0,0,0,0|1,1,0]=4 17181 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)NCCF 11a_100000724931_100000061453 [0,2,0,0,0,0|1,1,0]=4 17182 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)NCCF 1626a_100000724931_100000061453 [0,2,0,0,0,0|1,1,0]=4 17183 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)NCCF 240690a_100000724931_100000061453 [0,2,0,0,0,0|1,1,0]=4 17184 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)NCCF 527a_100000724931_100000061453 [0,2,0,0,0,0|1,1,0]=4 17185 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)NCCO 240690a_100000210304_100000061453 [0,2,0,0,0,0|0,1,0]=3 17186 B15R1.5924 Cc1cc(cc(c1F)F)C(=O)NCCO 527a_100000210304_100000061453 [0,2,0,0,0,0|0,1,0]=3 17187 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)CCCO 1458a_100010769667_100011215043 [0,2,0,0,0,0|1,1,0]=4 17188 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)NCCF 11a_100000724931_100010769667 [0,2,0,0,0,0|1,1,0]=4 17189 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)NCCF 1626a_100000724931_100010769667 [0,2,0,0,0,0|1,1,0]=4 17190 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)NCCF 240690a_100000724931_100010769667 [0,2,0,0,0,0|1,1,0]=4 17191 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)NCCF 527a_100000724931_100010769667 [0,2,0,0,0,0|1,1,0]=4 17192 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)NCCO 240690a_100000210304_100010769667 [0,2,0,0,0,0|0,1,0]=3 17193 B15R1.5924 Cc1cc(cc(c1I)C)C(=O)NCCO 527a_100000210304_100010769667 [0,2,0,0,0,0|0,1,0]=3 17194 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)CCCO 1458a_100011219978_100011215043 [0,2,0,0,0,0|2,0,0]=4 17195 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCF 240690a_100000724931_100011219978 [0,2,0,0,0,0|2,0,0]=4 17196 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCF 527a_100000724931_100011219978 [0,2,0,0,0,0|2,0,0]=4 17197 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCO 240690a_100000210304_100011219978 [0,2,0,0,0,0|1,0,0]=3 17198 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCO 527a_100000210304_100011219978 [0,2,0,0,0,0|1,0,0]=3 17199 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100000734998_200012920480 [0,2,0,0,0,0|1,0,1]=4 17200 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100000734998_200012920480 [0,2,0,0,0,0|1,0,1]=4 17201 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100000734998_100010291025 [0,2,0,0,0,0|1,0,1]=4 17202 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100000734998_100010291025 [0,2,0,0,0,0|1,0,1]=4 17203 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100000734998_100012339221 [0,2,0,0,0,0|1,0,1]=4 17204 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100000734998_100012339221 [0,2,0,0,0,0|1,0,1]=4 17205 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100000734998_200010244527 [0,2,0,0,0,0|1,0,1]=4 17206 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100000734998_200010244527 [0,2,0,0,0,0|1,0,1]=4 17207 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100000734998_100000104779 [0,2,0,0,0,0|1,0,1]=4 17208 B15R1.5924 N#CCNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100000734998_100000104779 [0,2,0,0,0,0|1,0,1]=4 17209 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100011934791 [0,2,0,0,0,0|2,0,0]=4 17210 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100011934791 [0,2,0,0,0,0|2,0,0]=4 17211 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100011934791 [0,2,0,0,0,0|2,0,0]=4 17212 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100011934791 [0,2,0,0,0,0|2,0,0]=4 17213 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100011934791 [0,2,0,0,0,0|2,0,0]=4 17214 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011934791 [0,2,0,0,0,0|2,0,0]=4 17215 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100011215043 [0,2,0,0,0,0|1,0,0]=3 17216 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100011215043 [0,2,0,0,0,0|1,0,0]=3 17217 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)F)F 1458a_100010259547_100011215043 [0,2,0,0,0,0|1,1,0]=4 17218 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011215043 [0,2,0,0,0,0|2,0,0]=4 17219 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215043 [0,2,0,0,0,0|2,0,0]=4 17220 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_100011215043 [0,2,0,0,0,0|1,1,0]=4 17221 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100011215043 [0,2,0,0,0,0|1,0,0]=3 17222 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100011215043 [0,2,0,0,0,0|1,0,0]=3 17223 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_100011215043 [0,2,0,0,0,0|1,1,0]=4 17224 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_100011215043 [0,2,0,0,0,0|1,1,0]=4 17225 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011215043 [0,2,0,0,0,0|2,0,0]=4 17226 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215043 [0,2,0,0,0,0|2,0,0]=4 17227 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)Br)F 1458a_100010078405_100011215043 [0,2,0,0,0,0|1,1,0]=4 17228 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100011215043 [0,2,0,0,0,0|1,0,0]=3 17229 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)F)F 1458a_100000751656_100011215043 [0,2,0,0,0,0|1,1,0]=4 17230 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011215043 [0,2,0,0,0,0|1,1,0]=4 17231 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011215043 [0,2,0,0,0,0|2,0,0]=4 17232 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011215043 [0,2,0,0,0,0|2,0,0]=4 17233 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215043 [0,2,0,0,0,0|1,0,0]=3 17234 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215043 [0,2,0,0,0,0|2,0,0]=4 17235 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)Cl 11a_100000724931_200012920480 [0,2,0,0,0,0|1,0,0]=3 17236 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)Cl 1626a_100000724931_200012920480 [0,2,0,0,0,0|1,0,0]=3 17237 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)Cl 240690a_100000724931_200012920480 [0,2,0,0,0,0|1,0,0]=3 17238 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)Cl 527a_100000724931_200012920480 [0,2,0,0,0,0|1,0,0]=3 17239 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)F 11a_100000724931_100010291025 [0,2,0,0,0,0|1,0,0]=3 17240 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)F 1626a_100000724931_100010291025 [0,2,0,0,0,0|1,0,0]=3 17241 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)F 240690a_100000724931_100010291025 [0,2,0,0,0,0|1,0,0]=3 17242 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)Cl)F 527a_100000724931_100010291025 [0,2,0,0,0,0|1,0,0]=3 17243 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)F)F 11a_100000724931_100010259547 [0,2,0,0,0,0|1,1,0]=4 17244 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)F)F 1626a_100000724931_100010259547 [0,2,0,0,0,0|1,1,0]=4 17245 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)F)F 240690a_100000724931_100010259547 [0,2,0,0,0,0|1,1,0]=4 17246 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)F)F 527a_100000724931_100010259547 [0,2,0,0,0,0|1,1,0]=4 17247 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)O)Br 240690a_100000724931_100000692688 [0,2,0,0,0,0|2,0,0]=4 17248 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)O)Br 527a_100000724931_100000692688 [0,2,0,0,0,0|2,0,0]=4 17249 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)O)O 240690a_100000724931_200009992764 [0,2,0,0,0,0|2,0,0]=4 17250 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Br)Cl 11a_100000724931_100012354307 [0,2,0,0,0,0|1,1,0]=4 17251 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Br)Cl 1626a_100000724931_100012354307 [0,2,0,0,0,0|1,1,0]=4 17252 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Br)Cl 240690a_100000724931_100012354307 [0,2,0,0,0,0|1,1,0]=4 17253 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)Cl 11a_100000724931_100012339221 [0,2,0,0,0,0|1,0,0]=3 17254 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100000724931_100012339221 [0,2,0,0,0,0|1,0,0]=3 17255 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100000724931_100012339221 [0,2,0,0,0,0|1,0,0]=3 17256 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)Cl 527a_100000724931_100012339221 [0,2,0,0,0,0|1,0,0]=3 17257 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)F 11a_100000724931_200010244527 [0,2,0,0,0,0|1,0,0]=3 17258 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)F 1626a_100000724931_200010244527 [0,2,0,0,0,0|1,0,0]=3 17259 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)F 240690a_100000724931_200010244527 [0,2,0,0,0,0|1,0,0]=3 17260 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)Cl)F 527a_100000724931_200010244527 [0,2,0,0,0,0|1,0,0]=3 17261 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)Cl 11a_100000724931_100011934374 [0,2,0,0,0,0|1,1,0]=4 17262 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)Cl 1626a_100000724931_100011934374 [0,2,0,0,0,0|1,1,0]=4 17263 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)Cl 240690a_100000724931_100011934374 [0,2,0,0,0,0|1,1,0]=4 17264 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)F 11a_100000724931_100000068011 [0,2,0,0,0,0|1,1,0]=4 17265 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)F 1626a_100000724931_100000068011 [0,2,0,0,0,0|1,1,0]=4 17266 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)F 240690a_100000724931_100000068011 [0,2,0,0,0,0|1,1,0]=4 17267 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)F)F 527a_100000724931_100000068011 [0,2,0,0,0,0|1,1,0]=4 17268 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)O)Cl 240690a_100000724931_100000184433 [0,2,0,0,0,0|2,0,0]=4 17269 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)O)Cl 527a_100000724931_100000184433 [0,2,0,0,0,0|2,0,0]=4 17270 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)O)O 240690a_100000724931_200000078382 [0,2,0,0,0,0|2,0,0]=4 17271 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Br)F 11a_100000724931_100010078405 [0,2,0,0,0,0|1,1,0]=4 17272 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Br)F 1626a_100000724931_100010078405 [0,2,0,0,0,0|1,1,0]=4 17273 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Br)F 240690a_100000724931_100010078405 [0,2,0,0,0,0|1,1,0]=4 17274 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Br)F 527a_100000724931_100010078405 [0,2,0,0,0,0|1,1,0]=4 17275 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Cl)F 11a_100000724931_100000104779 [0,2,0,0,0,0|1,0,0]=3 17276 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Cl)F 1626a_100000724931_100000104779 [0,2,0,0,0,0|1,0,0]=3 17277 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Cl)F 240690a_100000724931_100000104779 [0,2,0,0,0,0|1,0,0]=3 17278 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)Cl)F 527a_100000724931_100000104779 [0,2,0,0,0,0|1,0,0]=3 17279 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)F)F 11a_100000724931_100000751656 [0,2,0,0,0,0|1,1,0]=4 17280 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)F)F 1626a_100000724931_100000751656 [0,2,0,0,0,0|1,1,0]=4 17281 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)F)F 240690a_100000724931_100000751656 [0,2,0,0,0,0|1,1,0]=4 17282 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)F)F 527a_100000724931_100000751656 [0,2,0,0,0,0|1,1,0]=4 17283 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)F)O 240690a_100000724931_200000081825 [0,2,0,0,0,0|1,1,0]=4 17284 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)O)F 240690a_100000724931_100000766045 [0,2,0,0,0,0|2,0,0]=4 17285 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)O)F 527a_100000724931_100000766045 [0,2,0,0,0,0|2,0,0]=4 17286 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)I)O)I 1626a_100000724931_100000034356 [0,2,0,0,0,0|2,0,0]=4 17287 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)I)O)I 240690a_100000724931_100000034356 [0,2,0,0,0,0|2,0,0]=4 17288 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)I)O)I 527a_100000724931_100000034356 [0,2,0,0,0,0|2,0,0]=4 17289 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)O)Br)O 240690a_100000724931_100009812877 [0,2,0,0,0,0|1,1,0]=4 17290 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)O)Cl)O 240690a_100000724931_100000074654 [0,2,0,0,0,0|1,0,0]=3 17291 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)Cl)Cl 240690a_100000210304_200012920480 [0,2,0,0,0,0|0,0,0]=2 17292 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)Cl)Cl 527a_100000210304_200012920480 [0,2,0,0,0,0|0,0,0]=2 17293 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)Cl)F 240690a_100000210304_100010291025 [0,2,0,0,0,0|0,0,0]=2 17294 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)Cl)F 527a_100000210304_100010291025 [0,2,0,0,0,0|0,0,0]=2 17295 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)F)F 240690a_100000210304_100010259547 [0,2,0,0,0,0|0,1,0]=3 17296 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)F)F 527a_100000210304_100010259547 [0,2,0,0,0,0|0,1,0]=3 17297 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)O)Br 240690a_100000210304_100000692688 [0,2,0,0,0,0|1,0,0]=3 17298 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)O)Br 527a_100000210304_100000692688 [0,2,0,0,0,0|1,0,0]=3 17299 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)O)O 240690a_100000210304_200009992764 [0,2,0,0,0,0|1,0,0]=3 17300 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)Br)Cl 240690a_100000210304_100012354307 [0,2,0,0,0,0|0,1,0]=3 17301 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100000210304_100012339221 [0,2,0,0,0,0|0,0,0]=2 17302 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)Cl)Cl 527a_100000210304_100012339221 [0,2,0,0,0,0|0,0,0]=2 17303 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)Cl)F 240690a_100000210304_200010244527 [0,2,0,0,0,0|0,0,0]=2 17304 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)Cl)F 527a_100000210304_200010244527 [0,2,0,0,0,0|0,0,0]=2 17305 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)F)Cl 240690a_100000210304_100011934374 [0,2,0,0,0,0|0,1,0]=3 17306 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)F)F 240690a_100000210304_100000068011 [0,2,0,0,0,0|0,1,0]=3 17307 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)F)F 527a_100000210304_100000068011 [0,2,0,0,0,0|0,1,0]=3 17308 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)O)Cl 240690a_100000210304_100000184433 [0,2,0,0,0,0|1,0,0]=3 17309 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)O)Cl 527a_100000210304_100000184433 [0,2,0,0,0,0|1,0,0]=3 17310 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)O)O 240690a_100000210304_200000078382 [0,2,0,0,0,0|1,0,0]=3 17311 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)Br)F 240690a_100000210304_100010078405 [0,2,0,0,0,0|0,1,0]=3 17312 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)Br)F 527a_100000210304_100010078405 [0,2,0,0,0,0|0,1,0]=3 17313 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)Cl)F 240690a_100000210304_100000104779 [0,2,0,0,0,0|0,0,0]=2 17314 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)Cl)F 527a_100000210304_100000104779 [0,2,0,0,0,0|0,0,0]=2 17315 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)F)F 240690a_100000210304_100000751656 [0,2,0,0,0,0|0,1,0]=3 17316 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)F)F 527a_100000210304_100000751656 [0,2,0,0,0,0|0,1,0]=3 17317 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)F)O 240690a_100000210304_200000081825 [0,2,0,0,0,0|0,1,0]=3 17318 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)O)F 240690a_100000210304_100000766045 [0,2,0,0,0,0|1,0,0]=3 17319 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)O)F 527a_100000210304_100000766045 [0,2,0,0,0,0|1,0,0]=3 17320 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)I)O)I 240690a_100000210304_100000034356 [0,2,0,0,0,0|1,0,0]=3 17321 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)I)O)I 527a_100000210304_100000034356 [0,2,0,0,0,0|1,0,0]=3 17322 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)O)Br)O 240690a_100000210304_100009812877 [0,2,0,0,0,0|0,1,0]=3 17323 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)O)Cl)O 240690a_100000210304_100000074654 [0,2,0,0,0,0|0,0,0]=2 17324 B15R1.2313 C#CCNC(=O)c1ccc(cc1OC)Cl 11a_100000212058_100000217211 [0,2,0,0,0,0|1,0,1]=4 17325 B15R1.2313 C#CCNC(=O)c1ccc(cc1OC)Cl 1626a_100000212058_100000217211 [0,2,0,0,0,0|1,0,1]=4 17326 B15R1.2313 C#CCNC(=O)c1ccc(cc1OC)Cl 240690a_100000212058_100000217211 [0,2,0,0,0,0|1,0,1]=4 17327 B15R1.2313 C#CCNC(=O)c1ccc(cc1OC)Cl 527a_100000212058_100000217211 [0,2,0,0,0,0|1,0,1]=4 17328 B15R1.2313 C=CCNC(=O)c1ccc(cc1OC)Cl 1626a_100020586998_100000217211 [0,2,0,0,0,0|1,0,1]=4 17329 B15R1.2313 C=CCNC(=O)c1ccc(cc1OC)Cl 240690a_100020586998_100000217211 [0,2,0,0,0,0|1,0,1]=4 17330 B15R1.2313 C=CCNC(=O)c1ccc(cc1OC)Cl 527a_100020586998_100000217211 [0,2,0,0,0,0|1,0,1]=4 17331 B15R1.2313 CCCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000210211 [0,2,0,0,0,0|2,0,0]=4 17332 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)Br 11a_100020643023_100012349539 [0,2,0,0,0,0|1,1,0]=4 17333 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)Br 240690a_100020643023_100012349539 [0,2,0,0,0,0|1,1,0]=4 17334 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)C 1626a_100020643023_200012184421 [0,2,0,0,0,0|2,0,0]=4 17335 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)C 240690a_100020643023_200012184421 [0,2,0,0,0,0|2,0,0]=4 17336 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)C 527a_100020643023_200012184421 [0,2,0,0,0,0|2,0,0]=4 17337 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)F 11a_100020643023_100012002388 [0,2,0,0,0,0|1,1,0]=4 17338 B15R1.2313 CCCNC(=O)c1ccc(cc1C#N)F 1626a_100020643023_100012002388 [0,2,0,0,0,0|1,1,0]=4 17339 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 11a_100020643023_200012349896 [0,2,0,0,0,0|1,1,0]=4 17340 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 1626a_100020643023_200012349896 [0,2,0,0,0,0|1,1,0]=4 17341 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 240690a_100020643023_200012349896 [0,2,0,0,0,0|1,1,0]=4 17342 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 527a_100020643023_200012349896 [0,2,0,0,0,0|1,1,0]=4 17343 B15R1.2313 CCCNC(=O)c1ccc(cc1CO)F 1626a_100020643023_100013035055 [0,2,0,0,0,0|1,1,0]=4 17344 B15R1.2313 CCCNC(=O)c1ccc(cc1CO)F 240690a_100020643023_100013035055 [0,2,0,0,0,0|1,1,0]=4 17345 B15R1.2313 CCCNC(=O)c1ccc(cc1NC)Cl 34a_100000741975_200000210301 [0,2,0,0,0,0|1,0,0]=3 17346 B15R1.2313 CCCNC(=O)c1ccc(cc1NC)Cl 7a_100000741975_200000210301 [0,2,0,0,0,0|1,0,0]=3 17347 B15R1.2313 CCCNC(=O)c1ccc(cc1N[13CH3])Cl 34a_100000741975_200025704644 [0,2,0,0,0,0|1,0,0]=3 17348 B15R1.2313 CCCNC(=O)c1ccc(cc1N[13CH3])Cl 7a_100000741975_200025704644 [0,2,0,0,0,0|1,0,0]=3 17349 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 11a_100020643023_100000748230 [0,2,0,0,0,0|1,1,0]=4 17350 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 1626a_100020643023_100000748230 [0,2,0,0,0,0|1,1,0]=4 17351 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 240690a_100020643023_100000748230 [0,2,0,0,0,0|1,1,0]=4 17352 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 527a_100020643023_100000748230 [0,2,0,0,0,0|1,1,0]=4 17353 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 11a_100020643023_100000217210 [0,2,0,0,0,0|2,0,0]=4 17354 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 1626a_100020643023_100000217210 [0,2,0,0,0,0|2,0,0]=4 17355 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 240690a_100020643023_100000217210 [0,2,0,0,0,0|2,0,0]=4 17356 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 527a_100020643023_100000217210 [0,2,0,0,0,0|2,0,0]=4 17357 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 11a_100020643023_100000217211 [0,2,0,0,0,0|1,0,0]=3 17358 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 1626a_100020643023_100000217211 [0,2,0,0,0,0|1,0,0]=3 17359 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 240690a_100020643023_100000217211 [0,2,0,0,0,0|1,0,0]=3 17360 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 527a_100020643023_100000217211 [0,2,0,0,0,0|1,0,0]=3 17361 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 11a_100020643023_100000239970 [0,2,0,0,0,0|1,1,0]=4 17362 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 1626a_100020643023_100000239970 [0,2,0,0,0,0|1,1,0]=4 17363 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 240690a_100020643023_100000239970 [0,2,0,0,0,0|1,1,0]=4 17364 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 527a_100020643023_100000239970 [0,2,0,0,0,0|1,1,0]=4 17365 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 11a_100020643023_100012353712 [0,2,0,0,0,0|1,1,0]=4 17366 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 1626a_100020643023_100012353712 [0,2,0,0,0,0|1,1,0]=4 17367 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 240690a_100020643023_100012353712 [0,2,0,0,0,0|1,1,0]=4 17368 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 527a_100020643023_100012353712 [0,2,0,0,0,0|1,1,0]=4 17369 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)O 271570a_203496583355_200011640145 [0,2,0,0,0,0|2,0,0]=4 17370 B15R1.2313 CCNNC(=O)c1ccc(cc1OC)Cl 22a_100000756455_100000217211 [0,2,0,0,0,0|2,0,0]=4 17371 B15R1.2313 CCc1cc(ccc1C(=O)CCCO)Br 1458a_200012349896_100011215043 [0,2,0,0,0,0|1,1,0]=4 17372 B15R1.2313 CCc1cc(ccc1C(=O)NCCF)Br 11a_100000724931_200012349896 [0,2,0,0,0,0|1,1,0]=4 17373 B15R1.2313 CCc1cc(ccc1C(=O)NCCF)Br 1626a_100000724931_200012349896 [0,2,0,0,0,0|1,1,0]=4 17374 B15R1.2313 CCc1cc(ccc1C(=O)NCCF)Br 240690a_100000724931_200012349896 [0,2,0,0,0,0|1,1,0]=4 17375 B15R1.2313 CCc1cc(ccc1C(=O)NCCF)Br 527a_100000724931_200012349896 [0,2,0,0,0,0|1,1,0]=4 17376 B15R1.2313 CCc1cc(ccc1C(=O)NCCO)Br 240690a_100000210304_200012349896 [0,2,0,0,0,0|0,1,0]=3 17377 B15R1.2313 CCc1cc(ccc1C(=O)NCCO)Br 527a_100000210304_200012349896 [0,2,0,0,0,0|0,1,0]=3 17378 B15R1.2313 CCc1cc(ccc1C(C)NCCO)Cl 269862a_100000210304_200135296945 [0,2,0,0,0,0|1,0,1]=4 17379 B15R1.2313 COc1cc(ccc1C(=O)CCCF)Cl 1458a_100000217211_100011934791 [0,2,0,0,0,0|2,0,0]=4 17380 B15R1.2313 COc1cc(ccc1C(=O)CCCO)Br 1458a_100000748230_100011215043 [0,2,0,0,0,0|1,1,0]=4 17381 B15R1.2313 COc1cc(ccc1C(=O)CCCO)C 1458a_100000217210_100011215043 [0,2,0,0,0,0|2,0,0]=4 17382 B15R1.2313 COc1cc(ccc1C(=O)CCCO)Cl 1458a_100000217211_100011215043 [0,2,0,0,0,0|1,0,0]=3 17383 B15R1.2313 COc1cc(ccc1C(=O)CCCO)F 1458a_100000239970_100011215043 [0,2,0,0,0,0|1,1,0]=4 17384 B15R1.2313 COc1cc(ccc1C(=O)CCCO)I 1458a_100012353712_100011215043 [0,2,0,0,0,0|1,1,0]=4 17385 B15R1.2313 COc1cc(ccc1C(=O)NCC#N)Cl 1626a_100000734998_100000217211 [0,2,0,0,0,0|1,0,1]=4 17386 B15R1.2313 COc1cc(ccc1C(=O)NCC#N)Cl 527a_100000734998_100000217211 [0,2,0,0,0,0|1,0,1]=4 17387 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Br 11a_100000724931_100000748230 [0,2,0,0,0,0|1,1,0]=4 17388 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Br 1626a_100000724931_100000748230 [0,2,0,0,0,0|1,1,0]=4 17389 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Br 240690a_100000724931_100000748230 [0,2,0,0,0,0|1,1,0]=4 17390 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Br 527a_100000724931_100000748230 [0,2,0,0,0,0|1,1,0]=4 17391 B15R1.2313 COc1cc(ccc1C(=O)NCCF)C 11a_100000724931_100000217210 [0,2,0,0,0,0|2,0,0]=4 17392 B15R1.2313 COc1cc(ccc1C(=O)NCCF)C 1626a_100000724931_100000217210 [0,2,0,0,0,0|2,0,0]=4 17393 B15R1.2313 COc1cc(ccc1C(=O)NCCF)C 240690a_100000724931_100000217210 [0,2,0,0,0,0|2,0,0]=4 17394 B15R1.2313 COc1cc(ccc1C(=O)NCCF)C 527a_100000724931_100000217210 [0,2,0,0,0,0|2,0,0]=4 17395 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Cl 11a_100000724931_100000217211 [0,2,0,0,0,0|1,0,0]=3 17396 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Cl 1626a_100000724931_100000217211 [0,2,0,0,0,0|1,0,0]=3 17397 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Cl 240690a_100000724931_100000217211 [0,2,0,0,0,0|1,0,0]=3 17398 B15R1.2313 COc1cc(ccc1C(=O)NCCF)Cl 527a_100000724931_100000217211 [0,2,0,0,0,0|1,0,0]=3 17399 B15R1.2313 COc1cc(ccc1C(=O)NCCF)F 11a_100000724931_100000239970 [0,2,0,0,0,0|1,1,0]=4 17400 B15R1.2313 COc1cc(ccc1C(=O)NCCF)F 1626a_100000724931_100000239970 [0,2,0,0,0,0|1,1,0]=4 17401 B15R1.2313 COc1cc(ccc1C(=O)NCCF)F 240690a_100000724931_100000239970 [0,2,0,0,0,0|1,1,0]=4 17402 B15R1.2313 COc1cc(ccc1C(=O)NCCF)F 527a_100000724931_100000239970 [0,2,0,0,0,0|1,1,0]=4 17403 B15R1.2313 COc1cc(ccc1C(=O)NCCF)I 11a_100000724931_100012353712 [0,2,0,0,0,0|1,1,0]=4 17404 B15R1.2313 COc1cc(ccc1C(=O)NCCF)I 1626a_100000724931_100012353712 [0,2,0,0,0,0|1,1,0]=4 17405 B15R1.2313 COc1cc(ccc1C(=O)NCCF)I 240690a_100000724931_100012353712 [0,2,0,0,0,0|1,1,0]=4 17406 B15R1.2313 COc1cc(ccc1C(=O)NCCF)I 527a_100000724931_100012353712 [0,2,0,0,0,0|1,1,0]=4 17407 B15R1.2313 COc1cc(ccc1C(=O)NCCO)Br 240690a_100000210304_100000748230 [0,2,0,0,0,0|0,1,0]=3 17408 B15R1.2313 COc1cc(ccc1C(=O)NCCO)Br 527a_100000210304_100000748230 [0,2,0,0,0,0|0,1,0]=3 17409 B15R1.2313 COc1cc(ccc1C(=O)NCCO)C 240690a_100000210304_100000217210 [0,2,0,0,0,0|1,0,0]=3 17410 B15R1.2313 COc1cc(ccc1C(=O)NCCO)C 527a_100000210304_100000217210 [0,2,0,0,0,0|1,0,0]=3 17411 B15R1.2313 COc1cc(ccc1C(=O)NCCO)Cl 240690a_100000210304_100000217211 [0,2,0,0,0,0|0,0,0]=2 17412 B15R1.2313 COc1cc(ccc1C(=O)NCCO)Cl 527a_100000210304_100000217211 [0,2,0,0,0,0|0,0,0]=2 17413 B15R1.2313 COc1cc(ccc1C(=O)NCCO)F 240690a_100000210304_100000239970 [0,2,0,0,0,0|0,1,0]=3 17414 B15R1.2313 COc1cc(ccc1C(=O)NCCO)F 527a_100000210304_100000239970 [0,2,0,0,0,0|0,1,0]=3 17415 B15R1.2313 COc1cc(ccc1C(=O)NCCO)I 240690a_100000210304_100012353712 [0,2,0,0,0,0|0,1,0]=3 17416 B15R1.2313 COc1cc(ccc1C(=O)NCCO)I 527a_100000210304_100012353712 [0,2,0,0,0,0|0,1,0]=3 17417 B15R1.2313 COc1cc(ccc1C(C)NCCO)Cl 269862a_100000210304_100011551334 [0,2,0,0,0,0|1,0,1]=4 17418 B15R1.2313 Cc1ccc(c(c1)C#N)C(=O)CCCO 1458a_200012184421_100011215043 [0,2,0,0,0,0|2,0,0]=4 17419 B15R1.2313 Cc1ccc(c(c1)C#N)C(=O)NCCF 1626a_100000724931_200012184421 [0,2,0,0,0,0|2,0,0]=4 17420 B15R1.2313 Cc1ccc(c(c1)C#N)C(=O)NCCF 240690a_100000724931_200012184421 [0,2,0,0,0,0|2,0,0]=4 17421 B15R1.2313 Cc1ccc(c(c1)C#N)C(=O)NCCF 527a_100000724931_200012184421 [0,2,0,0,0,0|2,0,0]=4 17422 B15R1.2313 Cc1ccc(c(c1)C#N)C(=O)NCCO 240690a_100000210304_200012184421 [0,2,0,0,0,0|1,0,0]=3 17423 B15R1.2313 Cc1ccc(c(c1)C#N)C(=O)NCCO 527a_100000210304_200012184421 [0,2,0,0,0,0|1,0,0]=3 17424 B15R1.2313 N#Cc1cc(ccc1C(=O)CCCO)Br 1458a_100012349539_100011215043 [0,2,0,0,0,0|1,1,0]=4 17425 B15R1.2313 N#Cc1cc(ccc1C(=O)CCCO)F 1458a_100012002388_100011215043 [0,2,0,0,0,0|1,1,0]=4 17426 B15R1.2313 N#Cc1cc(ccc1C(=O)NCCF)Br 11a_100000724931_100012349539 [0,2,0,0,0,0|1,1,0]=4 17427 B15R1.2313 N#Cc1cc(ccc1C(=O)NCCF)Br 240690a_100000724931_100012349539 [0,2,0,0,0,0|1,1,0]=4 17428 B15R1.2313 N#Cc1cc(ccc1C(=O)NCCF)F 11a_100000724931_100012002388 [0,2,0,0,0,0|1,1,0]=4 17429 B15R1.2313 N#Cc1cc(ccc1C(=O)NCCF)F 1626a_100000724931_100012002388 [0,2,0,0,0,0|1,1,0]=4 17430 B15R1.2313 N#Cc1cc(ccc1C(=O)NCCO)Br 240690a_100000210304_100012349539 [0,2,0,0,0,0|0,1,0]=3 17431 B15R1.2313 O=C(CCCO)c1ccc(cc1CO)Br 1458a_100010253900_100011215043 [0,2,0,0,0,0|1,1,0]=4 17432 B15R1.2313 O=C(CCCO)c1ccc(cc1CO)F 1458a_100013035055_100011215043 [0,2,0,0,0,0|1,1,0]=4 17433 B15R1.2313 O=C(NCCF)c1ccc(cc1CO)F 1626a_100000724931_100013035055 [0,2,0,0,0,0|1,1,0]=4 17434 B15R1.2313 O=C(NCCF)c1ccc(cc1CO)F 240690a_100000724931_100013035055 [0,2,0,0,0,0|1,1,0]=4 17435 B15R1.2313 O=C(NCCO)c1ccc(cc1CO)F 240690a_100000210304_100013035055 [0,2,0,0,0,0|0,1,0]=3 17436 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Br)Cl)F 11a_100000212058_100010244364 [0,2,0,0,0,0|1,0,1]=4 17437 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100000212058_100010244364 [0,2,0,0,0,0|1,0,1]=4 17438 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100000212058_100010244364 [0,2,0,0,0,0|1,0,1]=4 17439 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Br)Cl)F 527a_100000212058_100010244364 [0,2,0,0,0,0|1,0,1]=4 17440 B15R1.45297 C#CCNC(=O)c1c(cc(cc1C)Cl)C 11a_100000212058_100000088873 [0,2,0,0,0,0|1,0,1]=4 17441 B15R1.45297 C#CCNC(=O)c1c(cc(cc1C)Cl)C 1626a_100000212058_100000088873 [0,2,0,0,0,0|1,0,1]=4 17442 B15R1.45297 C#CCNC(=O)c1c(cc(cc1C)Cl)C 240690a_100000212058_100000088873 [0,2,0,0,0,0|1,0,1]=4 17443 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 11a_100000212058_100011215713 [0,2,0,0,0,0|1,0,1]=4 17444 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100000212058_100011215713 [0,2,0,0,0,0|1,0,1]=4 17445 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100000212058_100011215713 [0,2,0,0,0,0|1,0,1]=4 17446 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)F 11a_100000212058_100010068318 [0,2,0,0,0,0|1,0,1]=4 17447 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100000212058_100010068318 [0,2,0,0,0,0|1,0,1]=4 17448 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100000212058_100010068318 [0,2,0,0,0,0|1,0,1]=4 17449 B15R1.45297 C#CCNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100000212058_100010068318 [0,2,0,0,0,0|1,0,1]=4 17450 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)C 11a_100000212058_100010768517 [0,2,0,0,0,0|1,0,1]=4 17451 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)C 1626a_100000212058_100010768517 [0,2,0,0,0,0|1,0,1]=4 17452 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)C 240690a_100000212058_100010768517 [0,2,0,0,0,0|1,0,1]=4 17453 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)C 527a_100000212058_100010768517 [0,2,0,0,0,0|1,0,1]=4 17454 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)F 11a_100000212058_100000062413 [0,2,0,0,0,0|1,0,1]=4 17455 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)F 1626a_100000212058_100000062413 [0,2,0,0,0,0|1,0,1]=4 17456 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)F 240690a_100000212058_100000062413 [0,2,0,0,0,0|1,0,1]=4 17457 B15R1.45297 C#CCNC(=O)c1c(cc(cc1F)Cl)F 527a_100000212058_100000062413 [0,2,0,0,0,0|1,0,1]=4 17458 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100020586998_100010244364 [0,2,0,0,0,0|1,0,1]=4 17459 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100020586998_100010244364 [0,2,0,0,0,0|1,0,1]=4 17460 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Br)Cl)F 527a_100020586998_100010244364 [0,2,0,0,0,0|1,0,1]=4 17461 B15R1.45297 C=CCNC(=O)c1c(cc(cc1C)Cl)C 1626a_100020586998_100000088873 [0,2,0,0,0,0|1,0,1]=4 17462 B15R1.45297 C=CCNC(=O)c1c(cc(cc1C)Cl)C 240690a_100020586998_100000088873 [0,2,0,0,0,0|1,0,1]=4 17463 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100020586998_100011215713 [0,2,0,0,0,0|1,0,1]=4 17464 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100020586998_100011215713 [0,2,0,0,0,0|1,0,1]=4 17465 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100020586998_100010068318 [0,2,0,0,0,0|1,0,1]=4 17466 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100020586998_100010068318 [0,2,0,0,0,0|1,0,1]=4 17467 B15R1.45297 C=CCNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100020586998_100010068318 [0,2,0,0,0,0|1,0,1]=4 17468 B15R1.45297 C=CCNC(=O)c1c(cc(cc1F)Cl)C 1626a_100020586998_100010768517 [0,2,0,0,0,0|1,0,1]=4 17469 B15R1.45297 C=CCNC(=O)c1c(cc(cc1F)Cl)C 240690a_100020586998_100010768517 [0,2,0,0,0,0|1,0,1]=4 17470 B15R1.45297 C=CCNC(=O)c1c(cc(cc1F)Cl)C 527a_100020586998_100010768517 [0,2,0,0,0,0|1,0,1]=4 17471 B15R1.45297 C=CCNC(=O)c1c(cc(cc1F)Cl)F 1626a_100020586998_100000062413 [0,2,0,0,0,0|1,0,1]=4 17472 B15R1.45297 C=CCNC(=O)c1c(cc(cc1F)Cl)F 240690a_100020586998_100000062413 [0,2,0,0,0,0|1,0,1]=4 17473 B15R1.45297 C=CCNC(=O)c1c(cc(cc1F)Cl)F 527a_100020586998_100000062413 [0,2,0,0,0,0|1,0,1]=4 17474 B15R1.45297 CCCCC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100000210211 [0,2,0,0,0,0|2,0,0]=4 17475 B15R1.45297 CCCCC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_100000210211 [0,2,0,0,0,0|2,0,0]=4 17476 B15R1.45297 CCCCC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100000210211 [0,2,0,0,0,0|2,0,0]=4 17477 B15R1.45297 CCCCC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_100000210211 [0,2,0,0,0,0|2,0,0]=4 17478 B15R1.45297 CCCCC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_100000210211 [0,2,0,0,0,0|2,0,0]=4 17479 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)Br 11a_100020643023_100011217931 [0,2,0,0,0,0|1,1,0]=4 17480 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)Br 240690a_100020643023_100011217931 [0,2,0,0,0,0|1,1,0]=4 17481 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)Br 527a_100020643023_100011217931 [0,2,0,0,0,0|1,1,0]=4 17482 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)F 11a_100020643023_100009813784 [0,2,0,0,0,0|1,1,0]=4 17483 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)F 1626a_100020643023_100009813784 [0,2,0,0,0,0|1,1,0]=4 17484 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)F 240690a_100020643023_100009813784 [0,2,0,0,0,0|1,1,0]=4 17485 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Br)F 527a_100020643023_100009813784 [0,2,0,0,0,0|1,1,0]=4 17486 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)C)F 11a_100020643023_100010768510 [0,2,0,0,0,0|2,0,0]=4 17487 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)C)F 1626a_100020643023_100010768510 [0,2,0,0,0,0|2,0,0]=4 17488 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)C)F 240690a_100020643023_100010768510 [0,2,0,0,0,0|2,0,0]=4 17489 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)C)F 527a_100020643023_100010768510 [0,2,0,0,0,0|2,0,0]=4 17490 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Cl)F 11a_100020643023_100010244364 [0,2,0,0,0,0|1,0,0]=3 17491 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100020643023_100010244364 [0,2,0,0,0,0|1,0,0]=3 17492 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Cl)F 240690a_100020643023_100010244364 [0,2,0,0,0,0|1,0,0]=3 17493 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)Cl)F 527a_100020643023_100010244364 [0,2,0,0,0,0|1,0,0]=3 17494 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)Br 11a_100020643023_200015320377 [0,2,0,0,0,0|1,1,0]=4 17495 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)Br 1626a_100020643023_200015320377 [0,2,0,0,0,0|1,1,0]=4 17496 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)Br 240690a_100020643023_200015320377 [0,2,0,0,0,0|1,1,0]=4 17497 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)Br 527a_100020643023_200015320377 [0,2,0,0,0,0|1,1,0]=4 17498 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)C 11a_100020643023_100010204434 [0,2,0,0,0,0|1,1,0]=4 17499 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)C 1626a_100020643023_100010204434 [0,2,0,0,0,0|1,1,0]=4 17500 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)C 240690a_100020643023_100010204434 [0,2,0,0,0,0|1,1,0]=4 17501 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)C 527a_100020643023_100010204434 [0,2,0,0,0,0|1,1,0]=4 17502 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)F 11a_100020643023_100013316034 [0,2,0,0,0,0|1,1,0]=4 17503 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)F 1626a_100020643023_100013316034 [0,2,0,0,0,0|1,1,0]=4 17504 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)F 240690a_100020643023_100013316034 [0,2,0,0,0,0|1,1,0]=4 17505 B15R1.45297 CCCNC(=O)c1c(cc(cc1Br)F)F 527a_100020643023_100013316034 [0,2,0,0,0,0|1,1,0]=4 17506 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)Br)C 11a_100020643023_100000739581 [0,2,0,0,0,0|1,1,0]=4 17507 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)Br)C 1626a_100020643023_100000739581 [0,2,0,0,0,0|1,1,0]=4 17508 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)Br)C 240690a_100020643023_100000739581 [0,2,0,0,0,0|1,1,0]=4 17509 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)C)C 11a_100020643023_100000211658 [0,2,0,0,0,0|2,0,0]=4 17510 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)C)C 1626a_100020643023_100000211658 [0,2,0,0,0,0|2,0,0]=4 17511 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)C)C 240690a_100020643023_100000211658 [0,2,0,0,0,0|2,0,0]=4 17512 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)Cl)C 11a_100020643023_100000088873 [0,2,0,0,0,0|1,0,0]=3 17513 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)Cl)C 1626a_100020643023_100000088873 [0,2,0,0,0,0|1,0,0]=3 17514 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)Cl)C 240690a_100020643023_100000088873 [0,2,0,0,0,0|1,0,0]=3 17515 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)F)C 11a_100020643023_100012017201 [0,2,0,0,0,0|1,1,0]=4 17516 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)F)C 1626a_100020643023_100012017201 [0,2,0,0,0,0|1,1,0]=4 17517 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)F)C 240690a_100020643023_100012017201 [0,2,0,0,0,0|1,1,0]=4 17518 B15R1.45297 CCCNC(=O)c1c(cc(cc1C)O)C 240690a_100020643023_100000066486 [0,2,0,0,0,0|2,0,0]=4 17519 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)C 11a_100020643023_100000698028 [0,2,0,0,0,0|1,1,0]=4 17520 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)C 1626a_100020643023_100000698028 [0,2,0,0,0,0|1,1,0]=4 17521 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)C 240690a_100020643023_100000698028 [0,2,0,0,0,0|1,1,0]=4 17522 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)Cl 11a_100020643023_100012360385 [0,2,0,0,0,0|1,1,0]=4 17523 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)Cl 1626a_100020643023_100012360385 [0,2,0,0,0,0|1,1,0]=4 17524 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)Cl 240690a_100020643023_100012360385 [0,2,0,0,0,0|1,1,0]=4 17525 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)F 11a_100020643023_100010078411 [0,2,0,0,0,0|1,1,0]=4 17526 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)F 1626a_100020643023_100010078411 [0,2,0,0,0,0|1,1,0]=4 17527 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)F 240690a_100020643023_100010078411 [0,2,0,0,0,0|1,1,0]=4 17528 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Br)F 527a_100020643023_100010078411 [0,2,0,0,0,0|1,1,0]=4 17529 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)C)Cl 11a_100020643023_100009989429 [0,2,0,0,0,0|2,0,0]=4 17530 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)C)Cl 1626a_100020643023_100009989429 [0,2,0,0,0,0|2,0,0]=4 17531 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)C)Cl 240690a_100020643023_100009989429 [0,2,0,0,0,0|2,0,0]=4 17532 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)C)Cl 527a_100020643023_100009989429 [0,2,0,0,0,0|2,0,0]=4 17533 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)Cl 11a_100020643023_100011215713 [0,2,0,0,0,0|1,0,0]=3 17534 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100020643023_100011215713 [0,2,0,0,0,0|1,0,0]=3 17535 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)Cl 240690a_100020643023_100011215713 [0,2,0,0,0,0|1,0,0]=3 17536 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)F 11a_100020643023_100010068318 [0,2,0,0,0,0|1,0,0]=3 17537 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100020643023_100010068318 [0,2,0,0,0,0|1,0,0]=3 17538 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)F 240690a_100020643023_100010068318 [0,2,0,0,0,0|1,0,0]=3 17539 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100020643023_100010068318 [0,2,0,0,0,0|1,0,0]=3 17540 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)Cl 11a_100020643023_100000703918 [0,2,0,0,0,0|1,1,0]=4 17541 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)Cl 1626a_100020643023_100000703918 [0,2,0,0,0,0|1,1,0]=4 17542 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)Cl 240690a_100020643023_100000703918 [0,2,0,0,0,0|1,1,0]=4 17543 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)F 11a_100020643023_100000119028 [0,2,0,0,0,0|1,1,0]=4 17544 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)F 1626a_100020643023_100000119028 [0,2,0,0,0,0|1,1,0]=4 17545 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)F 240690a_100020643023_100000119028 [0,2,0,0,0,0|1,1,0]=4 17546 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)F)F 527a_100020643023_100000119028 [0,2,0,0,0,0|1,1,0]=4 17547 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)I)Cl 11a_100020643023_100010740244 [0,2,0,0,0,0|1,1,0]=4 17548 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)I)Cl 1626a_100020643023_100010740244 [0,2,0,0,0,0|1,1,0]=4 17549 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)I)Cl 240690a_100020643023_100010740244 [0,2,0,0,0,0|1,1,0]=4 17550 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)I)Cl 527a_100020643023_100010740244 [0,2,0,0,0,0|1,1,0]=4 17551 B15R1.45297 CCCNC(=O)c1c(cc(cc1Cl)O)Cl 240690a_100020643023_100010423397 [0,2,0,0,0,0|2,0,0]=4 17552 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)C 11a_100020643023_100000708665 [0,2,0,0,0,0|1,1,0]=4 17553 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)C 1626a_100020643023_100000708665 [0,2,0,0,0,0|1,1,0]=4 17554 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)C 240690a_100020643023_100000708665 [0,2,0,0,0,0|1,1,0]=4 17555 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)C 527a_100020643023_100000708665 [0,2,0,0,0,0|1,1,0]=4 17556 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)F 11a_100020643023_100000766946 [0,2,0,0,0,0|1,1,0]=4 17557 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)F 1626a_100020643023_100000766946 [0,2,0,0,0,0|1,1,0]=4 17558 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)F 240690a_100020643023_100000766946 [0,2,0,0,0,0|1,1,0]=4 17559 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)F 527a_100020643023_100000766946 [0,2,0,0,0,0|1,1,0]=4 17560 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Br)O 527a_100020643023_200015963038 [0,2,0,0,0,0|1,1,0]=4 17561 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)C)F 11a_100020643023_100009878570 [0,2,0,0,0,0|2,0,0]=4 17562 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)C)F 1626a_100020643023_100009878570 [0,2,0,0,0,0|2,0,0]=4 17563 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)C)F 240690a_100020643023_100009878570 [0,2,0,0,0,0|2,0,0]=4 17564 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)C)F 527a_100020643023_100009878570 [0,2,0,0,0,0|2,0,0]=4 17565 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)C 11a_100020643023_100010768517 [0,2,0,0,0,0|1,0,0]=3 17566 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)C 1626a_100020643023_100010768517 [0,2,0,0,0,0|1,0,0]=3 17567 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)C 240690a_100020643023_100010768517 [0,2,0,0,0,0|1,0,0]=3 17568 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)C 527a_100020643023_100010768517 [0,2,0,0,0,0|1,0,0]=3 17569 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)F 11a_100020643023_100000062413 [0,2,0,0,0,0|1,0,0]=3 17570 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)F 1626a_100020643023_100000062413 [0,2,0,0,0,0|1,0,0]=3 17571 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)F 240690a_100020643023_100000062413 [0,2,0,0,0,0|1,0,0]=3 17572 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)Cl)F 527a_100020643023_100000062413 [0,2,0,0,0,0|1,0,0]=3 17573 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)F)F 11a_100020643023_100000751013 [0,2,0,0,0,0|1,1,0]=4 17574 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)F)F 1626a_100020643023_100000751013 [0,2,0,0,0,0|1,1,0]=4 17575 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)F)F 240690a_100020643023_100000751013 [0,2,0,0,0,0|1,1,0]=4 17576 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)F)F 527a_100020643023_100000751013 [0,2,0,0,0,0|1,1,0]=4 17577 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)F)O 240690a_100020643023_100000746385 [0,2,0,0,0,0|1,1,0]=4 17578 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)F)O 527a_100020643023_100000746385 [0,2,0,0,0,0|1,1,0]=4 17579 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)O)F 240690a_100020643023_100000038755 [0,2,0,0,0,0|2,0,0]=4 17580 B15R1.45297 CCCNC(=O)c1c(cc(cc1F)O)F 527a_100020643023_100000038755 [0,2,0,0,0,0|2,0,0]=4 17581 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)C)I 11a_100020643023_200010371430 [0,2,0,0,0,0|2,0,0]=4 17582 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)C)I 1626a_100020643023_200010371430 [0,2,0,0,0,0|2,0,0]=4 17583 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)C)I 240690a_100020643023_200010371430 [0,2,0,0,0,0|2,0,0]=4 17584 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)C)I 527a_100020643023_200010371430 [0,2,0,0,0,0|2,0,0]=4 17585 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)F)C 11a_100020643023_200010371433 [0,2,0,0,0,0|1,1,0]=4 17586 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)F)C 1626a_100020643023_200010371433 [0,2,0,0,0,0|1,1,0]=4 17587 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)F)C 240690a_100020643023_200010371433 [0,2,0,0,0,0|1,1,0]=4 17588 B15R1.45297 CCCNC(=O)c1c(cc(cc1I)F)C 527a_100020643023_200010371433 [0,2,0,0,0,0|1,1,0]=4 17589 B15R1.45297 CCCNC(=O)c1c(cc(cc1O)C)O 527a_100020643023_100000036929 [0,2,0,0,0,0|2,0,0]=4 17590 B15R1.45297 CCCNC(=O)c1c(cc(cc1O)O)O 527a_100020643023_100000040092 [0,2,0,0,0,0|2,0,0]=4 17591 B15R1.45297 CCNNC(=O)c1c(cc(cc1Br)Cl)F 22a_100000756455_100010244364 [0,2,0,0,0,0|2,0,0]=4 17592 B15R1.45297 CCNNC(=O)c1c(cc(cc1C)Cl)C 22a_100000756455_100000088873 [0,2,0,0,0,0|2,0,0]=4 17593 B15R1.45297 CCNNC(=O)c1c(cc(cc1Cl)Cl)Cl 22a_100000756455_100011215713 [0,2,0,0,0,0|2,0,0]=4 17594 B15R1.45297 CCNNC(=O)c1c(cc(cc1Cl)Cl)F 22a_100000756455_100010068318 [0,2,0,0,0,0|2,0,0]=4 17595 B15R1.45297 CCNNC(=O)c1c(cc(cc1F)Cl)C 22a_100000756455_100010768517 [0,2,0,0,0,0|2,0,0]=4 17596 B15R1.45297 CCNNC(=O)c1c(cc(cc1F)Cl)F 22a_100000756455_100000062413 [0,2,0,0,0,0|2,0,0]=4 17597 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)CCCO)F 1458a_100010768510_100011215043 [0,2,0,0,0,0|2,0,0]=4 17598 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)NCCF)F 11a_100000724931_100010768510 [0,2,0,0,0,0|2,0,0]=4 17599 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)NCCF)F 1626a_100000724931_100010768510 [0,2,0,0,0,0|2,0,0]=4 17600 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)NCCF)F 240690a_100000724931_100010768510 [0,2,0,0,0,0|2,0,0]=4 17601 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)NCCF)F 527a_100000724931_100010768510 [0,2,0,0,0,0|2,0,0]=4 17602 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)NCCO)F 240690a_100000210304_100010768510 [0,2,0,0,0,0|1,0,0]=3 17603 B15R1.45297 Cc1cc(c(c(c1)Br)C(=O)NCCO)F 527a_100000210304_100010768510 [0,2,0,0,0,0|1,0,0]=3 17604 B15R1.45297 Cc1cc(c(c(c1)C)C(=O)CCCO)C 1458a_100000211658_100011215043 [0,2,0,0,0,0|2,0,0]=4 17605 B15R1.45297 Cc1cc(c(c(c1)C)C(=O)NCCF)C 11a_100000724931_100000211658 [0,2,0,0,0,0|2,0,0]=4 17606 B15R1.45297 Cc1cc(c(c(c1)C)C(=O)NCCF)C 1626a_100000724931_100000211658 [0,2,0,0,0,0|2,0,0]=4 17607 B15R1.45297 Cc1cc(c(c(c1)C)C(=O)NCCF)C 240690a_100000724931_100000211658 [0,2,0,0,0,0|2,0,0]=4 17608 B15R1.45297 Cc1cc(c(c(c1)C)C(=O)NCCO)C 240690a_100000210304_100000211658 [0,2,0,0,0,0|1,0,0]=3 17609 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)CCCO)Cl 1458a_100009989429_100011215043 [0,2,0,0,0,0|2,0,0]=4 17610 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)NCCF)Cl 11a_100000724931_100009989429 [0,2,0,0,0,0|2,0,0]=4 17611 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)NCCF)Cl 1626a_100000724931_100009989429 [0,2,0,0,0,0|2,0,0]=4 17612 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)NCCF)Cl 240690a_100000724931_100009989429 [0,2,0,0,0,0|2,0,0]=4 17613 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)NCCF)Cl 527a_100000724931_100009989429 [0,2,0,0,0,0|2,0,0]=4 17614 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)NCCO)Cl 240690a_100000210304_100009989429 [0,2,0,0,0,0|1,0,0]=3 17615 B15R1.45297 Cc1cc(c(c(c1)Cl)C(=O)NCCO)Cl 527a_100000210304_100009989429 [0,2,0,0,0,0|1,0,0]=3 17616 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)CCCO)F 1458a_100009878570_100011215043 [0,2,0,0,0,0|2,0,0]=4 17617 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)NCCF)F 11a_100000724931_100009878570 [0,2,0,0,0,0|2,0,0]=4 17618 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)NCCF)F 1626a_100000724931_100009878570 [0,2,0,0,0,0|2,0,0]=4 17619 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)NCCF)F 240690a_100000724931_100009878570 [0,2,0,0,0,0|2,0,0]=4 17620 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)NCCF)F 527a_100000724931_100009878570 [0,2,0,0,0,0|2,0,0]=4 17621 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)NCCO)F 240690a_100000210304_100009878570 [0,2,0,0,0,0|1,0,0]=3 17622 B15R1.45297 Cc1cc(c(c(c1)F)C(=O)NCCO)F 527a_100000210304_100009878570 [0,2,0,0,0,0|1,0,0]=3 17623 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)CCCO)I 1458a_200010371430_100011215043 [0,2,0,0,0,0|2,0,0]=4 17624 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)NCCF)I 11a_100000724931_200010371430 [0,2,0,0,0,0|2,0,0]=4 17625 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)NCCF)I 1626a_100000724931_200010371430 [0,2,0,0,0,0|2,0,0]=4 17626 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)NCCF)I 240690a_100000724931_200010371430 [0,2,0,0,0,0|2,0,0]=4 17627 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)NCCF)I 527a_100000724931_200010371430 [0,2,0,0,0,0|2,0,0]=4 17628 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)NCCO)I 240690a_100000210304_200010371430 [0,2,0,0,0,0|1,0,0]=3 17629 B15R1.45297 Cc1cc(c(c(c1)I)C(=O)NCCO)I 527a_100000210304_200010371430 [0,2,0,0,0,0|1,0,0]=3 17630 B15R1.45297 Cc1cc(c(c(c1)O)C(=O)CCCO)C 1458a_100011255216_100011215043 [0,2,0,0,0,0|2,0,0]=4 17631 B15R1.45297 Cc1cc(c(c(c1)O)C(=O)CCCO)O 1458a_100000036929_100011215043 [0,2,0,0,0,0|2,0,0]=4 17632 B15R1.45297 Cc1cc(c(c(c1)O)C(=O)NCCF)O 527a_100000724931_100000036929 [0,2,0,0,0,0|2,0,0]=4 17633 B15R1.45297 Cc1cc(c(c(c1)O)C(=O)NCCO)O 527a_100000210304_100000036929 [0,2,0,0,0,0|1,0,0]=3 17634 B15R1.45297 Cc1cc(cc(c1C(=O)CCCF)C)Cl 1458a_100000088873_100011934791 [0,2,0,0,0,0|2,0,0]=4 17635 B15R1.45297 Cc1cc(cc(c1C(=O)CCCF)F)Cl 1458a_100010768517_100011934791 [0,2,0,0,0,0|2,0,0]=4 17636 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)Br)F 1458a_100010204434_100011215043 [0,2,0,0,0,0|1,1,0]=4 17637 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)C)Br 1458a_100000739581_100011215043 [0,2,0,0,0,0|1,1,0]=4 17638 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)C)Cl 1458a_100000088873_100011215043 [0,2,0,0,0,0|1,0,0]=3 17639 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)C)F 1458a_100012017201_100011215043 [0,2,0,0,0,0|1,1,0]=4 17640 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)C)O 1458a_100000066486_100011215043 [0,2,0,0,0,0|2,0,0]=4 17641 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)Cl)Br 1458a_100000698028_100011215043 [0,2,0,0,0,0|1,1,0]=4 17642 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)F)Br 1458a_100000708665_100011215043 [0,2,0,0,0,0|1,1,0]=4 17643 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)F)Cl 1458a_100010768517_100011215043 [0,2,0,0,0,0|1,0,0]=3 17644 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)I)F 1458a_200010371433_100011215043 [0,2,0,0,0,0|1,1,0]=4 17645 B15R1.45297 Cc1cc(cc(c1C(=O)CCCO)O)O 1458a_200000061528_100011215043 [0,2,0,0,0,0|2,0,0]=4 17646 B15R1.45297 Cc1cc(cc(c1C(=O)NCC#N)C)Cl 1626a_100000734998_100000088873 [0,2,0,0,0,0|1,0,1]=4 17647 B15R1.45297 Cc1cc(cc(c1C(=O)NCC#N)F)Cl 1626a_100000734998_100010768517 [0,2,0,0,0,0|1,0,1]=4 17648 B15R1.45297 Cc1cc(cc(c1C(=O)NCC#N)F)Cl 527a_100000734998_100010768517 [0,2,0,0,0,0|1,0,1]=4 17649 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Br)F 11a_100000724931_100010204434 [0,2,0,0,0,0|1,1,0]=4 17650 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Br)F 1626a_100000724931_100010204434 [0,2,0,0,0,0|1,1,0]=4 17651 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Br)F 240690a_100000724931_100010204434 [0,2,0,0,0,0|1,1,0]=4 17652 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Br)F 527a_100000724931_100010204434 [0,2,0,0,0,0|1,1,0]=4 17653 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)Br 11a_100000724931_100000739581 [0,2,0,0,0,0|1,1,0]=4 17654 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)Br 1626a_100000724931_100000739581 [0,2,0,0,0,0|1,1,0]=4 17655 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)Br 240690a_100000724931_100000739581 [0,2,0,0,0,0|1,1,0]=4 17656 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)Cl 11a_100000724931_100000088873 [0,2,0,0,0,0|1,0,0]=3 17657 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)Cl 1626a_100000724931_100000088873 [0,2,0,0,0,0|1,0,0]=3 17658 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)Cl 240690a_100000724931_100000088873 [0,2,0,0,0,0|1,0,0]=3 17659 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)F 11a_100000724931_100012017201 [0,2,0,0,0,0|1,1,0]=4 17660 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)F 1626a_100000724931_100012017201 [0,2,0,0,0,0|1,1,0]=4 17661 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)F 240690a_100000724931_100012017201 [0,2,0,0,0,0|1,1,0]=4 17662 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)C)O 240690a_100000724931_100000066486 [0,2,0,0,0,0|2,0,0]=4 17663 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Cl)Br 11a_100000724931_100000698028 [0,2,0,0,0,0|1,1,0]=4 17664 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Cl)Br 1626a_100000724931_100000698028 [0,2,0,0,0,0|1,1,0]=4 17665 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)Cl)Br 240690a_100000724931_100000698028 [0,2,0,0,0,0|1,1,0]=4 17666 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Br 11a_100000724931_100000708665 [0,2,0,0,0,0|1,1,0]=4 17667 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Br 1626a_100000724931_100000708665 [0,2,0,0,0,0|1,1,0]=4 17668 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Br 240690a_100000724931_100000708665 [0,2,0,0,0,0|1,1,0]=4 17669 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Br 527a_100000724931_100000708665 [0,2,0,0,0,0|1,1,0]=4 17670 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Cl 11a_100000724931_100010768517 [0,2,0,0,0,0|1,0,0]=3 17671 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Cl 1626a_100000724931_100010768517 [0,2,0,0,0,0|1,0,0]=3 17672 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Cl 240690a_100000724931_100010768517 [0,2,0,0,0,0|1,0,0]=3 17673 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)F)Cl 527a_100000724931_100010768517 [0,2,0,0,0,0|1,0,0]=3 17674 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)I)F 11a_100000724931_200010371433 [0,2,0,0,0,0|1,1,0]=4 17675 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)I)F 1626a_100000724931_200010371433 [0,2,0,0,0,0|1,1,0]=4 17676 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)I)F 240690a_100000724931_200010371433 [0,2,0,0,0,0|1,1,0]=4 17677 B15R1.45297 Cc1cc(cc(c1C(=O)NCCF)I)F 527a_100000724931_200010371433 [0,2,0,0,0,0|1,1,0]=4 17678 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)Br)F 240690a_100000210304_100010204434 [0,2,0,0,0,0|0,1,0]=3 17679 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)Br)F 527a_100000210304_100010204434 [0,2,0,0,0,0|0,1,0]=3 17680 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)C)Br 240690a_100000210304_100000739581 [0,2,0,0,0,0|0,1,0]=3 17681 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)C)Cl 240690a_100000210304_100000088873 [0,2,0,0,0,0|0,0,0]=2 17682 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)C)F 240690a_100000210304_100012017201 [0,2,0,0,0,0|0,1,0]=3 17683 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)C)O 240690a_100000210304_100000066486 [0,2,0,0,0,0|1,0,0]=3 17684 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)Cl)Br 240690a_100000210304_100000698028 [0,2,0,0,0,0|0,1,0]=3 17685 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)F)Br 240690a_100000210304_100000708665 [0,2,0,0,0,0|0,1,0]=3 17686 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)F)Br 527a_100000210304_100000708665 [0,2,0,0,0,0|0,1,0]=3 17687 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)F)Cl 240690a_100000210304_100010768517 [0,2,0,0,0,0|0,0,0]=2 17688 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)F)Cl 527a_100000210304_100010768517 [0,2,0,0,0,0|0,0,0]=2 17689 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)I)F 240690a_100000210304_200010371433 [0,2,0,0,0,0|0,1,0]=3 17690 B15R1.45297 Cc1cc(cc(c1C(=O)NCCO)I)F 527a_100000210304_200010371433 [0,2,0,0,0,0|0,1,0]=3 17691 B15R1.45297 N#CCNC(=O)c1c(cc(cc1Br)Cl)F 1626a_100000734998_100010244364 [0,2,0,0,0,0|1,0,1]=4 17692 B15R1.45297 N#CCNC(=O)c1c(cc(cc1Br)Cl)F 527a_100000734998_100010244364 [0,2,0,0,0,0|1,0,1]=4 17693 B15R1.45297 N#CCNC(=O)c1c(cc(cc1Cl)Cl)Cl 1626a_100000734998_100011215713 [0,2,0,0,0,0|1,0,1]=4 17694 B15R1.45297 N#CCNC(=O)c1c(cc(cc1Cl)Cl)F 1626a_100000734998_100010068318 [0,2,0,0,0,0|1,0,1]=4 17695 B15R1.45297 N#CCNC(=O)c1c(cc(cc1Cl)Cl)F 527a_100000734998_100010068318 [0,2,0,0,0,0|1,0,1]=4 17696 B15R1.45297 N#CCNC(=O)c1c(cc(cc1F)Cl)F 1626a_100000734998_100000062413 [0,2,0,0,0,0|1,0,1]=4 17697 B15R1.45297 N#CCNC(=O)c1c(cc(cc1F)Cl)F 527a_100000734998_100000062413 [0,2,0,0,0,0|1,0,1]=4 17698 B15R1.45297 O=C(CCCF)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100011934791 [0,2,0,0,0,0|2,0,0]=4 17699 B15R1.45297 O=C(CCCF)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100011934791 [0,2,0,0,0,0|2,0,0]=4 17700 B15R1.45297 O=C(CCCF)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100011934791 [0,2,0,0,0,0|2,0,0]=4 17701 B15R1.45297 O=C(CCCF)c1c(cc(cc1F)Cl)F 1458a_100000062413_100011934791 [0,2,0,0,0,0|2,0,0]=4 17702 B15R1.45297 O=C(CCCO)c1c(cc(cc1Br)Br)Br 1458a_100011217931_100011215043 [0,2,0,0,0,0|1,1,0]=4 17703 B15R1.45297 O=C(CCCO)c1c(cc(cc1Br)Br)F 1458a_100009813784_100011215043 [0,2,0,0,0,0|1,1,0]=4 17704 B15R1.45297 O=C(CCCO)c1c(cc(cc1Br)Cl)F 1458a_100010244364_100011215043 [0,2,0,0,0,0|1,0,0]=3 17705 B15R1.45297 O=C(CCCO)c1c(cc(cc1Br)F)Br 1458a_200015320377_100011215043 [0,2,0,0,0,0|1,1,0]=4 17706 B15R1.45297 O=C(CCCO)c1c(cc(cc1Br)F)F 1458a_100013316034_100011215043 [0,2,0,0,0,0|1,1,0]=4 17707 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_100011215043 [0,2,0,0,0,0|1,1,0]=4 17708 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)Br)F 1458a_100010078411_100011215043 [0,2,0,0,0,0|1,1,0]=4 17709 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_100011215043 [0,2,0,0,0,0|1,0,0]=3 17710 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_100011215043 [0,2,0,0,0,0|1,0,0]=3 17711 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_100011215043 [0,2,0,0,0,0|1,1,0]=4 17712 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)F)F 1458a_100000119028_100011215043 [0,2,0,0,0,0|1,1,0]=4 17713 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_100011215043 [0,2,0,0,0,0|1,1,0]=4 17714 B15R1.45297 O=C(CCCO)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_100011215043 [0,2,0,0,0,0|2,0,0]=4 17715 B15R1.45297 O=C(CCCO)c1c(cc(cc1F)Br)F 1458a_100000766946_100011215043 [0,2,0,0,0,0|1,1,0]=4 17716 B15R1.45297 O=C(CCCO)c1c(cc(cc1F)Br)O 1458a_200015963038_100011215043 [0,2,0,0,0,0|1,1,0]=4 17717 B15R1.45297 O=C(CCCO)c1c(cc(cc1F)Cl)F 1458a_100000062413_100011215043 [0,2,0,0,0,0|1,0,0]=3 17718 B15R1.45297 O=C(CCCO)c1c(cc(cc1F)F)F 1458a_100000751013_100011215043 [0,2,0,0,0,0|1,1,0]=4 17719 B15R1.45297 O=C(CCCO)c1c(cc(cc1F)F)O 1458a_100000746385_100011215043 [0,2,0,0,0,0|1,1,0]=4 17720 B15R1.45297 O=C(CCCO)c1c(cc(cc1F)O)F 1458a_100000038755_100011215043 [0,2,0,0,0,0|2,0,0]=4 17721 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)Br 11a_100000724931_100011217931 [0,2,0,0,0,0|1,1,0]=4 17722 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)Br 240690a_100000724931_100011217931 [0,2,0,0,0,0|1,1,0]=4 17723 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)Br 527a_100000724931_100011217931 [0,2,0,0,0,0|1,1,0]=4 17724 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)F 11a_100000724931_100009813784 [0,2,0,0,0,0|1,1,0]=4 17725 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)F 1626a_100000724931_100009813784 [0,2,0,0,0,0|1,1,0]=4 17726 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)F 240690a_100000724931_100009813784 [0,2,0,0,0,0|1,1,0]=4 17727 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Br)F 527a_100000724931_100009813784 [0,2,0,0,0,0|1,1,0]=4 17728 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Cl)F 11a_100000724931_100010244364 [0,2,0,0,0,0|1,0,0]=3 17729 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Cl)F 1626a_100000724931_100010244364 [0,2,0,0,0,0|1,0,0]=3 17730 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Cl)F 240690a_100000724931_100010244364 [0,2,0,0,0,0|1,0,0]=3 17731 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)Cl)F 527a_100000724931_100010244364 [0,2,0,0,0,0|1,0,0]=3 17732 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)Br 11a_100000724931_200015320377 [0,2,0,0,0,0|1,1,0]=4 17733 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)Br 1626a_100000724931_200015320377 [0,2,0,0,0,0|1,1,0]=4 17734 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)Br 240690a_100000724931_200015320377 [0,2,0,0,0,0|1,1,0]=4 17735 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)Br 527a_100000724931_200015320377 [0,2,0,0,0,0|1,1,0]=4 17736 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)F 11a_100000724931_100013316034 [0,2,0,0,0,0|1,1,0]=4 17737 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)F 1626a_100000724931_100013316034 [0,2,0,0,0,0|1,1,0]=4 17738 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)F 240690a_100000724931_100013316034 [0,2,0,0,0,0|1,1,0]=4 17739 B15R1.45297 O=C(NCCF)c1c(cc(cc1Br)F)F 527a_100000724931_100013316034 [0,2,0,0,0,0|1,1,0]=4 17740 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)Cl 11a_100000724931_100012360385 [0,2,0,0,0,0|1,1,0]=4 17741 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)Cl 1626a_100000724931_100012360385 [0,2,0,0,0,0|1,1,0]=4 17742 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)Cl 240690a_100000724931_100012360385 [0,2,0,0,0,0|1,1,0]=4 17743 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)F 11a_100000724931_100010078411 [0,2,0,0,0,0|1,1,0]=4 17744 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)F 1626a_100000724931_100010078411 [0,2,0,0,0,0|1,1,0]=4 17745 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)F 240690a_100000724931_100010078411 [0,2,0,0,0,0|1,1,0]=4 17746 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Br)F 527a_100000724931_100010078411 [0,2,0,0,0,0|1,1,0]=4 17747 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)Cl 11a_100000724931_100011215713 [0,2,0,0,0,0|1,0,0]=3 17748 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)Cl 1626a_100000724931_100011215713 [0,2,0,0,0,0|1,0,0]=3 17749 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)Cl 240690a_100000724931_100011215713 [0,2,0,0,0,0|1,0,0]=3 17750 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)F 11a_100000724931_100010068318 [0,2,0,0,0,0|1,0,0]=3 17751 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)F 1626a_100000724931_100010068318 [0,2,0,0,0,0|1,0,0]=3 17752 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)F 240690a_100000724931_100010068318 [0,2,0,0,0,0|1,0,0]=3 17753 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)Cl)F 527a_100000724931_100010068318 [0,2,0,0,0,0|1,0,0]=3 17754 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)Cl 11a_100000724931_100000703918 [0,2,0,0,0,0|1,1,0]=4 17755 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)Cl 1626a_100000724931_100000703918 [0,2,0,0,0,0|1,1,0]=4 17756 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)Cl 240690a_100000724931_100000703918 [0,2,0,0,0,0|1,1,0]=4 17757 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)F 11a_100000724931_100000119028 [0,2,0,0,0,0|1,1,0]=4 17758 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)F 1626a_100000724931_100000119028 [0,2,0,0,0,0|1,1,0]=4 17759 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)F 240690a_100000724931_100000119028 [0,2,0,0,0,0|1,1,0]=4 17760 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)F)F 527a_100000724931_100000119028 [0,2,0,0,0,0|1,1,0]=4 17761 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)I)Cl 11a_100000724931_100010740244 [0,2,0,0,0,0|1,1,0]=4 17762 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)I)Cl 1626a_100000724931_100010740244 [0,2,0,0,0,0|1,1,0]=4 17763 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)I)Cl 240690a_100000724931_100010740244 [0,2,0,0,0,0|1,1,0]=4 17764 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)I)Cl 527a_100000724931_100010740244 [0,2,0,0,0,0|1,1,0]=4 17765 B15R1.45297 O=C(NCCF)c1c(cc(cc1Cl)O)Cl 240690a_100000724931_100010423397 [0,2,0,0,0,0|2,0,0]=4 17766 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Br)F 11a_100000724931_100000766946 [0,2,0,0,0,0|1,1,0]=4 17767 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Br)F 1626a_100000724931_100000766946 [0,2,0,0,0,0|1,1,0]=4 17768 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Br)F 240690a_100000724931_100000766946 [0,2,0,0,0,0|1,1,0]=4 17769 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Br)F 527a_100000724931_100000766946 [0,2,0,0,0,0|1,1,0]=4 17770 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Br)O 527a_100000724931_200015963038 [0,2,0,0,0,0|1,1,0]=4 17771 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Cl)F 11a_100000724931_100000062413 [0,2,0,0,0,0|1,0,0]=3 17772 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Cl)F 1626a_100000724931_100000062413 [0,2,0,0,0,0|1,0,0]=3 17773 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Cl)F 240690a_100000724931_100000062413 [0,2,0,0,0,0|1,0,0]=3 17774 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)Cl)F 527a_100000724931_100000062413 [0,2,0,0,0,0|1,0,0]=3 17775 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)F)F 11a_100000724931_100000751013 [0,2,0,0,0,0|1,1,0]=4 17776 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)F)F 1626a_100000724931_100000751013 [0,2,0,0,0,0|1,1,0]=4 17777 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)F)F 240690a_100000724931_100000751013 [0,2,0,0,0,0|1,1,0]=4 17778 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)F)F 527a_100000724931_100000751013 [0,2,0,0,0,0|1,1,0]=4 17779 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)F)O 240690a_100000724931_100000746385 [0,2,0,0,0,0|1,1,0]=4 17780 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)F)O 527a_100000724931_100000746385 [0,2,0,0,0,0|1,1,0]=4 17781 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)O)F 240690a_100000724931_100000038755 [0,2,0,0,0,0|2,0,0]=4 17782 B15R1.45297 O=C(NCCF)c1c(cc(cc1F)O)F 527a_100000724931_100000038755 [0,2,0,0,0,0|2,0,0]=4 17783 B15R1.45297 O=C(NCCF)c1c(cc(cc1O)O)O 527a_100000724931_100000040092 [0,2,0,0,0,0|2,0,0]=4 17784 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)Br)Br 240690a_100000210304_100011217931 [0,2,0,0,0,0|0,1,0]=3 17785 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)Br)Br 527a_100000210304_100011217931 [0,2,0,0,0,0|0,1,0]=3 17786 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)Br)F 240690a_100000210304_100009813784 [0,2,0,0,0,0|0,1,0]=3 17787 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)Br)F 527a_100000210304_100009813784 [0,2,0,0,0,0|0,1,0]=3 17788 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)Cl)F 240690a_100000210304_100010244364 [0,2,0,0,0,0|0,0,0]=2 17789 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)Cl)F 527a_100000210304_100010244364 [0,2,0,0,0,0|0,0,0]=2 17790 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)F)Br 240690a_100000210304_200015320377 [0,2,0,0,0,0|0,1,0]=3 17791 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)F)Br 527a_100000210304_200015320377 [0,2,0,0,0,0|0,1,0]=3 17792 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)F)F 240690a_100000210304_100013316034 [0,2,0,0,0,0|0,1,0]=3 17793 B15R1.45297 O=C(NCCO)c1c(cc(cc1Br)F)F 527a_100000210304_100013316034 [0,2,0,0,0,0|0,1,0]=3 17794 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)Br)Cl 240690a_100000210304_100012360385 [0,2,0,0,0,0|0,1,0]=3 17795 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)Br)F 240690a_100000210304_100010078411 [0,2,0,0,0,0|0,1,0]=3 17796 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)Br)F 527a_100000210304_100010078411 [0,2,0,0,0,0|0,1,0]=3 17797 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)Cl)Cl 240690a_100000210304_100011215713 [0,2,0,0,0,0|0,0,0]=2 17798 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)Cl)F 240690a_100000210304_100010068318 [0,2,0,0,0,0|0,0,0]=2 17799 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)Cl)F 527a_100000210304_100010068318 [0,2,0,0,0,0|0,0,0]=2 17800 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)F)Cl 240690a_100000210304_100000703918 [0,2,0,0,0,0|0,1,0]=3 17801 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)F)F 240690a_100000210304_100000119028 [0,2,0,0,0,0|0,1,0]=3 17802 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)F)F 527a_100000210304_100000119028 [0,2,0,0,0,0|0,1,0]=3 17803 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)I)Cl 240690a_100000210304_100010740244 [0,2,0,0,0,0|0,1,0]=3 17804 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)I)Cl 527a_100000210304_100010740244 [0,2,0,0,0,0|0,1,0]=3 17805 B15R1.45297 O=C(NCCO)c1c(cc(cc1Cl)O)Cl 240690a_100000210304_100010423397 [0,2,0,0,0,0|1,0,0]=3 17806 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)Br)F 240690a_100000210304_100000766946 [0,2,0,0,0,0|0,1,0]=3 17807 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)Br)F 527a_100000210304_100000766946 [0,2,0,0,0,0|0,1,0]=3 17808 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)Br)O 527a_100000210304_200015963038 [0,2,0,0,0,0|0,1,0]=3 17809 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)Cl)F 240690a_100000210304_100000062413 [0,2,0,0,0,0|0,0,0]=2 17810 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)Cl)F 527a_100000210304_100000062413 [0,2,0,0,0,0|0,0,0]=2 17811 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)F)F 240690a_100000210304_100000751013 [0,2,0,0,0,0|0,1,0]=3 17812 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)F)F 527a_100000210304_100000751013 [0,2,0,0,0,0|0,1,0]=3 17813 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)F)O 240690a_100000210304_100000746385 [0,2,0,0,0,0|0,1,0]=3 17814 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)F)O 527a_100000210304_100000746385 [0,2,0,0,0,0|0,1,0]=3 17815 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)O)F 240690a_100000210304_100000038755 [0,2,0,0,0,0|1,0,0]=3 17816 B15R1.45297 O=C(NCCO)c1c(cc(cc1F)O)F 527a_100000210304_100000038755 [0,2,0,0,0,0|1,0,0]=3 17817 B13R1.43 O=C(Cc1ccc(s1)Cl)NCCO 240690a_100000210304_100000238644 [0,0,1,1,0,0|1,0,1]=4 17818 B13R2.12 Clc1ccc(cc1)C2=CCCC2 271570a_100000089523_100000755918 [1,0,0,1,0,0|2,0,0]=4 17819 B13R2.12 Oc1ccc(cc1)C2=NCCO2 271570a_203496583355_100009812740 [1,0,0,1,0,0|1,0,1]=4 17820 B13R2.527 Clc1ccc(cc1)C=CC2CC2 271570a_100102526188_100000755918 [1,0,0,1,0,0|2,0,0]=4 17821 B13R2.527 Clc1ccc(cc1)CNC2CC2 34a_100000174871_100000211595 [1,0,0,1,0,0|1,0,1]=4 17822 B13R2.527 Clc1ccc(cc1)CNC2CC2 34a_100000212008_100000694040 [1,0,0,1,0,0|1,0,1]=4 17823 B13R2.527 Clc1ccc(cc1)NCC2CO2 2230a_100000210052_100011216344 [1,0,0,1,0,0|2,0,0]=4 17824 B13R2.527 Clc1ccc(cc1)NCC2CO2 34a_100000210052_102125554688 [1,0,0,1,0,0|2,0,0]=4 17825 B13R2.527 Clc1ccc(cc1)OCC2CO2 34a_100000210216_102125554688 [1,0,0,1,0,0|2,0,0]=4 17826 B13R2.527 Clc1ccc(cc1)OCC2CO2 7a_100000210216_102125554688 [1,0,0,1,0,0|2,0,0]=4 17827 B13R2.527 Clc1ccc(cc1)OC[C@@H]2CO2 7a_100000210216_100000745022 [1,0,0,1,0,0|2,0,0]=4 17828 B13R2.527 Clc1ccc(cc1)SCC2CO2 62a_100000755918_102125554688 [1,0,0,1,0,0|2,0,0]=4 17829 B13R2.527 Clc1ccc(cc1)SCC2CO2 62a_102125554688_100000755918 [1,0,0,1,0,0|2,0,0]=4 17830 B13R2.527 Clc1ccc(cc1)SC[C@@H]2CO2 62a_100000745022_100000755918 [1,0,0,1,0,0|2,0,0]=4 17831 B13R2.527 Clc1ccc(cc1)SC[C@@H]2CO2 62a_100000755918_100000745022 [1,0,0,1,0,0|2,0,0]=4 17832 B13R2.1069 Clc1ccc(cc1)CN2CCC2 269982a_100000754969_100000187161 [1,0,0,1,0,0|1,0,1]=4 17833 B13R2.520 C=C(c1ccc(cc1)Cl)C2CC2 271570a_100010895485_100000755918 [1,0,0,1,0,0|2,0,0]=4 17834 B13R2.520 O=C(c1ccc(cc1)O)C2CC2 271570a_203496583355_100000764646 [1,0,0,1,0,0|2,0,0]=4 17835 B13R2.5179 O=C1CCCc2c1ccc(c2)O 271570a_203496583355_100000688402 [1,0,0,1,0,0|2,0,0]=4 17836 B13R2.5179 O=C1CCNc2c1ccc(c2)O 271570a_203496583355_100010157303 [1,0,0,1,0,0|2,0,0]=4 17837 B13R2.5179 O=C1CCOc2c1ccc(c2)O 271570a_203496583355_100000696939 [1,0,0,1,0,0|1,0,0]=3 17838 B13R2.5179 O=C1CCOc2c1ncc(c2)O 271570a_203496583355_100011092978 [1,0,0,1,0,0|2,0,0]=4 17839 B13R2.5179 O=C1CCSc2c1ccc(c2)O 271570a_203496583355_100010688399 [1,0,0,1,0,0|1,1,0]=4 17840 B13R2.5179 O=C1NCCc2c1ccc(c2)O 271570a_203496583355_100009817313 [1,0,0,1,0,0|1,0,0]=3 17841 B13R2.5179 O=C1NCCc2c1ccc(n2)O 271570a_203496583355_100009858568 [1,0,0,1,0,0|2,0,0]=4 17842 B13R2.5187 Cn1[nH]c(=O)c2c1cc(cc2)O 271570a_203496583355_100011014602 [1,0,0,1,0,0|2,0,0]=4 17843 B13R2.3 C1=C(CCCO1)c2ccccc2 271570a_100010175576_100000210277 [1,0,0,1,0,0|2,0,0]=4 17844 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [1,0,0,1,0,0|1,0,1]=4 17845 B13R2.690 O=C(CC1CC1)c2ccccc2 1458a_100000185807_100000742324 [1,0,0,1,0,0|2,0,0]=4 17846 B13R2.690 O=C(CC1CO1)c2ccccc2 1458a_100000185807_100011216344 [1,0,0,1,0,0|1,0,0]=3 17847 B13R2.690 O=C(CC1CS1)c2ccccc2 1458a_100000185807_100000031435 [1,0,0,1,0,0|1,1,0]=4 17848 B13R2.690 O=C(C[C@@H]1CO1)c2ccccc2 1458a_100000185807_100000745022 [1,0,0,1,0,0|1,0,0]=3 17849 B13R2.690 O=C(NC1CC1)c2ccccc2 1626a_100000212008_100000185807 [1,0,0,1,0,0|1,0,0]=3 17850 B13R2.690 O=C(NC1CC1)c2ccccc2 240690a_100000212008_100000185807 [1,0,0,1,0,0|1,0,0]=3 17851 B13R2.690 O=C(NC1CC1)c2ccccc2 527a_100000212008_100000185807 [1,0,0,1,0,0|1,0,0]=3 17852 B13R2.8137 O=C(c1ccccc1)C2CCC2 1458a_100000185807_100000749161 [1,0,0,1,0,0|2,0,0]=4 17853 B13R2.8137 O=C(c1ccccc1)N2CCC2 11a_100000754969_100000185807 [1,0,0,1,0,0|1,0,0]=3 17854 B13R2.8137 O=C(c1ccccc1)N2CCC2 240690a_100000754969_100000185807 [1,0,0,1,0,0|1,0,0]=3 17855 B13R2.8137 O=C(c1ccccc1)N2CCC2 527a_100000754969_100000185807 [1,0,0,1,0,0|1,0,0]=3 17856 B15R2.308 O=C1NCCCC1c2ccc(cc2)O 271570a_203496583355_100010110349 [0,0,0,1,0,1|2,0,0]=4 17857 B15R2.346 Cc1ccc2nc(sc2c1)NCCO 27a_100000210304_100010186437 [0,0,0,1,0,1|1,1,0]=4 17858 B15R2.346 Nc1ccc2nc(sc2c1)NCCO 27a_100000210304_100010253933 [0,0,0,1,0,1|1,1,0]=4 17859 B15R2.346 Nc1ccc2sc(nc2c1)NCCO 27a_100000210304_100010329861 [0,0,0,1,0,1|2,0,0]=4 17860 B15R2.346 OCCNc1nc2cc(ccc2s1)F 27a_100000210304_200010206605 [0,0,0,1,0,1|1,1,0]=4 17861 B15R2.346 OCCNc1nc2ccc(cc2s1)F 27a_100000210304_100000751617 [0,0,0,1,0,1|0,2,0]=4 17862 B15R2.346 OCCNc1nc2ccc(cc2s1)O 27a_100000210304_100010063415 [0,0,0,1,0,1|1,1,0]=4 17863 B15R2.1546 CC1CC1C(=O)Cc2ccc(cc2)Cl 1458a_100000211227_100000694040 [0,0,0,1,0,1|2,0,0]=4 17864 B15R2.1546 CC1CC1C(=O)Nc2ccc(cc2)Cl 11a_100000210052_100000211227 [0,0,0,1,0,1|2,0,0]=4 17865 B15R2.1546 CC1CC1C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100000211227 [0,0,0,1,0,1|2,0,0]=4 17866 B15R2.1546 CC1CC1C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100000211227 [0,0,0,1,0,1|2,0,0]=4 17867 B15R2.1546 CC1CC1C(=O)Nc2ccc(cc2)Cl 527a_100000210052_100000211227 [0,0,0,1,0,1|2,0,0]=4 17868 B15R2.1546 O=C(Cc1ccc(cc1)Cl)[C@@H]2C[C@@H]2F 1458a_100015396687_100000694040 [0,0,0,1,0,1|2,0,0]=4 17869 B15R2.1546 O=C(Nc1ccc(cc1)Cl)[C@@H]2C[C@@H]2F 11a_100000210052_100015396687 [0,0,0,1,0,1|2,0,0]=4 17870 B15R2.1546 O=C(Nc1ccc(cc1)Cl)[C@@H]2C[C@@H]2F 22a_100000210052_100015396687 [0,0,0,1,0,1|2,0,0]=4 17871 B15R2.1546 O=C(Nc1ccc(cc1)Cl)[C@@H]2C[C@@H]2F 527a_100000210052_100015396687 [0,0,0,1,0,1|2,0,0]=4 17872 B15R2.18927 Cc1ccc(cc1)CC(=O)CC2CO2 1458a_100000212244_100011216344 [0,0,0,1,0,1|2,0,0]=4 17873 B15R2.18927 Cc1ccc(cc1)CC(=O)C[C@@H]2CO2 1458a_100000212244_100000745022 [0,0,0,1,0,1|2,0,0]=4 17874 B15R2.18927 Cc1ccc(cc1)CC(=O)NC2CC2 240690a_100000212008_100000212244 [0,0,0,1,0,1|2,0,0]=4 17875 B15R2.18927 Cc1ccc(cc1)CC(=O)NC2CC2 527a_100000212008_100000212244 [0,0,0,1,0,1|2,0,0]=4 17876 B15R2.18927 Cc1ccc(cc1)NC(=O)NC2CC2 2430a_100000124888_100000212008 [0,0,0,1,0,1|2,0,0]=4 17877 B15R2.18927 O=C(CC1CC1)Nc2ccc(cc2)Cl 11a_100000210052_100000738066 [0,0,0,1,0,1|2,0,0]=4 17878 B15R2.18927 O=C(CC1CC1)Nc2ccc(cc2)Cl 1626a_100000210052_100000738066 [0,0,0,1,0,1|2,0,0]=4 17879 B15R2.18927 O=C(CC1CC1)Nc2ccc(cc2)Cl 22a_100000210052_100000738066 [0,0,0,1,0,1|2,0,0]=4 17880 B15R2.18927 O=C(CC1CC1)Nc2ccc(cc2)Cl 527a_100000210052_100000738066 [0,0,0,1,0,1|2,0,0]=4 17881 B15R2.18927 O=C(Cc1ccc(cc1)Br)CC2CO2 1458a_100000198978_100011216344 [0,0,0,1,0,1|1,1,0]=4 17882 B15R2.18927 O=C(Cc1ccc(cc1)Br)C[C@@H]2CO2 1458a_100000198978_100000745022 [0,0,0,1,0,1|1,1,0]=4 17883 B15R2.18927 O=C(Cc1ccc(cc1)Br)NC2CC2 240690a_100000212008_100000198978 [0,0,0,1,0,1|1,1,0]=4 17884 B15R2.18927 O=C(Cc1ccc(cc1)Br)NC2CC2 527a_100000212008_100000198978 [0,0,0,1,0,1|1,1,0]=4 17885 B15R2.18927 O=C(Cc1ccc(cc1)Cl)CC2CC2 1458a_100000211027_100000742324 [0,0,0,1,0,1|2,0,0]=4 17886 B15R2.18927 O=C(Cc1ccc(cc1)Cl)CC2CC2 1458a_100000738066_100000694040 [0,0,0,1,0,1|2,0,0]=4 17887 B15R2.18927 O=C(Cc1ccc(cc1)Cl)CC2CO2 1458a_100000211027_100011216344 [0,0,0,1,0,1|1,0,0]=3 17888 B15R2.18927 O=C(Cc1ccc(cc1)Cl)CC2CS2 1458a_100000211027_100000031435 [0,0,0,1,0,1|1,1,0]=4 17889 B15R2.18927 O=C(Cc1ccc(cc1)Cl)C[C@@H]2CO2 1458a_100000211027_100000745022 [0,0,0,1,0,1|1,0,0]=3 17890 B15R2.18927 O=C(Cc1ccc(cc1)Cl)NC2CC2 240690a_100000212008_100000211027 [0,0,0,1,0,1|1,0,0]=3 17891 B15R2.18927 O=C(Cc1ccc(cc1)Cl)NC2CC2 527a_100000212008_100000211027 [0,0,0,1,0,1|1,0,0]=3 17892 B15R2.18927 O=C(Cc1ccc(cc1)F)CC2CO2 1458a_100000210951_100011216344 [0,0,0,1,0,1|1,1,0]=4 17893 B15R2.18927 O=C(Cc1ccc(cc1)F)C[C@@H]2CO2 1458a_100000210951_100000745022 [0,0,0,1,0,1|1,1,0]=4 17894 B15R2.18927 O=C(Cc1ccc(cc1)F)NC2CC2 1626a_100000212008_100000210951 [0,0,0,1,0,1|1,1,0]=4 17895 B15R2.18927 O=C(Cc1ccc(cc1)F)NC2CC2 240690a_100000212008_100000210951 [0,0,0,1,0,1|1,1,0]=4 17896 B15R2.18927 O=C(Cc1ccc(cc1)F)NC2CC2 527a_100000212008_100000210951 [0,0,0,1,0,1|1,1,0]=4 17897 B15R2.18927 O=C(Cc1ccc(cc1)I)CC2CO2 1458a_100000688869_100011216344 [0,0,0,1,0,1|1,1,0]=4 17898 B15R2.18927 O=C(Cc1ccc(cc1)I)C[C@@H]2CO2 1458a_100000688869_100000745022 [0,0,0,1,0,1|1,1,0]=4 17899 B15R2.18927 O=C(Cc1ccc(cc1)I)NC2CC2 1626a_100000212008_100000688869 [0,0,0,1,0,1|1,1,0]=4 17900 B15R2.18927 O=C(Cc1ccc(cc1)I)NC2CC2 240690a_100000212008_100000688869 [0,0,0,1,0,1|1,1,0]=4 17901 B15R2.18927 O=C(Cc1ccc(cc1)I)NC2CC2 527a_100000212008_100000688869 [0,0,0,1,0,1|1,1,0]=4 17902 B15R2.18927 O=C(Cc1ccc(cc1)O)CC2CO2 1458a_100000198540_100011216344 [0,0,0,1,0,1|2,0,0]=4 17903 B15R2.18927 O=C(Cc1ccc(cc1)O)C[C@@H]2CO2 1458a_100000198540_100000745022 [0,0,0,1,0,1|2,0,0]=4 17904 B15R2.18927 O=C(Cc1ccc(cc1)O)NC2CC2 1626a_100000212008_100000198540 [0,0,0,1,0,1|2,0,0]=4 17905 B15R2.18927 O=C(Cc1ccc(cc1)O)NC2CC2 240690a_100000212008_100000198540 [0,0,0,1,0,1|2,0,0]=4 17906 B15R2.18927 O=C(Cc1ccc(cc1)O)NC2CC2 527a_100000212008_100000198540 [0,0,0,1,0,1|2,0,0]=4 17907 B15R2.18927 O=C(Cc1ccc(cn1)Cl)CC2CO2 1458a_100000728320_100011216344 [0,0,0,1,0,1|2,0,0]=4 17908 B15R2.18927 O=C(Cc1ccc(cn1)Cl)C[C@@H]2CO2 1458a_100000728320_100000745022 [0,0,0,1,0,1|2,0,0]=4 17909 B15R2.18927 O=C(Cc1ccc(cn1)Cl)NC2CC2 1626a_100000212008_100000728320 [0,0,0,1,0,1|2,0,0]=4 17910 B15R2.18927 O=C(Cc1ccc(cn1)Cl)NC2CC2 240690a_100000212008_100000728320 [0,0,0,1,0,1|2,0,0]=4 17911 B15R2.18927 O=C(Cc1ccc(cn1)Cl)NC2CC2 527a_100000212008_100000728320 [0,0,0,1,0,1|2,0,0]=4 17912 B15R2.18927 O=C(Cc1ccc(nc1)Cl)CC2CO2 1458a_100000061944_100011216344 [0,0,0,1,0,1|2,0,0]=4 17913 B15R2.18927 O=C(Cc1ccc(nc1)Cl)C[C@@H]2CO2 1458a_100000061944_100000745022 [0,0,0,1,0,1|2,0,0]=4 17914 B15R2.18927 O=C(Cc1ccc(nc1)Cl)NC2CC2 1626a_100000212008_100000061944 [0,0,0,1,0,1|2,0,0]=4 17915 B15R2.18927 O=C(Cc1ccc(nc1)Cl)NC2CC2 240690a_100000212008_100000061944 [0,0,0,1,0,1|2,0,0]=4 17916 B15R2.18927 O=C(Cc1ccc(nc1)Cl)NC2CC2 527a_100000212008_100000061944 [0,0,0,1,0,1|2,0,0]=4 17917 B15R2.18927 O=C(Nc1ccc(cc1)Br)NC2CC2 2430a_100000210018_100000212008 [0,0,0,1,0,1|1,1,0]=4 17918 B15R2.18927 O=C(Nc1ccc(cc1)Cl)NC2CC2 2430a_100000210052_100000212008 [0,0,0,1,0,1|1,0,0]=3 17919 B15R2.18927 O=C(Nc1ccc(cc1)F)NC2CC2 2430a_100000185862_100000212008 [0,0,0,1,0,1|1,1,0]=4 17920 B15R2.18927 O=C(Nc1ccc(cc1)I)NC2CC2 2430a_100000185761_100000212008 [0,0,0,1,0,1|1,1,0]=4 17921 B15R2.18927 O=C(Nc1ccc(cc1)O)NC2CC2 2430a_100000185829_100000212008 [0,0,0,1,0,1|2,0,0]=4 17922 B15R2.19022 Cc1ccc(cc1)CC(=O)C2CCO2 1458a_100000089072_100000210814 [0,0,0,1,0,1|2,0,0]=4 17923 B15R2.19022 Cc1ccc(cc1)CC(=O)N2CCC2 11a_100000754969_100000212244 [0,0,0,1,0,1|2,0,0]=4 17924 B15R2.19022 Cc1ccc(cc1)CC(=O)N2CCC2 240690a_100000754969_100000212244 [0,0,0,1,0,1|2,0,0]=4 17925 B15R2.19022 Cc1ccc(cc1)CC(=O)N2CCC2 527a_100000754969_100000212244 [0,0,0,1,0,1|2,0,0]=4 17926 B15R2.19022 Cc1ccc(cc1)NC(=O)C2CCO2 11a_100000124888_100000089072 [0,0,0,1,0,1|2,0,0]=4 17927 B15R2.19022 Cc1ccc(cc1)NC(=O)C2CCO2 1626a_100000124888_100000089072 [0,0,0,1,0,1|2,0,0]=4 17928 B15R2.19022 Cc1ccc(cc1)NC(=O)C2CCO2 22a_100000124888_100000089072 [0,0,0,1,0,1|2,0,0]=4 17929 B15R2.19022 Cc1ccc(cc1)NC(=O)C2CCO2 527a_100000124888_100000089072 [0,0,0,1,0,1|2,0,0]=4 17930 B15R2.19022 Cc1ccc(cc1)NC(=O)N2CCC2 2430a_100000124888_100000754969 [0,0,0,1,0,1|2,0,0]=4 17931 B15R2.19022 O=C(Cc1ccc(cc1)Br)C2CCO2 1458a_100000089072_100000189115 [0,0,0,1,0,1|1,1,0]=4 17932 B15R2.19022 O=C(Cc1ccc(cc1)Br)N2CCC2 11a_100000754969_100000198978 [0,0,0,1,0,1|1,1,0]=4 17933 B15R2.19022 O=C(Cc1ccc(cc1)Br)N2CCC2 240690a_100000754969_100000198978 [0,0,0,1,0,1|1,1,0]=4 17934 B15R2.19022 O=C(Cc1ccc(cc1)Br)N2CCC2 527a_100000754969_100000198978 [0,0,0,1,0,1|1,1,0]=4 17935 B15R2.19022 O=C(Cc1ccc(cc1)Cl)C2CCC2 1458a_100000209988_100000694040 [0,0,0,1,0,1|2,0,0]=4 17936 B15R2.19022 O=C(Cc1ccc(cc1)Cl)C2CCC2 1458a_100000211027_100000749161 [0,0,0,1,0,1|2,0,0]=4 17937 B15R2.19022 O=C(Cc1ccc(cc1)Cl)C2CCO2 1458a_100000089072_100000694040 [0,0,0,1,0,1|1,0,0]=3 17938 B15R2.19022 O=C(Cc1ccc(cc1)Cl)N2CCC2 11a_100000754969_100000211027 [0,0,0,1,0,1|1,0,0]=3 17939 B15R2.19022 O=C(Cc1ccc(cc1)Cl)N2CCC2 240690a_100000754969_100000211027 [0,0,0,1,0,1|1,0,0]=3 17940 B15R2.19022 O=C(Cc1ccc(cc1)Cl)N2CCC2 527a_100000754969_100000211027 [0,0,0,1,0,1|1,0,0]=3 17941 B15R2.19022 O=C(Cc1ccc(cc1)F)C2CCO2 1458a_100000089072_100000198546 [0,0,0,1,0,1|1,1,0]=4 17942 B15R2.19022 O=C(Cc1ccc(cc1)F)N2CCC2 11a_100000754969_100000210951 [0,0,0,1,0,1|1,1,0]=4 17943 B15R2.19022 O=C(Cc1ccc(cc1)F)N2CCC2 240690a_100000754969_100000210951 [0,0,0,1,0,1|1,1,0]=4 17944 B15R2.19022 O=C(Cc1ccc(cc1)F)N2CCC2 527a_100000754969_100000210951 [0,0,0,1,0,1|1,1,0]=4 17945 B15R2.19022 O=C(Cc1ccc(cc1)I)C2CCO2 1458a_100000089072_100000189116 [0,0,0,1,0,1|1,1,0]=4 17946 B15R2.19022 O=C(Cc1ccc(cc1)I)N2CCC2 11a_100000754969_100000688869 [0,0,0,1,0,1|1,1,0]=4 17947 B15R2.19022 O=C(Cc1ccc(cc1)I)N2CCC2 240690a_100000754969_100000688869 [0,0,0,1,0,1|1,1,0]=4 17948 B15R2.19022 O=C(Cc1ccc(cc1)I)N2CCC2 527a_100000754969_100000688869 [0,0,0,1,0,1|1,1,0]=4 17949 B15R2.19022 O=C(Cc1ccc(cc1)O)N2CCC2 240690a_100000754969_100000198540 [0,0,0,1,0,1|2,0,0]=4 17950 B15R2.19022 O=C(Cc1ccc(cc1)O)N2CCC2 527a_100000754969_100000198540 [0,0,0,1,0,1|2,0,0]=4 17951 B15R2.19022 O=C(Cc1ccc(cn1)Cl)C2CCO2 1458a_100000089072_100012066911 [0,0,0,1,0,1|2,0,0]=4 17952 B15R2.19022 O=C(Cc1ccc(cn1)Cl)N2CCC2 11a_100000754969_100000728320 [0,0,0,1,0,1|2,0,0]=4 17953 B15R2.19022 O=C(Cc1ccc(cn1)Cl)N2CCC2 240690a_100000754969_100000728320 [0,0,0,1,0,1|2,0,0]=4 17954 B15R2.19022 O=C(Cc1ccc(cn1)Cl)N2CCC2 527a_100000754969_100000728320 [0,0,0,1,0,1|2,0,0]=4 17955 B15R2.19022 O=C(Cc1ccc(nc1)Cl)C2CCO2 1458a_100000089072_100000735431 [0,0,0,1,0,1|2,0,0]=4 17956 B15R2.19022 O=C(Cc1ccc(nc1)Cl)N2CCC2 11a_100000754969_100000061944 [0,0,0,1,0,1|2,0,0]=4 17957 B15R2.19022 O=C(Cc1ccc(nc1)Cl)N2CCC2 240690a_100000754969_100000061944 [0,0,0,1,0,1|2,0,0]=4 17958 B15R2.19022 O=C(Cc1ccc(nc1)Cl)N2CCC2 527a_100000754969_100000061944 [0,0,0,1,0,1|2,0,0]=4 17959 B15R2.19022 O=C(Nc1ccc(cc1)Br)C2CCO2 11a_100000210018_100000089072 [0,0,0,1,0,1|1,1,0]=4 17960 B15R2.19022 O=C(Nc1ccc(cc1)Br)C2CCO2 1626a_100000210018_100000089072 [0,0,0,1,0,1|1,1,0]=4 17961 B15R2.19022 O=C(Nc1ccc(cc1)Br)C2CCO2 22a_100000210018_100000089072 [0,0,0,1,0,1|1,1,0]=4 17962 B15R2.19022 O=C(Nc1ccc(cc1)Br)C2CCO2 527a_100000210018_100000089072 [0,0,0,1,0,1|1,1,0]=4 17963 B15R2.19022 O=C(Nc1ccc(cc1)Br)N2CCC2 2430a_100000210018_100000754969 [0,0,0,1,0,1|1,1,0]=4 17964 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCC2 11a_100000210052_100000209988 [0,0,0,1,0,1|2,0,0]=4 17965 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCC2 1626a_100000210052_100000209988 [0,0,0,1,0,1|2,0,0]=4 17966 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCC2 22a_100000210052_100000209988 [0,0,0,1,0,1|2,0,0]=4 17967 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCC2 527a_100000210052_100000209988 [0,0,0,1,0,1|2,0,0]=4 17968 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCO2 11a_100000210052_100000089072 [0,0,0,1,0,1|1,0,0]=3 17969 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCO2 1626a_100000210052_100000089072 [0,0,0,1,0,1|1,0,0]=3 17970 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCO2 22a_100000210052_100000089072 [0,0,0,1,0,1|1,0,0]=3 17971 B15R2.19022 O=C(Nc1ccc(cc1)Cl)C2CCO2 527a_100000210052_100000089072 [0,0,0,1,0,1|1,0,0]=3 17972 B15R2.19022 O=C(Nc1ccc(cc1)Cl)N2CCC2 2430a_100000210052_100000754969 [0,0,0,1,0,1|1,0,0]=3 17973 B15R2.19022 O=C(Nc1ccc(cc1)F)C2CCO2 11a_100000185862_100000089072 [0,0,0,1,0,1|1,1,0]=4 17974 B15R2.19022 O=C(Nc1ccc(cc1)F)C2CCO2 1626a_100000185862_100000089072 [0,0,0,1,0,1|1,1,0]=4 17975 B15R2.19022 O=C(Nc1ccc(cc1)F)C2CCO2 22a_100000185862_100000089072 [0,0,0,1,0,1|1,1,0]=4 17976 B15R2.19022 O=C(Nc1ccc(cc1)F)C2CCO2 527a_100000185862_100000089072 [0,0,0,1,0,1|1,1,0]=4 17977 B15R2.19022 O=C(Nc1ccc(cc1)F)N2CCC2 2430a_100000185862_100000754969 [0,0,0,1,0,1|1,1,0]=4 17978 B15R2.19022 O=C(Nc1ccc(cc1)I)C2CCO2 11a_100000185761_100000089072 [0,0,0,1,0,1|1,1,0]=4 17979 B15R2.19022 O=C(Nc1ccc(cc1)I)C2CCO2 1626a_100000185761_100000089072 [0,0,0,1,0,1|1,1,0]=4 17980 B15R2.19022 O=C(Nc1ccc(cc1)I)C2CCO2 22a_100000185761_100000089072 [0,0,0,1,0,1|1,1,0]=4 17981 B15R2.19022 O=C(Nc1ccc(cc1)I)C2CCO2 527a_100000185761_100000089072 [0,0,0,1,0,1|1,1,0]=4 17982 B15R2.19022 O=C(Nc1ccc(cc1)I)N2CCC2 2430a_100000185761_100000754969 [0,0,0,1,0,1|1,1,0]=4 17983 B15R2.19022 O=C(Nc1ccc(cc1)O)C2CCO2 22a_100000185829_100000089072 [0,0,0,1,0,1|2,0,0]=4 17984 B15R2.19022 O=C(Nc1ccc(cc1)O)N2CCC2 2430a_100000185829_100000754969 [0,0,0,1,0,1|2,0,0]=4 17985 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)Br 11a_100000755817_100000185839 [0,1,0,1,0,0|1,1,0]=4 17986 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)Br 240690a_100000755817_100000185839 [0,1,0,1,0,0|1,1,0]=4 17987 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)Br 527a_100000755817_100000185839 [0,1,0,1,0,0|1,1,0]=4 17988 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)Cl 11a_100000755817_100000210187 [0,1,0,1,0,0|1,0,0]=3 17989 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)Cl 240690a_100000755817_100000210187 [0,1,0,1,0,0|1,0,0]=3 17990 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)Cl 527a_100000755817_100000210187 [0,1,0,1,0,0|1,0,0]=3 17991 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)F 11a_100000755817_100000187176 [0,1,0,1,0,0|1,1,0]=4 17992 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)F 240690a_100000755817_100000187176 [0,1,0,1,0,0|1,1,0]=4 17993 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)F 527a_100000755817_100000187176 [0,1,0,1,0,0|1,1,0]=4 17994 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)I 11a_100000755817_100000187904 [0,1,0,1,0,0|1,1,0]=4 17995 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)I 240690a_100000755817_100000187904 [0,1,0,1,0,0|1,1,0]=4 17996 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)I 527a_100000755817_100000187904 [0,1,0,1,0,0|1,1,0]=4 17997 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)O 240690a_100000755817_100000212099 [0,1,0,1,0,0|2,0,0]=4 17998 B15R2.1519 CC1CCN1C(=O)c2ccc(cc2)O 527a_100000755817_100000212099 [0,1,0,1,0,0|2,0,0]=4 17999 B15R2.1519 Cc1ccc(cc1)C(=O)N2CCC2C 11a_100000755817_100000188618 [0,1,0,1,0,0|2,0,0]=4 18000 B15R2.1519 Cc1ccc(cc1)C(=O)N2CCC2C 240690a_100000755817_100000188618 [0,1,0,1,0,0|2,0,0]=4 18001 B15R2.1519 Cc1ccc(cc1)C(=O)N2CCC2C 527a_100000755817_100000188618 [0,1,0,1,0,0|2,0,0]=4 18002 B15R2.1519 O=C1CCC1C(=O)c2ccc(cc2)Cl 1458a_100000210187_100009892977 [0,1,0,1,0,0|1,0,1]=4 18003 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Br 11a_100000757604_100000185839 [0,1,0,1,0,0|1,1,0]=4 18004 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Br 1626a_100000757604_100000185839 [0,1,0,1,0,0|1,1,0]=4 18005 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Br 240690a_100000757604_100000185839 [0,1,0,1,0,0|1,1,0]=4 18006 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Br 527a_100000757604_100000185839 [0,1,0,1,0,0|1,1,0]=4 18007 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Cl 11a_100000757604_100000210187 [0,1,0,1,0,0|1,0,0]=3 18008 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Cl 1626a_100000757604_100000210187 [0,1,0,1,0,0|1,0,0]=3 18009 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Cl 240690a_100000757604_100000210187 [0,1,0,1,0,0|1,0,0]=3 18010 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)Cl 527a_100000757604_100000210187 [0,1,0,1,0,0|1,0,0]=3 18011 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)F 11a_100000757604_100000187176 [0,1,0,1,0,0|1,1,0]=4 18012 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)F 1626a_100000757604_100000187176 [0,1,0,1,0,0|1,1,0]=4 18013 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)F 240690a_100000757604_100000187176 [0,1,0,1,0,0|1,1,0]=4 18014 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)F 527a_100000757604_100000187176 [0,1,0,1,0,0|1,1,0]=4 18015 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)I 11a_100000757604_100000187904 [0,1,0,1,0,0|1,1,0]=4 18016 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)I 1626a_100000757604_100000187904 [0,1,0,1,0,0|1,1,0]=4 18017 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)I 240690a_100000757604_100000187904 [0,1,0,1,0,0|1,1,0]=4 18018 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)I 527a_100000757604_100000187904 [0,1,0,1,0,0|1,1,0]=4 18019 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)O 240690a_100000757604_100000212099 [0,1,0,1,0,0|2,0,0]=4 18020 B15R2.1521 CC1(CC1)NC(=O)c2ccc(cc2)O 527a_100000757604_100000212099 [0,1,0,1,0,0|2,0,0]=4 18021 B15R2.1521 CC1(CO1)CC(=O)c2ccc(cc2)Br 1458a_100000185839_100000760498 [0,1,0,1,0,0|1,1,0]=4 18022 B15R2.1521 CC1(CO1)CC(=O)c2ccc(cc2)Cl 1458a_100000210187_100000760498 [0,1,0,1,0,0|1,0,0]=3 18023 B15R2.1521 CC1(CO1)CC(=O)c2ccc(cc2)F 1458a_100000187176_100000760498 [0,1,0,1,0,0|1,1,0]=4 18024 B15R2.1521 CC1(CO1)CC(=O)c2ccc(cc2)I 1458a_100000187904_100000760498 [0,1,0,1,0,0|1,1,0]=4 18025 B15R2.1521 CC1(CO1)CC(=O)c2ccc(cc2)O 1458a_100000212099_100000760498 [0,1,0,1,0,0|2,0,0]=4 18026 B15R2.1521 Cc1ccc(cc1)C(=O)CC2(CO2)C 1458a_100000188618_100000760498 [0,1,0,1,0,0|2,0,0]=4 18027 B15R2.1521 Cc1ccc(cc1)C(=O)NC2(CC2)C 11a_100000757604_100000188618 [0,1,0,1,0,0|2,0,0]=4 18028 B15R2.1521 Cc1ccc(cc1)C(=O)NC2(CC2)C 1626a_100000757604_100000188618 [0,1,0,1,0,0|2,0,0]=4 18029 B15R2.1521 Cc1ccc(cc1)C(=O)NC2(CC2)C 240690a_100000757604_100000188618 [0,1,0,1,0,0|2,0,0]=4 18030 B15R2.1521 Cc1ccc(cc1)C(=O)NC2(CC2)C 527a_100000757604_100000188618 [0,1,0,1,0,0|2,0,0]=4 18031 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000188618 [0,1,0,1,0,0|2,0,0]=4 18032 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000188618 [0,1,0,1,0,0|2,0,0]=4 18033 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 18034 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 18035 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 18036 B15R2.1529 Cc1ccc(cc1)C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000188618 [0,1,0,1,0,0|2,0,0]=4 18037 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Br 240690a_100015190264_100000185839 [0,1,0,1,0,0|1,1,0]=4 18038 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Br 527a_100015190264_100000185839 [0,1,0,1,0,0|1,1,0]=4 18039 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Cl 240690a_100015190264_100000210187 [0,1,0,1,0,0|1,0,0]=3 18040 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)Cl 527a_100015190264_100000210187 [0,1,0,1,0,0|1,0,0]=3 18041 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)F 240690a_100015190264_100000187176 [0,1,0,1,0,0|1,1,0]=4 18042 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)F 527a_100015190264_100000187176 [0,1,0,1,0,0|1,1,0]=4 18043 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)I 240690a_100015190264_100000187904 [0,1,0,1,0,0|1,1,0]=4 18044 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)I 527a_100015190264_100000187904 [0,1,0,1,0,0|1,1,0]=4 18045 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)O 240690a_100015190264_100000212099 [0,1,0,1,0,0|2,0,0]=4 18046 B15R2.1529 O=C(N[C@@H]1C[C@@H]1F)c2ccc(cc2)O 527a_100015190264_100000212099 [0,1,0,1,0,0|2,0,0]=4 18047 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 11a_100025746932_100000185839 [0,1,0,1,0,0|1,1,0]=4 18048 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 1626a_100025746932_100000185839 [0,1,0,1,0,0|1,1,0]=4 18049 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 240690a_100025746932_100000185839 [0,1,0,1,0,0|1,1,0]=4 18050 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Br 527a_100025746932_100000185839 [0,1,0,1,0,0|1,1,0]=4 18051 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 11a_100025746932_100000210187 [0,1,0,1,0,0|1,0,0]=3 18052 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 1626a_100025746932_100000210187 [0,1,0,1,0,0|1,0,0]=3 18053 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 240690a_100025746932_100000210187 [0,1,0,1,0,0|1,0,0]=3 18054 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)Cl 527a_100025746932_100000210187 [0,1,0,1,0,0|1,0,0]=3 18055 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 11a_100025746932_100000187176 [0,1,0,1,0,0|1,1,0]=4 18056 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 1626a_100025746932_100000187176 [0,1,0,1,0,0|1,1,0]=4 18057 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 240690a_100025746932_100000187176 [0,1,0,1,0,0|1,1,0]=4 18058 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)F 527a_100025746932_100000187176 [0,1,0,1,0,0|1,1,0]=4 18059 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 11a_100025746932_100000187904 [0,1,0,1,0,0|1,1,0]=4 18060 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 1626a_100025746932_100000187904 [0,1,0,1,0,0|1,1,0]=4 18061 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 240690a_100025746932_100000187904 [0,1,0,1,0,0|1,1,0]=4 18062 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)I 527a_100025746932_100000187904 [0,1,0,1,0,0|1,1,0]=4 18063 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)O 240690a_100025746932_100000212099 [0,1,0,1,0,0|2,0,0]=4 18064 B15R2.1529 O=C(N[C@@H]1C[C@H]1F)c2ccc(cc2)O 527a_100025746932_100000212099 [0,1,0,1,0,0|2,0,0]=4 18065 B15R2.18979 CC(NC1COC1)c2ccc(cc2)Cl 2230a_100016991112_100000684792 [0,1,0,1,0,0|1,0,1]=4 18066 B15R2.18979 CC(NC1COC1)c2ccc(cc2)Cl 269862a_100016991112_100000185797 [0,1,0,1,0,0|1,0,1]=4 18067 B15R2.18979 C[C@@H](NC1COC1)c2ccc(cc2)Cl 34a_100015205461_100009818527 [0,1,0,1,0,0|1,0,1]=4 18068 B15R2.18979 Cc1ccc(cc1)C(=O)CC2CCO2 1458a_100000188618_100000103362 [0,1,0,1,0,0|2,0,0]=4 18069 B15R2.18979 Cc1ccc(cc1)C(=O)CC2COC2 1458a_100000188618_100010264016 [0,1,0,1,0,0|2,0,0]=4 18070 B15R2.18979 Cc1ccc(cc1)C(=O)CN2CCC2 269982a_100000754969_100000211441 [0,1,0,1,0,0|2,0,0]=4 18071 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CCC2 11a_100000749019_100000188618 [0,1,0,1,0,0|2,0,0]=4 18072 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CCC2 1626a_100000749019_100000188618 [0,1,0,1,0,0|2,0,0]=4 18073 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CCC2 240690a_100000749019_100000188618 [0,1,0,1,0,0|2,0,0]=4 18074 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CCC2 527a_100000749019_100000188618 [0,1,0,1,0,0|2,0,0]=4 18075 B15R2.18979 Cc1ccc(cc1)C(=O)NC2COC2 11a_100016991112_100000188618 [0,1,0,1,0,0|1,0,0]=3 18076 B15R2.18979 Cc1ccc(cc1)C(=O)NC2COC2 1626a_100016991112_100000188618 [0,1,0,1,0,0|1,0,0]=3 18077 B15R2.18979 Cc1ccc(cc1)C(=O)NC2COC2 240690a_100016991112_100000188618 [0,1,0,1,0,0|1,0,0]=3 18078 B15R2.18979 Cc1ccc(cc1)C(=O)NC2COC2 527a_100016991112_100000188618 [0,1,0,1,0,0|1,0,0]=3 18079 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CSC2 11a_100016994217_100000188618 [0,1,0,1,0,0|1,1,0]=4 18080 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CSC2 1626a_100016994217_100000188618 [0,1,0,1,0,0|1,1,0]=4 18081 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CSC2 240690a_100016994217_100000188618 [0,1,0,1,0,0|1,1,0]=4 18082 B15R2.18979 Cc1ccc(cc1)C(=O)NC2CSC2 527a_100016994217_100000188618 [0,1,0,1,0,0|1,1,0]=4 18083 B15R2.18979 O=C(CC1CCC1)c2ccc(cc2)Cl 1458a_100000210187_100000763275 [0,1,0,1,0,0|2,0,0]=4 18084 B15R2.18979 O=C(CC1CCO1)c2ccc(cc2)Br 1458a_100000185839_100000103362 [0,1,0,1,0,0|1,1,0]=4 18085 B15R2.18979 O=C(CC1CCO1)c2ccc(cc2)Cl 1458a_100000210187_100000103362 [0,1,0,1,0,0|1,0,0]=3 18086 B15R2.18979 O=C(CC1CCO1)c2ccc(cc2)F 1458a_100000187176_100000103362 [0,1,0,1,0,0|1,1,0]=4 18087 B15R2.18979 O=C(CC1CCO1)c2ccc(cc2)I 1458a_100000187904_100000103362 [0,1,0,1,0,0|1,1,0]=4 18088 B15R2.18979 O=C(CC1CCO1)c2ccc(cc2)O 1458a_100000212099_100000103362 [0,1,0,1,0,0|2,0,0]=4 18089 B15R2.18979 O=C(CC1COC1)c2ccc(cc2)Br 1458a_100000185839_100010264016 [0,1,0,1,0,0|1,1,0]=4 18090 B15R2.18979 O=C(CC1COC1)c2ccc(cc2)Cl 1458a_100000210187_100010264016 [0,1,0,1,0,0|1,0,0]=3 18091 B15R2.18979 O=C(CC1COC1)c2ccc(cc2)F 1458a_100000187176_100010264016 [0,1,0,1,0,0|1,1,0]=4 18092 B15R2.18979 O=C(CC1COC1)c2ccc(cc2)I 1458a_100000187904_100010264016 [0,1,0,1,0,0|1,1,0]=4 18093 B15R2.18979 O=C(CC1COC1)c2ccc(cc2)O 1458a_100000212099_100010264016 [0,1,0,1,0,0|2,0,0]=4 18094 B15R2.18979 O=C(CN1CCC1)c2ccc(cc2)Br 269982a_100000754969_100000188085 [0,1,0,1,0,0|1,1,0]=4 18095 B15R2.18979 O=C(CN1CCC1)c2ccc(cc2)Cl 269982a_100000754969_100000211071 [0,1,0,1,0,0|1,0,0]=3 18096 B15R2.18979 O=C(CN1CCC1)c2ccc(cc2)F 269982a_100000754969_100000211279 [0,1,0,1,0,0|1,1,0]=4 18097 B15R2.18979 O=C(CN1CCC1)c2ccc(cc2)I 269982a_100000754969_100011216261 [0,1,0,1,0,0|1,1,0]=4 18098 B15R2.18979 O=C(CN1CCC1)c2ccc(cc2)O 269982a_100000754969_100009814261 [0,1,0,1,0,0|2,0,0]=4 18099 B15R2.18979 O=C(CN1CCC1)c2ccc(cn2)Cl 269982a_100000754969_100016989621 [0,1,0,1,0,0|2,0,0]=4 18100 B15R2.18979 O=C(CN1CCC1)c2ccc(nc2)Cl 269982a_100000754969_100009864725 [0,1,0,1,0,0|2,0,0]=4 18101 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Br 11a_100000749019_100000185839 [0,1,0,1,0,0|1,1,0]=4 18102 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Br 1626a_100000749019_100000185839 [0,1,0,1,0,0|1,1,0]=4 18103 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Br 240690a_100000749019_100000185839 [0,1,0,1,0,0|1,1,0]=4 18104 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Br 527a_100000749019_100000185839 [0,1,0,1,0,0|1,1,0]=4 18105 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Cl 11a_100000749019_100000210187 [0,1,0,1,0,0|1,0,0]=3 18106 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Cl 1626a_100000749019_100000210187 [0,1,0,1,0,0|1,0,0]=3 18107 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Cl 240690a_100000749019_100000210187 [0,1,0,1,0,0|1,0,0]=3 18108 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)Cl 527a_100000749019_100000210187 [0,1,0,1,0,0|1,0,0]=3 18109 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)F 11a_100000749019_100000187176 [0,1,0,1,0,0|1,1,0]=4 18110 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)F 1626a_100000749019_100000187176 [0,1,0,1,0,0|1,1,0]=4 18111 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)F 240690a_100000749019_100000187176 [0,1,0,1,0,0|1,1,0]=4 18112 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)F 527a_100000749019_100000187176 [0,1,0,1,0,0|1,1,0]=4 18113 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)I 11a_100000749019_100000187904 [0,1,0,1,0,0|1,1,0]=4 18114 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)I 1626a_100000749019_100000187904 [0,1,0,1,0,0|1,1,0]=4 18115 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)I 240690a_100000749019_100000187904 [0,1,0,1,0,0|1,1,0]=4 18116 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)I 527a_100000749019_100000187904 [0,1,0,1,0,0|1,1,0]=4 18117 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)O 240690a_100000749019_100000212099 [0,1,0,1,0,0|2,0,0]=4 18118 B15R2.18979 O=C(NC1CCC1)c2ccc(cc2)O 527a_100000749019_100000212099 [0,1,0,1,0,0|2,0,0]=4 18119 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Br 11a_100016991112_100000185839 [0,1,0,1,0,0|0,1,0]=3 18120 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Br 1626a_100016991112_100000185839 [0,1,0,1,0,0|0,1,0]=3 18121 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Br 240690a_100016991112_100000185839 [0,1,0,1,0,0|0,1,0]=3 18122 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Br 527a_100016991112_100000185839 [0,1,0,1,0,0|0,1,0]=3 18123 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Cl 11a_100016991112_100000210187 [0,1,0,1,0,0|0,0,0]=2 18124 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Cl 1626a_100016991112_100000210187 [0,1,0,1,0,0|0,0,0]=2 18125 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Cl 240690a_100016991112_100000210187 [0,1,0,1,0,0|0,0,0]=2 18126 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)Cl 527a_100016991112_100000210187 [0,1,0,1,0,0|0,0,0]=2 18127 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)F 11a_100016991112_100000187176 [0,1,0,1,0,0|0,1,0]=3 18128 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)F 1626a_100016991112_100000187176 [0,1,0,1,0,0|0,1,0]=3 18129 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)F 240690a_100016991112_100000187176 [0,1,0,1,0,0|0,1,0]=3 18130 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)F 527a_100016991112_100000187176 [0,1,0,1,0,0|0,1,0]=3 18131 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)I 11a_100016991112_100000187904 [0,1,0,1,0,0|0,1,0]=3 18132 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)I 1626a_100016991112_100000187904 [0,1,0,1,0,0|0,1,0]=3 18133 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)I 240690a_100016991112_100000187904 [0,1,0,1,0,0|0,1,0]=3 18134 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)I 527a_100016991112_100000187904 [0,1,0,1,0,0|0,1,0]=3 18135 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)O 240690a_100016991112_100000212099 [0,1,0,1,0,0|1,0,0]=3 18136 B15R2.18979 O=C(NC1COC1)c2ccc(cc2)O 527a_100016991112_100000212099 [0,1,0,1,0,0|1,0,0]=3 18137 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Br 11a_100016994217_100000185839 [0,1,0,1,0,0|0,2,0]=4 18138 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Br 1626a_100016994217_100000185839 [0,1,0,1,0,0|0,2,0]=4 18139 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Br 240690a_100016994217_100000185839 [0,1,0,1,0,0|0,2,0]=4 18140 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Br 527a_100016994217_100000185839 [0,1,0,1,0,0|0,2,0]=4 18141 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Cl 11a_100016994217_100000210187 [0,1,0,1,0,0|0,1,0]=3 18142 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Cl 1626a_100016994217_100000210187 [0,1,0,1,0,0|0,1,0]=3 18143 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Cl 240690a_100016994217_100000210187 [0,1,0,1,0,0|0,1,0]=3 18144 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)Cl 527a_100016994217_100000210187 [0,1,0,1,0,0|0,1,0]=3 18145 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)F 11a_100016994217_100000187176 [0,1,0,1,0,0|0,2,0]=4 18146 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)F 1626a_100016994217_100000187176 [0,1,0,1,0,0|0,2,0]=4 18147 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)F 240690a_100016994217_100000187176 [0,1,0,1,0,0|0,2,0]=4 18148 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)F 527a_100016994217_100000187176 [0,1,0,1,0,0|0,2,0]=4 18149 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)I 11a_100016994217_100000187904 [0,1,0,1,0,0|0,2,0]=4 18150 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)I 1626a_100016994217_100000187904 [0,1,0,1,0,0|0,2,0]=4 18151 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)I 240690a_100016994217_100000187904 [0,1,0,1,0,0|0,2,0]=4 18152 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)I 527a_100016994217_100000187904 [0,1,0,1,0,0|0,2,0]=4 18153 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)O 240690a_100016994217_100000212099 [0,1,0,1,0,0|1,1,0]=4 18154 B15R2.18979 O=C(NC1CSC1)c2ccc(cc2)O 527a_100016994217_100000212099 [0,1,0,1,0,0|1,1,0]=4 18155 B15R2.91 Cc1ccc(cc1)C(=O)C2CCOC2 1458a_100000188618_100000690089 [0,1,0,1,0,0|2,0,0]=4 18156 B15R2.91 Cc1ccc(cc1)C(=O)N2CCCC2 240690a_100000188435_100000188618 [0,1,0,1,0,0|2,0,0]=4 18157 B15R2.91 Cc1ccc(cc1)C(=O)N2CCCC2 527a_100000188435_100000188618 [0,1,0,1,0,0|2,0,0]=4 18158 B15R2.91 Cc1ccc(cc1)C(=O)N2CCSC2 11a_100011215254_100000188618 [0,1,0,1,0,0|1,1,0]=4 18159 B15R2.91 Cc1ccc(cc1)C(=O)N2CCSC2 240690a_100011215254_100000188618 [0,1,0,1,0,0|1,1,0]=4 18160 B15R2.91 Cc1ccc(cc1)C(=O)N2CCSC2 527a_100011215254_100000188618 [0,1,0,1,0,0|1,1,0]=4 18161 B15R2.91 O=C(c1ccc(cc1)Br)C2CCOC2 1458a_100000185839_100000690089 [0,1,0,1,0,0|1,1,0]=4 18162 B15R2.91 O=C(c1ccc(cc1)Br)N2CCCC2 240690a_100000188435_100000185839 [0,1,0,1,0,0|1,1,0]=4 18163 B15R2.91 O=C(c1ccc(cc1)Br)N2CCCC2 527a_100000188435_100000185839 [0,1,0,1,0,0|1,1,0]=4 18164 B15R2.91 O=C(c1ccc(cc1)Br)N2CCSC2 11a_100011215254_100000185839 [0,1,0,1,0,0|0,2,0]=4 18165 B15R2.91 O=C(c1ccc(cc1)Br)N2CCSC2 240690a_100011215254_100000185839 [0,1,0,1,0,0|0,2,0]=4 18166 B15R2.91 O=C(c1ccc(cc1)Br)N2CCSC2 527a_100011215254_100000185839 [0,1,0,1,0,0|0,2,0]=4 18167 B15R2.91 O=C(c1ccc(cc1)Cl)C2CCCC2 1458a_100000210187_100000179811 [0,1,0,1,0,0|2,0,0]=4 18168 B15R2.91 O=C(c1ccc(cc1)Cl)C2CCOC2 1458a_100000210187_100000690089 [0,1,0,1,0,0|1,0,0]=3 18169 B15R2.91 O=C(c1ccc(cc1)Cl)N2CC=CC2 1626a_100015195280_100000210187 [0,1,0,1,0,0|1,0,1]=4 18170 B15R2.91 O=C(c1ccc(cc1)Cl)N2CC=CC2 240690a_100015195280_100000210187 [0,1,0,1,0,0|1,0,1]=4 18171 B15R2.91 O=C(c1ccc(cc1)Cl)N2CCCC2 240690a_100000188435_100000210187 [0,1,0,1,0,0|1,0,0]=3 18172 B15R2.91 O=C(c1ccc(cc1)Cl)N2CCCC2 527a_100000188435_100000210187 [0,1,0,1,0,0|1,0,0]=3 18173 B15R2.91 O=C(c1ccc(cc1)Cl)N2CCSC2 11a_100011215254_100000210187 [0,1,0,1,0,0|0,1,0]=3 18174 B15R2.91 O=C(c1ccc(cc1)Cl)N2CCSC2 240690a_100011215254_100000210187 [0,1,0,1,0,0|0,1,0]=3 18175 B15R2.91 O=C(c1ccc(cc1)Cl)N2CCSC2 527a_100011215254_100000210187 [0,1,0,1,0,0|0,1,0]=3 18176 B15R2.91 O=C(c1ccc(cc1)F)C2CCOC2 1458a_100000187176_100000690089 [0,1,0,1,0,0|1,1,0]=4 18177 B15R2.91 O=C(c1ccc(cc1)F)N2CCCC2 240690a_100000188435_100000187176 [0,1,0,1,0,0|1,1,0]=4 18178 B15R2.91 O=C(c1ccc(cc1)F)N2CCCC2 527a_100000188435_100000187176 [0,1,0,1,0,0|1,1,0]=4 18179 B15R2.91 O=C(c1ccc(cc1)F)N2CCSC2 11a_100011215254_100000187176 [0,1,0,1,0,0|0,2,0]=4 18180 B15R2.91 O=C(c1ccc(cc1)F)N2CCSC2 240690a_100011215254_100000187176 [0,1,0,1,0,0|0,2,0]=4 18181 B15R2.91 O=C(c1ccc(cc1)F)N2CCSC2 527a_100011215254_100000187176 [0,1,0,1,0,0|0,2,0]=4 18182 B15R2.91 O=C(c1ccc(cc1)I)C2CCOC2 1458a_100000187904_100000690089 [0,1,0,1,0,0|1,1,0]=4 18183 B15R2.91 O=C(c1ccc(cc1)I)N2CCCC2 240690a_100000188435_100000187904 [0,1,0,1,0,0|1,1,0]=4 18184 B15R2.91 O=C(c1ccc(cc1)I)N2CCCC2 527a_100000188435_100000187904 [0,1,0,1,0,0|1,1,0]=4 18185 B15R2.91 O=C(c1ccc(cc1)I)N2CCSC2 11a_100011215254_100000187904 [0,1,0,1,0,0|0,2,0]=4 18186 B15R2.91 O=C(c1ccc(cc1)I)N2CCSC2 240690a_100011215254_100000187904 [0,1,0,1,0,0|0,2,0]=4 18187 B15R2.91 O=C(c1ccc(cc1)I)N2CCSC2 527a_100011215254_100000187904 [0,1,0,1,0,0|0,2,0]=4 18188 B15R2.91 O=C(c1ccc(cc1)O)C2CCOC2 1458a_100000212099_100000690089 [0,1,0,1,0,0|2,0,0]=4 18189 B15R2.91 O=C(c1ccc(cc1)O)N2CCCC2 240690a_100000188435_100000212099 [0,1,0,1,0,0|2,0,0]=4 18190 B15R2.91 O=C(c1ccc(cc1)O)N2CCCC2 271570a_203496583355_100000153374 [0,1,0,1,0,0|2,0,0]=4 18191 B15R2.91 O=C(c1ccc(cc1)O)N2CCCC2 527a_100000188435_100000212099 [0,1,0,1,0,0|2,0,0]=4 18192 B15R2.91 O=C(c1ccc(cc1)O)N2CCSC2 240690a_100011215254_100000212099 [0,1,0,1,0,0|1,1,0]=4 18193 B15R2.91 O=C(c1ccc(cc1)O)N2CCSC2 527a_100011215254_100000212099 [0,1,0,1,0,0|1,1,0]=4 18194 B15R2.6983 CC(=NNC1CC1)c2ccc(cc2)Cl 4a_100000701032_100000185797 [0,1,0,1,0,0|2,0,0]=4 18195 B15R2.6983 C[C@@H](NCC1CO1)c2ccc(cc2)Cl 2230a_100015205461_100011216344 [0,1,0,1,0,0|1,0,1]=4 18196 B15R2.6983 C[C@@H](NCC1CO1)c2ccc(cc2)Cl 34a_100015205461_102125554688 [0,1,0,1,0,0|1,0,1]=4 18197 B15R2.6983 Cc1ccc(cc1)C(=O)CCC2CO2 1458a_100000188618_100000732470 [0,1,0,1,0,0|2,0,0]=4 18198 B15R2.6983 Cc1ccc(cc1)C(=O)CNC2CC2 34a_100000212008_100000211441 [0,1,0,1,0,0|2,0,0]=4 18199 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 11a_100000735609_100000188618 [0,1,0,1,0,0|2,0,0]=4 18200 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 1626a_100000735609_100000188618 [0,1,0,1,0,0|2,0,0]=4 18201 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 240690a_100000735609_100000188618 [0,1,0,1,0,0|2,0,0]=4 18202 B15R2.6983 Cc1ccc(cc1)C(=O)NCC2CC2 527a_100000735609_100000188618 [0,1,0,1,0,0|2,0,0]=4 18203 B15R2.6983 Cc1ccc(cc1)C(=O)NNC2CC2 22a_100000701032_100000188618 [0,1,0,1,0,0|2,0,0]=4 18204 B15R2.6983 O=C(CCC1CC1)c2ccc(cc2)Cl 1458a_100000210187_100000694398 [0,1,0,1,0,0|2,0,0]=4 18205 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)Br 1458a_100000185839_100000732470 [0,1,0,1,0,0|1,1,0]=4 18206 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)Cl 1458a_100000210187_100000732470 [0,1,0,1,0,0|1,0,0]=3 18207 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)F 1458a_100000187176_100000732470 [0,1,0,1,0,0|1,1,0]=4 18208 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)I 1458a_100000187904_100000732470 [0,1,0,1,0,0|1,1,0]=4 18209 B15R2.6983 O=C(CCC1CO1)c2ccc(cc2)O 1458a_100000212099_100000732470 [0,1,0,1,0,0|2,0,0]=4 18210 B15R2.6983 O=C(CNC1CC1)c2ccc(cc2)Br 34a_100000212008_100000188085 [0,1,0,1,0,0|1,1,0]=4 18211 B15R2.6983 O=C(CNC1CC1)c2ccc(cc2)I 34a_100000212008_100011216261 [0,1,0,1,0,0|1,1,0]=4 18212 B15R2.6983 O=C(CNC1CC1)c2ccc(cc2)O 34a_100000212008_100009814261 [0,1,0,1,0,0|2,0,0]=4 18213 B15R2.6983 O=C(CSC1CC1)c2ccc(cc2)Cl 62a_100000211071_100000211595 [0,1,0,1,0,0|2,0,0]=4 18214 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 11a_100000735609_100000185839 [0,1,0,1,0,0|1,1,0]=4 18215 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 1626a_100000735609_100000185839 [0,1,0,1,0,0|1,1,0]=4 18216 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 240690a_100000735609_100000185839 [0,1,0,1,0,0|1,1,0]=4 18217 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Br 527a_100000735609_100000185839 [0,1,0,1,0,0|1,1,0]=4 18218 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 11a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 18219 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 1626a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 18220 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 240690a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 18221 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)Cl 527a_100000735609_100000210187 [0,1,0,1,0,0|1,0,0]=3 18222 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 11a_100000735609_100000187176 [0,1,0,1,0,0|1,1,0]=4 18223 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 1626a_100000735609_100000187176 [0,1,0,1,0,0|1,1,0]=4 18224 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 240690a_100000735609_100000187176 [0,1,0,1,0,0|1,1,0]=4 18225 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)F 527a_100000735609_100000187176 [0,1,0,1,0,0|1,1,0]=4 18226 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 11a_100000735609_100000187904 [0,1,0,1,0,0|1,1,0]=4 18227 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 1626a_100000735609_100000187904 [0,1,0,1,0,0|1,1,0]=4 18228 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 240690a_100000735609_100000187904 [0,1,0,1,0,0|1,1,0]=4 18229 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)I 527a_100000735609_100000187904 [0,1,0,1,0,0|1,1,0]=4 18230 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)O 240690a_100000735609_100000212099 [0,1,0,1,0,0|2,0,0]=4 18231 B15R2.6983 O=C(NCC1CC1)c2ccc(cc2)O 527a_100000735609_100000212099 [0,1,0,1,0,0|2,0,0]=4 18232 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)Br 22a_100000701032_100000185839 [0,1,0,1,0,0|1,1,0]=4 18233 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)Cl 22a_100000701032_100000210187 [0,1,0,1,0,0|1,0,0]=3 18234 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)F 22a_100000701032_100000187176 [0,1,0,1,0,0|1,1,0]=4 18235 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)I 22a_100000701032_100000187904 [0,1,0,1,0,0|1,1,0]=4 18236 B15R2.6983 O=C(NNC1CC1)c2ccc(cc2)O 22a_100000701032_100000212099 [0,1,0,1,0,0|2,0,0]=4 18237 B15R2.3 OC1CC=C(CC1)c2ccc(cc2)Cl 271570a_100010254553_100000755918 [0,1,0,1,0,0|2,0,0]=4 18238 B15R2.1385 OCCNC1CCc2c1ccc(c2)Cl 2230a_100000743821_100000211926 [0,1,0,1,0,0|1,0,1]=4 18239 B15R2.1385 OCCNC1CCc2c1ccc(c2)Cl 269862a_100000210304_100000751102 [0,1,0,1,0,0|1,0,1]=4 18240 B15R2.1385 OCCNC1CCc2c1ccc(c2)Cl 34a_100000743821_100000211926 [0,1,0,1,0,0|1,0,1]=4 18241 B15R2.1385 OCCN[C@@H]1COc2c1ccc(c2)Cl 2230a_100138412546_100000211926 [0,1,0,1,0,0|0,0,2]=4 18242 B15R2.1385 OCCSc1n[nH]c2c1ccc(c2)Cl 62a_100000211926_100000049627 [0,1,0,1,0,0|2,0,0]=4 18243 B15R2.1654 OCCNC1(CC1)c2ccc(cc2)Cl 2230a_100015183379_100000211926 [0,1,0,1,0,0|1,0,1]=4 18244 B15R2.1654 OCCNC1(CC1)c2ccc(cc2)Cl 34a_100015183379_100000211926 [0,1,0,1,0,0|1,0,1]=4 18245 B15R2.1520 CC(c1ccc(cc1)Cl)N2CC(C2)O 269982a_100000749847_100000684792 [0,1,0,1,0,0|1,0,1]=4 18246 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Br 11a_100000702820_100000185839 [0,1,0,1,0,0|1,1,0]=4 18247 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Br 240690a_100000702820_100000185839 [0,1,0,1,0,0|1,1,0]=4 18248 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Br 527a_100000702820_100000185839 [0,1,0,1,0,0|1,1,0]=4 18249 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Cl 11a_100000702820_100000210187 [0,1,0,1,0,0|1,0,0]=3 18250 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Cl 240690a_100000702820_100000210187 [0,1,0,1,0,0|1,0,0]=3 18251 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)Cl 527a_100000702820_100000210187 [0,1,0,1,0,0|1,0,0]=3 18252 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)F 11a_100000702820_100000187176 [0,1,0,1,0,0|1,1,0]=4 18253 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)F 240690a_100000702820_100000187176 [0,1,0,1,0,0|1,1,0]=4 18254 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)F 527a_100000702820_100000187176 [0,1,0,1,0,0|1,1,0]=4 18255 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)I 11a_100000702820_100000187904 [0,1,0,1,0,0|1,1,0]=4 18256 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)I 240690a_100000702820_100000187904 [0,1,0,1,0,0|1,1,0]=4 18257 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)I 527a_100000702820_100000187904 [0,1,0,1,0,0|1,1,0]=4 18258 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)O 240690a_100000702820_100000212099 [0,1,0,1,0,0|2,0,0]=4 18259 B15R2.1520 CC1CN(C1)C(=O)c2ccc(cc2)O 527a_100000702820_100000212099 [0,1,0,1,0,0|2,0,0]=4 18260 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)C 11a_100000702820_100000188618 [0,1,0,1,0,0|2,0,0]=4 18261 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)C 240690a_100000702820_100000188618 [0,1,0,1,0,0|2,0,0]=4 18262 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)C 527a_100000702820_100000188618 [0,1,0,1,0,0|2,0,0]=4 18263 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)F 11a_100000690557_100000188618 [0,1,0,1,0,0|2,0,0]=4 18264 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)F 240690a_100000690557_100000188618 [0,1,0,1,0,0|2,0,0]=4 18265 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)F 527a_100000690557_100000188618 [0,1,0,1,0,0|2,0,0]=4 18266 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)O 11a_100000749847_100000188618 [0,1,0,1,0,0|1,0,0]=3 18267 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)O 240690a_100000749847_100000188618 [0,1,0,1,0,0|1,0,0]=3 18268 B15R2.1520 Cc1ccc(cc1)C(=O)N2CC(C2)O 527a_100000749847_100000188618 [0,1,0,1,0,0|1,0,0]=3 18269 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)F 11a_100000690557_100000185839 [0,1,0,1,0,0|1,1,0]=4 18270 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)F 240690a_100000690557_100000185839 [0,1,0,1,0,0|1,1,0]=4 18271 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)F 527a_100000690557_100000185839 [0,1,0,1,0,0|1,1,0]=4 18272 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)O 11a_100000749847_100000185839 [0,1,0,1,0,0|0,1,0]=3 18273 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)O 240690a_100000749847_100000185839 [0,1,0,1,0,0|0,1,0]=3 18274 B15R2.1520 O=C(c1ccc(cc1)Br)N2CC(C2)O 527a_100000749847_100000185839 [0,1,0,1,0,0|0,1,0]=3 18275 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)F 11a_100000690557_100000210187 [0,1,0,1,0,0|1,0,0]=3 18276 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)F 240690a_100000690557_100000210187 [0,1,0,1,0,0|1,0,0]=3 18277 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)F 527a_100000690557_100000210187 [0,1,0,1,0,0|1,0,0]=3 18278 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)O 11a_100000749847_100000210187 [0,1,0,1,0,0|0,0,0]=2 18279 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)O 240690a_100000749847_100000210187 [0,1,0,1,0,0|0,0,0]=2 18280 B15R2.1520 O=C(c1ccc(cc1)Cl)N2CC(C2)O 527a_100000749847_100000210187 [0,1,0,1,0,0|0,0,0]=2 18281 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)F 11a_100000690557_100000187176 [0,1,0,1,0,0|1,1,0]=4 18282 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)F 240690a_100000690557_100000187176 [0,1,0,1,0,0|1,1,0]=4 18283 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)F 527a_100000690557_100000187176 [0,1,0,1,0,0|1,1,0]=4 18284 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)O 11a_100000749847_100000187176 [0,1,0,1,0,0|0,1,0]=3 18285 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)O 240690a_100000749847_100000187176 [0,1,0,1,0,0|0,1,0]=3 18286 B15R2.1520 O=C(c1ccc(cc1)F)N2CC(C2)O 527a_100000749847_100000187176 [0,1,0,1,0,0|0,1,0]=3 18287 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)F 11a_100000690557_100000187904 [0,1,0,1,0,0|1,1,0]=4 18288 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)F 240690a_100000690557_100000187904 [0,1,0,1,0,0|1,1,0]=4 18289 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)F 527a_100000690557_100000187904 [0,1,0,1,0,0|1,1,0]=4 18290 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)O 11a_100000749847_100000187904 [0,1,0,1,0,0|0,1,0]=3 18291 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)O 240690a_100000749847_100000187904 [0,1,0,1,0,0|0,1,0]=3 18292 B15R2.1520 O=C(c1ccc(cc1)I)N2CC(C2)O 527a_100000749847_100000187904 [0,1,0,1,0,0|0,1,0]=3 18293 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)F 240690a_100000690557_100000212099 [0,1,0,1,0,0|2,0,0]=4 18294 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)F 527a_100000690557_100000212099 [0,1,0,1,0,0|2,0,0]=4 18295 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)O 240690a_100000749847_100000212099 [0,1,0,1,0,0|1,0,0]=3 18296 B15R2.1520 O=C(c1ccc(cc1)O)N2CC(C2)O 527a_100000749847_100000212099 [0,1,0,1,0,0|1,0,0]=3 18297 B15R2.1527 CN(C(=O)c1ccc(cc1)Br)C2CC2 11a_100000226674_100000185839 [0,1,0,1,0,0|1,1,0]=4 18298 B15R2.1527 CN(C(=O)c1ccc(cc1)Br)C2CC2 1626a_100000226674_100000185839 [0,1,0,1,0,0|1,1,0]=4 18299 B15R2.1527 CN(C(=O)c1ccc(cc1)Br)C2CC2 240690a_100000226674_100000185839 [0,1,0,1,0,0|1,1,0]=4 18300 B15R2.1527 CN(C(=O)c1ccc(cc1)Br)C2CC2 527a_100000226674_100000185839 [0,1,0,1,0,0|1,1,0]=4 18301 B15R2.1527 CN(C(=O)c1ccc(cc1)Cl)C2CC2 11a_100000226674_100000210187 [0,1,0,1,0,0|1,0,0]=3 18302 B15R2.1527 CN(C(=O)c1ccc(cc1)Cl)C2CC2 1626a_100000226674_100000210187 [0,1,0,1,0,0|1,0,0]=3 18303 B15R2.1527 CN(C(=O)c1ccc(cc1)Cl)C2CC2 240690a_100000226674_100000210187 [0,1,0,1,0,0|1,0,0]=3 18304 B15R2.1527 CN(C(=O)c1ccc(cc1)Cl)C2CC2 527a_100000226674_100000210187 [0,1,0,1,0,0|1,0,0]=3 18305 B15R2.1527 CN(C(=O)c1ccc(cc1)F)C2CC2 11a_100000226674_100000187176 [0,1,0,1,0,0|1,1,0]=4 18306 B15R2.1527 CN(C(=O)c1ccc(cc1)F)C2CC2 1626a_100000226674_100000187176 [0,1,0,1,0,0|1,1,0]=4 18307 B15R2.1527 CN(C(=O)c1ccc(cc1)F)C2CC2 240690a_100000226674_100000187176 [0,1,0,1,0,0|1,1,0]=4 18308 B15R2.1527 CN(C(=O)c1ccc(cc1)F)C2CC2 527a_100000226674_100000187176 [0,1,0,1,0,0|1,1,0]=4 18309 B15R2.1527 CN(C(=O)c1ccc(cc1)I)C2CC2 11a_100000226674_100000187904 [0,1,0,1,0,0|1,1,0]=4 18310 B15R2.1527 CN(C(=O)c1ccc(cc1)I)C2CC2 1626a_100000226674_100000187904 [0,1,0,1,0,0|1,1,0]=4 18311 B15R2.1527 CN(C(=O)c1ccc(cc1)I)C2CC2 240690a_100000226674_100000187904 [0,1,0,1,0,0|1,1,0]=4 18312 B15R2.1527 CN(C(=O)c1ccc(cc1)I)C2CC2 527a_100000226674_100000187904 [0,1,0,1,0,0|1,1,0]=4 18313 B15R2.1527 CN(C(=O)c1ccc(cc1)O)C2CC2 240690a_100000226674_100000212099 [0,1,0,1,0,0|2,0,0]=4 18314 B15R2.1527 CN(C(=O)c1ccc(cc1)O)C2CC2 527a_100000226674_100000212099 [0,1,0,1,0,0|2,0,0]=4 18315 B15R2.1527 Cc1ccc(cc1)C(=O)N(C)C2CC2 11a_100000226674_100000188618 [0,1,0,1,0,0|2,0,0]=4 18316 B15R2.1527 Cc1ccc(cc1)C(=O)N(C)C2CC2 1626a_100000226674_100000188618 [0,1,0,1,0,0|2,0,0]=4 18317 B15R2.1527 Cc1ccc(cc1)C(=O)N(C)C2CC2 240690a_100000226674_100000188618 [0,1,0,1,0,0|2,0,0]=4 18318 B15R2.1527 Cc1ccc(cc1)C(=O)N(C)C2CC2 527a_100000226674_100000188618 [0,1,0,1,0,0|2,0,0]=4 18319 B15R2.18998 O=S(=O)(NC1CC1)c2ccc(cc2)Cl 270084a_100000212008_100000209962 [0,1,0,1,0,0|2,0,0]=4 18320 B15R2.18998 O=S(=O)(NC1CC1)c2ccc(cc2)Cl 274078a_100000212008_100000209962 [0,1,0,1,0,0|2,0,0]=4 18321 B15R2.18999 O=S(=O)(c1ccc(cc1)Cl)N2CCC2 270084a_100000754969_100000209962 [0,1,0,1,0,0|2,0,0]=4 18322 B15R2.18999 O=S(=O)(c1ccc(cc1)Cl)N2CCC2 274078a_100000754969_100000209962 [0,1,0,1,0,0|2,0,0]=4 18323 B15R2.18999 O=S(=O)(c1ccc(cc1)Cl)N2CCC2 40a_100000754969_100000077732 [0,1,0,1,0,0|2,0,0]=4 18324 B15R2.447 C#Cc1ccc(cc1)C(=O)CC2CO2 1458a_100011217615_100011216344 [0,1,0,1,0,0|2,0,0]=4 18325 B15R2.447 C#Cc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100011217615_100000745022 [0,1,0,1,0,0|2,0,0]=4 18326 B15R2.447 C#Cc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100011217615 [0,1,0,1,0,0|2,0,0]=4 18327 B15R2.447 C#Cc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100011217615 [0,1,0,1,0,0|2,0,0]=4 18328 B15R2.447 C#Cc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100011217615 [0,1,0,1,0,0|2,0,0]=4 18329 B15R2.447 C=Cc1ccc(cc1)C(=O)CC2CO2 1458a_100000687532_100011216344 [0,1,0,1,0,0|2,0,0]=4 18330 B15R2.447 C=Cc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100000687532_100000745022 [0,1,0,1,0,0|2,0,0]=4 18331 B15R2.447 C=Cc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100000687532 [0,1,0,1,0,0|2,0,0]=4 18332 B15R2.447 C=Cc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100000687532 [0,1,0,1,0,0|2,0,0]=4 18333 B15R2.447 C=Cc1ccc(cc1)C(=O)NC2CC2 271570a_100011290941_100000155670 [0,1,0,1,0,0|2,0,0]=4 18334 B15R2.447 C=Cc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100000687532 [0,1,0,1,0,0|2,0,0]=4 18335 B15R2.447 CCc1ccc(cc1)C(=O)CC2CO2 1458a_100000211226_100011216344 [0,1,0,1,0,0|2,0,0]=4 18336 B15R2.447 CCc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100000211226_100000745022 [0,1,0,1,0,0|2,0,0]=4 18337 B15R2.447 CCc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100000211226 [0,1,0,1,0,0|2,0,0]=4 18338 B15R2.447 CCc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100000211226 [0,1,0,1,0,0|2,0,0]=4 18339 B15R2.447 CCc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100000211226 [0,1,0,1,0,0|2,0,0]=4 18340 B15R2.447 CNc1ccc(cc1)C(=O)NC2CC2 2230a_100000242198_200000210301 [0,1,0,1,0,0|2,0,0]=4 18341 B15R2.447 CNc1ccc(cc1)C(=O)NC2CC2 27a_100102657272_100000155670 [0,1,0,1,0,0|2,0,0]=4 18342 B15R2.447 CNc1ccc(cc1)C(=O)NC2CC2 34a_100000242198_200000210301 [0,1,0,1,0,0|2,0,0]=4 18343 B15R2.447 COc1ccc(cc1)C(=O)CC2CO2 1458a_100000184203_100011216344 [0,1,0,1,0,0|2,0,0]=4 18344 B15R2.447 COc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100000184203_100000745022 [0,1,0,1,0,0|2,0,0]=4 18345 B15R2.447 COc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100000184203 [0,1,0,1,0,0|2,0,0]=4 18346 B15R2.447 COc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100000184203 [0,1,0,1,0,0|2,0,0]=4 18347 B15R2.447 COc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100000184203 [0,1,0,1,0,0|2,0,0]=4 18348 B15R2.447 CSc1ccc(cc1)C(=O)CC2CO2 1458a_100000189692_100011216344 [0,1,0,1,0,0|2,0,0]=4 18349 B15R2.447 CSc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100000189692_100000745022 [0,1,0,1,0,0|2,0,0]=4 18350 B15R2.447 CSc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100000189692 [0,1,0,1,0,0|2,0,0]=4 18351 B15R2.447 CSc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100000189692 [0,1,0,1,0,0|2,0,0]=4 18352 B15R2.447 CSc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100000189692 [0,1,0,1,0,0|2,0,0]=4 18353 B15R2.447 CSc1ccc(cc1)C(=O)NC2CC2 62a_100000155670_200000210301 [0,1,0,1,0,0|2,0,0]=4 18354 B15R2.447 CSc1ccc(cc1)C(=O)NC2CC2 62a_200000210301_100000155670 [0,1,0,1,0,0|2,0,0]=4 18355 B15R2.447 N#Cc1ccc(cc1)C(=O)CC2CO2 1458a_100000210717_100011216344 [0,1,0,1,0,0|2,0,0]=4 18356 B15R2.447 N#Cc1ccc(cc1)C(=O)C[C@@H]2CO2 1458a_100000210717_100000745022 [0,1,0,1,0,0|2,0,0]=4 18357 B15R2.447 N#Cc1ccc(cc1)C(=O)NC2CC2 1626a_100000212008_100000210717 [0,1,0,1,0,0|2,0,0]=4 18358 B15R2.447 N#Cc1ccc(cc1)C(=O)NC2CC2 240690a_100000212008_100000210717 [0,1,0,1,0,0|2,0,0]=4 18359 B15R2.447 N#Cc1ccc(cc1)C(=O)NC2CC2 527a_100000212008_100000210717 [0,1,0,1,0,0|2,0,0]=4 18360 B15R2.447 O=C(CC1CO1)c2ccc(cc2)CO 1458a_100000183892_100011216344 [0,1,0,1,0,0|2,0,0]=4 18361 B15R2.447 O=C(C[C@@H]1CO1)c2ccc(cc2)CO 1458a_100000183892_100000745022 [0,1,0,1,0,0|2,0,0]=4 18362 B15R2.447 O=C(NC1CC1)c2ccc(cc2)CO 1626a_100000212008_100000183892 [0,1,0,1,0,0|2,0,0]=4 18363 B15R2.447 O=C(NC1CC1)c2ccc(cc2)CO 240690a_100000212008_100000183892 [0,1,0,1,0,0|2,0,0]=4 18364 B15R2.447 [13CH3]Nc1ccc(cc1)C(=O)NC2CC2 2230a_100000242198_200025704644 [0,1,0,1,0,0|2,0,0]=4 18365 B15R2.447 [13CH3]Nc1ccc(cc1)C(=O)NC2CC2 34a_100000242198_200025704644 [0,1,0,1,0,0|2,0,0]=4 18366 B15R2.447 [13CH3]Sc1ccc(cc1)C(=O)NC2CC2 62a_100000155670_200025704644 [0,1,0,1,0,0|2,0,0]=4 18367 B15R2.447 [13CH3]Sc1ccc(cc1)C(=O)NC2CC2 62a_200025704644_100000155670 [0,1,0,1,0,0|2,0,0]=4 18368 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 11a_100020643023_100000137882 [0,1,0,1,0,0|2,0,0]=4 18369 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 1626a_100020643023_100000137882 [0,1,0,1,0,0|2,0,0]=4 18370 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 240690a_100020643023_100000137882 [0,1,0,1,0,0|2,0,0]=4 18371 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 527a_100020643023_100000137882 [0,1,0,1,0,0|2,0,0]=4 18372 B15R2.3423 O=C(CCCO)c1ccc2c(c1)CC2 1458a_100000137882_100011215043 [0,1,0,1,0,0|2,0,0]=4 18373 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 11a_100000724931_100000137882 [0,1,0,1,0,0|2,0,0]=4 18374 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 1626a_100000724931_100000137882 [0,1,0,1,0,0|2,0,0]=4 18375 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 240690a_100000724931_100000137882 [0,1,0,1,0,0|2,0,0]=4 18376 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 527a_100000724931_100000137882 [0,1,0,1,0,0|2,0,0]=4 18377 B15R2.3423 O=C(NCCO)c1ccc2c(c1)CC2 240690a_100000210304_100000137882 [0,1,0,1,0,0|1,0,0]=3 18378 B15R2.3423 O=C(NCCO)c1ccc2c(c1)CC2 527a_100000210304_100000137882 [0,1,0,1,0,0|1,0,0]=3 18379 B15R2.7890 C#Cc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100011217615 [0,1,0,1,0,0|2,0,0]=4 18380 B15R2.7890 C#Cc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100011217615 [0,1,0,1,0,0|2,0,0]=4 18381 B15R2.7890 C#Cc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100011217615 [0,1,0,1,0,0|2,0,0]=4 18382 B15R2.7890 C=Cc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100000687532 [0,1,0,1,0,0|2,0,0]=4 18383 B15R2.7890 C=Cc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100000687532 [0,1,0,1,0,0|2,0,0]=4 18384 B15R2.7890 C=Cc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100000687532 [0,1,0,1,0,0|2,0,0]=4 18385 B15R2.7890 CCc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100000211226 [0,1,0,1,0,0|2,0,0]=4 18386 B15R2.7890 CCc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100000211226 [0,1,0,1,0,0|2,0,0]=4 18387 B15R2.7890 CCc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100000211226 [0,1,0,1,0,0|2,0,0]=4 18388 B15R2.7890 COc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100000184203 [0,1,0,1,0,0|2,0,0]=4 18389 B15R2.7890 COc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100000184203 [0,1,0,1,0,0|2,0,0]=4 18390 B15R2.7890 COc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100000184203 [0,1,0,1,0,0|2,0,0]=4 18391 B15R2.7890 CSc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100000189692 [0,1,0,1,0,0|2,0,0]=4 18392 B15R2.7890 CSc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100000189692 [0,1,0,1,0,0|2,0,0]=4 18393 B15R2.7890 CSc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100000189692 [0,1,0,1,0,0|2,0,0]=4 18394 B15R2.7890 N#Cc1ccc(cc1)C(=O)N2CCC2 11a_100000754969_100000210717 [0,1,0,1,0,0|2,0,0]=4 18395 B15R2.7890 N#Cc1ccc(cc1)C(=O)N2CCC2 240690a_100000754969_100000210717 [0,1,0,1,0,0|2,0,0]=4 18396 B15R2.7890 N#Cc1ccc(cc1)C(=O)N2CCC2 527a_100000754969_100000210717 [0,1,0,1,0,0|2,0,0]=4 18397 B15R2.7890 O=C(c1ccc(cc1)CO)N2CCC2 240690a_100000754969_100000183892 [0,1,0,1,0,0|2,0,0]=4 18398 B15R2.22338 C=Cc1ccc2c(c1)NCCNC2=O 271570a_100011290941_200000725643 [0,1,0,1,0,0|2,0,0]=4 18399 B15R2.22338 C=Cc1ccc2c(c1)OCCCC2=O 271570a_100011290941_100000735630 [0,1,0,1,0,0|2,0,0]=4 18400 B15R2.22338 C=Cc1ccc2c(c1)OCCNC2=O 271570a_100011290941_200013358270 [0,1,0,1,0,0|1,0,0]=3 18401 B15R2.22338 CSc1ccc2c(c1)NCCNC2=O 62a_200000210301_200000725643 [0,1,0,1,0,0|2,0,0]=4 18402 B15R2.22338 CSc1ccc2c(c1)NCCNC2=O 62a_200000725643_200000210301 [0,1,0,1,0,0|2,0,0]=4 18403 B15R2.22338 CSc1ccc2c(c1)OCCCC2=O 62a_100000735630_200000210301 [0,1,0,1,0,0|2,0,0]=4 18404 B15R2.22338 CSc1ccc2c(c1)OCCCC2=O 62a_200000210301_100000735630 [0,1,0,1,0,0|2,0,0]=4 18405 B15R2.22338 CSc1ccc2c(c1)OCCNC2=O 62a_200000210301_200013358270 [0,1,0,1,0,0|1,0,0]=3 18406 B15R2.22338 CSc1ccc2c(c1)OCCNC2=O 62a_200013358270_200000210301 [0,1,0,1,0,0|1,0,0]=3 18407 B15R2.22338 [13CH3]Sc1ccc2c(c1)NCCNC2=O 62a_200000725643_200025704644 [0,1,0,1,0,0|2,0,0]=4 18408 B15R2.22338 [13CH3]Sc1ccc2c(c1)NCCNC2=O 62a_200025704644_200000725643 [0,1,0,1,0,0|2,0,0]=4 18409 B15R2.22338 [13CH3]Sc1ccc2c(c1)OCCCC2=O 62a_100000735630_200025704644 [0,1,0,1,0,0|2,0,0]=4 18410 B15R2.22338 [13CH3]Sc1ccc2c(c1)OCCCC2=O 62a_200025704644_100000735630 [0,1,0,1,0,0|2,0,0]=4 18411 B15R2.22338 [13CH3]Sc1ccc2c(c1)OCCNC2=O 62a_200013358270_200025704644 [0,1,0,1,0,0|1,0,0]=3 18412 B15R2.22338 [13CH3]Sc1ccc2c(c1)OCCNC2=O 62a_200025704644_200013358270 [0,1,0,1,0,0|1,0,0]=3 18413 B15R2.94 Cc1cc(ccc1Cl)C2=COCCC2 271570a_100010175576_100000049509 [0,1,0,1,0,0|2,0,0]=4 18414 B15R2.94 Clc1ccc(cc1Br)C2=COCCC2 271570a_100010175576_100012353702 [0,1,0,1,0,0|2,0,0]=4 18415 B15R2.94 Clc1ccc(cc1Cl)C2=COCCC2 271570a_100010175576_100011214914 [0,1,0,1,0,0|2,0,0]=4 18416 B15R2.94 Fc1cc(ccc1Cl)C2=COCCC2 271570a_100010175576_100011216805 [0,1,0,1,0,0|2,0,0]=4 18417 B15R2.94 Nc1cc(ccc1Cl)C2=COCCC2 271570a_100010175576_200000761891 [0,1,0,1,0,0|2,0,0]=4 18418 B15R2.94 Oc1cc(ccc1Cl)C2=COCCC2 271570a_100010175576_100011356854 [0,1,0,1,0,0|2,0,0]=4 18419 B15R2.18898 Cc1cc(ccc1Br)C(=O)CC2CO2 1458a_100000692631_100011216344 [0,1,0,1,0,0|1,1,0]=4 18420 B15R2.18898 Cc1cc(ccc1Br)C(=O)C[C@@H]2CO2 1458a_100000692631_100000745022 [0,1,0,1,0,0|1,1,0]=4 18421 B15R2.18898 Cc1cc(ccc1Br)C(=O)NC2CC2 1626a_100000212008_100000692631 [0,1,0,1,0,0|1,1,0]=4 18422 B15R2.18898 Cc1cc(ccc1Br)C(=O)NC2CC2 240690a_100000212008_100000692631 [0,1,0,1,0,0|1,1,0]=4 18423 B15R2.18898 Cc1cc(ccc1Br)C(=O)NC2CC2 527a_100000212008_100000692631 [0,1,0,1,0,0|1,1,0]=4 18424 B15R2.18898 Cc1cc(ccc1Cl)C(=O)CC2CC2 1458a_100000686306_100000742324 [0,1,0,1,0,0|2,0,0]=4 18425 B15R2.18898 Cc1cc(ccc1Cl)C(=O)CC2CO2 1458a_100000686306_100011216344 [0,1,0,1,0,0|1,0,0]=3 18426 B15R2.18898 Cc1cc(ccc1Cl)C(=O)CC2CS2 1458a_100000686306_100000031435 [0,1,0,1,0,0|1,1,0]=4 18427 B15R2.18898 Cc1cc(ccc1Cl)C(=O)C[C@@H]2CO2 1458a_100000686306_100000745022 [0,1,0,1,0,0|1,0,0]=3 18428 B15R2.18898 Cc1cc(ccc1Cl)C(=O)NC2CC2 1626a_100000212008_100000686306 [0,1,0,1,0,0|1,0,0]=3 18429 B15R2.18898 Cc1cc(ccc1Cl)C(=O)NC2CC2 240690a_100000212008_100000686306 [0,1,0,1,0,0|1,0,0]=3 18430 B15R2.18898 Cc1cc(ccc1Cl)C(=O)NC2CC2 527a_100000212008_100000686306 [0,1,0,1,0,0|1,0,0]=3 18431 B15R2.18898 Cc1cc(ccc1F)C(=O)CC2CO2 1458a_100000751819_100011216344 [0,1,0,1,0,0|1,1,0]=4 18432 B15R2.18898 Cc1cc(ccc1F)C(=O)C[C@@H]2CO2 1458a_100000751819_100000745022 [0,1,0,1,0,0|1,1,0]=4 18433 B15R2.18898 Cc1cc(ccc1F)C(=O)NC2CC2 1626a_100000212008_100000751819 [0,1,0,1,0,0|1,1,0]=4 18434 B15R2.18898 Cc1cc(ccc1F)C(=O)NC2CC2 240690a_100000212008_100000751819 [0,1,0,1,0,0|1,1,0]=4 18435 B15R2.18898 Cc1cc(ccc1F)C(=O)NC2CC2 527a_100000212008_100000751819 [0,1,0,1,0,0|1,1,0]=4 18436 B15R2.18898 Cc1cc(ccc1I)C(=O)CC2CO2 1458a_100000751300_100011216344 [0,1,0,1,0,0|1,1,0]=4 18437 B15R2.18898 Cc1cc(ccc1I)C(=O)C[C@@H]2CO2 1458a_100000751300_100000745022 [0,1,0,1,0,0|1,1,0]=4 18438 B15R2.18898 Cc1cc(ccc1I)C(=O)NC2CC2 1626a_100000212008_100000751300 [0,1,0,1,0,0|1,1,0]=4 18439 B15R2.18898 Cc1cc(ccc1I)C(=O)NC2CC2 240690a_100000212008_100000751300 [0,1,0,1,0,0|1,1,0]=4 18440 B15R2.18898 Cc1cc(ccc1I)C(=O)NC2CC2 527a_100000212008_100000751300 [0,1,0,1,0,0|1,1,0]=4 18441 B15R2.18898 Cc1cc(ccc1O)C(=O)CC2CO2 1458a_100000685612_100011216344 [0,1,0,1,0,0|2,0,0]=4 18442 B15R2.18898 Cc1cc(ccc1O)C(=O)C[C@@H]2CO2 1458a_100000685612_100000745022 [0,1,0,1,0,0|2,0,0]=4 18443 B15R2.18898 Cc1cc(ccc1O)C(=O)NC2CC2 240690a_100000212008_100000685612 [0,1,0,1,0,0|2,0,0]=4 18444 B15R2.18898 Cc1ccc(cc1Br)C(=O)CC2CO2 1458a_100000186397_100011216344 [0,1,0,1,0,0|2,0,0]=4 18445 B15R2.18898 Cc1ccc(cc1Br)C(=O)C[C@@H]2CO2 1458a_100000186397_100000745022 [0,1,0,1,0,0|2,0,0]=4 18446 B15R2.18898 Cc1ccc(cc1Br)C(=O)NC2CC2 1626a_100000212008_100000186397 [0,1,0,1,0,0|2,0,0]=4 18447 B15R2.18898 Cc1ccc(cc1Br)C(=O)NC2CC2 240690a_100000212008_100000186397 [0,1,0,1,0,0|2,0,0]=4 18448 B15R2.18898 Cc1ccc(cc1Br)C(=O)NC2CC2 527a_100000212008_100000186397 [0,1,0,1,0,0|2,0,0]=4 18449 B15R2.18898 Cc1ccc(cc1C)C(=O)CC2CO2 1458a_100000210898_100011216344 [0,1,0,1,0,0|2,0,0]=4 18450 B15R2.18898 Cc1ccc(cc1C)C(=O)C[C@@H]2CO2 1458a_100000210898_100000745022 [0,1,0,1,0,0|2,0,0]=4 18451 B15R2.18898 Cc1ccc(cc1C)C(=O)NC2CC2 1626a_100000212008_100000210898 [0,1,0,1,0,0|2,0,0]=4 18452 B15R2.18898 Cc1ccc(cc1C)C(=O)NC2CC2 240690a_100000212008_100000210898 [0,1,0,1,0,0|2,0,0]=4 18453 B15R2.18898 Cc1ccc(cc1C)C(=O)NC2CC2 527a_100000212008_100000210898 [0,1,0,1,0,0|2,0,0]=4 18454 B15R2.18898 Cc1ccc(cc1Cl)C(=O)CC2CO2 1458a_100000751740_100011216344 [0,1,0,1,0,0|2,0,0]=4 18455 B15R2.18898 Cc1ccc(cc1Cl)C(=O)C[C@@H]2CO2 1458a_100000751740_100000745022 [0,1,0,1,0,0|2,0,0]=4 18456 B15R2.18898 Cc1ccc(cc1Cl)C(=O)NC2CC2 1626a_100000212008_100000751740 [0,1,0,1,0,0|2,0,0]=4 18457 B15R2.18898 Cc1ccc(cc1Cl)C(=O)NC2CC2 240690a_100000212008_100000751740 [0,1,0,1,0,0|2,0,0]=4 18458 B15R2.18898 Cc1ccc(cc1Cl)C(=O)NC2CC2 527a_100000212008_100000751740 [0,1,0,1,0,0|2,0,0]=4 18459 B15R2.18898 Cc1ccc(cc1F)C(=O)CC2CO2 1458a_100000212313_100011216344 [0,1,0,1,0,0|2,0,0]=4 18460 B15R2.18898 Cc1ccc(cc1F)C(=O)C[C@@H]2CO2 1458a_100000212313_100000745022 [0,1,0,1,0,0|2,0,0]=4 18461 B15R2.18898 Cc1ccc(cc1F)C(=O)NC2CC2 1626a_100000212008_100000212313 [0,1,0,1,0,0|2,0,0]=4 18462 B15R2.18898 Cc1ccc(cc1F)C(=O)NC2CC2 240690a_100000212008_100000212313 [0,1,0,1,0,0|2,0,0]=4 18463 B15R2.18898 Cc1ccc(cc1F)C(=O)NC2CC2 527a_100000212008_100000212313 [0,1,0,1,0,0|2,0,0]=4 18464 B15R2.18898 Cc1ccc(cc1I)C(=O)CC2CO2 1458a_100000751299_100011216344 [0,1,0,1,0,0|2,0,0]=4 18465 B15R2.18898 Cc1ccc(cc1I)C(=O)C[C@@H]2CO2 1458a_100000751299_100000745022 [0,1,0,1,0,0|2,0,0]=4 18466 B15R2.18898 Cc1ccc(cc1I)C(=O)NC2CC2 1626a_100000212008_100000751299 [0,1,0,1,0,0|2,0,0]=4 18467 B15R2.18898 Cc1ccc(cc1I)C(=O)NC2CC2 240690a_100000212008_100000751299 [0,1,0,1,0,0|2,0,0]=4 18468 B15R2.18898 Cc1ccc(cc1I)C(=O)NC2CC2 527a_100000212008_100000751299 [0,1,0,1,0,0|2,0,0]=4 18469 B15R2.18898 Cc1ccc(cc1O)C(=O)CC2CO2 1458a_100000233767_100011216344 [0,1,0,1,0,0|2,0,0]=4 18470 B15R2.18898 Cc1ccc(cc1O)C(=O)C[C@@H]2CO2 1458a_100000233767_100000745022 [0,1,0,1,0,0|2,0,0]=4 18471 B15R2.18898 Cc1ccc(cc1O)C(=O)NC2CC2 240690a_100000212008_100000233767 [0,1,0,1,0,0|2,0,0]=4 18472 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)Br)Cl 1458a_100000691181_100000742324 [0,1,0,1,0,0|2,0,0]=4 18473 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)Cl)Cl 1458a_100000210401_100000742324 [0,1,0,1,0,0|2,0,0]=4 18474 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)F)Cl 1458a_100000743183_100000742324 [0,1,0,1,0,0|2,0,0]=4 18475 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)I)Cl 1458a_100000739381_100000742324 [0,1,0,1,0,0|2,0,0]=4 18476 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)O)Cl 1458a_100011933997_100000742324 [0,1,0,1,0,0|2,0,0]=4 18477 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Br)Br 1458a_100012339404_100011216344 [0,1,0,1,0,0|1,1,0]=4 18478 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Br)Cl 1458a_100000691181_100011216344 [0,1,0,1,0,0|1,0,0]=3 18479 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Br)F 1458a_100000760357_100011216344 [0,1,0,1,0,0|1,1,0]=4 18480 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Br)I 1458a_100000739115_100011216344 [0,1,0,1,0,0|1,1,0]=4 18481 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Br)O 1458a_100000189672_100011216344 [0,1,0,1,0,0|2,0,0]=4 18482 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Cl)Br 1458a_100000687082_100011216344 [0,1,0,1,0,0|1,1,0]=4 18483 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Cl)Cl 1458a_100000210401_100011216344 [0,1,0,1,0,0|1,0,0]=3 18484 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Cl)F 1458a_100000686462_100011216344 [0,1,0,1,0,0|1,1,0]=4 18485 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Cl)I 1458a_100000684831_100011216344 [0,1,0,1,0,0|1,1,0]=4 18486 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)Cl)O 1458a_100000212196_100011216344 [0,1,0,1,0,0|2,0,0]=4 18487 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)F)Br 1458a_100000743946_100011216344 [0,1,0,1,0,0|1,1,0]=4 18488 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)F)Cl 1458a_100000743183_100011216344 [0,1,0,1,0,0|1,0,0]=3 18489 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)F)F 1458a_100000209822_100011216344 [0,1,0,1,0,0|1,1,0]=4 18490 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)F)I 1458a_100000062624_100011216344 [0,1,0,1,0,0|1,1,0]=4 18491 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)F)O 1458a_100000185466_100011216344 [0,1,0,1,0,0|2,0,0]=4 18492 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)I)Br 1458a_100012343876_100011216344 [0,1,0,1,0,0|1,1,0]=4 18493 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)I)Cl 1458a_100000739381_100011216344 [0,1,0,1,0,0|1,0,0]=3 18494 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)I)F 1458a_100000688015_100011216344 [0,1,0,1,0,0|1,1,0]=4 18495 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)I)I 1458a_100000725830_100011216344 [0,1,0,1,0,0|1,1,0]=4 18496 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)I)O 1458a_100000037485_100011216344 [0,1,0,1,0,0|2,0,0]=4 18497 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)O)Br 1458a_100000689001_100011216344 [0,1,0,1,0,0|1,1,0]=4 18498 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)O)Cl 1458a_100011933997_100011216344 [0,1,0,1,0,0|1,0,0]=3 18499 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)O)F 1458a_100000035894_100011216344 [0,1,0,1,0,0|1,1,0]=4 18500 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)O)I 1458a_100000239334_100011216344 [0,1,0,1,0,0|1,1,0]=4 18501 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)O)O 1458a_100000212155_100011216344 [0,1,0,1,0,0|2,0,0]=4 18502 B15R2.18898 O=C(CC1CS1)c2ccc(c(c2)Br)Cl 1458a_100000691181_100000031435 [0,1,0,1,0,0|1,1,0]=4 18503 B15R2.18898 O=C(CC1CS1)c2ccc(c(c2)Cl)Cl 1458a_100000210401_100000031435 [0,1,0,1,0,0|1,1,0]=4 18504 B15R2.18898 O=C(CC1CS1)c2ccc(c(c2)F)Cl 1458a_100000743183_100000031435 [0,1,0,1,0,0|1,1,0]=4 18505 B15R2.18898 O=C(CC1CS1)c2ccc(c(c2)I)Cl 1458a_100000739381_100000031435 [0,1,0,1,0,0|1,1,0]=4 18506 B15R2.18898 O=C(CC1CS1)c2ccc(c(c2)O)Cl 1458a_100011933997_100000031435 [0,1,0,1,0,0|1,1,0]=4 18507 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Br)Br 1458a_100012339404_100000745022 [0,1,0,1,0,0|1,1,0]=4 18508 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Br)Cl 1458a_100000691181_100000745022 [0,1,0,1,0,0|1,0,0]=3 18509 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Br)F 1458a_100000760357_100000745022 [0,1,0,1,0,0|1,1,0]=4 18510 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Br)I 1458a_100000739115_100000745022 [0,1,0,1,0,0|1,1,0]=4 18511 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Br)O 1458a_100000189672_100000745022 [0,1,0,1,0,0|2,0,0]=4 18512 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Cl)Br 1458a_100000687082_100000745022 [0,1,0,1,0,0|1,1,0]=4 18513 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Cl)Cl 1458a_100000210401_100000745022 [0,1,0,1,0,0|1,0,0]=3 18514 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Cl)F 1458a_100000686462_100000745022 [0,1,0,1,0,0|1,1,0]=4 18515 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Cl)I 1458a_100000684831_100000745022 [0,1,0,1,0,0|1,1,0]=4 18516 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)Cl)O 1458a_100000212196_100000745022 [0,1,0,1,0,0|2,0,0]=4 18517 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)F)Br 1458a_100000743946_100000745022 [0,1,0,1,0,0|1,1,0]=4 18518 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)F)Cl 1458a_100000743183_100000745022 [0,1,0,1,0,0|1,0,0]=3 18519 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)F)F 1458a_100000209822_100000745022 [0,1,0,1,0,0|1,1,0]=4 18520 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)F)I 1458a_100000062624_100000745022 [0,1,0,1,0,0|1,1,0]=4 18521 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)F)O 1458a_100000185466_100000745022 [0,1,0,1,0,0|2,0,0]=4 18522 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)I)Br 1458a_100012343876_100000745022 [0,1,0,1,0,0|1,1,0]=4 18523 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)I)Cl 1458a_100000739381_100000745022 [0,1,0,1,0,0|1,0,0]=3 18524 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)I)F 1458a_100000688015_100000745022 [0,1,0,1,0,0|1,1,0]=4 18525 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)I)I 1458a_100000725830_100000745022 [0,1,0,1,0,0|1,1,0]=4 18526 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)I)O 1458a_100000037485_100000745022 [0,1,0,1,0,0|2,0,0]=4 18527 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)O)Br 1458a_100000689001_100000745022 [0,1,0,1,0,0|1,1,0]=4 18528 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)O)Cl 1458a_100011933997_100000745022 [0,1,0,1,0,0|1,0,0]=3 18529 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)O)F 1458a_100000035894_100000745022 [0,1,0,1,0,0|1,1,0]=4 18530 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)O)I 1458a_100000239334_100000745022 [0,1,0,1,0,0|1,1,0]=4 18531 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)O)O 1458a_100000212155_100000745022 [0,1,0,1,0,0|2,0,0]=4 18532 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)Br 1626a_100000212008_100012339404 [0,1,0,1,0,0|1,1,0]=4 18533 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)Br 240690a_100000212008_100012339404 [0,1,0,1,0,0|1,1,0]=4 18534 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)Br 527a_100000212008_100012339404 [0,1,0,1,0,0|1,1,0]=4 18535 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)Cl 1626a_100000212008_100000691181 [0,1,0,1,0,0|1,0,0]=3 18536 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)Cl 240690a_100000212008_100000691181 [0,1,0,1,0,0|1,0,0]=3 18537 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)Cl 527a_100000212008_100000691181 [0,1,0,1,0,0|1,0,0]=3 18538 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)F 1626a_100000212008_100000760357 [0,1,0,1,0,0|1,1,0]=4 18539 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)F 240690a_100000212008_100000760357 [0,1,0,1,0,0|1,1,0]=4 18540 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)F 527a_100000212008_100000760357 [0,1,0,1,0,0|1,1,0]=4 18541 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)I 1626a_100000212008_100000739115 [0,1,0,1,0,0|1,1,0]=4 18542 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)I 240690a_100000212008_100000739115 [0,1,0,1,0,0|1,1,0]=4 18543 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)I 527a_100000212008_100000739115 [0,1,0,1,0,0|1,1,0]=4 18544 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)O 240690a_100000212008_100000189672 [0,1,0,1,0,0|2,0,0]=4 18545 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)Br 1626a_100000212008_100000687082 [0,1,0,1,0,0|1,1,0]=4 18546 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)Br 240690a_100000212008_100000687082 [0,1,0,1,0,0|1,1,0]=4 18547 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)Br 527a_100000212008_100000687082 [0,1,0,1,0,0|1,1,0]=4 18548 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)Cl 1626a_100000212008_100000210401 [0,1,0,1,0,0|1,0,0]=3 18549 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)Cl 240690a_100000212008_100000210401 [0,1,0,1,0,0|1,0,0]=3 18550 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)Cl 527a_100000212008_100000210401 [0,1,0,1,0,0|1,0,0]=3 18551 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)F 1626a_100000212008_100000686462 [0,1,0,1,0,0|1,1,0]=4 18552 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)F 240690a_100000212008_100000686462 [0,1,0,1,0,0|1,1,0]=4 18553 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)F 527a_100000212008_100000686462 [0,1,0,1,0,0|1,1,0]=4 18554 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)I 1626a_100000212008_100000684831 [0,1,0,1,0,0|1,1,0]=4 18555 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)I 240690a_100000212008_100000684831 [0,1,0,1,0,0|1,1,0]=4 18556 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)I 527a_100000212008_100000684831 [0,1,0,1,0,0|1,1,0]=4 18557 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)O 240690a_100000212008_100000212196 [0,1,0,1,0,0|2,0,0]=4 18558 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)O 527a_100000212008_100000212196 [0,1,0,1,0,0|2,0,0]=4 18559 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)Br 1626a_100000212008_100000743946 [0,1,0,1,0,0|1,1,0]=4 18560 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)Br 240690a_100000212008_100000743946 [0,1,0,1,0,0|1,1,0]=4 18561 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)Br 527a_100000212008_100000743946 [0,1,0,1,0,0|1,1,0]=4 18562 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)Cl 1626a_100000212008_100000743183 [0,1,0,1,0,0|1,0,0]=3 18563 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)Cl 240690a_100000212008_100000743183 [0,1,0,1,0,0|1,0,0]=3 18564 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)Cl 527a_100000212008_100000743183 [0,1,0,1,0,0|1,0,0]=3 18565 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)F 1626a_100000212008_100000209822 [0,1,0,1,0,0|1,1,0]=4 18566 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)F 240690a_100000212008_100000209822 [0,1,0,1,0,0|1,1,0]=4 18567 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)F 527a_100000212008_100000209822 [0,1,0,1,0,0|1,1,0]=4 18568 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)I 1626a_100000212008_100000062624 [0,1,0,1,0,0|1,1,0]=4 18569 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)I 240690a_100000212008_100000062624 [0,1,0,1,0,0|1,1,0]=4 18570 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)I 527a_100000212008_100000062624 [0,1,0,1,0,0|1,1,0]=4 18571 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)O 240690a_100000212008_100000185466 [0,1,0,1,0,0|2,0,0]=4 18572 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)O 527a_100000212008_100000185466 [0,1,0,1,0,0|2,0,0]=4 18573 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)Br 1626a_100000212008_100012343876 [0,1,0,1,0,0|1,1,0]=4 18574 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)Br 240690a_100000212008_100012343876 [0,1,0,1,0,0|1,1,0]=4 18575 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)Br 527a_100000212008_100012343876 [0,1,0,1,0,0|1,1,0]=4 18576 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)Cl 1626a_100000212008_100000739381 [0,1,0,1,0,0|1,0,0]=3 18577 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)Cl 240690a_100000212008_100000739381 [0,1,0,1,0,0|1,0,0]=3 18578 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)Cl 527a_100000212008_100000739381 [0,1,0,1,0,0|1,0,0]=3 18579 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)F 1626a_100000212008_100000688015 [0,1,0,1,0,0|1,1,0]=4 18580 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)F 240690a_100000212008_100000688015 [0,1,0,1,0,0|1,1,0]=4 18581 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)F 527a_100000212008_100000688015 [0,1,0,1,0,0|1,1,0]=4 18582 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)I 1626a_100000212008_100000725830 [0,1,0,1,0,0|1,1,0]=4 18583 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)I 240690a_100000212008_100000725830 [0,1,0,1,0,0|1,1,0]=4 18584 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)I 527a_100000212008_100000725830 [0,1,0,1,0,0|1,1,0]=4 18585 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)O 1626a_100000212008_100000037485 [0,1,0,1,0,0|2,0,0]=4 18586 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)O 240690a_100000212008_100000037485 [0,1,0,1,0,0|2,0,0]=4 18587 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Br 240690a_100000212008_100000689001 [0,1,0,1,0,0|1,1,0]=4 18588 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Br 527a_100000212008_100000689001 [0,1,0,1,0,0|1,1,0]=4 18589 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Cl 240690a_100000212008_100011933997 [0,1,0,1,0,0|1,0,0]=3 18590 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Cl 527a_100000212008_100011933997 [0,1,0,1,0,0|1,0,0]=3 18591 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)F 240690a_100000212008_100000035894 [0,1,0,1,0,0|1,1,0]=4 18592 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)F 271570a_203496583355_200012359902 [0,1,0,1,0,0|1,1,0]=4 18593 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)F 527a_100000212008_100000035894 [0,1,0,1,0,0|1,1,0]=4 18594 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)I 1626a_100000212008_100000239334 [0,1,0,1,0,0|1,1,0]=4 18595 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)I 240690a_100000212008_100000239334 [0,1,0,1,0,0|1,1,0]=4 18596 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)I 527a_100000212008_100000239334 [0,1,0,1,0,0|1,1,0]=4 18597 B15R2.19038 Cc1cc(ccc1Br)C(=O)N2CCC2 11a_100000754969_100000692631 [0,1,0,1,0,0|1,1,0]=4 18598 B15R2.19038 Cc1cc(ccc1Br)C(=O)N2CCC2 240690a_100000754969_100000692631 [0,1,0,1,0,0|1,1,0]=4 18599 B15R2.19038 Cc1cc(ccc1Br)C(=O)N2CCC2 527a_100000754969_100000692631 [0,1,0,1,0,0|1,1,0]=4 18600 B15R2.19038 Cc1cc(ccc1Cl)C(=O)C2CCC2 1458a_100000686306_100000749161 [0,1,0,1,0,0|2,0,0]=4 18601 B15R2.19038 Cc1cc(ccc1Cl)C(=O)N2CCC2 11a_100000754969_100000686306 [0,1,0,1,0,0|1,0,0]=3 18602 B15R2.19038 Cc1cc(ccc1Cl)C(=O)N2CCC2 240690a_100000754969_100000686306 [0,1,0,1,0,0|1,0,0]=3 18603 B15R2.19038 Cc1cc(ccc1Cl)C(=O)N2CCC2 527a_100000754969_100000686306 [0,1,0,1,0,0|1,0,0]=3 18604 B15R2.19038 Cc1cc(ccc1F)C(=O)N2CCC2 11a_100000754969_100000751819 [0,1,0,1,0,0|1,1,0]=4 18605 B15R2.19038 Cc1cc(ccc1F)C(=O)N2CCC2 240690a_100000754969_100000751819 [0,1,0,1,0,0|1,1,0]=4 18606 B15R2.19038 Cc1cc(ccc1F)C(=O)N2CCC2 527a_100000754969_100000751819 [0,1,0,1,0,0|1,1,0]=4 18607 B15R2.19038 Cc1cc(ccc1I)C(=O)N2CCC2 11a_100000754969_100000751300 [0,1,0,1,0,0|1,1,0]=4 18608 B15R2.19038 Cc1cc(ccc1I)C(=O)N2CCC2 240690a_100000754969_100000751300 [0,1,0,1,0,0|1,1,0]=4 18609 B15R2.19038 Cc1cc(ccc1I)C(=O)N2CCC2 527a_100000754969_100000751300 [0,1,0,1,0,0|1,1,0]=4 18610 B15R2.19038 Cc1cc(ccc1O)C(=O)N2CCC2 240690a_100000754969_100000685612 [0,1,0,1,0,0|2,0,0]=4 18611 B15R2.19038 Cc1ccc(cc1Br)C(=O)N2CCC2 11a_100000754969_100000186397 [0,1,0,1,0,0|2,0,0]=4 18612 B15R2.19038 Cc1ccc(cc1Br)C(=O)N2CCC2 240690a_100000754969_100000186397 [0,1,0,1,0,0|2,0,0]=4 18613 B15R2.19038 Cc1ccc(cc1Br)C(=O)N2CCC2 527a_100000754969_100000186397 [0,1,0,1,0,0|2,0,0]=4 18614 B15R2.19038 Cc1ccc(cc1C)C(=O)N2CCC2 11a_100000754969_100000210898 [0,1,0,1,0,0|2,0,0]=4 18615 B15R2.19038 Cc1ccc(cc1C)C(=O)N2CCC2 240690a_100000754969_100000210898 [0,1,0,1,0,0|2,0,0]=4 18616 B15R2.19038 Cc1ccc(cc1C)C(=O)N2CCC2 527a_100000754969_100000210898 [0,1,0,1,0,0|2,0,0]=4 18617 B15R2.19038 Cc1ccc(cc1Cl)C(=O)N2CCC2 11a_100000754969_100000751740 [0,1,0,1,0,0|2,0,0]=4 18618 B15R2.19038 Cc1ccc(cc1Cl)C(=O)N2CCC2 240690a_100000754969_100000751740 [0,1,0,1,0,0|2,0,0]=4 18619 B15R2.19038 Cc1ccc(cc1Cl)C(=O)N2CCC2 527a_100000754969_100000751740 [0,1,0,1,0,0|2,0,0]=4 18620 B15R2.19038 Cc1ccc(cc1F)C(=O)N2CCC2 11a_100000754969_100000212313 [0,1,0,1,0,0|2,0,0]=4 18621 B15R2.19038 Cc1ccc(cc1F)C(=O)N2CCC2 240690a_100000754969_100000212313 [0,1,0,1,0,0|2,0,0]=4 18622 B15R2.19038 Cc1ccc(cc1F)C(=O)N2CCC2 527a_100000754969_100000212313 [0,1,0,1,0,0|2,0,0]=4 18623 B15R2.19038 Cc1ccc(cc1I)C(=O)N2CCC2 11a_100000754969_100000751299 [0,1,0,1,0,0|2,0,0]=4 18624 B15R2.19038 Cc1ccc(cc1I)C(=O)N2CCC2 240690a_100000754969_100000751299 [0,1,0,1,0,0|2,0,0]=4 18625 B15R2.19038 Cc1ccc(cc1I)C(=O)N2CCC2 527a_100000754969_100000751299 [0,1,0,1,0,0|2,0,0]=4 18626 B15R2.19038 Cc1ccc(cc1O)C(=O)N2CCC2 240690a_100000754969_100000233767 [0,1,0,1,0,0|2,0,0]=4 18627 B15R2.19038 O=C(c1ccc(c(c1)Br)Br)N2CCC2 11a_100000754969_100012339404 [0,1,0,1,0,0|1,1,0]=4 18628 B15R2.19038 O=C(c1ccc(c(c1)Br)Br)N2CCC2 240690a_100000754969_100012339404 [0,1,0,1,0,0|1,1,0]=4 18629 B15R2.19038 O=C(c1ccc(c(c1)Br)Br)N2CCC2 527a_100000754969_100012339404 [0,1,0,1,0,0|1,1,0]=4 18630 B15R2.19038 O=C(c1ccc(c(c1)Br)Cl)C2CCC2 1458a_100000691181_100000749161 [0,1,0,1,0,0|2,0,0]=4 18631 B15R2.19038 O=C(c1ccc(c(c1)Br)Cl)N2CCC2 11a_100000754969_100000691181 [0,1,0,1,0,0|1,0,0]=3 18632 B15R2.19038 O=C(c1ccc(c(c1)Br)Cl)N2CCC2 240690a_100000754969_100000691181 [0,1,0,1,0,0|1,0,0]=3 18633 B15R2.19038 O=C(c1ccc(c(c1)Br)Cl)N2CCC2 527a_100000754969_100000691181 [0,1,0,1,0,0|1,0,0]=3 18634 B15R2.19038 O=C(c1ccc(c(c1)Br)F)N2CCC2 11a_100000754969_100000760357 [0,1,0,1,0,0|1,1,0]=4 18635 B15R2.19038 O=C(c1ccc(c(c1)Br)F)N2CCC2 240690a_100000754969_100000760357 [0,1,0,1,0,0|1,1,0]=4 18636 B15R2.19038 O=C(c1ccc(c(c1)Br)F)N2CCC2 527a_100000754969_100000760357 [0,1,0,1,0,0|1,1,0]=4 18637 B15R2.19038 O=C(c1ccc(c(c1)Br)I)N2CCC2 11a_100000754969_100000739115 [0,1,0,1,0,0|1,1,0]=4 18638 B15R2.19038 O=C(c1ccc(c(c1)Br)I)N2CCC2 240690a_100000754969_100000739115 [0,1,0,1,0,0|1,1,0]=4 18639 B15R2.19038 O=C(c1ccc(c(c1)Br)I)N2CCC2 527a_100000754969_100000739115 [0,1,0,1,0,0|1,1,0]=4 18640 B15R2.19038 O=C(c1ccc(c(c1)Br)O)N2CCC2 240690a_100000754969_100000189672 [0,1,0,1,0,0|2,0,0]=4 18641 B15R2.19038 O=C(c1ccc(c(c1)Cl)Br)N2CCC2 11a_100000754969_100000687082 [0,1,0,1,0,0|1,1,0]=4 18642 B15R2.19038 O=C(c1ccc(c(c1)Cl)Br)N2CCC2 240690a_100000754969_100000687082 [0,1,0,1,0,0|1,1,0]=4 18643 B15R2.19038 O=C(c1ccc(c(c1)Cl)Br)N2CCC2 527a_100000754969_100000687082 [0,1,0,1,0,0|1,1,0]=4 18644 B15R2.19038 O=C(c1ccc(c(c1)Cl)Cl)C2CCC2 1458a_100000210401_100000749161 [0,1,0,1,0,0|2,0,0]=4 18645 B15R2.19038 O=C(c1ccc(c(c1)Cl)Cl)N2CCC2 11a_100000754969_100000210401 [0,1,0,1,0,0|1,0,0]=3 18646 B15R2.19038 O=C(c1ccc(c(c1)Cl)Cl)N2CCC2 240690a_100000754969_100000210401 [0,1,0,1,0,0|1,0,0]=3 18647 B15R2.19038 O=C(c1ccc(c(c1)Cl)Cl)N2CCC2 527a_100000754969_100000210401 [0,1,0,1,0,0|1,0,0]=3 18648 B15R2.19038 O=C(c1ccc(c(c1)Cl)F)N2CCC2 11a_100000754969_100000686462 [0,1,0,1,0,0|1,1,0]=4 18649 B15R2.19038 O=C(c1ccc(c(c1)Cl)F)N2CCC2 240690a_100000754969_100000686462 [0,1,0,1,0,0|1,1,0]=4 18650 B15R2.19038 O=C(c1ccc(c(c1)Cl)F)N2CCC2 527a_100000754969_100000686462 [0,1,0,1,0,0|1,1,0]=4 18651 B15R2.19038 O=C(c1ccc(c(c1)Cl)I)N2CCC2 11a_100000754969_100000684831 [0,1,0,1,0,0|1,1,0]=4 18652 B15R2.19038 O=C(c1ccc(c(c1)Cl)I)N2CCC2 240690a_100000754969_100000684831 [0,1,0,1,0,0|1,1,0]=4 18653 B15R2.19038 O=C(c1ccc(c(c1)Cl)I)N2CCC2 527a_100000754969_100000684831 [0,1,0,1,0,0|1,1,0]=4 18654 B15R2.19038 O=C(c1ccc(c(c1)Cl)O)N2CCC2 240690a_100000754969_100000212196 [0,1,0,1,0,0|2,0,0]=4 18655 B15R2.19038 O=C(c1ccc(c(c1)Cl)O)N2CCC2 527a_100000754969_100000212196 [0,1,0,1,0,0|2,0,0]=4 18656 B15R2.19038 O=C(c1ccc(c(c1)F)Br)N2CCC2 11a_100000754969_100000743946 [0,1,0,1,0,0|1,1,0]=4 18657 B15R2.19038 O=C(c1ccc(c(c1)F)Br)N2CCC2 240690a_100000754969_100000743946 [0,1,0,1,0,0|1,1,0]=4 18658 B15R2.19038 O=C(c1ccc(c(c1)F)Br)N2CCC2 527a_100000754969_100000743946 [0,1,0,1,0,0|1,1,0]=4 18659 B15R2.19038 O=C(c1ccc(c(c1)F)Cl)C2CCC2 1458a_100000743183_100000749161 [0,1,0,1,0,0|2,0,0]=4 18660 B15R2.19038 O=C(c1ccc(c(c1)F)Cl)N2CCC2 11a_100000754969_100000743183 [0,1,0,1,0,0|1,0,0]=3 18661 B15R2.19038 O=C(c1ccc(c(c1)F)Cl)N2CCC2 240690a_100000754969_100000743183 [0,1,0,1,0,0|1,0,0]=3 18662 B15R2.19038 O=C(c1ccc(c(c1)F)Cl)N2CCC2 527a_100000754969_100000743183 [0,1,0,1,0,0|1,0,0]=3 18663 B15R2.19038 O=C(c1ccc(c(c1)F)F)N2CCC2 11a_100000754969_100000209822 [0,1,0,1,0,0|1,1,0]=4 18664 B15R2.19038 O=C(c1ccc(c(c1)F)F)N2CCC2 240690a_100000754969_100000209822 [0,1,0,1,0,0|1,1,0]=4 18665 B15R2.19038 O=C(c1ccc(c(c1)F)F)N2CCC2 527a_100000754969_100000209822 [0,1,0,1,0,0|1,1,0]=4 18666 B15R2.19038 O=C(c1ccc(c(c1)F)I)N2CCC2 11a_100000754969_100000062624 [0,1,0,1,0,0|1,1,0]=4 18667 B15R2.19038 O=C(c1ccc(c(c1)F)I)N2CCC2 240690a_100000754969_100000062624 [0,1,0,1,0,0|1,1,0]=4 18668 B15R2.19038 O=C(c1ccc(c(c1)F)I)N2CCC2 527a_100000754969_100000062624 [0,1,0,1,0,0|1,1,0]=4 18669 B15R2.19038 O=C(c1ccc(c(c1)F)O)N2CCC2 240690a_100000754969_100000185466 [0,1,0,1,0,0|2,0,0]=4 18670 B15R2.19038 O=C(c1ccc(c(c1)F)O)N2CCC2 527a_100000754969_100000185466 [0,1,0,1,0,0|2,0,0]=4 18671 B15R2.19038 O=C(c1ccc(c(c1)I)Br)N2CCC2 11a_100000754969_100012343876 [0,1,0,1,0,0|1,1,0]=4 18672 B15R2.19038 O=C(c1ccc(c(c1)I)Br)N2CCC2 240690a_100000754969_100012343876 [0,1,0,1,0,0|1,1,0]=4 18673 B15R2.19038 O=C(c1ccc(c(c1)I)Br)N2CCC2 527a_100000754969_100012343876 [0,1,0,1,0,0|1,1,0]=4 18674 B15R2.19038 O=C(c1ccc(c(c1)I)Cl)C2CCC2 1458a_100000739381_100000749161 [0,1,0,1,0,0|2,0,0]=4 18675 B15R2.19038 O=C(c1ccc(c(c1)I)Cl)N2CCC2 11a_100000754969_100000739381 [0,1,0,1,0,0|1,0,0]=3 18676 B15R2.19038 O=C(c1ccc(c(c1)I)Cl)N2CCC2 240690a_100000754969_100000739381 [0,1,0,1,0,0|1,0,0]=3 18677 B15R2.19038 O=C(c1ccc(c(c1)I)Cl)N2CCC2 527a_100000754969_100000739381 [0,1,0,1,0,0|1,0,0]=3 18678 B15R2.19038 O=C(c1ccc(c(c1)I)F)N2CCC2 11a_100000754969_100000688015 [0,1,0,1,0,0|1,1,0]=4 18679 B15R2.19038 O=C(c1ccc(c(c1)I)F)N2CCC2 240690a_100000754969_100000688015 [0,1,0,1,0,0|1,1,0]=4 18680 B15R2.19038 O=C(c1ccc(c(c1)I)F)N2CCC2 527a_100000754969_100000688015 [0,1,0,1,0,0|1,1,0]=4 18681 B15R2.19038 O=C(c1ccc(c(c1)I)I)N2CCC2 11a_100000754969_100000725830 [0,1,0,1,0,0|1,1,0]=4 18682 B15R2.19038 O=C(c1ccc(c(c1)I)I)N2CCC2 240690a_100000754969_100000725830 [0,1,0,1,0,0|1,1,0]=4 18683 B15R2.19038 O=C(c1ccc(c(c1)I)I)N2CCC2 527a_100000754969_100000725830 [0,1,0,1,0,0|1,1,0]=4 18684 B15R2.19038 O=C(c1ccc(c(c1)I)O)N2CCC2 240690a_100000754969_100000037485 [0,1,0,1,0,0|2,0,0]=4 18685 B15R2.19038 O=C(c1ccc(c(c1)O)Br)N2CCC2 240690a_100000754969_100000689001 [0,1,0,1,0,0|1,1,0]=4 18686 B15R2.19038 O=C(c1ccc(c(c1)O)Br)N2CCC2 527a_100000754969_100000689001 [0,1,0,1,0,0|1,1,0]=4 18687 B15R2.19038 O=C(c1ccc(c(c1)O)Cl)C2CCC2 1458a_100011933997_100000749161 [0,1,0,1,0,0|2,0,0]=4 18688 B15R2.19038 O=C(c1ccc(c(c1)O)Cl)N2CCC2 240690a_100000754969_100011933997 [0,1,0,1,0,0|1,0,0]=3 18689 B15R2.19038 O=C(c1ccc(c(c1)O)Cl)N2CCC2 527a_100000754969_100011933997 [0,1,0,1,0,0|1,0,0]=3 18690 B15R2.19038 O=C(c1ccc(c(c1)O)F)N2CCC2 240690a_100000754969_100000035894 [0,1,0,1,0,0|1,1,0]=4 18691 B15R2.19038 O=C(c1ccc(c(c1)O)F)N2CCC2 527a_100000754969_100000035894 [0,1,0,1,0,0|1,1,0]=4 18692 B15R2.19038 O=C(c1ccc(c(c1)O)I)N2CCC2 240690a_100000754969_100000239334 [0,1,0,1,0,0|1,1,0]=4 18693 B15R2.19038 O=C(c1ccc(c(c1)O)I)N2CCC2 527a_100000754969_100000239334 [0,1,0,1,0,0|1,1,0]=4 18694 B15R2.389 Cc1cc(ccc1C2=COCCC2)Cl 271570a_100010175576_100011219607 [0,1,0,1,0,0|2,0,0]=4 18695 B15R2.389 Clc1ccc(c(c1)Br)C2=COCCC2 271570a_100010175576_100011219703 [0,1,0,1,0,0|2,0,0]=4 18696 B15R2.389 Clc1ccc(c(c1)Cl)C2=COCCC2 271570a_100010175576_100000699841 [0,1,0,1,0,0|2,0,0]=4 18697 B15R2.389 Fc1cc(ccc1C2=COCCC2)Cl 271570a_100010175576_100011216042 [0,1,0,1,0,0|2,0,0]=4 18698 B15R2.389 Nc1cc(ccc1C2=COCCC2)Cl 271570a_100010175576_100000761886 [0,1,0,1,0,0|2,0,0]=4 18699 B15R2.389 Oc1cc(ccc1C2=COCCC2)Cl 271570a_100010175576_100000050036 [0,1,0,1,0,0|2,0,0]=4 18700 B15R2.7543 Cc1cc(ccc1C(=O)CC2CC2)Cl 1458a_100000688705_100000742324 [0,1,0,1,0,0|2,0,0]=4 18701 B15R2.7543 Cc1cc(ccc1C(=O)CC2CO2)Br 1458a_100000741311_100011216344 [0,1,0,1,0,0|1,1,0]=4 18702 B15R2.7543 Cc1cc(ccc1C(=O)CC2CO2)Cl 1458a_100000688705_100011216344 [0,1,0,1,0,0|1,0,0]=3 18703 B15R2.7543 Cc1cc(ccc1C(=O)CC2CO2)F 1458a_100000686989_100011216344 [0,1,0,1,0,0|1,1,0]=4 18704 B15R2.7543 Cc1cc(ccc1C(=O)CC2CO2)I 1458a_100010189873_100011216344 [0,1,0,1,0,0|1,1,0]=4 18705 B15R2.7543 Cc1cc(ccc1C(=O)CC2CO2)O 1458a_100000692822_100011216344 [0,1,0,1,0,0|2,0,0]=4 18706 B15R2.7543 Cc1cc(ccc1C(=O)CC2CS2)Cl 1458a_100000688705_100000031435 [0,1,0,1,0,0|1,1,0]=4 18707 B15R2.7543 Cc1cc(ccc1C(=O)C[C@@H]2CO2)Br 1458a_100000741311_100000745022 [0,1,0,1,0,0|1,1,0]=4 18708 B15R2.7543 Cc1cc(ccc1C(=O)C[C@@H]2CO2)Cl 1458a_100000688705_100000745022 [0,1,0,1,0,0|1,0,0]=3 18709 B15R2.7543 Cc1cc(ccc1C(=O)C[C@@H]2CO2)F 1458a_100000686989_100000745022 [0,1,0,1,0,0|1,1,0]=4 18710 B15R2.7543 Cc1cc(ccc1C(=O)C[C@@H]2CO2)I 1458a_100010189873_100000745022 [0,1,0,1,0,0|1,1,0]=4 18711 B15R2.7543 Cc1cc(ccc1C(=O)C[C@@H]2CO2)O 1458a_100000692822_100000745022 [0,1,0,1,0,0|2,0,0]=4 18712 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)Br 1626a_100000212008_100000741311 [0,1,0,1,0,0|1,1,0]=4 18713 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)Br 240690a_100000212008_100000741311 [0,1,0,1,0,0|1,1,0]=4 18714 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)Br 527a_100000212008_100000741311 [0,1,0,1,0,0|1,1,0]=4 18715 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)Cl 1626a_100000212008_100000688705 [0,1,0,1,0,0|1,0,0]=3 18716 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)Cl 240690a_100000212008_100000688705 [0,1,0,1,0,0|1,0,0]=3 18717 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)Cl 527a_100000212008_100000688705 [0,1,0,1,0,0|1,0,0]=3 18718 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)F 1626a_100000212008_100000686989 [0,1,0,1,0,0|1,1,0]=4 18719 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)F 240690a_100000212008_100000686989 [0,1,0,1,0,0|1,1,0]=4 18720 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)F 527a_100000212008_100000686989 [0,1,0,1,0,0|1,1,0]=4 18721 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)I 1626a_100000212008_100010189873 [0,1,0,1,0,0|1,1,0]=4 18722 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)I 240690a_100000212008_100010189873 [0,1,0,1,0,0|1,1,0]=4 18723 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)I 527a_100000212008_100010189873 [0,1,0,1,0,0|1,1,0]=4 18724 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)O 240690a_100000212008_100000692822 [0,1,0,1,0,0|2,0,0]=4 18725 B15R2.7543 Cc1cc(ccc1C(=O)NC2CC2)O 527a_100000212008_100000692822 [0,1,0,1,0,0|2,0,0]=4 18726 B15R2.7543 Cc1ccc(c(c1)Br)C(=O)CC2CO2 1458a_100000685072_100011216344 [0,1,0,1,0,0|2,0,0]=4 18727 B15R2.7543 Cc1ccc(c(c1)Br)C(=O)C[C@@H]2CO2 1458a_100000685072_100000745022 [0,1,0,1,0,0|2,0,0]=4 18728 B15R2.7543 Cc1ccc(c(c1)Br)C(=O)NC2CC2 1626a_100000212008_100000685072 [0,1,0,1,0,0|2,0,0]=4 18729 B15R2.7543 Cc1ccc(c(c1)Br)C(=O)NC2CC2 240690a_100000212008_100000685072 [0,1,0,1,0,0|2,0,0]=4 18730 B15R2.7543 Cc1ccc(c(c1)Br)C(=O)NC2CC2 527a_100000212008_100000685072 [0,1,0,1,0,0|2,0,0]=4 18731 B15R2.7543 Cc1ccc(c(c1)C)C(=O)CC2CO2 1458a_100000211164_100011216344 [0,1,0,1,0,0|2,0,0]=4 18732 B15R2.7543 Cc1ccc(c(c1)C)C(=O)C[C@@H]2CO2 1458a_100000211164_100000745022 [0,1,0,1,0,0|2,0,0]=4 18733 B15R2.7543 Cc1ccc(c(c1)C)C(=O)NC2CC2 1626a_100000212008_100000211164 [0,1,0,1,0,0|2,0,0]=4 18734 B15R2.7543 Cc1ccc(c(c1)C)C(=O)NC2CC2 240690a_100000212008_100000211164 [0,1,0,1,0,0|2,0,0]=4 18735 B15R2.7543 Cc1ccc(c(c1)C)C(=O)NC2CC2 527a_100000212008_100000211164 [0,1,0,1,0,0|2,0,0]=4 18736 B15R2.7543 Cc1ccc(c(c1)Cl)C(=O)CC2CO2 1458a_100000766932_100011216344 [0,1,0,1,0,0|2,0,0]=4 18737 B15R2.7543 Cc1ccc(c(c1)Cl)C(=O)C[C@@H]2CO2 1458a_100000766932_100000745022 [0,1,0,1,0,0|2,0,0]=4 18738 B15R2.7543 Cc1ccc(c(c1)Cl)C(=O)NC2CC2 1626a_100000212008_100000766932 [0,1,0,1,0,0|2,0,0]=4 18739 B15R2.7543 Cc1ccc(c(c1)Cl)C(=O)NC2CC2 240690a_100000212008_100000766932 [0,1,0,1,0,0|2,0,0]=4 18740 B15R2.7543 Cc1ccc(c(c1)Cl)C(=O)NC2CC2 527a_100000212008_100000766932 [0,1,0,1,0,0|2,0,0]=4 18741 B15R2.7543 Cc1ccc(c(c1)F)C(=O)CC2CO2 1458a_100000766033_100011216344 [0,1,0,1,0,0|2,0,0]=4 18742 B15R2.7543 Cc1ccc(c(c1)F)C(=O)C[C@@H]2CO2 1458a_100000766033_100000745022 [0,1,0,1,0,0|2,0,0]=4 18743 B15R2.7543 Cc1ccc(c(c1)F)C(=O)NC2CC2 1626a_100000212008_100000766033 [0,1,0,1,0,0|2,0,0]=4 18744 B15R2.7543 Cc1ccc(c(c1)F)C(=O)NC2CC2 240690a_100000212008_100000766033 [0,1,0,1,0,0|2,0,0]=4 18745 B15R2.7543 Cc1ccc(c(c1)F)C(=O)NC2CC2 527a_100000212008_100000766033 [0,1,0,1,0,0|2,0,0]=4 18746 B15R2.7543 Cc1ccc(c(c1)I)C(=O)CC2CO2 1458a_100009999607_100011216344 [0,1,0,1,0,0|2,0,0]=4 18747 B15R2.7543 Cc1ccc(c(c1)I)C(=O)C[C@@H]2CO2 1458a_100009999607_100000745022 [0,1,0,1,0,0|2,0,0]=4 18748 B15R2.7543 Cc1ccc(c(c1)I)C(=O)NC2CC2 1626a_100000212008_100009999607 [0,1,0,1,0,0|2,0,0]=4 18749 B15R2.7543 Cc1ccc(c(c1)I)C(=O)NC2CC2 240690a_100000212008_100009999607 [0,1,0,1,0,0|2,0,0]=4 18750 B15R2.7543 Cc1ccc(c(c1)I)C(=O)NC2CC2 527a_100000212008_100009999607 [0,1,0,1,0,0|2,0,0]=4 18751 B15R2.7543 Cc1ccc(c(c1)O)C(=O)CC2CO2 1458a_100000212137_100011216344 [0,1,0,1,0,0|2,0,0]=4 18752 B15R2.7543 Cc1ccc(c(c1)O)C(=O)C[C@@H]2CO2 1458a_100000212137_100000745022 [0,1,0,1,0,0|2,0,0]=4 18753 B15R2.7543 Cc1ccc(c(c1)O)C(=O)NC2CC2 1626a_100000212008_100000212137 [0,1,0,1,0,0|2,0,0]=4 18754 B15R2.7543 Cc1ccc(c(c1)O)C(=O)NC2CC2 240690a_100000212008_100000212137 [0,1,0,1,0,0|2,0,0]=4 18755 B15R2.7543 Cc1ccc(c(c1)O)C(=O)NC2CC2 527a_100000212008_100000212137 [0,1,0,1,0,0|2,0,0]=4 18756 B15R2.7543 O=C(CC1CC1)c2ccc(cc2Br)Cl 1458a_100000766353_100000742324 [0,1,0,1,0,0|2,0,0]=4 18757 B15R2.7543 O=C(CC1CC1)c2ccc(cc2Cl)Cl 1458a_100000185840_100000742324 [0,1,0,1,0,0|2,0,0]=4 18758 B15R2.7543 O=C(CC1CC1)c2ccc(cc2F)Cl 1458a_100000212326_100000742324 [0,1,0,1,0,0|2,0,0]=4 18759 B15R2.7543 O=C(CC1CC1)c2ccc(cc2I)Cl 1458a_100000739380_100000742324 [0,1,0,1,0,0|2,0,0]=4 18760 B15R2.7543 O=C(CC1CC1)c2ccc(cc2O)Cl 1458a_100000188622_100000742324 [0,1,0,1,0,0|2,0,0]=4 18761 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Br)Br 1458a_100000762965_100011216344 [0,1,0,1,0,0|1,1,0]=4 18762 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Br)Cl 1458a_100000766353_100011216344 [0,1,0,1,0,0|1,0,0]=3 18763 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Br)F 1458a_100000212304_100011216344 [0,1,0,1,0,0|1,1,0]=4 18764 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Br)I 1458a_100012360512_100011216344 [0,1,0,1,0,0|1,1,0]=4 18765 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Br)O 1458a_100012344906_100011216344 [0,1,0,1,0,0|2,0,0]=4 18766 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Cl)Br 1458a_100000741628_100011216344 [0,1,0,1,0,0|1,1,0]=4 18767 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Cl)Cl 1458a_100000185840_100011216344 [0,1,0,1,0,0|1,0,0]=3 18768 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Cl)F 1458a_100000211397_100011216344 [0,1,0,1,0,0|1,1,0]=4 18769 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Cl)I 1458a_100000751301_100011216344 [0,1,0,1,0,0|1,1,0]=4 18770 B15R2.7543 O=C(CC1CO1)c2ccc(cc2Cl)O 1458a_100000702456_100011216344 [0,1,0,1,0,0|2,0,0]=4 18771 B15R2.7543 O=C(CC1CO1)c2ccc(cc2F)Br 1458a_100000214689_100011216344 [0,1,0,1,0,0|1,1,0]=4 18772 B15R2.7543 O=C(CC1CO1)c2ccc(cc2F)Cl 1458a_100000212326_100011216344 [0,1,0,1,0,0|1,0,0]=3 18773 B15R2.7543 O=C(CC1CO1)c2ccc(cc2F)F 1458a_100000211022_100011216344 [0,1,0,1,0,0|1,1,0]=4 18774 B15R2.7543 O=C(CC1CO1)c2ccc(cc2F)I 1458a_100000037189_100011216344 [0,1,0,1,0,0|1,1,0]=4 18775 B15R2.7543 O=C(CC1CO1)c2ccc(cc2F)O 1458a_100000689029_100011216344 [0,1,0,1,0,0|2,0,0]=4 18776 B15R2.7543 O=C(CC1CO1)c2ccc(cc2I)Br 1458a_100000751167_100011216344 [0,1,0,1,0,0|1,1,0]=4 18777 B15R2.7543 O=C(CC1CO1)c2ccc(cc2I)Cl 1458a_100000739380_100011216344 [0,1,0,1,0,0|1,0,0]=3 18778 B15R2.7543 O=C(CC1CO1)c2ccc(cc2I)F 1458a_100000739341_100011216344 [0,1,0,1,0,0|1,1,0]=4 18779 B15R2.7543 O=C(CC1CO1)c2ccc(cc2O)Br 1458a_100000744433_100011216344 [0,1,0,1,0,0|1,1,0]=4 18780 B15R2.7543 O=C(CC1CO1)c2ccc(cc2O)Cl 1458a_100000188622_100011216344 [0,1,0,1,0,0|1,0,0]=3 18781 B15R2.7543 O=C(CC1CO1)c2ccc(cc2O)F 1458a_100000746061_100011216344 [0,1,0,1,0,0|1,1,0]=4 18782 B15R2.7543 O=C(CC1CO1)c2ccc(cc2O)I 1458a_100000091984_100011216344 [0,1,0,1,0,0|1,1,0]=4 18783 B15R2.7543 O=C(CC1CO1)c2ccc(cc2O)O 1458a_100000212172_100011216344 [0,1,0,1,0,0|2,0,0]=4 18784 B15R2.7543 O=C(CC1CS1)c2ccc(cc2Br)Cl 1458a_100000766353_100000031435 [0,1,0,1,0,0|1,1,0]=4 18785 B15R2.7543 O=C(CC1CS1)c2ccc(cc2Cl)Cl 1458a_100000185840_100000031435 [0,1,0,1,0,0|1,1,0]=4 18786 B15R2.7543 O=C(CC1CS1)c2ccc(cc2F)Cl 1458a_100000212326_100000031435 [0,1,0,1,0,0|1,1,0]=4 18787 B15R2.7543 O=C(CC1CS1)c2ccc(cc2I)Cl 1458a_100000739380_100000031435 [0,1,0,1,0,0|1,1,0]=4 18788 B15R2.7543 O=C(CC1CS1)c2ccc(cc2O)Cl 1458a_100000188622_100000031435 [0,1,0,1,0,0|1,1,0]=4 18789 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Br)Br 1458a_100000762965_100000745022 [0,1,0,1,0,0|1,1,0]=4 18790 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Br)Cl 1458a_100000766353_100000745022 [0,1,0,1,0,0|1,0,0]=3 18791 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Br)F 1458a_100000212304_100000745022 [0,1,0,1,0,0|1,1,0]=4 18792 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Br)I 1458a_100012360512_100000745022 [0,1,0,1,0,0|1,1,0]=4 18793 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Br)O 1458a_100012344906_100000745022 [0,1,0,1,0,0|2,0,0]=4 18794 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Cl)Br 1458a_100000741628_100000745022 [0,1,0,1,0,0|1,1,0]=4 18795 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Cl)Cl 1458a_100000185840_100000745022 [0,1,0,1,0,0|1,0,0]=3 18796 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Cl)F 1458a_100000211397_100000745022 [0,1,0,1,0,0|1,1,0]=4 18797 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Cl)I 1458a_100000751301_100000745022 [0,1,0,1,0,0|1,1,0]=4 18798 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2Cl)O 1458a_100000702456_100000745022 [0,1,0,1,0,0|2,0,0]=4 18799 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2F)Br 1458a_100000214689_100000745022 [0,1,0,1,0,0|1,1,0]=4 18800 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2F)Cl 1458a_100000212326_100000745022 [0,1,0,1,0,0|1,0,0]=3 18801 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2F)F 1458a_100000211022_100000745022 [0,1,0,1,0,0|1,1,0]=4 18802 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2F)I 1458a_100000037189_100000745022 [0,1,0,1,0,0|1,1,0]=4 18803 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2F)O 1458a_100000689029_100000745022 [0,1,0,1,0,0|2,0,0]=4 18804 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2I)Br 1458a_100000751167_100000745022 [0,1,0,1,0,0|1,1,0]=4 18805 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2I)Cl 1458a_100000739380_100000745022 [0,1,0,1,0,0|1,0,0]=3 18806 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2I)F 1458a_100000739341_100000745022 [0,1,0,1,0,0|1,1,0]=4 18807 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2O)Br 1458a_100000744433_100000745022 [0,1,0,1,0,0|1,1,0]=4 18808 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2O)Cl 1458a_100000188622_100000745022 [0,1,0,1,0,0|1,0,0]=3 18809 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2O)F 1458a_100000746061_100000745022 [0,1,0,1,0,0|1,1,0]=4 18810 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2O)I 1458a_100000091984_100000745022 [0,1,0,1,0,0|1,1,0]=4 18811 B15R2.7543 O=C(C[C@@H]1CO1)c2ccc(cc2O)O 1458a_100000212172_100000745022 [0,1,0,1,0,0|2,0,0]=4 18812 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)Br 1626a_100000212008_100000762965 [0,1,0,1,0,0|1,1,0]=4 18813 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)Br 240690a_100000212008_100000762965 [0,1,0,1,0,0|1,1,0]=4 18814 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)Br 527a_100000212008_100000762965 [0,1,0,1,0,0|1,1,0]=4 18815 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)Cl 1626a_100000212008_100000766353 [0,1,0,1,0,0|1,0,0]=3 18816 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)Cl 240690a_100000212008_100000766353 [0,1,0,1,0,0|1,0,0]=3 18817 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)Cl 527a_100000212008_100000766353 [0,1,0,1,0,0|1,0,0]=3 18818 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)F 1626a_100000212008_100000212304 [0,1,0,1,0,0|1,1,0]=4 18819 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)F 240690a_100000212008_100000212304 [0,1,0,1,0,0|1,1,0]=4 18820 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)F 527a_100000212008_100000212304 [0,1,0,1,0,0|1,1,0]=4 18821 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)I 1626a_100000212008_100012360512 [0,1,0,1,0,0|1,1,0]=4 18822 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)I 240690a_100000212008_100012360512 [0,1,0,1,0,0|1,1,0]=4 18823 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)I 527a_100000212008_100012360512 [0,1,0,1,0,0|1,1,0]=4 18824 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)O 240690a_100000212008_100012344906 [0,1,0,1,0,0|2,0,0]=4 18825 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Br)O 527a_100000212008_100012344906 [0,1,0,1,0,0|2,0,0]=4 18826 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)Br 1626a_100000212008_100000741628 [0,1,0,1,0,0|1,1,0]=4 18827 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)Br 240690a_100000212008_100000741628 [0,1,0,1,0,0|1,1,0]=4 18828 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)Br 527a_100000212008_100000741628 [0,1,0,1,0,0|1,1,0]=4 18829 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)Cl 1626a_100000212008_100000185840 [0,1,0,1,0,0|1,0,0]=3 18830 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)Cl 240690a_100000212008_100000185840 [0,1,0,1,0,0|1,0,0]=3 18831 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)Cl 527a_100000212008_100000185840 [0,1,0,1,0,0|1,0,0]=3 18832 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)F 1626a_100000212008_100000211397 [0,1,0,1,0,0|1,1,0]=4 18833 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)F 240690a_100000212008_100000211397 [0,1,0,1,0,0|1,1,0]=4 18834 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)F 527a_100000212008_100000211397 [0,1,0,1,0,0|1,1,0]=4 18835 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)I 1626a_100000212008_100000751301 [0,1,0,1,0,0|1,1,0]=4 18836 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)I 240690a_100000212008_100000751301 [0,1,0,1,0,0|1,1,0]=4 18837 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)I 527a_100000212008_100000751301 [0,1,0,1,0,0|1,1,0]=4 18838 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)O 240690a_100000212008_100000702456 [0,1,0,1,0,0|2,0,0]=4 18839 B15R2.7543 O=C(NC1CC1)c2ccc(cc2Cl)O 527a_100000212008_100000702456 [0,1,0,1,0,0|2,0,0]=4 18840 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)Br 1626a_100000212008_100000214689 [0,1,0,1,0,0|1,1,0]=4 18841 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)Br 240690a_100000212008_100000214689 [0,1,0,1,0,0|1,1,0]=4 18842 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)Br 527a_100000212008_100000214689 [0,1,0,1,0,0|1,1,0]=4 18843 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)Cl 1626a_100000212008_100000212326 [0,1,0,1,0,0|1,0,0]=3 18844 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)Cl 240690a_100000212008_100000212326 [0,1,0,1,0,0|1,0,0]=3 18845 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)Cl 527a_100000212008_100000212326 [0,1,0,1,0,0|1,0,0]=3 18846 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)F 1626a_100000212008_100000211022 [0,1,0,1,0,0|1,1,0]=4 18847 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)F 240690a_100000212008_100000211022 [0,1,0,1,0,0|1,1,0]=4 18848 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)F 527a_100000212008_100000211022 [0,1,0,1,0,0|1,1,0]=4 18849 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)I 1626a_100000212008_100000037189 [0,1,0,1,0,0|1,1,0]=4 18850 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)I 240690a_100000212008_100000037189 [0,1,0,1,0,0|1,1,0]=4 18851 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)I 527a_100000212008_100000037189 [0,1,0,1,0,0|1,1,0]=4 18852 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)O 240690a_100000212008_100000689029 [0,1,0,1,0,0|2,0,0]=4 18853 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)O 271570a_203496583355_100000215510 [0,1,0,1,0,0|2,0,0]=4 18854 B15R2.7543 O=C(NC1CC1)c2ccc(cc2F)O 527a_100000212008_100000689029 [0,1,0,1,0,0|2,0,0]=4 18855 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)Br 1626a_100000212008_100000751167 [0,1,0,1,0,0|1,1,0]=4 18856 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)Br 240690a_100000212008_100000751167 [0,1,0,1,0,0|1,1,0]=4 18857 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)Br 527a_100000212008_100000751167 [0,1,0,1,0,0|1,1,0]=4 18858 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)Cl 1626a_100000212008_100000739380 [0,1,0,1,0,0|1,0,0]=3 18859 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)Cl 240690a_100000212008_100000739380 [0,1,0,1,0,0|1,0,0]=3 18860 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)Cl 527a_100000212008_100000739380 [0,1,0,1,0,0|1,0,0]=3 18861 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)F 1626a_100000212008_100000739341 [0,1,0,1,0,0|1,1,0]=4 18862 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)F 240690a_100000212008_100000739341 [0,1,0,1,0,0|1,1,0]=4 18863 B15R2.7543 O=C(NC1CC1)c2ccc(cc2I)F 527a_100000212008_100000739341 [0,1,0,1,0,0|1,1,0]=4 18864 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)Br 240690a_100000212008_100000744433 [0,1,0,1,0,0|1,1,0]=4 18865 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)Br 527a_100000212008_100000744433 [0,1,0,1,0,0|1,1,0]=4 18866 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)Cl 240690a_100000212008_100000188622 [0,1,0,1,0,0|1,0,0]=3 18867 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)Cl 527a_100000212008_100000188622 [0,1,0,1,0,0|1,0,0]=3 18868 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)F 240690a_100000212008_100000746061 [0,1,0,1,0,0|1,1,0]=4 18869 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)F 527a_100000212008_100000746061 [0,1,0,1,0,0|1,1,0]=4 18870 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)I 240690a_100000212008_100000091984 [0,1,0,1,0,0|1,1,0]=4 18871 B15R2.7543 O=C(NC1CC1)c2ccc(cc2O)I 527a_100000212008_100000091984 [0,1,0,1,0,0|1,1,0]=4 18872 B15R2.65869 Cc1cc(ccc1C(=O)C2CCC2)Cl 1458a_100000688705_100000749161 [0,1,0,1,0,0|2,0,0]=4 18873 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)Br 11a_100000754969_100000741311 [0,1,0,1,0,0|1,1,0]=4 18874 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)Br 240690a_100000754969_100000741311 [0,1,0,1,0,0|1,1,0]=4 18875 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)Br 527a_100000754969_100000741311 [0,1,0,1,0,0|1,1,0]=4 18876 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)Cl 11a_100000754969_100000688705 [0,1,0,1,0,0|1,0,0]=3 18877 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)Cl 240690a_100000754969_100000688705 [0,1,0,1,0,0|1,0,0]=3 18878 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)Cl 527a_100000754969_100000688705 [0,1,0,1,0,0|1,0,0]=3 18879 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)F 11a_100000754969_100000686989 [0,1,0,1,0,0|1,1,0]=4 18880 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)F 240690a_100000754969_100000686989 [0,1,0,1,0,0|1,1,0]=4 18881 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)F 527a_100000754969_100000686989 [0,1,0,1,0,0|1,1,0]=4 18882 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)I 11a_100000754969_100010189873 [0,1,0,1,0,0|1,1,0]=4 18883 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)I 240690a_100000754969_100010189873 [0,1,0,1,0,0|1,1,0]=4 18884 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)I 527a_100000754969_100010189873 [0,1,0,1,0,0|1,1,0]=4 18885 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)O 240690a_100000754969_100000692822 [0,1,0,1,0,0|2,0,0]=4 18886 B15R2.65869 Cc1cc(ccc1C(=O)N2CCC2)O 527a_100000754969_100000692822 [0,1,0,1,0,0|2,0,0]=4 18887 B15R2.65869 Cc1ccc(c(c1)Br)C(=O)N2CCC2 11a_100000754969_100000685072 [0,1,0,1,0,0|2,0,0]=4 18888 B15R2.65869 Cc1ccc(c(c1)Br)C(=O)N2CCC2 240690a_100000754969_100000685072 [0,1,0,1,0,0|2,0,0]=4 18889 B15R2.65869 Cc1ccc(c(c1)Br)C(=O)N2CCC2 527a_100000754969_100000685072 [0,1,0,1,0,0|2,0,0]=4 18890 B15R2.65869 Cc1ccc(c(c1)C)C(=O)N2CCC2 11a_100000754969_100000211164 [0,1,0,1,0,0|2,0,0]=4 18891 B15R2.65869 Cc1ccc(c(c1)C)C(=O)N2CCC2 240690a_100000754969_100000211164 [0,1,0,1,0,0|2,0,0]=4 18892 B15R2.65869 Cc1ccc(c(c1)C)C(=O)N2CCC2 527a_100000754969_100000211164 [0,1,0,1,0,0|2,0,0]=4 18893 B15R2.65869 Cc1ccc(c(c1)Cl)C(=O)N2CCC2 11a_100000754969_100000766932 [0,1,0,1,0,0|2,0,0]=4 18894 B15R2.65869 Cc1ccc(c(c1)Cl)C(=O)N2CCC2 240690a_100000754969_100000766932 [0,1,0,1,0,0|2,0,0]=4 18895 B15R2.65869 Cc1ccc(c(c1)Cl)C(=O)N2CCC2 527a_100000754969_100000766932 [0,1,0,1,0,0|2,0,0]=4 18896 B15R2.65869 Cc1ccc(c(c1)F)C(=O)N2CCC2 11a_100000754969_100000766033 [0,1,0,1,0,0|2,0,0]=4 18897 B15R2.65869 Cc1ccc(c(c1)F)C(=O)N2CCC2 240690a_100000754969_100000766033 [0,1,0,1,0,0|2,0,0]=4 18898 B15R2.65869 Cc1ccc(c(c1)F)C(=O)N2CCC2 527a_100000754969_100000766033 [0,1,0,1,0,0|2,0,0]=4 18899 B15R2.65869 Cc1ccc(c(c1)I)C(=O)N2CCC2 11a_100000754969_100009999607 [0,1,0,1,0,0|2,0,0]=4 18900 B15R2.65869 Cc1ccc(c(c1)I)C(=O)N2CCC2 240690a_100000754969_100009999607 [0,1,0,1,0,0|2,0,0]=4 18901 B15R2.65869 Cc1ccc(c(c1)I)C(=O)N2CCC2 527a_100000754969_100009999607 [0,1,0,1,0,0|2,0,0]=4 18902 B15R2.65869 Cc1ccc(c(c1)O)C(=O)N2CCC2 240690a_100000754969_100000212137 [0,1,0,1,0,0|2,0,0]=4 18903 B15R2.65869 Cc1ccc(c(c1)O)C(=O)N2CCC2 527a_100000754969_100000212137 [0,1,0,1,0,0|2,0,0]=4 18904 B15R2.65869 O=C(c1ccc(cc1Br)Br)N2CCC2 11a_100000754969_100000762965 [0,1,0,1,0,0|1,1,0]=4 18905 B15R2.65869 O=C(c1ccc(cc1Br)Br)N2CCC2 240690a_100000754969_100000762965 [0,1,0,1,0,0|1,1,0]=4 18906 B15R2.65869 O=C(c1ccc(cc1Br)Br)N2CCC2 527a_100000754969_100000762965 [0,1,0,1,0,0|1,1,0]=4 18907 B15R2.65869 O=C(c1ccc(cc1Br)Cl)C2CCC2 1458a_100000766353_100000749161 [0,1,0,1,0,0|2,0,0]=4 18908 B15R2.65869 O=C(c1ccc(cc1Br)Cl)N2CCC2 11a_100000754969_100000766353 [0,1,0,1,0,0|1,0,0]=3 18909 B15R2.65869 O=C(c1ccc(cc1Br)Cl)N2CCC2 240690a_100000754969_100000766353 [0,1,0,1,0,0|1,0,0]=3 18910 B15R2.65869 O=C(c1ccc(cc1Br)Cl)N2CCC2 527a_100000754969_100000766353 [0,1,0,1,0,0|1,0,0]=3 18911 B15R2.65869 O=C(c1ccc(cc1Br)F)N2CCC2 11a_100000754969_100000212304 [0,1,0,1,0,0|1,1,0]=4 18912 B15R2.65869 O=C(c1ccc(cc1Br)F)N2CCC2 240690a_100000754969_100000212304 [0,1,0,1,0,0|1,1,0]=4 18913 B15R2.65869 O=C(c1ccc(cc1Br)F)N2CCC2 527a_100000754969_100000212304 [0,1,0,1,0,0|1,1,0]=4 18914 B15R2.65869 O=C(c1ccc(cc1Br)I)N2CCC2 11a_100000754969_100012360512 [0,1,0,1,0,0|1,1,0]=4 18915 B15R2.65869 O=C(c1ccc(cc1Br)I)N2CCC2 240690a_100000754969_100012360512 [0,1,0,1,0,0|1,1,0]=4 18916 B15R2.65869 O=C(c1ccc(cc1Br)I)N2CCC2 527a_100000754969_100012360512 [0,1,0,1,0,0|1,1,0]=4 18917 B15R2.65869 O=C(c1ccc(cc1Br)O)N2CCC2 240690a_100000754969_100012344906 [0,1,0,1,0,0|2,0,0]=4 18918 B15R2.65869 O=C(c1ccc(cc1Br)O)N2CCC2 527a_100000754969_100012344906 [0,1,0,1,0,0|2,0,0]=4 18919 B15R2.65869 O=C(c1ccc(cc1Cl)Br)N2CCC2 11a_100000754969_100000741628 [0,1,0,1,0,0|1,1,0]=4 18920 B15R2.65869 O=C(c1ccc(cc1Cl)Br)N2CCC2 240690a_100000754969_100000741628 [0,1,0,1,0,0|1,1,0]=4 18921 B15R2.65869 O=C(c1ccc(cc1Cl)Br)N2CCC2 527a_100000754969_100000741628 [0,1,0,1,0,0|1,1,0]=4 18922 B15R2.65869 O=C(c1ccc(cc1Cl)Cl)C2CCC2 1458a_100000185840_100000749161 [0,1,0,1,0,0|2,0,0]=4 18923 B15R2.65869 O=C(c1ccc(cc1Cl)Cl)N2CCC2 11a_100000754969_100000185840 [0,1,0,1,0,0|1,0,0]=3 18924 B15R2.65869 O=C(c1ccc(cc1Cl)Cl)N2CCC2 240690a_100000754969_100000185840 [0,1,0,1,0,0|1,0,0]=3 18925 B15R2.65869 O=C(c1ccc(cc1Cl)Cl)N2CCC2 527a_100000754969_100000185840 [0,1,0,1,0,0|1,0,0]=3 18926 B15R2.65869 O=C(c1ccc(cc1Cl)F)N2CCC2 11a_100000754969_100000211397 [0,1,0,1,0,0|1,1,0]=4 18927 B15R2.65869 O=C(c1ccc(cc1Cl)F)N2CCC2 240690a_100000754969_100000211397 [0,1,0,1,0,0|1,1,0]=4 18928 B15R2.65869 O=C(c1ccc(cc1Cl)F)N2CCC2 527a_100000754969_100000211397 [0,1,0,1,0,0|1,1,0]=4 18929 B15R2.65869 O=C(c1ccc(cc1Cl)I)N2CCC2 11a_100000754969_100000751301 [0,1,0,1,0,0|1,1,0]=4 18930 B15R2.65869 O=C(c1ccc(cc1Cl)I)N2CCC2 240690a_100000754969_100000751301 [0,1,0,1,0,0|1,1,0]=4 18931 B15R2.65869 O=C(c1ccc(cc1Cl)I)N2CCC2 527a_100000754969_100000751301 [0,1,0,1,0,0|1,1,0]=4 18932 B15R2.65869 O=C(c1ccc(cc1Cl)O)N2CCC2 240690a_100000754969_100000702456 [0,1,0,1,0,0|2,0,0]=4 18933 B15R2.65869 O=C(c1ccc(cc1Cl)O)N2CCC2 527a_100000754969_100000702456 [0,1,0,1,0,0|2,0,0]=4 18934 B15R2.65869 O=C(c1ccc(cc1F)Br)N2CCC2 11a_100000754969_100000214689 [0,1,0,1,0,0|1,1,0]=4 18935 B15R2.65869 O=C(c1ccc(cc1F)Br)N2CCC2 240690a_100000754969_100000214689 [0,1,0,1,0,0|1,1,0]=4 18936 B15R2.65869 O=C(c1ccc(cc1F)Br)N2CCC2 527a_100000754969_100000214689 [0,1,0,1,0,0|1,1,0]=4 18937 B15R2.65869 O=C(c1ccc(cc1F)Cl)C2CCC2 1458a_100000212326_100000749161 [0,1,0,1,0,0|2,0,0]=4 18938 B15R2.65869 O=C(c1ccc(cc1F)Cl)N2CCC2 11a_100000754969_100000212326 [0,1,0,1,0,0|1,0,0]=3 18939 B15R2.65869 O=C(c1ccc(cc1F)Cl)N2CCC2 240690a_100000754969_100000212326 [0,1,0,1,0,0|1,0,0]=3 18940 B15R2.65869 O=C(c1ccc(cc1F)Cl)N2CCC2 527a_100000754969_100000212326 [0,1,0,1,0,0|1,0,0]=3 18941 B15R2.65869 O=C(c1ccc(cc1F)F)N2CCC2 11a_100000754969_100000211022 [0,1,0,1,0,0|1,1,0]=4 18942 B15R2.65869 O=C(c1ccc(cc1F)F)N2CCC2 240690a_100000754969_100000211022 [0,1,0,1,0,0|1,1,0]=4 18943 B15R2.65869 O=C(c1ccc(cc1F)F)N2CCC2 527a_100000754969_100000211022 [0,1,0,1,0,0|1,1,0]=4 18944 B15R2.65869 O=C(c1ccc(cc1F)I)N2CCC2 11a_100000754969_100000037189 [0,1,0,1,0,0|1,1,0]=4 18945 B15R2.65869 O=C(c1ccc(cc1F)I)N2CCC2 240690a_100000754969_100000037189 [0,1,0,1,0,0|1,1,0]=4 18946 B15R2.65869 O=C(c1ccc(cc1F)I)N2CCC2 527a_100000754969_100000037189 [0,1,0,1,0,0|1,1,0]=4 18947 B15R2.65869 O=C(c1ccc(cc1F)O)N2CCC2 240690a_100000754969_100000689029 [0,1,0,1,0,0|2,0,0]=4 18948 B15R2.65869 O=C(c1ccc(cc1F)O)N2CCC2 527a_100000754969_100000689029 [0,1,0,1,0,0|2,0,0]=4 18949 B15R2.65869 O=C(c1ccc(cc1I)Br)N2CCC2 11a_100000754969_100000751167 [0,1,0,1,0,0|1,1,0]=4 18950 B15R2.65869 O=C(c1ccc(cc1I)Br)N2CCC2 240690a_100000754969_100000751167 [0,1,0,1,0,0|1,1,0]=4 18951 B15R2.65869 O=C(c1ccc(cc1I)Br)N2CCC2 527a_100000754969_100000751167 [0,1,0,1,0,0|1,1,0]=4 18952 B15R2.65869 O=C(c1ccc(cc1I)Cl)C2CCC2 1458a_100000739380_100000749161 [0,1,0,1,0,0|2,0,0]=4 18953 B15R2.65869 O=C(c1ccc(cc1I)Cl)N2CCC2 11a_100000754969_100000739380 [0,1,0,1,0,0|1,0,0]=3 18954 B15R2.65869 O=C(c1ccc(cc1I)Cl)N2CCC2 240690a_100000754969_100000739380 [0,1,0,1,0,0|1,0,0]=3 18955 B15R2.65869 O=C(c1ccc(cc1I)Cl)N2CCC2 527a_100000754969_100000739380 [0,1,0,1,0,0|1,0,0]=3 18956 B15R2.65869 O=C(c1ccc(cc1I)F)N2CCC2 11a_100000754969_100000739341 [0,1,0,1,0,0|1,1,0]=4 18957 B15R2.65869 O=C(c1ccc(cc1I)F)N2CCC2 240690a_100000754969_100000739341 [0,1,0,1,0,0|1,1,0]=4 18958 B15R2.65869 O=C(c1ccc(cc1I)F)N2CCC2 527a_100000754969_100000739341 [0,1,0,1,0,0|1,1,0]=4 18959 B15R2.65869 O=C(c1ccc(cc1O)Br)N2CCC2 240690a_100000754969_100000744433 [0,1,0,1,0,0|1,1,0]=4 18960 B15R2.65869 O=C(c1ccc(cc1O)Br)N2CCC2 527a_100000754969_100000744433 [0,1,0,1,0,0|1,1,0]=4 18961 B15R2.65869 O=C(c1ccc(cc1O)Cl)C2CCC2 1458a_100000188622_100000749161 [0,1,0,1,0,0|2,0,0]=4 18962 B15R2.65869 O=C(c1ccc(cc1O)Cl)N2CCC2 11a_100000754969_100000188622 [0,1,0,1,0,0|1,0,0]=3 18963 B15R2.65869 O=C(c1ccc(cc1O)Cl)N2CCC2 240690a_100000754969_100000188622 [0,1,0,1,0,0|1,0,0]=3 18964 B15R2.65869 O=C(c1ccc(cc1O)Cl)N2CCC2 527a_100000754969_100000188622 [0,1,0,1,0,0|1,0,0]=3 18965 B15R2.65869 O=C(c1ccc(cc1O)F)N2CCC2 240690a_100000754969_100000746061 [0,1,0,1,0,0|1,1,0]=4 18966 B15R2.65869 O=C(c1ccc(cc1O)F)N2CCC2 527a_100000754969_100000746061 [0,1,0,1,0,0|1,1,0]=4 18967 B15R2.65869 O=C(c1ccc(cc1O)I)N2CCC2 240690a_100000754969_100000091984 [0,1,0,1,0,0|1,1,0]=4 18968 B15R2.65869 O=C(c1ccc(cc1O)I)N2CCC2 527a_100000754969_100000091984 [0,1,0,1,0,0|1,1,0]=4 18969 B11R1.27 OCCNCc1cc(cs1)Cl 207a_100000210304_100000102487 [1,0,0,0,1,0|1,0,1]=4 18970 B11R1.27 OCCNCc1cc(cs1)Cl 270004a_100000210304_100000102487 [1,0,0,0,1,0|1,0,1]=4 18971 B11R1.27 OCCNCc1ccc(o1)Cl 207a_100000210304_100000188459 [1,0,0,0,1,0|1,0,1]=4 18972 B11R1.27 OCCNCc1ccc(o1)Cl 270004a_100000210304_100000188459 [1,0,0,0,1,0|1,0,1]=4 18973 B11R1.27 OCCNCc1ccc(s1)Cl 207a_100000210304_100000242774 [1,0,0,0,1,0|1,0,1]=4 18974 B11R1.27 OCCNCc1ccc(s1)Cl 2230a_100000737310_100000211926 [1,0,0,0,1,0|1,0,1]=4 18975 B11R1.27 OCCNCc1ccc(s1)Cl 2230a_100016997473_100000185097 [1,0,0,0,1,0|1,0,1]=4 18976 B11R1.27 OCCNCc1ccc(s1)Cl 270004a_100000210304_100000242774 [1,0,0,0,1,0|1,0,1]=4 18977 B11R1.27 OCCNCc1ccc(s1)Cl 34a_100016990907_100000185097 [1,0,0,0,1,0|1,0,1]=4 18978 B11R1.27 OCCNCc1csc(c1)Cl 207a_100000210304_100009844934 [1,0,0,0,1,0|1,0,1]=4 18979 B11R1.27 OCCNCc1csc(c1)Cl 270004a_100000210304_100009844934 [1,0,0,0,1,0|1,0,1]=4 18980 B11R1.15 CCNC(=O)c1ccc(s1)O 271570a_203496583355_200000155171 [1,0,0,0,1,0|2,0,0]=4 18981 B13R1.44 C#CCNC(=O)Nc1ccccc1 2430a_100000106764_100000212058 [1,0,0,0,0,1|1,0,1]=4 18982 B13R1.44 C=CCNC(=O)Nc1ccccc1 2430a_100000106764_100020586998 [1,0,0,0,0,1|1,0,1]=4 18983 B13R1.44 CC(Cc1ccccc1)NCCO 34a_100016990907_200011218536 [1,0,0,0,0,1|1,0,1]=4 18984 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [1,0,0,0,0,1|2,0,0]=4 18985 B13R1.44 CCCCC(=O)Nc1ccccc1 11a_100000106764_100000210183 [1,0,0,0,0,1|2,0,0]=4 18986 B13R1.44 CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000210183 [1,0,0,0,0,1|2,0,0]=4 18987 B13R1.44 CCCCC(=O)Nc1ccccc1 22a_100000106764_100000210183 [1,0,0,0,0,1|2,0,0]=4 18988 B13R1.44 CCCCC(=O)Nc1ccccc1 527a_100000106764_100000210183 [1,0,0,0,0,1|2,0,0]=4 18989 B13R1.44 CCCNC(=O)C[n+]1ccccc1 11a_100020643023_200000086051 [1,0,0,0,0,1|2,0,0]=4 18990 B13R1.44 CCCNC(=O)C[n+]1ccccc1 240690a_100020643023_200000086051 [1,0,0,0,0,1|2,0,0]=4 18991 B13R1.44 CCCNC(=O)C[n+]1ccccc1 527a_100020643023_200000086051 [1,0,0,0,0,1|2,0,0]=4 18992 B13R1.44 CCCNC(=O)Cc1ccccn1 11a_100020643023_100000233486 [1,0,0,0,0,1|2,0,0]=4 18993 B13R1.44 CCCNC(=O)Cc1cccnc1 11a_100020643023_100000737805 [1,0,0,0,0,1|2,0,0]=4 18994 B13R1.44 CCCNC(=O)Cc1cccnc1 240690a_100020643023_100000737805 [1,0,0,0,0,1|2,0,0]=4 18995 B13R1.44 CCCNC(=O)Cc1cccnc1 527a_100020643023_100000737805 [1,0,0,0,0,1|2,0,0]=4 18996 B13R1.44 CCCNC(=O)Cc1ccncc1 11a_100020643023_100011201483 [1,0,0,0,0,1|2,0,0]=4 18997 B13R1.44 CCCNC(=O)Cc1ccncc1 240690a_100020643023_100011201483 [1,0,0,0,0,1|2,0,0]=4 18998 B13R1.44 CCCNC(=O)Nc1ccccc1 2430a_100000106764_100020643023 [1,0,0,0,0,1|1,0,0]=3 18999 B13R1.44 N#CCNC(=O)Nc1ccccc1 2430a_100000106764_100000734998 [1,0,0,0,0,1|1,0,1]=4 19000 B13R1.44 O=C(C#CCO)Cc1ccccc1 1458a_100000049017_100015291786 [1,0,0,0,0,1|1,0,1]=4 19001 B13R1.44 O=C(CCCO)C[n+]1ccccc1 1458a_200000086051_100011215043 [1,0,0,0,0,1|2,0,0]=4 19002 B13R1.44 O=C(CCCO)Cc1ccccn1 1458a_100000233486_100011215043 [1,0,0,0,0,1|2,0,0]=4 19003 B13R1.44 O=C(CCCO)Cc1cccnc1 1458a_100000737805_100011215043 [1,0,0,0,0,1|2,0,0]=4 19004 B13R1.44 O=C(C[n+]1ccccc1)NCCF 11a_100000724931_200000086051 [1,0,0,0,0,1|2,0,0]=4 19005 B13R1.44 O=C(C[n+]1ccccc1)NCCF 240690a_100000724931_200000086051 [1,0,0,0,0,1|2,0,0]=4 19006 B13R1.44 O=C(C[n+]1ccccc1)NCCF 527a_100000724931_200000086051 [1,0,0,0,0,1|2,0,0]=4 19007 B13R1.44 O=C(C[n+]1ccccc1)NCCO 240690a_100000210304_200000086051 [1,0,0,0,0,1|1,0,0]=3 19008 B13R1.44 O=C(C[n+]1ccccc1)NCCO 527a_100000210304_200000086051 [1,0,0,0,0,1|1,0,0]=3 19009 B13R1.44 O=C(Cc1ccccn1)NCCF 11a_100000724931_100000233486 [1,0,0,0,0,1|2,0,0]=4 19010 B13R1.44 O=C(Cc1cccnc1)NCCF 11a_100000724931_100000737805 [1,0,0,0,0,1|2,0,0]=4 19011 B13R1.44 O=C(Cc1cccnc1)NCCF 240690a_100000724931_100000737805 [1,0,0,0,0,1|2,0,0]=4 19012 B13R1.44 O=C(Cc1cccnc1)NCCF 527a_100000724931_100000737805 [1,0,0,0,0,1|2,0,0]=4 19013 B13R1.44 O=C(Cc1cccnc1)NCCO 240690a_100000210304_100000737805 [1,0,0,0,0,1|1,0,0]=3 19014 B13R1.44 O=C(Cc1cccnc1)NCCO 527a_100000210304_100000737805 [1,0,0,0,0,1|1,0,0]=3 19015 B13R1.44 O=C(Cc1ccncc1)NCCF 11a_100000724931_100011201483 [1,0,0,0,0,1|2,0,0]=4 19016 B13R1.44 O=C(Cc1ccncc1)NCCF 240690a_100000724931_100011201483 [1,0,0,0,0,1|2,0,0]=4 19017 B13R1.44 O=C(Cc1ccncc1)NCCO 240690a_100000210304_100011201483 [1,0,0,0,0,1|1,0,0]=3 19018 B13R1.44 O=C(Cc1cnccn1)NCCO 240690a_100000210304_100000726051 [1,0,0,0,0,1|2,0,0]=4 19019 B13R1.44 O=C(Cc1cnccn1)NCCO 527a_100000210304_100000726051 [1,0,0,0,0,1|2,0,0]=4 19020 B13R1.44 O=C(Cc1cncnc1)NCCO 240690a_100000210304_100000721575 [1,0,0,0,0,1|2,0,0]=4 19021 B13R1.44 O=C(Cc1cncnc1)NCCO 527a_100000210304_100000721575 [1,0,0,0,0,1|2,0,0]=4 19022 B13R1.44 O=C(NCCF)Nc1ccccc1 2430a_100000106764_100000724931 [1,0,0,0,0,1|1,0,0]=3 19023 B13R1.44 O=C(NCCO)Nc1ccccc1 2430a_100000106764_100000210304 [1,0,0,0,0,1|0,0,0]=2 19024 B15R1.139 C#CCNC(=O)C#Cc1ccc(cc1)Cl 240690a_100000212058_100011892723 [0,0,0,0,0,2|1,0,1]=4 19025 B15R1.139 C#CCNC(=O)C=Cc1ccc(cc1)Cl 11a_100000212058_100000184863 [0,0,0,0,0,2|1,0,1]=4 19026 B15R1.139 C#CCNC(=O)C=Cc1ccc(cc1)Cl 1626a_100000212058_100000184863 [0,0,0,0,0,2|1,0,1]=4 19027 B15R1.139 C#CCNC(=O)C=Cc1ccc(cc1)Cl 240690a_100000212058_100000184863 [0,0,0,0,0,2|1,0,1]=4 19028 B15R1.139 C#CCNC(=O)CCc1ccc(cc1)Cl 11a_100000212058_100000235379 [0,0,0,0,0,2|1,0,1]=4 19029 B15R1.139 C#CCNC(=O)CCc1ccc(cc1)Cl 1626a_100000212058_100000235379 [0,0,0,0,0,2|1,0,1]=4 19030 B15R1.139 C#CCNC(=O)CCc1ccc(cc1)Cl 240690a_100000212058_100000235379 [0,0,0,0,0,2|1,0,1]=4 19031 B15R1.139 C#CCNC(=O)CCc1ccc(cc1)Cl 527a_100000212058_100000235379 [0,0,0,0,0,2|1,0,1]=4 19032 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 11a_100000212058_100016990877 [0,0,0,0,0,2|1,0,1]=4 19033 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 1626a_100000212058_100016990877 [0,0,0,0,0,2|1,0,1]=4 19034 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 240690a_100000212058_100016990877 [0,0,0,0,0,2|1,0,1]=4 19035 B15R1.139 C#CCNC(=O)COc1ccc(cc1)Cl 527a_100000212058_100016990877 [0,0,0,0,0,2|1,0,1]=4 19036 B15R1.139 C#CCNC(=O)CSc1ccc(cc1)Cl 11a_100000212058_100000178402 [0,0,0,0,0,2|1,0,1]=4 19037 B15R1.139 C#CCNC(=O)CSc1ccc(cc1)Cl 1626a_100000212058_100000178402 [0,0,0,0,0,2|1,0,1]=4 19038 B15R1.139 C#CCNC(=O)CSc1ccc(cc1)Cl 240690a_100000212058_100000178402 [0,0,0,0,0,2|1,0,1]=4 19039 B15R1.139 C#CCNC(=O)CSc1ccc(cc1)Cl 527a_100000212058_100000178402 [0,0,0,0,0,2|1,0,1]=4 19040 B15R1.139 C#CCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100000212058 [0,0,0,0,0,2|1,0,1]=4 19041 B15R1.139 C#CCNC(=O)NCc1ccc(cc1)Cl 2708a_100000212058_100000174871 [0,0,0,0,0,2|1,0,1]=4 19042 B15R1.139 C#CCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100000212058 [0,0,0,0,0,2|1,0,1]=4 19043 B15R1.139 C#CCNC(=O)NCc1ccc(cc1)Cl 273464a_100000212058_100000174871 [0,0,0,0,0,2|1,0,1]=4 19044 B15R1.139 C#CCNC(=O)NCc1ccc(cc1)Cl 512a_100000212058_100000174871 [0,0,0,0,0,2|1,0,1]=4 19045 B15R1.139 C#CCNC(=O)NNc1ccc(cc1)Cl 273464a_100000212058_100000683521 [0,0,0,0,0,2|1,0,1]=4 19046 B15R1.139 C#CCNC(=O)NNc1ccc(cc1)Cl 512a_100000212058_100000683521 [0,0,0,0,0,2|1,0,1]=4 19047 B15R1.139 C=CCNC(=O)C#Cc1ccc(cc1)Cl 240690a_100020586998_100011892723 [0,0,0,0,0,2|1,0,1]=4 19048 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Cl 1626a_100020586998_100000184863 [0,0,0,0,0,2|1,0,1]=4 19049 B15R1.139 C=CCNC(=O)C=Cc1ccc(cc1)Cl 240690a_100020586998_100000184863 [0,0,0,0,0,2|1,0,1]=4 19050 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Cl 1626a_100020586998_100000235379 [0,0,0,0,0,2|1,0,1]=4 19051 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Cl 240690a_100020586998_100000235379 [0,0,0,0,0,2|1,0,1]=4 19052 B15R1.139 C=CCNC(=O)CCc1ccc(cc1)Cl 527a_100020586998_100000235379 [0,0,0,0,0,2|1,0,1]=4 19053 B15R1.139 C=CCNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183597 [0,0,0,0,0,2|1,0,1]=4 19054 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 1626a_100020586998_100016990877 [0,0,0,0,0,2|1,0,1]=4 19055 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 240690a_100020586998_100016990877 [0,0,0,0,0,2|1,0,1]=4 19056 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 527a_100020586998_100016990877 [0,0,0,0,0,2|1,0,1]=4 19057 B15R1.139 C=CCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183597 [0,0,0,0,0,2|1,0,1]=4 19058 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 1626a_100020586998_100000178402 [0,0,0,0,0,2|1,0,1]=4 19059 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 240690a_100020586998_100000178402 [0,0,0,0,0,2|1,0,1]=4 19060 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 527a_100020586998_100000178402 [0,0,0,0,0,2|1,0,1]=4 19061 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 62a_100000183597_100000755918 [0,0,0,0,0,2|1,0,1]=4 19062 B15R1.139 C=CCNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183597 [0,0,0,0,0,2|1,0,1]=4 19063 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100020586998 [0,0,0,0,0,2|1,0,1]=4 19064 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100020586998 [0,0,0,0,0,2|1,0,1]=4 19065 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 273464a_100020586998_100000174871 [0,0,0,0,0,2|1,0,1]=4 19066 B15R1.139 C=CCNC(=O)NCc1ccc(cc1)Cl 512a_100020586998_100000174871 [0,0,0,0,0,2|1,0,1]=4 19067 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)Cl 273464a_100020586998_100000683521 [0,0,0,0,0,2|1,0,1]=4 19068 B15R1.139 C=CCNC(=O)NNc1ccc(cc1)Cl 512a_100020586998_100000683521 [0,0,0,0,0,2|1,0,1]=4 19069 B15R1.139 CC(=NNc1ccc(cc1)Cl)CCCO 4a_100000683521_100000759063 [0,0,0,0,0,2|2,0,0]=4 19070 B15R1.139 CC(CCc1ccc(cc1)Cl)NCCO 270004a_100000210304_100011279170 [0,0,0,0,0,2|1,0,1]=4 19071 B15R1.139 CC(COc1ccc(cc1)Cl)NCCO 270004a_100000210304_200000150450 [0,0,0,0,0,2|1,0,1]=4 19072 B15R1.139 CC(CSc1ccc(cc1)Cl)NCCO 270004a_100000210304_100000150472 [0,0,0,0,0,2|1,0,1]=4 19073 B15R1.139 CCCCC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_100000210211 [0,0,0,0,0,2|2,0,0]=4 19074 B15R1.139 CCCCC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_100000210211 [0,0,0,0,0,2|2,0,0]=4 19075 B15R1.139 CCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000210183_100011713675 [0,0,0,0,0,2|2,0,0]=4 19076 B15R1.139 CCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000210211 [0,0,0,0,0,2|2,0,0]=4 19077 B15R1.139 CCCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210211 [0,0,0,0,0,2|2,0,0]=4 19078 B15R1.139 CCCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000210211 [0,0,0,0,0,2|2,0,0]=4 19079 B15R1.139 CCCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000210183 [0,0,0,0,0,2|2,0,0]=4 19080 B15R1.139 CCCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000210183 [0,0,0,0,0,2|2,0,0]=4 19081 B15R1.139 CCCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000210183 [0,0,0,0,0,2|2,0,0]=4 19082 B15R1.139 CCCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000210183 [0,0,0,0,0,2|2,0,0]=4 19083 B15R1.139 CCCCC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000210183 [0,0,0,0,0,2|2,0,0]=4 19084 B15R1.139 CCCNC(=O)C#Cc1ccc(cc1)Cl 240690a_100020643023_100011892723 [0,0,0,0,0,2|1,0,0]=3 19085 B15R1.139 CCCNC(=O)C#Cc1ccc(cc1)F 240690a_100020643023_100000238512 [0,0,0,0,0,2|1,1,0]=4 19086 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Br 11a_100020643023_100016267368 [0,0,0,0,0,2|1,1,0]=4 19087 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Br 1626a_100020643023_100016267368 [0,0,0,0,0,2|1,1,0]=4 19088 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)C 11a_100020643023_100000716854 [0,0,0,0,0,2|2,0,0]=4 19089 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)C 1626a_100020643023_100000716854 [0,0,0,0,0,2|2,0,0]=4 19090 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)C 240690a_100020643023_100000716854 [0,0,0,0,0,2|2,0,0]=4 19091 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Cl 11a_100020643023_100000184863 [0,0,0,0,0,2|1,0,0]=3 19092 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Cl 1626a_100020643023_100000184863 [0,0,0,0,0,2|1,0,0]=3 19093 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)Cl 240690a_100020643023_100000184863 [0,0,0,0,0,2|1,0,0]=3 19094 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)F 11a_100020643023_100000182136 [0,0,0,0,0,2|1,1,0]=4 19095 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)F 1626a_100020643023_100000182136 [0,0,0,0,0,2|1,1,0]=4 19096 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)F 240690a_100020643023_100000182136 [0,0,0,0,0,2|1,1,0]=4 19097 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)I 11a_100020643023_100102526154 [0,0,0,0,0,2|1,1,0]=4 19098 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)I 1626a_100020643023_100102526154 [0,0,0,0,0,2|1,1,0]=4 19099 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)I 240690a_100020643023_100102526154 [0,0,0,0,0,2|1,1,0]=4 19100 B15R1.139 CCCNC(=O)C=Cc1ccc(cc1)O 240690a_100020643023_100016269017 [0,0,0,0,0,2|2,0,0]=4 19101 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Br 11a_100020643023_100000217147 [0,0,0,0,0,2|1,1,0]=4 19102 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Br 1626a_100020643023_100000217147 [0,0,0,0,0,2|1,1,0]=4 19103 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Br 240690a_100020643023_100000217147 [0,0,0,0,0,2|1,1,0]=4 19104 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Br 527a_100020643023_100000217147 [0,0,0,0,0,2|1,1,0]=4 19105 B15R1.139 CCCNC(=O)CCc1ccc(cc1)C 11a_100020643023_100000234883 [0,0,0,0,0,2|2,0,0]=4 19106 B15R1.139 CCCNC(=O)CCc1ccc(cc1)C 1626a_100020643023_100000234883 [0,0,0,0,0,2|2,0,0]=4 19107 B15R1.139 CCCNC(=O)CCc1ccc(cc1)C 240690a_100020643023_100000234883 [0,0,0,0,0,2|2,0,0]=4 19108 B15R1.139 CCCNC(=O)CCc1ccc(cc1)C 527a_100020643023_100000234883 [0,0,0,0,0,2|2,0,0]=4 19109 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Cl 11a_100020643023_100000235379 [0,0,0,0,0,2|1,0,0]=3 19110 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Cl 1626a_100020643023_100000235379 [0,0,0,0,0,2|1,0,0]=3 19111 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Cl 240690a_100020643023_100000235379 [0,0,0,0,0,2|1,0,0]=3 19112 B15R1.139 CCCNC(=O)CCc1ccc(cc1)Cl 527a_100020643023_100000235379 [0,0,0,0,0,2|1,0,0]=3 19113 B15R1.139 CCCNC(=O)CCc1ccc(cc1)F 11a_100020643023_100000198493 [0,0,0,0,0,2|1,1,0]=4 19114 B15R1.139 CCCNC(=O)CCc1ccc(cc1)F 1626a_100020643023_100000198493 [0,0,0,0,0,2|1,1,0]=4 19115 B15R1.139 CCCNC(=O)CCc1ccc(cc1)F 240690a_100020643023_100000198493 [0,0,0,0,0,2|1,1,0]=4 19116 B15R1.139 CCCNC(=O)CCc1ccc(cc1)F 527a_100020643023_100000198493 [0,0,0,0,0,2|1,1,0]=4 19117 B15R1.139 CCCNC(=O)CCc1ccc(cc1)I 11a_100020643023_100011217499 [0,0,0,0,0,2|1,1,0]=4 19118 B15R1.139 CCCNC(=O)CCc1ccc(cc1)I 1626a_100020643023_100011217499 [0,0,0,0,0,2|1,1,0]=4 19119 B15R1.139 CCCNC(=O)CCc1ccc(cc1)I 240690a_100020643023_100011217499 [0,0,0,0,0,2|1,1,0]=4 19120 B15R1.139 CCCNC(=O)CCc1ccc(cc1)I 527a_100020643023_100011217499 [0,0,0,0,0,2|1,1,0]=4 19121 B15R1.139 CCCNC(=O)CCc1ccc(cc1)O 240690a_100020643023_100000742835 [0,0,0,0,0,2|2,0,0]=4 19122 B15R1.139 CCCNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000183358 [0,0,0,0,0,2|1,1,0]=4 19123 B15R1.139 CCCNC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000183358 [0,0,0,0,0,2|1,1,0]=4 19124 B15R1.139 CCCNC(=O)CNc1ccc(cc1)C 34a_100000124888_100000183358 [0,0,0,0,0,2|2,0,0]=4 19125 B15R1.139 CCCNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183358 [0,0,0,0,0,2|1,0,0]=3 19126 B15R1.139 CCCNC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000183358 [0,0,0,0,0,2|1,0,0]=3 19127 B15R1.139 CCCNC(=O)CNc1ccc(cc1)F 34a_100000185862_100000183358 [0,0,0,0,0,2|1,1,0]=4 19128 B15R1.139 CCCNC(=O)CNc1ccc(cc1)I 34a_100000185761_100000183358 [0,0,0,0,0,2|1,1,0]=4 19129 B15R1.139 CCCNC(=O)CNc1ccc(cc1)O 34a_100000185829_100000183358 [0,0,0,0,0,2|2,0,0]=4 19130 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 11a_100020643023_100000182358 [0,0,0,0,0,2|1,1,0]=4 19131 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 1626a_100020643023_100000182358 [0,0,0,0,0,2|1,1,0]=4 19132 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 240690a_100020643023_100000182358 [0,0,0,0,0,2|1,1,0]=4 19133 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183358 [0,0,0,0,0,2|1,1,0]=4 19134 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 527a_100020643023_100000182358 [0,0,0,0,0,2|1,1,0]=4 19135 B15R1.139 CCCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183358 [0,0,0,0,0,2|1,1,0]=4 19136 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 11a_100020643023_100000182360 [0,0,0,0,0,2|2,0,0]=4 19137 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 1626a_100020643023_100000182360 [0,0,0,0,0,2|2,0,0]=4 19138 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 240690a_100020643023_100000182360 [0,0,0,0,0,2|2,0,0]=4 19139 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183358 [0,0,0,0,0,2|2,0,0]=4 19140 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 527a_100020643023_100000182360 [0,0,0,0,0,2|2,0,0]=4 19141 B15R1.139 CCCNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183358 [0,0,0,0,0,2|2,0,0]=4 19142 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 11a_100020643023_100016990877 [0,0,0,0,0,2|1,0,0]=3 19143 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 1626a_100020643023_100016990877 [0,0,0,0,0,2|1,0,0]=3 19144 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 240690a_100020643023_100016990877 [0,0,0,0,0,2|1,0,0]=3 19145 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183358 [0,0,0,0,0,2|1,0,0]=3 19146 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 527a_100020643023_100016990877 [0,0,0,0,0,2|1,0,0]=3 19147 B15R1.139 CCCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183358 [0,0,0,0,0,2|1,0,0]=3 19148 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 11a_100020643023_100000184765 [0,0,0,0,0,2|1,1,0]=4 19149 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 1626a_100020643023_100000184765 [0,0,0,0,0,2|1,1,0]=4 19150 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 240690a_100020643023_100000184765 [0,0,0,0,0,2|1,1,0]=4 19151 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183358 [0,0,0,0,0,2|1,1,0]=4 19152 B15R1.139 CCCNC(=O)COc1ccc(cc1)F 527a_100020643023_100000184765 [0,0,0,0,0,2|1,1,0]=4 19153 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 11a_100020643023_100000184369 [0,0,0,0,0,2|1,1,0]=4 19154 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 1626a_100020643023_100000184369 [0,0,0,0,0,2|1,1,0]=4 19155 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 240690a_100020643023_100000184369 [0,0,0,0,0,2|1,1,0]=4 19156 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183358 [0,0,0,0,0,2|1,1,0]=4 19157 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 527a_100020643023_100000184369 [0,0,0,0,0,2|1,1,0]=4 19158 B15R1.139 CCCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183358 [0,0,0,0,0,2|1,1,0]=4 19159 B15R1.139 CCCNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183358 [0,0,0,0,0,2|2,0,0]=4 19160 B15R1.139 CCCNC(=O)COc1ccc(cc1)O 240690a_100020643023_100000031633 [0,0,0,0,0,2|2,0,0]=4 19161 B15R1.139 CCCNC(=O)COc1ccc(cc1)O 527a_100020643023_100000031633 [0,0,0,0,0,2|2,0,0]=4 19162 B15R1.139 CCCNC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000183358 [0,0,0,0,0,2|2,0,0]=4 19163 B15R1.139 CCCNC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000183358 [0,0,0,0,0,2|2,0,0]=4 19164 B15R1.139 CCCNC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000183358 [0,0,0,0,0,2|2,0,0]=4 19165 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Br 11a_100020643023_100000179496 [0,0,0,0,0,2|1,1,0]=4 19166 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Br 1626a_100020643023_100000179496 [0,0,0,0,0,2|1,1,0]=4 19167 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Br 240690a_100020643023_100000179496 [0,0,0,0,0,2|1,1,0]=4 19168 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Br 527a_100020643023_100000179496 [0,0,0,0,0,2|1,1,0]=4 19169 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Br 62a_100000183358_100000752885 [0,0,0,0,0,2|1,1,0]=4 19170 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183358 [0,0,0,0,0,2|1,1,0]=4 19171 B15R1.139 CCCNC(=O)CSc1ccc(cc1)C 11a_100020643023_100000179497 [0,0,0,0,0,2|2,0,0]=4 19172 B15R1.139 CCCNC(=O)CSc1ccc(cc1)C 1626a_100020643023_100000179497 [0,0,0,0,0,2|2,0,0]=4 19173 B15R1.139 CCCNC(=O)CSc1ccc(cc1)C 240690a_100020643023_100000179497 [0,0,0,0,0,2|2,0,0]=4 19174 B15R1.139 CCCNC(=O)CSc1ccc(cc1)C 527a_100020643023_100000179497 [0,0,0,0,0,2|2,0,0]=4 19175 B15R1.139 CCCNC(=O)CSc1ccc(cc1)C 62a_100000183358_100000186775 [0,0,0,0,0,2|2,0,0]=4 19176 B15R1.139 CCCNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183358 [0,0,0,0,0,2|2,0,0]=4 19177 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Cl 11a_100020643023_100000178402 [0,0,0,0,0,2|1,0,0]=3 19178 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Cl 1626a_100020643023_100000178402 [0,0,0,0,0,2|1,0,0]=3 19179 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Cl 240690a_100020643023_100000178402 [0,0,0,0,0,2|1,0,0]=3 19180 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Cl 527a_100020643023_100000178402 [0,0,0,0,0,2|1,0,0]=3 19181 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Cl 62a_100000183358_100000755918 [0,0,0,0,0,2|1,0,0]=3 19182 B15R1.139 CCCNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183358 [0,0,0,0,0,2|1,0,0]=3 19183 B15R1.139 CCCNC(=O)CSc1ccc(cc1)F 11a_100020643023_100000691584 [0,0,0,0,0,2|1,1,0]=4 19184 B15R1.139 CCCNC(=O)CSc1ccc(cc1)F 1626a_100020643023_100000691584 [0,0,0,0,0,2|1,1,0]=4 19185 B15R1.139 CCCNC(=O)CSc1ccc(cc1)F 240690a_100020643023_100000691584 [0,0,0,0,0,2|1,1,0]=4 19186 B15R1.139 CCCNC(=O)CSc1ccc(cc1)F 527a_100020643023_100000691584 [0,0,0,0,0,2|1,1,0]=4 19187 B15R1.139 CCCNC(=O)CSc1ccc(cc1)F 62a_100000183358_100000211213 [0,0,0,0,0,2|1,1,0]=4 19188 B15R1.139 CCCNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183358 [0,0,0,0,0,2|1,1,0]=4 19189 B15R1.139 CCCNC(=O)CSc1ccc(cc1)N 62a_100000183358_100000185761 [0,0,0,0,0,2|2,0,0]=4 19190 B15R1.139 CCCNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183358 [0,0,0,0,0,2|2,0,0]=4 19191 B15R1.139 CCCNC(=O)CSc1ccc(cc1)O 62a_100000183358_100000185759 [0,0,0,0,0,2|2,0,0]=4 19192 B15R1.139 CCCNC(=O)CSc1ccc(cn1)Cl 62a_100000183358_100011356976 [0,0,0,0,0,2|2,0,0]=4 19193 B15R1.139 CCCNC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000183358 [0,0,0,0,0,2|2,0,0]=4 19194 B15R1.139 CCCNC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000183358 [0,0,0,0,0,2|2,0,0]=4 19195 B15R1.139 CCCNC(=O)CSc1ccc(nc1)Cl 62a_100000183358_100000034144 [0,0,0,0,0,2|2,0,0]=4 19196 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_100020643023 [0,0,0,0,0,2|1,1,0]=4 19197 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Br 2708a_100020643023_100000174875 [0,0,0,0,0,2|1,1,0]=4 19198 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100020643023 [0,0,0,0,0,2|1,1,0]=4 19199 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Br 273464a_100020643023_100000174875 [0,0,0,0,0,2|1,1,0]=4 19200 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100020643023 [0,0,0,0,0,2|1,1,0]=4 19201 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Br 512a_100020643023_100000174875 [0,0,0,0,0,2|1,1,0]=4 19202 B15R1.139 CCCNC(=O)NCc1ccc(cc1)C 2708a_100000174908_100020643023 [0,0,0,0,0,2|2,0,0]=4 19203 B15R1.139 CCCNC(=O)NCc1ccc(cc1)C 2708a_100020643023_100000174908 [0,0,0,0,0,2|2,0,0]=4 19204 B15R1.139 CCCNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100020643023 [0,0,0,0,0,2|2,0,0]=4 19205 B15R1.139 CCCNC(=O)NCc1ccc(cc1)C 273464a_100020643023_100000174908 [0,0,0,0,0,2|2,0,0]=4 19206 B15R1.139 CCCNC(=O)NCc1ccc(cc1)C 512a_100000174908_100020643023 [0,0,0,0,0,2|2,0,0]=4 19207 B15R1.139 CCCNC(=O)NCc1ccc(cc1)C 512a_100020643023_100000174908 [0,0,0,0,0,2|2,0,0]=4 19208 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100020643023 [0,0,0,0,0,2|1,0,0]=3 19209 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Cl 2708a_100020643023_100000174871 [0,0,0,0,0,2|1,0,0]=3 19210 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100020643023 [0,0,0,0,0,2|1,0,0]=3 19211 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Cl 273464a_100020643023_100000174871 [0,0,0,0,0,2|1,0,0]=3 19212 B15R1.139 CCCNC(=O)NCc1ccc(cc1)Cl 512a_100020643023_100000174871 [0,0,0,0,0,2|1,0,0]=3 19213 B15R1.139 CCCNC(=O)NCc1ccc(cc1)F 2708a_100000174882_100020643023 [0,0,0,0,0,2|1,1,0]=4 19214 B15R1.139 CCCNC(=O)NCc1ccc(cc1)F 2708a_100020643023_100000174882 [0,0,0,0,0,2|1,1,0]=4 19215 B15R1.139 CCCNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100020643023 [0,0,0,0,0,2|1,1,0]=4 19216 B15R1.139 CCCNC(=O)NCc1ccc(cc1)F 273464a_100020643023_100000174882 [0,0,0,0,0,2|1,1,0]=4 19217 B15R1.139 CCCNC(=O)NCc1ccc(cc1)F 512a_100000174882_100020643023 [0,0,0,0,0,2|1,1,0]=4 19218 B15R1.139 CCCNC(=O)NCc1ccc(cc1)F 512a_100020643023_100000174882 [0,0,0,0,0,2|1,1,0]=4 19219 B15R1.139 CCCNC(=O)NCc1ccc(cc1)I 2708a_100016989417_100020643023 [0,0,0,0,0,2|1,1,0]=4 19220 B15R1.139 CCCNC(=O)NCc1ccc(cc1)I 2708a_100020643023_100016989417 [0,0,0,0,0,2|1,1,0]=4 19221 B15R1.139 CCCNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100020643023 [0,0,0,0,0,2|1,1,0]=4 19222 B15R1.139 CCCNC(=O)NCc1ccc(cc1)I 273464a_100020643023_100016989417 [0,0,0,0,0,2|1,1,0]=4 19223 B15R1.139 CCCNC(=O)NCc1ccc(cc1)I 512a_100016989417_100020643023 [0,0,0,0,0,2|1,1,0]=4 19224 B15R1.139 CCCNC(=O)NCc1ccc(cc1)I 512a_100020643023_100016989417 [0,0,0,0,0,2|1,1,0]=4 19225 B15R1.139 CCCNC(=O)NCc1ccc(cc1)O 2708a_100000185549_100020643023 [0,0,0,0,0,2|2,0,0]=4 19226 B15R1.139 CCCNC(=O)NCc1ccc(cc1)O 2708a_100020643023_100000185549 [0,0,0,0,0,2|2,0,0]=4 19227 B15R1.139 CCCNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100020643023 [0,0,0,0,0,2|2,0,0]=4 19228 B15R1.139 CCCNC(=O)NCc1ccc(cc1)O 273464a_100020643023_100000185549 [0,0,0,0,0,2|2,0,0]=4 19229 B15R1.139 CCCNC(=O)NCc1ccc(cc1)O 512a_100020643023_100000185549 [0,0,0,0,0,2|2,0,0]=4 19230 B15R1.139 CCCNC(=O)NCc1ccc(cn1)Cl 2708a_100000697193_100020643023 [0,0,0,0,0,2|2,0,0]=4 19231 B15R1.139 CCCNC(=O)NCc1ccc(cn1)Cl 2708a_100020643023_100000697193 [0,0,0,0,0,2|2,0,0]=4 19232 B15R1.139 CCCNC(=O)NCc1ccc(cn1)Cl 273464a_100000697193_100020643023 [0,0,0,0,0,2|2,0,0]=4 19233 B15R1.139 CCCNC(=O)NCc1ccc(cn1)Cl 273464a_100020643023_100000697193 [0,0,0,0,0,2|2,0,0]=4 19234 B15R1.139 CCCNC(=O)NCc1ccc(cn1)Cl 512a_100000697193_100020643023 [0,0,0,0,0,2|2,0,0]=4 19235 B15R1.139 CCCNC(=O)NCc1ccc(cn1)Cl 512a_100020643023_100000697193 [0,0,0,0,0,2|2,0,0]=4 19236 B15R1.139 CCCNC(=O)NCc1ccc(nc1)Cl 2708a_100000735879_100020643023 [0,0,0,0,0,2|2,0,0]=4 19237 B15R1.139 CCCNC(=O)NCc1ccc(nc1)Cl 2708a_100020643023_100000735879 [0,0,0,0,0,2|2,0,0]=4 19238 B15R1.139 CCCNC(=O)NCc1ccc(nc1)Cl 273464a_100000735879_100020643023 [0,0,0,0,0,2|2,0,0]=4 19239 B15R1.139 CCCNC(=O)NCc1ccc(nc1)Cl 273464a_100020643023_100000735879 [0,0,0,0,0,2|2,0,0]=4 19240 B15R1.139 CCCNC(=O)NCc1ccc(nc1)Cl 512a_100000735879_100020643023 [0,0,0,0,0,2|2,0,0]=4 19241 B15R1.139 CCCNC(=O)NCc1ccc(nc1)Cl 512a_100020643023_100000735879 [0,0,0,0,0,2|2,0,0]=4 19242 B15R1.139 CCCNC(=O)NNc1ccc(cc1)Br 273464a_100020643023_100000735608 [0,0,0,0,0,2|1,1,0]=4 19243 B15R1.139 CCCNC(=O)NNc1ccc(cc1)Br 512a_100020643023_100000735608 [0,0,0,0,0,2|1,1,0]=4 19244 B15R1.139 CCCNC(=O)NNc1ccc(cc1)C 273464a_100020643023_100000683527 [0,0,0,0,0,2|2,0,0]=4 19245 B15R1.139 CCCNC(=O)NNc1ccc(cc1)C 512a_100020643023_100000683527 [0,0,0,0,0,2|2,0,0]=4 19246 B15R1.139 CCCNC(=O)NNc1ccc(cc1)Cl 273464a_100020643023_100000683521 [0,0,0,0,0,2|1,0,0]=3 19247 B15R1.139 CCCNC(=O)NNc1ccc(cc1)Cl 512a_100020643023_100000683521 [0,0,0,0,0,2|1,0,0]=3 19248 B15R1.139 CCCNC(=O)NNc1ccc(cc1)F 273464a_100020643023_100000728448 [0,0,0,0,0,2|1,1,0]=4 19249 B15R1.139 CCCNC(=O)NNc1ccc(cc1)F 512a_100020643023_100000728448 [0,0,0,0,0,2|1,1,0]=4 19250 B15R1.139 CCCNC(=O)NNc1ccc(cc1)I 273464a_100020643023_100016988836 [0,0,0,0,0,2|1,1,0]=4 19251 B15R1.139 CCCNC(=O)NNc1ccc(cc1)I 512a_100020643023_100016988836 [0,0,0,0,0,2|1,1,0]=4 19252 B15R1.139 CCCNC(=O)NNc1ccc(cn1)Cl 273464a_100020643023_100011206499 [0,0,0,0,0,2|2,0,0]=4 19253 B15R1.139 CCCNC(=O)NNc1ccc(cn1)Cl 512a_100020643023_100011206499 [0,0,0,0,0,2|2,0,0]=4 19254 B15R1.139 CCCNC(=O)NNc1ccc(nc1)Cl 273464a_100020643023_100000119030 [0,0,0,0,0,2|2,0,0]=4 19255 B15R1.139 CCCNC(=O)NNc1ccc(nc1)Cl 512a_100020643023_100000119030 [0,0,0,0,0,2|2,0,0]=4 19256 B15R1.139 CCCOC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_200011215008 [0,0,0,0,0,2|2,0,0]=4 19257 B15R1.139 CCCOC(=O)CNc1ccc(cc1)Cl 34a_100000210052_200011215008 [0,0,0,0,0,2|2,0,0]=4 19258 B15R1.139 CCCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_200011215008 [0,0,0,0,0,2|2,0,0]=4 19259 B15R1.139 CCCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_200011215008 [0,0,0,0,0,2|2,0,0]=4 19260 B15R1.139 CCCOC(=O)CSc1ccc(cc1)Cl 62a_100000755918_200011215008 [0,0,0,0,0,2|2,0,0]=4 19261 B15R1.139 CCCOC(=O)CSc1ccc(cc1)Cl 62a_200011215008_100000755918 [0,0,0,0,0,2|2,0,0]=4 19262 B15R1.139 CCNNC(=O)C#Cc1ccc(cc1)Cl 22a_100000756455_100011892723 [0,0,0,0,0,2|2,0,0]=4 19263 B15R1.139 CCNNC(=O)C=Cc1ccc(cc1)Cl 22a_100000756455_100000184863 [0,0,0,0,0,2|2,0,0]=4 19264 B15R1.139 CCNNC(=O)CCc1ccc(cc1)Cl 22a_100000756455_100000235379 [0,0,0,0,0,2|2,0,0]=4 19265 B15R1.139 CCNNC(=O)COc1ccc(cc1)Cl 22a_100000756455_100016990877 [0,0,0,0,0,2|2,0,0]=4 19266 B15R1.139 CCNNC(=O)CSc1ccc(cc1)Cl 22a_100000756455_100000178402 [0,0,0,0,0,2|2,0,0]=4 19267 B15R1.139 CCNNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100000756455 [0,0,0,0,0,2|2,0,0]=4 19268 B15R1.139 CCNNC(=O)NCc1ccc(cc1)Cl 512a_100000756455_100000174871 [0,0,0,0,0,2|2,0,0]=4 19269 B15R1.139 CCNNC(=O)NNc1ccc(cc1)Cl 512a_100000756455_100000683521 [0,0,0,0,0,2|2,0,0]=4 19270 B15R1.139 Cc1ccc(cc1)C=CC(=O)CCCO 1458a_100000716854_100011215043 [0,0,0,0,0,2|2,0,0]=4 19271 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCCF 11a_100000724931_100000716854 [0,0,0,0,0,2|2,0,0]=4 19272 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCCF 1626a_100000724931_100000716854 [0,0,0,0,0,2|2,0,0]=4 19273 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCCF 240690a_100000724931_100000716854 [0,0,0,0,0,2|2,0,0]=4 19274 B15R1.139 Cc1ccc(cc1)C=CC(=O)NCCO 240690a_100000210304_100000716854 [0,0,0,0,0,2|1,0,0]=3 19275 B15R1.139 Cc1ccc(cc1)CCC(=O)CCCO 1458a_100000234883_100011215043 [0,0,0,0,0,2|2,0,0]=4 19276 B15R1.139 Cc1ccc(cc1)CCC(=O)NCCF 11a_100000724931_100000234883 [0,0,0,0,0,2|2,0,0]=4 19277 B15R1.139 Cc1ccc(cc1)CCC(=O)NCCF 1626a_100000724931_100000234883 [0,0,0,0,0,2|2,0,0]=4 19278 B15R1.139 Cc1ccc(cc1)CCC(=O)NCCF 240690a_100000724931_100000234883 [0,0,0,0,0,2|2,0,0]=4 19279 B15R1.139 Cc1ccc(cc1)CCC(=O)NCCF 527a_100000724931_100000234883 [0,0,0,0,0,2|2,0,0]=4 19280 B15R1.139 Cc1ccc(cc1)CCC(=O)NCCO 240690a_100000210304_100000234883 [0,0,0,0,0,2|1,0,0]=3 19281 B15R1.139 Cc1ccc(cc1)CCC(=O)NCCO 527a_100000210304_100000234883 [0,0,0,0,0,2|1,0,0]=3 19282 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCF 2708a_100000174908_100000724931 [0,0,0,0,0,2|2,0,0]=4 19283 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCF 273464a_100000174908_100000724931 [0,0,0,0,0,2|2,0,0]=4 19284 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCF 273464a_100000724931_100000174908 [0,0,0,0,0,2|2,0,0]=4 19285 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCF 512a_100000174908_100000724931 [0,0,0,0,0,2|2,0,0]=4 19286 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCO 2708a_100000174908_100000210304 [0,0,0,0,0,2|1,0,0]=3 19287 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCO 273464a_100000174908_100000210304 [0,0,0,0,0,2|1,0,0]=3 19288 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCO 273464a_100000210304_100000174908 [0,0,0,0,0,2|1,0,0]=3 19289 B15R1.139 Cc1ccc(cc1)CNC(=O)NCCO 512a_100000174908_100000210304 [0,0,0,0,0,2|1,0,0]=3 19290 B15R1.139 Cc1ccc(cc1)NNC(=O)NCCF 273464a_100000724931_100000683527 [0,0,0,0,0,2|2,0,0]=4 19291 B15R1.139 Cc1ccc(cc1)NNC(=O)NCCO 273464a_100000210304_100000683527 [0,0,0,0,0,2|1,0,0]=3 19292 B15R1.139 Cc1ccc(cc1)OCC(=O)CCCO 1458a_100000182360_100011215043 [0,0,0,0,0,2|2,0,0]=4 19293 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 11a_100000724931_100000182360 [0,0,0,0,0,2|2,0,0]=4 19294 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 1626a_100000724931_100000182360 [0,0,0,0,0,2|2,0,0]=4 19295 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 240690a_100000724931_100000182360 [0,0,0,0,0,2|2,0,0]=4 19296 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCF 527a_100000724931_100000182360 [0,0,0,0,0,2|2,0,0]=4 19297 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCO 240690a_100000210304_100000182360 [0,0,0,0,0,2|1,0,0]=3 19298 B15R1.139 Cc1ccc(cc1)OCC(=O)NCCO 527a_100000210304_100000182360 [0,0,0,0,0,2|1,0,0]=3 19299 B15R1.139 Cc1ccc(cc1)SCC(=O)CCCO 1458a_100000179497_100011215043 [0,0,0,0,0,2|2,0,0]=4 19300 B15R1.139 Cc1ccc(cc1)SCC(=O)NCCF 11a_100000724931_100000179497 [0,0,0,0,0,2|2,0,0]=4 19301 B15R1.139 Cc1ccc(cc1)SCC(=O)NCCF 1626a_100000724931_100000179497 [0,0,0,0,0,2|2,0,0]=4 19302 B15R1.139 Cc1ccc(cc1)SCC(=O)NCCF 240690a_100000724931_100000179497 [0,0,0,0,0,2|2,0,0]=4 19303 B15R1.139 Cc1ccc(cc1)SCC(=O)NCCF 527a_100000724931_100000179497 [0,0,0,0,0,2|2,0,0]=4 19304 B15R1.139 Cc1ccc(cc1)SCC(=O)NCCO 240690a_100000210304_100000179497 [0,0,0,0,0,2|1,0,0]=3 19305 B15R1.139 Cc1ccc(cc1)SCC(=O)NCCO 527a_100000210304_100000179497 [0,0,0,0,0,2|1,0,0]=3 19306 B15R1.139 Cc1ccc(cn1)CNC(=O)NCCO 2708a_100000740942_100000210304 [0,0,0,0,0,2|2,0,0]=4 19307 B15R1.139 Cc1ccc(cn1)CNC(=O)NCCO 273464a_100000210304_100000740942 [0,0,0,0,0,2|2,0,0]=4 19308 B15R1.139 Cc1ccc(cn1)CNC(=O)NCCO 273464a_100000740942_100000210304 [0,0,0,0,0,2|2,0,0]=4 19309 B15R1.139 Cc1ccc(cn1)CNC(=O)NCCO 512a_100000740942_100000210304 [0,0,0,0,0,2|2,0,0]=4 19310 B15R1.139 Cc1ccc(cn1)NNC(=O)NCCO 273464a_100000210304_100020639869 [0,0,0,0,0,2|2,0,0]=4 19311 B15R1.139 Cc1ccc(nc1)CNC(=O)NCCO 2708a_100015187455_100000210304 [0,0,0,0,0,2|2,0,0]=4 19312 B15R1.139 Cc1ccc(nc1)CNC(=O)NCCO 273464a_100000210304_100015187455 [0,0,0,0,0,2|2,0,0]=4 19313 B15R1.139 Cc1ccc(nc1)CNC(=O)NCCO 273464a_100015187455_100000210304 [0,0,0,0,0,2|2,0,0]=4 19314 B15R1.139 Cc1ccc(nc1)CNC(=O)NCCO 512a_100015187455_100000210304 [0,0,0,0,0,2|2,0,0]=4 19315 B15R1.139 Cc1ccc(nc1)NNC(=O)NCCO 273464a_100000210304_100000746693 [0,0,0,0,0,2|2,0,0]=4 19316 B15R1.139 N#CCNC(=O)C=Cc1ccc(cc1)Cl 1626a_100000734998_100000184863 [0,0,0,0,0,2|1,0,1]=4 19317 B15R1.139 N#CCNC(=O)CCc1ccc(cc1)Cl 1626a_100000734998_100000235379 [0,0,0,0,0,2|1,0,1]=4 19318 B15R1.139 N#CCNC(=O)CCc1ccc(cc1)Cl 527a_100000734998_100000235379 [0,0,0,0,0,2|1,0,1]=4 19319 B15R1.139 N#CCNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000736037 [0,0,0,0,0,2|1,0,1]=4 19320 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Cl 1626a_100000734998_100016990877 [0,0,0,0,0,2|1,0,1]=4 19321 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Cl 527a_100000734998_100016990877 [0,0,0,0,0,2|1,0,1]=4 19322 B15R1.139 N#CCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000736037 [0,0,0,0,0,2|1,0,1]=4 19323 B15R1.139 N#CCNC(=O)CSc1ccc(cc1)Cl 1626a_100000734998_100000178402 [0,0,0,0,0,2|1,0,1]=4 19324 B15R1.139 N#CCNC(=O)CSc1ccc(cc1)Cl 527a_100000734998_100000178402 [0,0,0,0,0,2|1,0,1]=4 19325 B15R1.139 N#CCNC(=O)CSc1ccc(cc1)Cl 62a_100000736037_100000755918 [0,0,0,0,0,2|1,0,1]=4 19326 B15R1.139 N#CCNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000736037 [0,0,0,0,0,2|1,0,1]=4 19327 B15R1.139 N#CCNC(=O)NCc1ccc(cc1)Cl 2708a_100000734998_100000174871 [0,0,0,0,0,2|1,0,1]=4 19328 B15R1.139 N#CCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100000734998 [0,0,0,0,0,2|1,0,1]=4 19329 B15R1.139 N#CCNC(=O)NCc1ccc(cc1)Cl 273464a_100000734998_100000174871 [0,0,0,0,0,2|1,0,1]=4 19330 B15R1.139 N#CCNC(=O)NCc1ccc(cc1)Cl 512a_100000734998_100000174871 [0,0,0,0,0,2|1,0,1]=4 19331 B15R1.139 N#CCNC(=O)NNc1ccc(cc1)Cl 273464a_100000734998_100000683521 [0,0,0,0,0,2|1,0,1]=4 19332 B15R1.139 N#CCNC(=O)NNc1ccc(cc1)Cl 512a_100000734998_100000683521 [0,0,0,0,0,2|1,0,1]=4 19333 B15R1.139 O=C(C#CCO)CCc1ccc(cc1)Cl 1458a_100000049017_100011713675 [0,0,0,0,0,2|1,0,1]=4 19334 B15R1.139 O=C(C#Cc1ccc(cc1)Br)CCCO 1458a_100012100275_100011215043 [0,0,0,0,0,2|1,1,0]=4 19335 B15R1.139 O=C(C#Cc1ccc(cc1)Cl)CCCF 1458a_100011892723_100011934791 [0,0,0,0,0,2|2,0,0]=4 19336 B15R1.139 O=C(C#Cc1ccc(cc1)Cl)CCCO 1458a_100011892723_100011215043 [0,0,0,0,0,2|1,0,0]=3 19337 B15R1.139 O=C(C#Cc1ccc(cc1)Cl)NCCF 240690a_100000724931_100011892723 [0,0,0,0,0,2|1,0,0]=3 19338 B15R1.139 O=C(C#Cc1ccc(cc1)Cl)NCCO 240690a_100000210304_100011892723 [0,0,0,0,0,2|0,0,0]=2 19339 B15R1.139 O=C(C#Cc1ccc(cc1)F)CCCO 1458a_100000238512_100011215043 [0,0,0,0,0,2|1,1,0]=4 19340 B15R1.139 O=C(C#Cc1ccc(cc1)F)NCCF 240690a_100000724931_100000238512 [0,0,0,0,0,2|1,1,0]=4 19341 B15R1.139 O=C(C#Cc1ccc(cc1)F)NCCO 240690a_100000210304_100000238512 [0,0,0,0,0,2|0,1,0]=3 19342 B15R1.139 O=C(C=Cc1ccc(cc1)Br)CCCO 1458a_100016267368_100011215043 [0,0,0,0,0,2|1,1,0]=4 19343 B15R1.139 O=C(C=Cc1ccc(cc1)Br)NCCF 11a_100000724931_100016267368 [0,0,0,0,0,2|1,1,0]=4 19344 B15R1.139 O=C(C=Cc1ccc(cc1)Br)NCCF 1626a_100000724931_100016267368 [0,0,0,0,0,2|1,1,0]=4 19345 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)CCCF 1458a_100000184863_100011934791 [0,0,0,0,0,2|2,0,0]=4 19346 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)CCCO 1458a_100000184863_100011215043 [0,0,0,0,0,2|1,0,0]=3 19347 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)NCCF 11a_100000724931_100000184863 [0,0,0,0,0,2|1,0,0]=3 19348 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)NCCF 1626a_100000724931_100000184863 [0,0,0,0,0,2|1,0,0]=3 19349 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)NCCF 240690a_100000724931_100000184863 [0,0,0,0,0,2|1,0,0]=3 19350 B15R1.139 O=C(C=Cc1ccc(cc1)Cl)NCCO 240690a_100000210304_100000184863 [0,0,0,0,0,2|0,0,0]=2 19351 B15R1.139 O=C(C=Cc1ccc(cc1)F)CCCO 1458a_100000182136_100011215043 [0,0,0,0,0,2|1,1,0]=4 19352 B15R1.139 O=C(C=Cc1ccc(cc1)F)NCCF 11a_100000724931_100000182136 [0,0,0,0,0,2|1,1,0]=4 19353 B15R1.139 O=C(C=Cc1ccc(cc1)F)NCCF 1626a_100000724931_100000182136 [0,0,0,0,0,2|1,1,0]=4 19354 B15R1.139 O=C(C=Cc1ccc(cc1)F)NCCF 240690a_100000724931_100000182136 [0,0,0,0,0,2|1,1,0]=4 19355 B15R1.139 O=C(C=Cc1ccc(cc1)F)NCCO 240690a_100000210304_100000182136 [0,0,0,0,0,2|0,1,0]=3 19356 B15R1.139 O=C(C=Cc1ccc(cc1)I)CCCO 1458a_100102526154_100011215043 [0,0,0,0,0,2|1,1,0]=4 19357 B15R1.139 O=C(C=Cc1ccc(cc1)I)NCCF 11a_100000724931_100102526154 [0,0,0,0,0,2|1,1,0]=4 19358 B15R1.139 O=C(C=Cc1ccc(cc1)I)NCCF 1626a_100000724931_100102526154 [0,0,0,0,0,2|1,1,0]=4 19359 B15R1.139 O=C(C=Cc1ccc(cc1)I)NCCF 240690a_100000724931_100102526154 [0,0,0,0,0,2|1,1,0]=4 19360 B15R1.139 O=C(C=Cc1ccc(cc1)I)NCCO 240690a_100000210304_100102526154 [0,0,0,0,0,2|0,1,0]=3 19361 B15R1.139 O=C(C=Cc1ccc(cc1)O)NCCF 240690a_100000724931_100016269017 [0,0,0,0,0,2|2,0,0]=4 19362 B15R1.139 O=C(C=Cc1ccc(cc1)O)NCCO 240690a_100000210304_100016269017 [0,0,0,0,0,2|1,0,0]=3 19363 B15R1.139 O=C(C=Cc1ccc(cn1)F)NCCO 240690a_100000210304_100020630499 [0,0,0,0,0,2|1,1,0]=4 19364 B15R1.139 O=C(C=Cc1ccc(nc1)Br)NCCO 240690a_100000210304_100020588214 [0,0,0,0,0,2|1,1,0]=4 19365 B15R1.139 O=C(CCCF)CCc1ccc(cc1)Cl 1458a_100000235379_100011934791 [0,0,0,0,0,2|2,0,0]=4 19366 B15R1.139 O=C(CCCF)COc1ccc(cc1)Cl 1458a_100016990877_100011934791 [0,0,0,0,0,2|2,0,0]=4 19367 B15R1.139 O=C(CCCF)CSc1ccc(cc1)Cl 1458a_100000178402_100011934791 [0,0,0,0,0,2|2,0,0]=4 19368 B15R1.139 O=C(CCCO)CCc1ccc(cc1)Br 1458a_100000217147_100011215043 [0,0,0,0,0,2|1,1,0]=4 19369 B15R1.139 O=C(CCCO)CCc1ccc(cc1)Cl 1458a_100000235379_100011215043 [0,0,0,0,0,2|1,0,0]=3 19370 B15R1.139 O=C(CCCO)CCc1ccc(cc1)F 1458a_100000198493_100011215043 [0,0,0,0,0,2|1,1,0]=4 19371 B15R1.139 O=C(CCCO)CCc1ccc(cc1)I 1458a_100011217499_100011215043 [0,0,0,0,0,2|1,1,0]=4 19372 B15R1.139 O=C(CCCO)CCc1ccc(cc1)O 1458a_100000742835_100011215043 [0,0,0,0,0,2|2,0,0]=4 19373 B15R1.139 O=C(CCCO)COc1ccc(cc1)Br 1458a_100000182358_100011215043 [0,0,0,0,0,2|1,1,0]=4 19374 B15R1.139 O=C(CCCO)COc1ccc(cc1)Cl 1458a_100016990877_100011215043 [0,0,0,0,0,2|1,0,0]=3 19375 B15R1.139 O=C(CCCO)COc1ccc(cc1)F 1458a_100000184765_100011215043 [0,0,0,0,0,2|1,1,0]=4 19376 B15R1.139 O=C(CCCO)COc1ccc(cc1)I 1458a_100000184369_100011215043 [0,0,0,0,0,2|1,1,0]=4 19377 B15R1.139 O=C(CCCO)COc1ccc(cc1)O 1458a_100000031633_100011215043 [0,0,0,0,0,2|2,0,0]=4 19378 B15R1.139 O=C(CCCO)CSc1ccc(cc1)Br 1458a_100000179496_100011215043 [0,0,0,0,0,2|1,1,0]=4 19379 B15R1.139 O=C(CCCO)CSc1ccc(cc1)Cl 1458a_100000178402_100011215043 [0,0,0,0,0,2|1,0,0]=3 19380 B15R1.139 O=C(CCCO)CSc1ccc(cc1)F 1458a_100000691584_100011215043 [0,0,0,0,0,2|1,1,0]=4 19381 B15R1.139 O=C(CCc1ccc(cc1)Br)NCCF 11a_100000724931_100000217147 [0,0,0,0,0,2|1,1,0]=4 19382 B15R1.139 O=C(CCc1ccc(cc1)Br)NCCF 1626a_100000724931_100000217147 [0,0,0,0,0,2|1,1,0]=4 19383 B15R1.139 O=C(CCc1ccc(cc1)Br)NCCF 240690a_100000724931_100000217147 [0,0,0,0,0,2|1,1,0]=4 19384 B15R1.139 O=C(CCc1ccc(cc1)Br)NCCF 527a_100000724931_100000217147 [0,0,0,0,0,2|1,1,0]=4 19385 B15R1.139 O=C(CCc1ccc(cc1)Br)NCCO 240690a_100000210304_100000217147 [0,0,0,0,0,2|0,1,0]=3 19386 B15R1.139 O=C(CCc1ccc(cc1)Br)NCCO 527a_100000210304_100000217147 [0,0,0,0,0,2|0,1,0]=3 19387 B15R1.139 O=C(CCc1ccc(cc1)Cl)NCCF 11a_100000724931_100000235379 [0,0,0,0,0,2|1,0,0]=3 19388 B15R1.139 O=C(CCc1ccc(cc1)Cl)NCCF 1626a_100000724931_100000235379 [0,0,0,0,0,2|1,0,0]=3 19389 B15R1.139 O=C(CCc1ccc(cc1)Cl)NCCF 240690a_100000724931_100000235379 [0,0,0,0,0,2|1,0,0]=3 19390 B15R1.139 O=C(CCc1ccc(cc1)Cl)NCCF 527a_100000724931_100000235379 [0,0,0,0,0,2|1,0,0]=3 19391 B15R1.139 O=C(CCc1ccc(cc1)Cl)NCCO 240690a_100000210304_100000235379 [0,0,0,0,0,2|0,0,0]=2 19392 B15R1.139 O=C(CCc1ccc(cc1)Cl)NCCO 527a_100000210304_100000235379 [0,0,0,0,0,2|0,0,0]=2 19393 B15R1.139 O=C(CCc1ccc(cc1)F)NCCF 11a_100000724931_100000198493 [0,0,0,0,0,2|1,1,0]=4 19394 B15R1.139 O=C(CCc1ccc(cc1)F)NCCF 1626a_100000724931_100000198493 [0,0,0,0,0,2|1,1,0]=4 19395 B15R1.139 O=C(CCc1ccc(cc1)F)NCCF 240690a_100000724931_100000198493 [0,0,0,0,0,2|1,1,0]=4 19396 B15R1.139 O=C(CCc1ccc(cc1)F)NCCF 527a_100000724931_100000198493 [0,0,0,0,0,2|1,1,0]=4 19397 B15R1.139 O=C(CCc1ccc(cc1)F)NCCO 240690a_100000210304_100000198493 [0,0,0,0,0,2|0,1,0]=3 19398 B15R1.139 O=C(CCc1ccc(cc1)F)NCCO 527a_100000210304_100000198493 [0,0,0,0,0,2|0,1,0]=3 19399 B15R1.139 O=C(CCc1ccc(cc1)I)NCCF 11a_100000724931_100011217499 [0,0,0,0,0,2|1,1,0]=4 19400 B15R1.139 O=C(CCc1ccc(cc1)I)NCCF 1626a_100000724931_100011217499 [0,0,0,0,0,2|1,1,0]=4 19401 B15R1.139 O=C(CCc1ccc(cc1)I)NCCF 240690a_100000724931_100011217499 [0,0,0,0,0,2|1,1,0]=4 19402 B15R1.139 O=C(CCc1ccc(cc1)I)NCCF 527a_100000724931_100011217499 [0,0,0,0,0,2|1,1,0]=4 19403 B15R1.139 O=C(CCc1ccc(cc1)I)NCCO 240690a_100000210304_100011217499 [0,0,0,0,0,2|0,1,0]=3 19404 B15R1.139 O=C(CCc1ccc(cc1)I)NCCO 527a_100000210304_100011217499 [0,0,0,0,0,2|0,1,0]=3 19405 B15R1.139 O=C(CCc1ccc(cc1)O)NCCF 240690a_100000724931_100000742835 [0,0,0,0,0,2|2,0,0]=4 19406 B15R1.139 O=C(CCc1ccc(cc1)O)NCCO 240690a_100000210304_100000742835 [0,0,0,0,0,2|1,0,0]=3 19407 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 11a_100000724931_100000182358 [0,0,0,0,0,2|1,1,0]=4 19408 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 1626a_100000724931_100000182358 [0,0,0,0,0,2|1,1,0]=4 19409 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 240690a_100000724931_100000182358 [0,0,0,0,0,2|1,1,0]=4 19410 B15R1.139 O=C(COc1ccc(cc1)Br)NCCF 527a_100000724931_100000182358 [0,0,0,0,0,2|1,1,0]=4 19411 B15R1.139 O=C(COc1ccc(cc1)Br)NCCO 240690a_100000210304_100000182358 [0,0,0,0,0,2|0,1,0]=3 19412 B15R1.139 O=C(COc1ccc(cc1)Br)NCCO 527a_100000210304_100000182358 [0,0,0,0,0,2|0,1,0]=3 19413 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 11a_100000724931_100016990877 [0,0,0,0,0,2|1,0,0]=3 19414 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 1626a_100000724931_100016990877 [0,0,0,0,0,2|1,0,0]=3 19415 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 240690a_100000724931_100016990877 [0,0,0,0,0,2|1,0,0]=3 19416 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCF 527a_100000724931_100016990877 [0,0,0,0,0,2|1,0,0]=3 19417 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCO 240690a_100000210304_100016990877 [0,0,0,0,0,2|0,0,0]=2 19418 B15R1.139 O=C(COc1ccc(cc1)Cl)NCCO 527a_100000210304_100016990877 [0,0,0,0,0,2|0,0,0]=2 19419 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 11a_100000724931_100000184765 [0,0,0,0,0,2|1,1,0]=4 19420 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 1626a_100000724931_100000184765 [0,0,0,0,0,2|1,1,0]=4 19421 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 240690a_100000724931_100000184765 [0,0,0,0,0,2|1,1,0]=4 19422 B15R1.139 O=C(COc1ccc(cc1)F)NCCF 527a_100000724931_100000184765 [0,0,0,0,0,2|1,1,0]=4 19423 B15R1.139 O=C(COc1ccc(cc1)F)NCCO 240690a_100000210304_100000184765 [0,0,0,0,0,2|0,1,0]=3 19424 B15R1.139 O=C(COc1ccc(cc1)F)NCCO 527a_100000210304_100000184765 [0,0,0,0,0,2|0,1,0]=3 19425 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 11a_100000724931_100000184369 [0,0,0,0,0,2|1,1,0]=4 19426 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 1626a_100000724931_100000184369 [0,0,0,0,0,2|1,1,0]=4 19427 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 240690a_100000724931_100000184369 [0,0,0,0,0,2|1,1,0]=4 19428 B15R1.139 O=C(COc1ccc(cc1)I)NCCF 527a_100000724931_100000184369 [0,0,0,0,0,2|1,1,0]=4 19429 B15R1.139 O=C(COc1ccc(cc1)I)NCCO 240690a_100000210304_100000184369 [0,0,0,0,0,2|0,1,0]=3 19430 B15R1.139 O=C(COc1ccc(cc1)I)NCCO 527a_100000210304_100000184369 [0,0,0,0,0,2|0,1,0]=3 19431 B15R1.139 O=C(COc1ccc(cc1)O)NCCF 240690a_100000724931_100000031633 [0,0,0,0,0,2|2,0,0]=4 19432 B15R1.139 O=C(COc1ccc(cc1)O)NCCF 527a_100000724931_100000031633 [0,0,0,0,0,2|2,0,0]=4 19433 B15R1.139 O=C(COc1ccc(cc1)O)NCCO 240690a_100000210304_100000031633 [0,0,0,0,0,2|1,0,0]=3 19434 B15R1.139 O=C(COc1ccc(cc1)O)NCCO 271570a_203496583355_200000158804 [0,0,0,0,0,2|1,0,0]=3 19435 B15R1.139 O=C(COc1ccc(cc1)O)NCCO 527a_100000210304_100000031633 [0,0,0,0,0,2|1,0,0]=3 19436 B15R1.139 O=C(CSc1ccc(cc1)Br)NCCF 11a_100000724931_100000179496 [0,0,0,0,0,2|1,1,0]=4 19437 B15R1.139 O=C(CSc1ccc(cc1)Br)NCCF 1626a_100000724931_100000179496 [0,0,0,0,0,2|1,1,0]=4 19438 B15R1.139 O=C(CSc1ccc(cc1)Br)NCCF 240690a_100000724931_100000179496 [0,0,0,0,0,2|1,1,0]=4 19439 B15R1.139 O=C(CSc1ccc(cc1)Br)NCCF 527a_100000724931_100000179496 [0,0,0,0,0,2|1,1,0]=4 19440 B15R1.139 O=C(CSc1ccc(cc1)Br)NCCO 240690a_100000210304_100000179496 [0,0,0,0,0,2|0,1,0]=3 19441 B15R1.139 O=C(CSc1ccc(cc1)Br)NCCO 527a_100000210304_100000179496 [0,0,0,0,0,2|0,1,0]=3 19442 B15R1.139 O=C(CSc1ccc(cc1)Cl)NCCF 11a_100000724931_100000178402 [0,0,0,0,0,2|1,0,0]=3 19443 B15R1.139 O=C(CSc1ccc(cc1)Cl)NCCF 1626a_100000724931_100000178402 [0,0,0,0,0,2|1,0,0]=3 19444 B15R1.139 O=C(CSc1ccc(cc1)Cl)NCCF 240690a_100000724931_100000178402 [0,0,0,0,0,2|1,0,0]=3 19445 B15R1.139 O=C(CSc1ccc(cc1)Cl)NCCF 527a_100000724931_100000178402 [0,0,0,0,0,2|1,0,0]=3 19446 B15R1.139 O=C(CSc1ccc(cc1)Cl)NCCO 240690a_100000210304_100000178402 [0,0,0,0,0,2|0,0,0]=2 19447 B15R1.139 O=C(CSc1ccc(cc1)Cl)NCCO 527a_100000210304_100000178402 [0,0,0,0,0,2|0,0,0]=2 19448 B15R1.139 O=C(CSc1ccc(cc1)F)NCCF 11a_100000724931_100000691584 [0,0,0,0,0,2|1,1,0]=4 19449 B15R1.139 O=C(CSc1ccc(cc1)F)NCCF 1626a_100000724931_100000691584 [0,0,0,0,0,2|1,1,0]=4 19450 B15R1.139 O=C(CSc1ccc(cc1)F)NCCF 240690a_100000724931_100000691584 [0,0,0,0,0,2|1,1,0]=4 19451 B15R1.139 O=C(CSc1ccc(cc1)F)NCCF 527a_100000724931_100000691584 [0,0,0,0,0,2|1,1,0]=4 19452 B15R1.139 O=C(CSc1ccc(cc1)F)NCCO 240690a_100000210304_100000691584 [0,0,0,0,0,2|0,1,0]=3 19453 B15R1.139 O=C(CSc1ccc(cc1)F)NCCO 527a_100000210304_100000691584 [0,0,0,0,0,2|0,1,0]=3 19454 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Br 2708a_100000174875_100000724931 [0,0,0,0,0,2|1,1,0]=4 19455 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Br 273464a_100000174875_100000724931 [0,0,0,0,0,2|1,1,0]=4 19456 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Br 273464a_100000724931_100000174875 [0,0,0,0,0,2|1,1,0]=4 19457 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Br 512a_100000174875_100000724931 [0,0,0,0,0,2|1,1,0]=4 19458 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Cl 2708a_100000174871_100000724931 [0,0,0,0,0,2|1,0,0]=3 19459 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Cl 273464a_100000174871_100000724931 [0,0,0,0,0,2|1,0,0]=3 19460 B15R1.139 O=C(NCCF)NCc1ccc(cc1)Cl 273464a_100000724931_100000174871 [0,0,0,0,0,2|1,0,0]=3 19461 B15R1.139 O=C(NCCF)NCc1ccc(cc1)F 2708a_100000174882_100000724931 [0,0,0,0,0,2|1,1,0]=4 19462 B15R1.139 O=C(NCCF)NCc1ccc(cc1)F 273464a_100000174882_100000724931 [0,0,0,0,0,2|1,1,0]=4 19463 B15R1.139 O=C(NCCF)NCc1ccc(cc1)F 273464a_100000724931_100000174882 [0,0,0,0,0,2|1,1,0]=4 19464 B15R1.139 O=C(NCCF)NCc1ccc(cc1)F 512a_100000174882_100000724931 [0,0,0,0,0,2|1,1,0]=4 19465 B15R1.139 O=C(NCCF)NCc1ccc(cc1)I 2708a_100016989417_100000724931 [0,0,0,0,0,2|1,1,0]=4 19466 B15R1.139 O=C(NCCF)NCc1ccc(cc1)I 273464a_100000724931_100016989417 [0,0,0,0,0,2|1,1,0]=4 19467 B15R1.139 O=C(NCCF)NCc1ccc(cc1)I 273464a_100016989417_100000724931 [0,0,0,0,0,2|1,1,0]=4 19468 B15R1.139 O=C(NCCF)NCc1ccc(cc1)I 512a_100016989417_100000724931 [0,0,0,0,0,2|1,1,0]=4 19469 B15R1.139 O=C(NCCF)NCc1ccc(cc1)O 2708a_100000185549_100000724931 [0,0,0,0,0,2|2,0,0]=4 19470 B15R1.139 O=C(NCCF)NCc1ccc(cc1)O 273464a_100000185549_100000724931 [0,0,0,0,0,2|2,0,0]=4 19471 B15R1.139 O=C(NCCF)NCc1ccc(cc1)O 273464a_100000724931_100000185549 [0,0,0,0,0,2|2,0,0]=4 19472 B15R1.139 O=C(NCCF)NCc1ccc(cn1)Cl 2708a_100000697193_100000724931 [0,0,0,0,0,2|2,0,0]=4 19473 B15R1.139 O=C(NCCF)NCc1ccc(cn1)Cl 273464a_100000697193_100000724931 [0,0,0,0,0,2|2,0,0]=4 19474 B15R1.139 O=C(NCCF)NCc1ccc(cn1)Cl 273464a_100000724931_100000697193 [0,0,0,0,0,2|2,0,0]=4 19475 B15R1.139 O=C(NCCF)NCc1ccc(cn1)Cl 512a_100000697193_100000724931 [0,0,0,0,0,2|2,0,0]=4 19476 B15R1.139 O=C(NCCF)NCc1ccc(nc1)Cl 2708a_100000735879_100000724931 [0,0,0,0,0,2|2,0,0]=4 19477 B15R1.139 O=C(NCCF)NCc1ccc(nc1)Cl 273464a_100000724931_100000735879 [0,0,0,0,0,2|2,0,0]=4 19478 B15R1.139 O=C(NCCF)NCc1ccc(nc1)Cl 273464a_100000735879_100000724931 [0,0,0,0,0,2|2,0,0]=4 19479 B15R1.139 O=C(NCCF)NCc1ccc(nc1)Cl 512a_100000735879_100000724931 [0,0,0,0,0,2|2,0,0]=4 19480 B15R1.139 O=C(NCCF)NNc1ccc(cc1)Br 273464a_100000724931_100000735608 [0,0,0,0,0,2|1,1,0]=4 19481 B15R1.139 O=C(NCCF)NNc1ccc(cc1)Cl 273464a_100000724931_100000683521 [0,0,0,0,0,2|1,0,0]=3 19482 B15R1.139 O=C(NCCF)NNc1ccc(cc1)F 273464a_100000724931_100000728448 [0,0,0,0,0,2|1,1,0]=4 19483 B15R1.139 O=C(NCCF)NNc1ccc(cc1)I 273464a_100000724931_100016988836 [0,0,0,0,0,2|1,1,0]=4 19484 B15R1.139 O=C(NCCF)NNc1ccc(cn1)Cl 273464a_100000724931_100011206499 [0,0,0,0,0,2|2,0,0]=4 19485 B15R1.139 O=C(NCCF)NNc1ccc(nc1)Cl 273464a_100000724931_100000119030 [0,0,0,0,0,2|2,0,0]=4 19486 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Br 2708a_100000174875_100000210304 [0,0,0,0,0,2|0,1,0]=3 19487 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Br 273464a_100000174875_100000210304 [0,0,0,0,0,2|0,1,0]=3 19488 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Br 273464a_100000210304_100000174875 [0,0,0,0,0,2|0,1,0]=3 19489 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Br 512a_100000174875_100000210304 [0,0,0,0,0,2|0,1,0]=3 19490 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Cl 2708a_100000174871_100000210304 [0,0,0,0,0,2|0,0,0]=2 19491 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Cl 273464a_100000174871_100000210304 [0,0,0,0,0,2|0,0,0]=2 19492 B15R1.139 O=C(NCCO)NCc1ccc(cc1)Cl 273464a_100000210304_100000174871 [0,0,0,0,0,2|0,0,0]=2 19493 B15R1.139 O=C(NCCO)NCc1ccc(cc1)F 2708a_100000174882_100000210304 [0,0,0,0,0,2|0,1,0]=3 19494 B15R1.139 O=C(NCCO)NCc1ccc(cc1)F 273464a_100000174882_100000210304 [0,0,0,0,0,2|0,1,0]=3 19495 B15R1.139 O=C(NCCO)NCc1ccc(cc1)F 273464a_100000210304_100000174882 [0,0,0,0,0,2|0,1,0]=3 19496 B15R1.139 O=C(NCCO)NCc1ccc(cc1)F 512a_100000174882_100000210304 [0,0,0,0,0,2|0,1,0]=3 19497 B15R1.139 O=C(NCCO)NCc1ccc(cc1)I 2708a_100016989417_100000210304 [0,0,0,0,0,2|0,1,0]=3 19498 B15R1.139 O=C(NCCO)NCc1ccc(cc1)I 273464a_100000210304_100016989417 [0,0,0,0,0,2|0,1,0]=3 19499 B15R1.139 O=C(NCCO)NCc1ccc(cc1)I 273464a_100016989417_100000210304 [0,0,0,0,0,2|0,1,0]=3 19500 B15R1.139 O=C(NCCO)NCc1ccc(cc1)I 512a_100016989417_100000210304 [0,0,0,0,0,2|0,1,0]=3 19501 B15R1.139 O=C(NCCO)NCc1ccc(cc1)O 2708a_100000185549_100000210304 [0,0,0,0,0,2|1,0,0]=3 19502 B15R1.139 O=C(NCCO)NCc1ccc(cc1)O 273464a_100000185549_100000210304 [0,0,0,0,0,2|1,0,0]=3 19503 B15R1.139 O=C(NCCO)NCc1ccc(cc1)O 273464a_100000210304_100000185549 [0,0,0,0,0,2|1,0,0]=3 19504 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Br 2708a_100015188789_100000210304 [0,0,0,0,0,2|1,1,0]=4 19505 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Br 273464a_100000210304_100015188789 [0,0,0,0,0,2|1,1,0]=4 19506 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Br 273464a_100015188789_100000210304 [0,0,0,0,0,2|1,1,0]=4 19507 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Br 512a_100015188789_100000210304 [0,0,0,0,0,2|1,1,0]=4 19508 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Cl 2708a_100000697193_100000210304 [0,0,0,0,0,2|1,0,0]=3 19509 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Cl 273464a_100000210304_100000697193 [0,0,0,0,0,2|1,0,0]=3 19510 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Cl 273464a_100000697193_100000210304 [0,0,0,0,0,2|1,0,0]=3 19511 B15R1.139 O=C(NCCO)NCc1ccc(cn1)Cl 512a_100000697193_100000210304 [0,0,0,0,0,2|1,0,0]=3 19512 B15R1.139 O=C(NCCO)NCc1ccc(cn1)F 2708a_100020620131_100000210304 [0,0,0,0,0,2|1,1,0]=4 19513 B15R1.139 O=C(NCCO)NCc1ccc(cn1)F 273464a_100000210304_100020620131 [0,0,0,0,0,2|1,1,0]=4 19514 B15R1.139 O=C(NCCO)NCc1ccc(cn1)F 273464a_100020620131_100000210304 [0,0,0,0,0,2|1,1,0]=4 19515 B15R1.139 O=C(NCCO)NCc1ccc(cn1)F 512a_100020620131_100000210304 [0,0,0,0,0,2|1,1,0]=4 19516 B15R1.139 O=C(NCCO)NCc1ccc(cn1)O 2708a_100020605196_100000210304 [0,0,0,0,0,2|2,0,0]=4 19517 B15R1.139 O=C(NCCO)NCc1ccc(cn1)O 273464a_100000210304_100020605196 [0,0,0,0,0,2|2,0,0]=4 19518 B15R1.139 O=C(NCCO)NCc1ccc(cn1)O 273464a_100020605196_100000210304 [0,0,0,0,0,2|2,0,0]=4 19519 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Br 2708a_100009817727_100000210304 [0,0,0,0,0,2|1,1,0]=4 19520 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Br 273464a_100000210304_100009817727 [0,0,0,0,0,2|1,1,0]=4 19521 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Br 273464a_100009817727_100000210304 [0,0,0,0,0,2|1,1,0]=4 19522 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Br 512a_100009817727_100000210304 [0,0,0,0,0,2|1,1,0]=4 19523 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Cl 2708a_100000735879_100000210304 [0,0,0,0,0,2|1,0,0]=3 19524 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Cl 273464a_100000210304_100000735879 [0,0,0,0,0,2|1,0,0]=3 19525 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Cl 273464a_100000735879_100000210304 [0,0,0,0,0,2|1,0,0]=3 19526 B15R1.139 O=C(NCCO)NCc1ccc(nc1)Cl 512a_100000735879_100000210304 [0,0,0,0,0,2|1,0,0]=3 19527 B15R1.139 O=C(NCCO)NCc1ccc(nc1)F 2708a_100000101913_100000210304 [0,0,0,0,0,2|1,1,0]=4 19528 B15R1.139 O=C(NCCO)NCc1ccc(nc1)F 273464a_100000101913_100000210304 [0,0,0,0,0,2|1,1,0]=4 19529 B15R1.139 O=C(NCCO)NCc1ccc(nc1)F 273464a_100000210304_100000101913 [0,0,0,0,0,2|1,1,0]=4 19530 B15R1.139 O=C(NCCO)NCc1ccc(nc1)F 512a_100000101913_100000210304 [0,0,0,0,0,2|1,1,0]=4 19531 B15R1.139 O=C(NCCO)NCc1ccc(nc1)O 2708a_100000757128_100000210304 [0,0,0,0,0,2|2,0,0]=4 19532 B15R1.139 O=C(NCCO)NCc1ccc(nc1)O 273464a_100000210304_100000757128 [0,0,0,0,0,2|2,0,0]=4 19533 B15R1.139 O=C(NCCO)NCc1ccc(nc1)O 273464a_100000757128_100000210304 [0,0,0,0,0,2|2,0,0]=4 19534 B15R1.139 O=C(NCCO)NCc1ncc(cn1)Cl 2708a_200015186297_100000210304 [0,0,0,0,0,2|2,0,0]=4 19535 B15R1.139 O=C(NCCO)NCc1ncc(cn1)Cl 273464a_100000210304_200015186297 [0,0,0,0,0,2|2,0,0]=4 19536 B15R1.139 O=C(NCCO)NCc1ncc(cn1)Cl 273464a_200015186297_100000210304 [0,0,0,0,0,2|2,0,0]=4 19537 B15R1.139 O=C(NCCO)NCc1ncc(cn1)Cl 512a_200015186297_100000210304 [0,0,0,0,0,2|2,0,0]=4 19538 B15R1.139 O=C(NCCO)NNc1ccc(cc1)Br 273464a_100000210304_100000735608 [0,0,0,0,0,2|0,1,0]=3 19539 B15R1.139 O=C(NCCO)NNc1ccc(cc1)Cl 273464a_100000210304_100000683521 [0,0,0,0,0,2|0,0,0]=2 19540 B15R1.139 O=C(NCCO)NNc1ccc(cc1)F 273464a_100000210304_100000728448 [0,0,0,0,0,2|0,1,0]=3 19541 B15R1.139 O=C(NCCO)NNc1ccc(cc1)I 273464a_100000210304_100016988836 [0,0,0,0,0,2|0,1,0]=3 19542 B15R1.139 O=C(NCCO)NNc1ccc(cn1)Br 273464a_100000210304_100000750576 [0,0,0,0,0,2|1,1,0]=4 19543 B15R1.139 O=C(NCCO)NNc1ccc(cn1)Cl 273464a_100000210304_100011206499 [0,0,0,0,0,2|1,0,0]=3 19544 B15R1.139 O=C(NCCO)NNc1ccc(cn1)F 273464a_100000210304_100000753838 [0,0,0,0,0,2|1,1,0]=4 19545 B15R1.139 O=C(NCCO)NNc1ccc(cn1)I 273464a_100000210304_100010221006 [0,0,0,0,0,2|1,1,0]=4 19546 B15R1.139 O=C(NCCO)NNc1ccc(nc1)Br 273464a_100000210304_100000755011 [0,0,0,0,0,2|1,1,0]=4 19547 B15R1.139 O=C(NCCO)NNc1ccc(nc1)Cl 273464a_100000210304_100000119030 [0,0,0,0,0,2|1,0,0]=3 19548 B15R1.139 O=C(NCCO)NNc1ccc(nc1)F 273464a_100000210304_100000120849 [0,0,0,0,0,2|1,1,0]=4 19549 B15R1.139 O=C(NCCO)NNc1ccc(nn1)Cl 273464a_100000210304_100000182438 [0,0,0,0,0,2|2,0,0]=4 19550 B15R1.139 O=C(NCCO)NNc1cnc(cn1)Cl 273464a_100000210304_100000121042 [0,0,0,0,0,2|2,0,0]=4 19551 B15R1.139 O=C(NCCO)NNc1ncc(cn1)Cl 273464a_100000210304_100012000172 [0,0,0,0,0,2|2,0,0]=4